*HEADER DNA BINDING PROTEIN 26-JUN-09 2KKO *TITLE SOLUTION NMR STRUCTURE OF THE HOMODIMERIC WINGED HELIX-TURN- *TITLE 2 HELIX DNA-BINDING DOMAIN (FRAGMENT 1-100) MB0332 FROM *TITLE 3 MYCOBACTERIUM BOVIS, A POSSIBLE ARSR-FAMILY TRANSCRIPTIONAL *TITLE 4 REGULATOR. NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET *TITLE 5 MBR242E. *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: POSSIBLE TRANSCRIPTIONAL REGULATORY PROTEIN *COMPND 3 (POSSIBLY ARSR-FAMILY); *COMPND 4 CHAIN: A, B; *COMPND 5 FRAGMENT: HTH ARSR-TYPE DNA BINDING DOMAIN RESIDUES 1-100; *COMPND 6 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM BOVIS; *SOURCE 3 ORGANISM_TAXID: 1765; *SOURCE 4 GENE: MB0332; *SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; *SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) PMGK; *SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET21-23C *KEYWDS NESG, DNA-BINDING, TRANSCRIPTION REGULATION, TRANSCRIPTIONAL *KEYWDS 2 REGULATOR, WHTH, HOMODIMER, WINGED HELIX-TURN-HELIX, *KEYWDS 3 TRANSCRIPTION, TRANSFERASE, STRUCTURAL GENOMICS, PSI-2, *KEYWDS 4 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS *KEYWDS 5 CONSORTIUM, DNA BINDING PROTEIN *EXPDTA SOLUTION NMR *NUMMDL 20 *AUTHOR T.A.RAMELOT, J.R.RAMELOT, D.WANG, C.CICCOSANTI, M.JIANG, *AUTHOR 2 R.NAIR, B.ROST, G.SWAPNA, T.B.ACTON, R.XIAO, J.K.EVERETT, *AUTHOR 3 G.T.MONTELIONE, M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS *AUTHOR 4 CONSORTIUM (NESG) *REVDAT 1 11-AUG-09 2KKO 0 ! 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4.25 assign (segid A and resid 31 and name HD2* )(segid A and resid 68 and name HG1* ) 1.8 0.0 1.72 assign (segid A and resid 31 and name HD2* )(segid A and resid 81 and name HA ) 1.8 0.0 2.88 assign (segid A and resid 31 and name HD2* )(segid A and resid 81 and name HD1* ) 1.8 0.0 2.05 assign (segid A and resid 31 and name HD2* )(segid A and resid 81 and name HG2* ) 1.8 0.0 3.01 assign (segid A and resid 31 and name HD2* )(segid A and resid 82 and name HN ) 1.8 0.0 4.25 assign (segid A and resid 31 and name HD2* )(segid A and resid 86 and name HG1* ) 1.8 0.0 2.37 assign (segid A and resid 31 and name HD2* )(segid A and resid 90 and name HD* ) 1.8 0.0 2.79 assign (segid A and resid 31 and name HD2* )(segid A and resid 90 and name HE* ) 1.8 0.0 3.36 assign (segid A and resid 31 and name HG )(segid A and resid 62 and name HD1* ) 1.8 0.0 2.36 assign (segid A and resid 31 and name HN )(segid A and resid 31 and name HD1* ) 1.8 0.0 2.78 assign (segid A and resid 31 and name HN )(segid A and resid 31 and name HD2* ) 1.8 0.0 2.38 assign (segid A and resid 31 and name HN )(segid A and resid 31 and name HG ) 1.8 0.0 2.77 assign (segid A and resid 31 and name HN )(segid A and resid 32 and name HN ) 1.8 0.0 2.67 assign (segid A and resid 31 and name HN )(segid A and resid 62 and name HD1* ) 1.8 0.0 2.72 assign (segid A and resid 32 and name HA )(segid A and resid 35 and name HB* ) 1.8 0.0 1.97 assign (segid A and resid 32 and name HA )(segid A and resid 35 and name HN ) 1.8 0.0 3 assign (segid A and resid 32 and name HA )(segid A and resid 90 and name HE* ) 1.8 0.0 2.43 assign (segid A and resid 32 and name HB* )(segid A and resid 33 and name HB* ) 1.8 0.0 3.66 assign (segid A and resid 32 and name HB* )(segid A and resid 33 and name HN ) 1.8 0.0 2.38 assign (segid A and resid 32 and name HN )(segid A and resid 32 and name HB* ) 1.8 0.0 1.97 assign (segid A and resid 32 and name HN )(segid A and resid 33 and name HN ) 1.8 0.0 2.49 assign (segid A and resid 32 and name HN 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(segid A and resid 33 and name HG )(segid A and resid 39 and name HE ) 1.8 0.0 4.25 assign (segid A and resid 33 and name HN )(segid A and resid 33 and name HB* ) 1.8 0.0 1.73 assign (segid A and resid 33 and name HN )(segid A and resid 33 and name HD1* ) 1.8 0.0 2.97 assign (segid A and resid 33 and name HN )(segid A and resid 33 and name HD2* ) 1.8 0.0 2.97 assign (segid A and resid 33 and name HN )(segid A and resid 33 and name HG ) 1.8 0.0 3.5 assign (segid A and resid 33 and name HN )(segid A and resid 34 and name HN ) 1.8 0.0 2.53 assign (segid A and resid 33 and name HN )(segid A and resid 35 and name HN ) 1.8 0.0 3.63 assign (segid A and resid 34 and name HA )(segid A and resid 34 and name HD1* ) 1.8 0.0 2.84 assign (segid A and resid 34 and name HA )(segid A and resid 34 and name HD2* ) 1.8 0.0 1.83 assign (segid A and resid 34 and name HA )(segid A and resid 37 and name HN ) 1.8 0.0 2.62 assign (segid A and resid 34 and name HB* )(segid A and resid 80 and name HA ) 1.8 0.0 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and name HG ) 1.8 0.0 3.48 assign (segid A and resid 34 and name HN )(segid A and resid 81 and name HD1* ) 1.8 0.0 4.07 assign (segid A and resid 35 and name HA )(segid A and resid 37 and name HN ) 1.8 0.0 3.07 assign (segid A and resid 35 and name HA )(segid A and resid 81 and name HD1* ) 1.8 0.0 2.04 assign (segid A and resid 35 and name HB* )(segid A and resid 36 and name HA ) 1.8 0.0 2.63 assign (segid A and resid 35 and name HB* )(segid A and resid 36 and name HE2* ) 1.8 0.0 4.07 assign (segid A and resid 35 and name HB* )(segid A and resid 36 and name HN ) 1.8 0.0 2.07 assign (segid A and resid 35 and name HB* )(segid A and resid 37 and name HN ) 1.8 0.0 3.59 assign (segid A and resid 35 and name HB* )(segid A and resid 81 and name HD1* ) 1.8 0.0 2.77 assign (segid A and resid 35 and name HB* )(segid A and resid 90 and name HD* ) 1.8 0.0 2.46 assign (segid A and resid 35 and name HB* )(segid A and resid 90 and name HE* ) 1.8 0.0 2.64 assign (segid A and resid 35 and name HN 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37 and name HN )(segid A and resid 38 and name HN ) 1.8 0.0 3.64 assign (segid A and resid 38 and name HA )(segid A and resid 39 and name HN ) 1.8 0.0 1.99 assign (segid A and resid 38 and name HA )(segid A and resid 80 and name HA ) 1.8 0.0 2.77 assign (segid A and resid 38 and name HB* )(segid A and resid 80 and name HE ) 1.8 0.0 3.64 assign (segid A and resid 38 and name HB* )(segid A and resid 80 and name HG* ) 1.8 0.0 3.21 assign (segid A and resid 38 and name HG* )(segid A and resid 39 and name HN ) 1.8 0.0 2.74 assign (segid A and resid 38 and name HG* )(segid A and resid 78 and name HB* ) 1.8 0.0 2.62 assign (segid A and resid 38 and name HG* )(segid A and resid 78 and name HD* ) 1.8 0.0 3.33 assign (segid A and resid 38 and name HN )(segid A and resid 38 and name HB* ) 1.8 0.0 1.64 assign (segid A and resid 38 and name HN )(segid A and resid 38 and name HG* ) 1.8 0.0 2.61 assign (segid A and resid 38 and name HN )(segid A and resid 39 and name HN ) 1.8 0.0 3.48 assign (segid A 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assign (segid A and resid 40 and name HA )(segid A and resid 41 and name HG2* ) 1.8 0.0 2.57 assign (segid A and resid 40 and name HA )(segid A and resid 41 and name HN ) 1.8 0.0 2.12 assign (segid A and resid 40 and name HA )(segid A and resid 78 and name HA ) 1.8 0.0 2.24 assign (segid A and resid 40 and name HA )(segid A and resid 79 and name HN ) 1.8 0.0 2.61 assign (segid A and resid 40 and name HB* )(segid A and resid 41 and name HA ) 1.8 0.0 3.44 assign (segid A and resid 40 and name HB* )(segid A and resid 41 and name HG1* ) 1.8 0.0 4.12 assign (segid A and resid 40 and name HB* )(segid A and resid 41 and name HN ) 1.8 0.0 1.96 assign (segid A and resid 40 and name HB* )(segid A and resid 42 and name HB* ) 1.8 0.0 2.47 assign (segid A and resid 40 and name HB* )(segid A and resid 42 and name HG* ) 1.8 0.0 3.15 assign (segid A and resid 40 and name HB* )(segid A and resid 42 and name HN ) 1.8 0.0 2.37 assign (segid A and resid 40 and name HB* )(segid A and resid 43 and name HB* 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0.0 2.67 assign (segid A and resid 41 and name HG2* )(segid A and resid 79 and name HD* ) 1.8 0.0 2.03 assign (segid A and resid 41 and name HG2* )(segid A and resid 79 and name HE* ) 1.8 0.0 1.7 assign (segid A and resid 41 and name HN )(segid A and resid 41 and name HB ) 1.8 0.0 2.12 assign (segid A and resid 41 and name HN )(segid A and resid 41 and name HG1* ) 1.8 0.0 2.4 assign (segid A and resid 41 and name HN )(segid A and resid 41 and name HG2* ) 1.8 0.0 1.43 assign (segid A and resid 41 and name HN )(segid A and resid 42 and name HN ) 1.8 0.0 2.78 assign (segid A and resid 41 and name HN )(segid A and resid 44 and name HD1* ) 1.8 0.0 3.09 assign (segid A and resid 42 and name HA )(segid A and resid 42 and name HG* ) 1.8 0.0 1.91 assign (segid A and resid 42 and name HA )(segid A and resid 45 and name HB* ) 1.8 0.0 2.36 assign (segid A and resid 42 and name HA )(segid A and resid 45 and name HN ) 1.8 0.0 2.81 assign (segid A and resid 42 and name HA )(segid A and resid 46 and name HN ) 1.8 0.0 3.53 assign (segid A and resid 42 and name HA )(segid A and resid 52 and name HD* ) 1.8 0.0 1.54 assign (segid A and resid 42 and name HB* )(segid A and resid 43 and name HA ) 1.8 0.0 3.84 assign (segid A and resid 42 and name HB* )(segid A and resid 43 and name HN ) 1.8 0.0 2.18 assign (segid A and resid 42 and name HB* )(segid A and resid 45 and name HB* ) 1.8 0.0 3.82 assign (segid A and resid 42 and name HB* )(segid A and resid 52 and name HD1* ) 1.8 0.0 3.35 assign (segid A and resid 42 and name HB* )(segid A and resid 52 and name HD2* ) 1.8 0.0 3.35 assign (segid A and resid 42 and name HG* )(segid A and resid 43 and name HN ) 1.8 0.0 3.23 assign (segid A and resid 42 and name HG* )(segid A and resid 45 and name HB* ) 1.8 0.0 2.89 assign (segid A and resid 42 and name HG* )(segid A and resid 52 and name HD* ) 1.8 0.0 1.18 assign (segid A and resid 42 and name HG* )(segid A and resid 52 and name HG ) 1.8 0.0 2.67 assign (segid A and resid 42 and name HG1 )(segid 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2.68 assign (segid A and resid 62 and name HB2 )(segid A and resid 68 and name HG2* ) 1.8 0.0 3.52 assign (segid A and resid 62 and name HD1* )(segid A and resid 63 and name HN ) 1.8 0.0 3.28 assign (segid A and resid 62 and name HN )(segid A and resid 62 and name HD1* ) 1.8 0.0 2.66 assign (segid A and resid 62 and name HN )(segid A and resid 62 and name HD2* ) 1.8 0.0 3.05 assign (segid A and resid 62 and name HN )(segid A and resid 62 and name HG ) 1.8 0.0 2.49 assign (segid A and resid 62 and name HN )(segid A and resid 63 and name HN ) 1.8 0.0 2.72 assign (segid A and resid 63 and name HA )(segid A and resid 63 and name HG* ) 1.8 0.0 2.14 assign (segid A and resid 63 and name HA )(segid A and resid 67 and name HN ) 1.8 0.0 3.44 assign (segid A and resid 63 and name HA )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.14 assign (segid A and resid 63 and name HA )(segid A and resid 68 and name HN ) 1.8 0.0 2.48 assign (segid A and resid 63 and name HB* )(segid A and resid 63 and name HE* ) 1.8 0.0 2.13 assign (segid A and resid 63 and name HB* )(segid A and resid 64 and name HN ) 1.8 0.0 2.27 assign (segid A and resid 63 and name HB* )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.1 assign (segid A and resid 63 and name HB* )(segid A and resid 68 and name HN ) 1.8 0.0 3.48 assign (segid A and resid 63 and name HB* )(segid A and resid 79 and name HE* ) 1.8 0.0 2.31 assign (segid A and resid 63 and name HB* )(segid A and resid 69 and name HA ) 1.8 0.0 3.37 assign (segid A and resid 63 and name HD* )(segid A and resid 70 and name HB* ) 1.8 0.0 3.12 assign (segid A and resid 63 and name HD* )(segid A and resid 70 and name HN ) 1.8 0.0 3.92 assign (segid A and resid 63 and name HD* )(segid A and resid 79 and name HE* ) 1.8 0.0 2.64 assign (segid A and resid 63 and name HE* )(segid A and resid 69 and name HA ) 1.8 0.0 2.96 assign (segid A and resid 63 and name HE* )(segid A and resid 70 and name HB* ) 1.8 0.0 1.61 assign (segid A and resid 63 and name HE* )(segid A and resid 70 and name HN ) 1.8 0.0 2.38 assign (segid A and resid 63 and name HE* )(segid A and resid 79 and name HE* ) 1.8 0.0 2.42 assign (segid A and resid 63 and name HG* )(segid A and resid 64 and name HA ) 1.8 0.0 3.3 assign (segid A and resid 63 and name HG* )(segid A and resid 64 and name HN ) 1.8 0.0 2.66 assign (segid A and resid 63 and name HG* )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.79 assign (segid A and resid 63 and name HG* )(segid A and resid 68 and name HN ) 1.8 0.0 4.25 assign (segid A and resid 63 and name HG* )(segid A and resid 70 and name HB* ) 1.8 0.0 3.71 assign (segid A and resid 63 and name HG* )(segid A and resid 79 and name HE* ) 1.8 0.0 3.39 assign (segid A and resid 63 and name HN )(segid A and resid 63 and name HD* ) 1.8 0.0 3.6 assign (segid A and resid 63 and name HN )(segid A and resid 63 and name HG* ) 1.8 0.0 2.63 assign (segid A and resid 63 and name HN )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.69 assign (segid A and resid 64 and name HA )(segid A and resid 66 and name HN ) 1.8 0.0 3.11 assign (segid A and resid 64 and name HB* )(segid A and resid 65 and name HA* ) 1.8 0.0 3.51 assign (segid A and resid 64 and name HB* )(segid A and resid 65 and name HN ) 1.8 0.0 2.48 assign (segid A and resid 64 and name HN )(segid A and resid 64 and name HB* ) 1.8 0.0 1.61 assign (segid A and resid 64 and name HN )(segid A and resid 65 and name HN ) 1.8 0.0 2.38 assign (segid A and resid 65 and name HA* )(segid A and resid 67 and name HB* ) 1.8 0.0 3.69 assign (segid A and resid 65 and name HN )(segid A and resid 66 and name HA* ) 1.8 0.0 3.64 assign (segid A and resid 65 and name HN )(segid A and resid 66 and name HN ) 1.8 0.0 2.42 assign (segid A and resid 65 and name HN )(segid A and resid 67 and name HN ) 1.8 0.0 3.14 assign (segid A and resid 66 and name HA* )(segid A and resid 67 and name HD2* ) 1.8 0.0 3.7 assign (segid A and resid 66 and name HN )(segid A and resid 67 and name HB* ) 1.8 0.0 3.23 assign (segid A and resid 66 and name HN )(segid A and resid 67 and name HN ) 1.8 0.0 2.56 assign (segid A and resid 67 and name HA )(segid A and resid 67 and name HD1* ) 1.8 0.0 2.12 assign (segid A and resid 67 and name HA )(segid A and resid 67 and name HD2* ) 1.8 0.0 2.85 assign (segid A and resid 67 and name HA )(segid A and resid 82 and name HB* ) 1.8 0.0 2.7 assign (segid A and resid 67 and name HA )(segid A and resid 86 and name HG1* ) 1.8 0.0 3.4 assign (segid A and resid 67 and name HA )(segid A and resid 86 and name HG2* ) 1.8 0.0 1.96 assign (segid A and resid 67 and name HB* )(segid A and resid 67 and name HD1* ) 1.8 0.0 1.87 assign (segid A and resid 67 and name HB* )(segid A and resid 67 and name HD2* ) 1.8 0.0 1.87 assign (segid A and resid 67 and name HB* )(segid A and resid 68 and name HA ) 1.8 0.0 3.7 assign (segid A and resid 67 and name HB* )(segid A and resid 68 and name HG1* ) 1.8 0.0 2.46 assign (segid A and resid 67 and name HB* )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.95 assign (segid A and resid 67 and name HB* )(segid A and resid 68 and name HN ) 1.8 0.0 2.49 assign (segid A and resid 67 and name HD1* )(segid A and resid 86 and name HA ) 1.8 0.0 3.09 assign (segid A and resid 67 and name HD1* )(segid A and resid 86 and name HG1* ) 1.8 0.0 2.2 assign (segid A and resid 67 and name HD2* )(segid A and resid 68 and name HN ) 1.8 0.0 4.25 assign (segid A and resid 67 and name HN )(segid A and resid 67 and name HD1* ) 1.8 0.0 2.81 assign (segid A and resid 67 and name HN )(segid A and resid 67 and name HD2* ) 1.8 0.0 2.57 assign (segid A and resid 67 and name HN )(segid A and resid 68 and name HG2* ) 1.8 0.0 3.3 assign (segid A and resid 67 and name HN )(segid A and resid 68 and name HN ) 1.8 0.0 2.18 assign (segid A and resid 68 and name HA )(segid A and resid 68 and name HG1* ) 1.8 0.0 2.28 assign (segid A and resid 68 and name HA )(segid A and resid 69 and name HB* ) 1.8 0.0 4.2 assign (segid A and resid 68 and name HA )(segid A and resid 80 and name HN ) 1.8 0.0 3.69 assign (segid A and resid 68 and name HA )(segid A and resid 81 and name HA ) 1.8 0.0 2.78 assign (segid A and resid 68 and name HA )(segid A and resid 81 and name HG2* ) 1.8 0.0 3.13 assign (segid A and resid 68 and name HA )(segid A and resid 82 and name HB* ) 1.8 0.0 2.47 assign (segid A and resid 68 and name HA )(segid A and resid 82 and name HN ) 1.8 0.0 2.88 assign (segid A and resid 68 and name HB )(segid A and resid 69 and name HN ) 1.8 0.0 2.41 assign (segid A and resid 68 and name HB )(segid A and resid 80 and name HN ) 1.8 0.0 3.35 assign (segid A and resid 68 and name HB )(segid A and resid 81 and name HA ) 1.8 0.0 3.71 assign (segid A and resid 68 and name HG1* )(segid A and resid 69 and name HB* ) 1.8 0.0 4.25 assign (segid A and resid 68 and name HG1* )(segid A and resid 69 and name HN ) 1.8 0.0 2.56 assign (segid A and resid 68 and name HG1* )(segid A and resid 80 and name HN ) 1.8 0.0 3.95 assign (segid A and resid 68 and name HG1* )(segid A and resid 81 and name HA ) 1.8 0.0 2.43 assign (segid A and resid 68 and name HG1* )(segid A and resid 82 and name HN ) 1.8 0.0 3.01 assign (segid A and resid 68 and name HG1* )(segid A and resid 86 and name HG1* ) 1.8 0.0 2.77 assign (segid A and resid 68 and name HG2* )(segid A and resid 69 and name HA ) 1.8 0.0 3.26 assign (segid A and resid 68 and name HG2* )(segid A and resid 69 and name HB* ) 1.8 0.0 4.25 assign (segid A and resid 68 and name HG2* )(segid A and resid 69 and name HN ) 1.8 0.0 3.08 assign (segid A and resid 68 and name HG2* )(segid A and resid 79 and name HD* ) 1.8 0.0 2.25 assign (segid A and resid 68 and name HG2* )(segid A and resid 79 and name HE* ) 1.8 0.0 2.8 assign (segid A and resid 68 and name HG2* )(segid A and resid 80 and name HN ) 1.8 0.0 4.25 assign (segid A and resid 68 and name HN )(segid A and resid 68 and name HG1* ) 1.8 0.0 3.04 assign (segid A and resid 68 and name HN )(segid A and resid 68 and name HG2* ) 1.8 0.0 2.03 assign (segid A and resid 68 and name HN )(segid A and resid 82 and name HB* ) 1.8 0.0 2.83 assign (segid A and resid 68 and name HN )(segid A and resid 86 and name HG1* ) 1.8 0.0 3.7 assign (segid A and resid 69 and name HA )(segid A and resid 69 and name HG1 ) 1.8 0.0 2.58 assign (segid A and resid 69 and name HA )(segid A and resid 69 and name HG2 ) 1.8 0.0 2.58 assign (segid A and resid 69 and name HA )(segid A and resid 70 and name HB* ) 1.8 0.0 3.08 assign (segid A and resid 69 and name HA )(segid A and resid 70 and name HN ) 1.8 0.0 1.57 assign (segid A and resid 69 and name HB1 )(segid A and resid 70 and name HB* ) 1.8 0.0 4.25 assign (segid A and resid 69 and name HB1 )(segid A and resid 70 and name HN ) 1.8 0.0 2.77 assign (segid A and resid 69 and name HB1 )(segid A and resid 82 and name HB* ) 1.8 0.0 4.02 assign (segid A and resid 69 and name HB2 )(segid A and resid 70 and name HB* ) 1.8 0.0 4.25 assign (segid A and resid 69 and name HB2 )(segid A and resid 70 and name HN ) 1.8 0.0 2.77 assign (segid A and resid 69 and name HB2 )(segid A and resid 82 and name HB* ) 1.8 0.0 4.02 assign (segid A and resid 69 and name HG* )(segid A and resid 70 and name HN ) 1.8 0.0 3.05 assign (segid A and resid 69 and name HG1 )(segid A and resid 82 and name HA ) 1.8 0.0 2.71 assign (segid A and resid 69 and name HG1 )(segid A and resid 82 and name HB* ) 1.8 0.0 1.94 assign (segid A and resid 69 and name HG2 )(segid A and resid 82 and name HA ) 1.8 0.0 2.71 assign (segid A and resid 69 and name HG2 )(segid A and resid 82 and name HB* ) 1.8 0.0 1.94 assign (segid A and resid 69 and name HN )(segid A and resid 69 and name HG* ) 1.8 0.0 2.96 assign (segid A and resid 69 and name HN )(segid A and resid 80 and name HN ) 1.8 0.0 2.7 assign (segid A and resid 69 and name HN )(segid A and resid 81 and name HA ) 1.8 0.0 3.23 assign (segid A and resid 69 and name HN )(segid A and resid 82 and name HB* ) 1.8 0.0 3.14 assign (segid A and resid 69 and name HN )(segid A and resid 82 and name HN ) 1.8 0.0 3.67 assign (segid A and resid 70 and name HA )(segid A and resid 71 and name HN ) 1.8 0.0 1.92 assign (segid A and resid 70 and name HA )(segid A and resid 79 and name HA ) 1.8 0.0 1.68 assign (segid A and resid 70 and name HA )(segid A and resid 80 and name HN ) 1.8 0.0 3.23 assign (segid A and resid 70 and name HB* )(segid A and resid 71 and name HA ) 1.8 0.0 3.46 assign (segid A and resid 70 and name HB* )(segid A and resid 71 and name HN ) 1.8 0.0 2.19 assign (segid A and resid 70 and name HB* )(segid A and resid 77 and name HB* ) 1.8 0.0 3.47 assign (segid A and resid 70 and name HB* )(segid A and resid 77 and name HE21 ) 1.8 0.0 2.95 assign (segid A and resid 70 and name HB* )(segid A and resid 77 and name HE22 ) 1.8 0.0 2.95 assign (segid A and resid 70 and name HB* )(segid A and resid 77 and name HG* ) 1.8 0.0 4.07 assign (segid A and resid 70 and name HB* )(segid A and resid 79 and name HA ) 1.8 0.0 2.68 assign (segid A and resid 70 and name HB* )(segid A and resid 79 and name HD* ) 1.8 0.0 3.01 assign (segid A and resid 70 and name HB* )(segid A and resid 79 and name HE* ) 1.8 0.0 1.92 assign (segid A and resid 70 and name HN )(segid A and resid 70 and name HB* ) 1.8 0.0 1.58 assign (segid A and resid 71 and name HA )(segid A and resid 72 and name HB* ) 1.8 0.0 3.3 assign (segid A and resid 71 and name HA )(segid A and resid 72 and name HN ) 1.8 0.0 1.61 assign (segid A and resid 71 and name HB* )(segid A and resid 71 and name HE ) 1.8 0.0 3.19 assign (segid A and resid 71 and name HB* )(segid A and resid 72 and name HN ) 1.8 0.0 2.6 assign (segid A and resid 71 and name HB* )(segid A and resid 79 and name HA ) 1.8 0.0 4.07 assign (segid A and resid 71 and name HD* )(segid A and resid 71 and name HH2* ) 1.8 0.0 3.05 assign (segid A and resid 71 and name HG* )(segid A and resid 72 and name HN ) 1.8 0.0 3.52 assign (segid A and resid 71 and name HG* )(segid A and resid 78 and name HB* ) 1.8 0.0 3.21 assign (segid A and resid 71 and name HN )(segid A and resid 71 and name HG* ) 1.8 0.0 2.89 assign (segid A and resid 71 and name HN )(segid A and resid 78 and name HN ) 1.8 0.0 2.67 assign (segid A and resid 71 and name HN )(segid A and resid 79 and name HA ) 1.8 0.0 3.33 assign (segid A and resid 72 and name HA )(segid A and resid 72 and name HD* ) 1.8 0.0 2.69 assign (segid A and resid 72 and name HA )(segid A and resid 72 and name HG1 ) 1.8 0.0 2.63 assign (segid A and resid 72 and name HA )(segid A and resid 72 and name HG2 ) 1.8 0.0 2.63 assign (segid A and resid 72 and name HA )(segid A and resid 73 and name HN ) 1.8 0.0 1.67 assign (segid A and resid 72 and name HA )(segid A and resid 77 and name HA ) 1.8 0.0 2.91 assign (segid A and resid 72 and name HA )(segid A and resid 77 and name HG* ) 1.8 0.0 3.09 assign (segid A and resid 72 and name HA )(segid A and resid 78 and name HN ) 1.8 0.0 2.94 assign (segid A and resid 72 and name HB* )(segid A and resid 73 and name HN ) 1.8 0.0 2.74 assign (segid A and resid 72 and name HB1 )(segid A and resid 72 and name HD* ) 1.8 0.0 2.22 assign (segid A and resid 72 and name HB2 )(segid A and resid 72 and name HD* ) 1.8 0.0 2.22 assign (segid A and resid 72 and name HD* )(segid A and resid 73 and name HN ) 1.8 0.0 4.25 assign (segid A and resid 72 and name HD* )(segid A and resid 77 and name HG* ) 1.8 0.0 2.54 assign (segid A and resid 72 and name HG* )(segid A and resid 73 and name HN ) 1.8 0.0 3.61 assign (segid A and resid 72 and name HN )(segid A and resid 72 and name HB* ) 1.8 0.0 1.49 assign (segid A and resid 72 and name HN )(segid A and resid 72 and name HD* ) 1.8 0.0 4.03 assign (segid A and resid 72 and name HN )(segid A and resid 72 and name HG* ) 1.8 0.0 3.29 assign (segid A and resid 73 and name HA )(segid A and resid 73 and name HG* ) 1.8 0.0 1.95 assign (segid A and resid 73 and name HB* )(segid A and resid 76 and name HG* ) 1.8 0.0 4.06 assign (segid A and resid 73 and name HB* )(segid A and resid 78 and name HD* ) 1.8 0.0 1.98 assign (segid A and resid 73 and name HB* )(segid A and resid 78 and name HE* ) 1.8 0.0 2.23 assign (segid A and resid 73 and name HG* )(segid A and resid 78 and name HD* ) 1.8 0.0 3.14 assign (segid A and resid 73 and name HG* )(segid A and resid 78 and name HE* ) 1.8 0.0 3.25 assign (segid A and resid 73 and name HN )(segid A and resid 73 and name HG* ) 1.8 0.0 2.78 assign (segid A and resid 73 and name HN )(segid A and resid 76 and name HG* ) 1.8 0.0 4.75 assign (segid A and resid 73 and name HN )(segid A and resid 77 and name HA ) 1.8 0.0 2.69 assign (segid A and resid 73 and name HN )(segid A and resid 78 and name HD* ) 1.8 0.0 3.71 assign (segid A and resid 74 and name HA* )(segid A and resid 75 and name HB ) 1.8 0.0 3.46 assign (segid A and resid 74 and name HA* )(segid A and resid 76 and name HN ) 1.8 0.0 2.99 assign (segid A and resid 75 and name HA )(segid A and resid 75 and name HG2* ) 1.8 0.0 1.73 assign (segid A and resid 75 and name HG2* )(segid A and resid 76 and name HN ) 1.8 0.0 2.88 assign (segid A and resid 75 and name HN )(segid A and resid 75 and name HG2* ) 1.8 0.0 3.53 assign (segid A and resid 75 and name HN )(segid A and resid 76 and name HG* ) 1.8 0.0 4.13 assign (segid A and resid 75 and name HN )(segid A and resid 76 and name HN ) 1.8 0.0 2.27 assign (segid A and resid 76 and name HA )(segid A and resid 76 and name HD* ) 1.8 0.0 3.14 assign (segid A and resid 76 and name HA )(segid A and resid 76 and name HG1 ) 1.8 0.0 2.58 assign (segid A and resid 76 and name HA )(segid A and resid 76 and name HG2 ) 1.8 0.0 2.58 assign (segid A and resid 76 and name HA )(segid A and resid 77 and name HN ) 1.8 0.0 1.46 assign (segid A and resid 76 and name HB* )(segid A and resid 78 and name HD* ) 1.8 0.0 4.25 assign (segid A and resid 76 and name HB* )(segid A and resid 78 and name HE* ) 1.8 0.0 4.25 assign (segid A and resid 76 and name HB1 )(segid A and resid 76 and name HD* ) 1.8 0.0 2.5 assign (segid A and resid 76 and name HB1 )(segid A and resid 77 and name HN ) 1.8 0.0 3.16 assign (segid A and resid 76 and name HB2 )(segid A and resid 76 and name HD* ) 1.8 0.0 2.5 assign (segid A and resid 76 and name HB2 )(segid A and resid 77 and name HN ) 1.8 0.0 3.16 assign (segid A and resid 76 and name HD* )(segid A and resid 77 and name HN ) 1.8 0.0 3 assign (segid A and resid 76 and name HD* )(segid A and resid 78 and name HE* ) 1.8 0.0 2.29 assign (segid A and resid 76 and name HG* )(segid A and resid 77 and name HN ) 1.8 0.0 2.63 assign (segid A and resid 76 and name HG* )(segid A and resid 78 and name HE* ) 1.8 0.0 3.47 assign (segid A and resid 76 and name HN )(segid A and resid 76 and name HD* ) 1.8 0.0 2.94 assign (segid A and resid 76 and name HN )(segid A and resid 76 and name HG1 ) 1.8 0.0 2.45 assign (segid A and resid 76 and name HN )(segid A and resid 76 and name HG2 ) 1.8 0.0 2.45 assign (segid A and resid 76 and name HN )(segid A and resid 77 and name HN ) 1.8 0.0 3.17 assign (segid A and resid 77 and name HA )(segid A and resid 77 and name HG1 ) 1.8 0.0 2.43 assign (segid A and resid 77 and name HA )(segid A and resid 77 and name HG2 ) 1.8 0.0 2.43 assign (segid A and resid 77 and name HA )(segid A and resid 78 and name HN ) 1.8 0.0 1.99 assign (segid A and resid 77 and name HB* )(segid A and resid 77 and name HE2* ) 1.8 0.0 3.17 assign (segid A and resid 77 and name HB* )(segid A and resid 78 and name HN ) 1.8 0.0 2.68 assign (segid A and resid 77 and name HB* )(segid A and resid 79 and name HE* ) 1.8 0.0 2.88 assign (segid A and resid 77 and name HG* )(segid A and resid 77 and name HE2* ) 1.8 0.0 1.63 assign (segid A and resid 77 and name HG* )(segid A and resid 78 and name HN ) 1.8 0.0 3.57 assign (segid A and resid 77 and name HG* )(segid A and resid 79 and name HE* ) 1.8 0.0 3.11 assign (segid A and resid 77 and name HN )(segid A and resid 77 and name HB* ) 1.8 0.0 1.79 assign (segid A and resid 77 and name HN )(segid A and resid 77 and name HG* ) 1.8 0.0 2.29 assign (segid A and resid 78 and name HB* )(segid A and resid 79 and name HN ) 1.8 0.0 2.77 assign (segid A and resid 78 and name HN )(segid A and resid 78 and name HD* ) 1.8 0.0 2.77 assign (segid A and resid 79 and name HA )(segid A and resid 79 and name HD* ) 1.8 0.0 3.46 assign (segid A and resid 79 and name HA )(segid A and resid 80 and name HG* ) 1.8 0.0 4.07 assign (segid A and resid 79 and name HN )(segid A and resid 79 and name HD* ) 1.8 0.0 2.93 assign (segid A and resid 80 and name HA )(segid A and resid 81 and name HG1* ) 1.8 0.0 4.05 assign (segid A and resid 80 and name HB* )(segid A and resid 80 and name HE ) 1.8 0.0 2.74 assign (segid A and resid 80 and name HB* )(segid A and resid 81 and name HN ) 1.8 0.0 2.74 assign (segid A and resid 80 and name HN )(segid A and resid 80 and name HD* ) 1.8 0.0 3.58 assign (segid A and resid 80 and name HN )(segid A and resid 80 and name HG* ) 1.8 0.0 2.47 assign (segid A and resid 81 and name HA )(segid A and resid 81 and name HG2* ) 1.8 0.0 1.69 assign (segid A and resid 81 and name HA )(segid A and resid 82 and name HB* ) 1.8 0.0 2.68 assign (segid A and resid 81 and name HA )(segid A and resid 86 and name HB ) 1.8 0.0 4.25 assign (segid A and resid 81 and name HB )(segid A and resid 82 and name HN ) 1.8 0.0 3.59 assign (segid A and resid 81 and name HD1* )(segid A and resid 82 and name HN ) 1.8 0.0 3.22 assign (segid A and resid 81 and name HD1* )(segid A and resid 86 and name HB ) 1.8 0.0 3.01 assign (segid A and resid 81 and name HD1* )(segid A and resid 87 and name HA ) 1.8 0.0 2.27 assign (segid A and resid 81 and name HD1* )(segid A and resid 87 and name HB* ) 1.8 0.0 3.11 assign (segid A and resid 81 and name HD1* )(segid A and resid 87 and name HN ) 1.8 0.0 3.3 assign (segid A and resid 81 and name HD1* )(segid A and resid 90 and name HD* ) 1.8 0.0 3.51 assign (segid A and resid 81 and name HG1* )(segid A and resid 82 and name HN ) 1.8 0.0 3.45 assign (segid A and resid 81 and name HG1* )(segid A and resid 87 and name HA ) 1.8 0.0 2.81 assign (segid A and resid 81 and name HG1* )(segid A and resid 87 and name HB* ) 1.8 0.0 3.34 assign (segid A and resid 81 and name HG2* )(segid A and resid 81 and name HG1* ) 1.8 0.0 1.52 assign (segid A and resid 81 and name HG2* )(segid A and resid 82 and name HN ) 1.8 0.0 2.09 assign (segid A and resid 81 and name HG2* )(segid A and resid 83 and name HA* ) 1.8 0.0 2.81 assign (segid A and resid 81 and name HG2* )(segid A and resid 83 and name HN ) 1.8 0.0 1.74 assign (segid A and resid 81 and name HG2* )(segid A and resid 86 and name HA ) 1.8 0.0 3.21 assign (segid A and resid 81 and name HG2* )(segid A and resid 86 and name HB ) 1.8 0.0 1.79 assign (segid A and resid 81 and name HG2* )(segid A and resid 86 and name HG1* ) 1.8 0.0 1.36 assign (segid A and resid 81 and name HG2* )(segid A and resid 87 and name HA ) 1.8 0.0 2.15 assign (segid A and resid 81 and name HG2* )(segid A and resid 87 and name HB* ) 1.8 0.0 1.81 assign (segid A and resid 81 and name HG2* )(segid A and resid 87 and name HN ) 1.8 0.0 2.12 assign (segid A and resid 81 and name HG2* )(segid A and resid 88 and name HN ) 1.8 0.0 3.58 assign (segid A and resid 81 and name HN )(segid A and resid 81 and name HB ) 1.8 0.0 2.16 assign (segid A and resid 81 and name HN )(segid A and resid 81 and name HD1* ) 1.8 0.0 3.11 assign (segid A and resid 81 and name HN )(segid A and resid 81 and name HG11 ) 1.8 0.0 2.85 assign (segid A and resid 81 and name HN )(segid A and resid 81 and name HG12 ) 1.8 0.0 2.85 assign (segid A and resid 81 and name HN )(segid A and resid 81 and name HG2* ) 1.8 0.0 2.42 assign (segid A and resid 82 and name HB* )(segid A and resid 83 and name HN ) 1.8 0.0 1.82 assign (segid A and resid 82 and name HB* )(segid A and resid 86 and name HB ) 1.8 0.0 2.62 assign (segid A and resid 82 and name HN )(segid A and resid 83 and name HN ) 1.8 0.0 3.25 assign (segid A and resid 82 and name HN )(segid A and resid 86 and name HG1* ) 1.8 0.0 3.22 assign (segid A and resid 82 and name HN )(segid A and resid 86 and name HG2* ) 1.8 0.0 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assign (segid A and resid 96 and name HG1* )(segid A and resid 100 and name HD2 ) 1.8 0.0 3.45 assign (segid A and resid 96 and name HG2* )(segid A and resid 97 and name HN ) 1.8 0.0 2.24 assign (segid A and resid 96 and name HG2* )(segid A and resid 100 and name HD2 ) 1.8 0.0 3.45 assign (segid A and resid 96 and name HN )(segid A and resid 96 and name HB ) 1.8 0.0 2.49 assign (segid A and resid 96 and name HN )(segid A and resid 96 and name HG1* ) 1.8 0.0 2.38 assign (segid A and resid 96 and name HN )(segid A and resid 96 and name HG2* ) 1.8 0.0 2.18 assign (segid A and resid 96 and name HN )(segid A and resid 97 and name HN ) 1.8 0.0 2.51 assign (segid A and resid 97 and name HA )(segid A and resid 101 and name HD2* ) 1.8 0.0 3.63 assign (segid A and resid 97 and name HB* )(segid A and resid 98 and name HA ) 1.8 0.0 3.74 assign (segid A and resid 97 and name HB* )(segid A and resid 98 and name HB* ) 1.8 0.0 3.56 assign (segid A and resid 97 and name HB* )(segid A and resid 98 and 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and name HN )(segid B and resid 29 and name HG* ) 1.8 0.0 2.52 assign (segid B and resid 29 and name HN )(segid B and resid 30 and name HN ) 1.8 0.0 2.31 assign (segid B and resid 30 and name HA )(segid B and resid 30 and name HD1* ) 1.8 0.0 2.77 assign (segid B and resid 30 and name HA )(segid B and resid 33 and name HB1 ) 1.8 0.0 3.3 assign (segid B and resid 30 and name HA )(segid B and resid 33 and name HB2 ) 1.8 0.0 3.3 assign (segid B and resid 30 and name HA )(segid B and resid 33 and name HD* ) 1.8 0.0 3.62 assign (segid B and resid 30 and name HA )(segid B and resid 33 and name HN ) 1.8 0.0 3.7 assign (segid B and resid 30 and name HA )(segid B and resid 44 and name HD1* ) 1.8 0.0 4.25 assign (segid B and resid 30 and name HA )(segid B and resid 48 and name HG2* ) 1.8 0.0 2.78 assign (segid B and resid 30 and name HB )(segid B and resid 31 and name HD1* ) 1.8 0.0 3.64 assign (segid B and resid 30 and name HB )(segid B and resid 31 and name HD2* ) 1.8 0.0 3.37 assign (segid B and resid 30 and name HB )(segid B and resid 31 and name HN ) 1.8 0.0 2.84 assign (segid B and resid 30 and name HB )(segid B and resid 59 and name HD2* ) 1.8 0.0 3.58 assign (segid B and resid 30 and name HB )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.13 assign (segid B and resid 30 and name HD1* )(segid B and resid 55 and name HA ) 1.8 0.0 2.66 assign (segid B and resid 30 and name HD1* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.79 assign (segid B and resid 30 and name HD1* )(segid B and resid 58 and name HB* ) 1.8 0.0 2.36 assign (segid B and resid 30 and name HD1* )(segid B and resid 58 and name HD2* ) 1.8 0.0 3.83 assign (segid B and resid 30 and name HD1* )(segid B and resid 58 and name HN ) 1.8 0.0 3.66 assign (segid B and resid 30 and name HD1* )(segid B and resid 59 and name HA ) 1.8 0.0 3.18 assign (segid B and resid 30 and name HD1* )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.57 assign (segid B and resid 30 and name HD1* )(segid B and resid 59 and name HD2* ) 1.8 0.0 2.71 assign (segid B and resid 30 and name HD1* )(segid B and resid 59 and name HG ) 1.8 0.0 2.24 assign (segid B and resid 30 and name HD1* )(segid B and resid 59 and name HN ) 1.8 0.0 3.33 assign (segid B and resid 30 and name HG2* )(segid B and resid 31 and name HD2* ) 1.8 0.0 2.56 assign (segid B and resid 30 and name HG2* )(segid B and resid 31 and name HN ) 1.8 0.0 2.46 assign (segid B and resid 30 and name HG2* )(segid B and resid 32 and name HN ) 1.8 0.0 3.88 assign (segid B and resid 30 and name HG2* )(segid B and resid 33 and name HB* ) 1.8 0.0 3.34 assign (segid B and resid 30 and name HG2* )(segid B and resid 34 and name HN ) 1.8 0.0 3.13 assign (segid B and resid 30 and name HG2* )(segid B and resid 44 and name HD1* ) 1.8 0.0 1.7 assign (segid B and resid 30 and name HG2* )(segid B and resid 48 and name HG2* ) 1.8 0.0 4.25 assign (segid B and resid 30 and name HG2* )(segid B and resid 55 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 30 and name HG2* )(segid B and resid 59 and name HA ) 1.8 0.0 3.11 assign (segid B and resid 30 and name HG2* )(segid B and resid 59 and name HD2* ) 1.8 0.0 1.25 assign (segid B and resid 30 and name HG2* )(segid B and resid 79 and name HB1 ) 1.8 0.0 4.25 assign (segid B and resid 30 and name HG2* )(segid B and resid 79 and name HB2 ) 1.8 0.0 4.25 assign (segid B and resid 30 and name HN )(segid B and resid 30 and name HD1* ) 1.8 0.0 2.25 assign (segid B and resid 30 and name HN )(segid B and resid 30 and name HG11 ) 1.8 0.0 3.02 assign (segid B and resid 30 and name HN )(segid B and resid 30 and name HG12 ) 1.8 0.0 3.02 assign (segid B and resid 30 and name HN )(segid B and resid 30 and name HG2* ) 1.8 0.0 2.88 assign (segid B and resid 31 and name HA )(segid B and resid 31 and name HD1* ) 1.8 0.0 2.72 assign (segid B and resid 31 and name HA )(segid B and resid 31 and name HD2* ) 1.8 0.0 1.69 assign (segid B and resid 31 and name HA )(segid B and resid 34 and name HB* ) 1.8 0.0 3.24 assign (segid B and resid 31 and name HA )(segid B and resid 34 and name HD1* ) 1.8 0.0 3.2 assign (segid B and resid 31 and name HA )(segid B and resid 34 and name HN ) 1.8 0.0 3.61 assign (segid B and resid 31 and name HA )(segid B and resid 35 and name HN ) 1.8 0.0 3.74 assign (segid B and resid 31 and name HA )(segid B and resid 62 and name HD1* ) 1.8 0.0 3.59 assign (segid B and resid 31 and name HA )(segid B and resid 81 and name HD1* ) 1.8 0.0 2.85 assign (segid B and resid 31 and name HB* )(segid B and resid 31 and name HD1* ) 1.8 0.0 1.79 assign (segid B and resid 31 and name HB* )(segid B and resid 31 and name HD2* ) 1.8 0.0 1.53 assign (segid B and resid 31 and name HB* )(segid B and resid 62 and name HD1* ) 1.8 0.0 3.58 assign (segid B and resid 31 and name HB* )(segid B and resid 90 and name HD* ) 1.8 0.0 3.24 assign (segid B and resid 31 and name HB* )(segid B and resid 90 and name HE* ) 1.8 0.0 2.93 assign (segid B and resid 31 and name HB* )(segid B and resid 90 and name HZ ) 1.8 0.0 4.07 assign (segid B and resid 31 and name HB1 )(segid B and resid 32 and name HN ) 1.8 0.0 2.81 assign (segid B and resid 31 and name HB2 )(segid B and resid 32 and name HN ) 1.8 0.0 2.81 assign (segid B and resid 31 and name HD1* )(segid B and resid 32 and name HN ) 1.8 0.0 3.28 assign (segid B and resid 31 and name HD1* )(segid B and resid 62 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 31 and name HD1* )(segid B and resid 67 and name HB* ) 1.8 0.0 3.14 assign (segid B and resid 31 and name HD1* )(segid B and resid 67 and name HG ) 1.8 0.0 3.49 assign (segid B and resid 31 and name HD1* )(segid B and resid 86 and name HG1* ) 1.8 0.0 2.8 assign (segid B and resid 31 and name HD1* )(segid B and resid 90 and name HD* ) 1.8 0.0 2.8 assign (segid B and resid 31 and name HD1* )(segid B and resid 90 and name HE* ) 1.8 0.0 2.9 assign (segid B and resid 31 and name HD2* )(segid B and resid 32 and name HN ) 1.8 0.0 4.1 assign (segid B and resid 31 and name HD2* )(segid B and resid 34 and name HN ) 1.8 0.0 3.83 assign (segid B and resid 31 and name HD2* )(segid B and resid 62 and name HB* ) 1.8 0.0 4.02 assign (segid B and resid 31 and name HD2* )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.27 assign (segid B and resid 31 and name HD2* )(segid B and resid 67 and name HA ) 1.8 0.0 4.04 assign (segid B and resid 31 and name HD2* )(segid B and resid 67 and name HB* ) 1.8 0.0 3.2 assign (segid B and resid 31 and name HD2* )(segid B and resid 67 and name HD1* ) 1.8 0.0 3.27 assign (segid B and resid 31 and name HD2* )(segid B and resid 68 and name HB ) 1.8 0.0 4.25 assign (segid B and resid 31 and name HD2* )(segid B and resid 68 and name HG1* ) 1.8 0.0 1.72 assign (segid B and resid 31 and name HD2* )(segid B and resid 81 and name HA ) 1.8 0.0 2.88 assign (segid B and resid 31 and name HD2* )(segid B and resid 81 and name HD1* ) 1.8 0.0 2.05 assign (segid B and resid 31 and name HD2* )(segid B and resid 81 and name HG2* ) 1.8 0.0 3.01 assign (segid B and resid 31 and name HD2* )(segid B and resid 82 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 31 and name HD2* )(segid B and resid 86 and name HG1* ) 1.8 0.0 2.37 assign (segid B and resid 31 and name HD2* )(segid B and resid 90 and name HD* ) 1.8 0.0 2.79 assign (segid B and resid 31 and name HD2* )(segid B and resid 90 and name HE* ) 1.8 0.0 3.36 assign (segid B and resid 31 and name HG )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.36 assign (segid B and resid 31 and name HN )(segid B and resid 31 and name HD1* ) 1.8 0.0 2.78 assign (segid B and resid 31 and name HN )(segid B and resid 31 and name HD2* ) 1.8 0.0 2.38 assign (segid B and resid 31 and name HN )(segid B and resid 31 and name HG ) 1.8 0.0 2.77 assign (segid B and resid 31 and name HN )(segid B and resid 32 and name HN ) 1.8 0.0 2.67 assign (segid B and resid 31 and name HN )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.72 assign (segid B and resid 32 and name HA )(segid B and resid 35 and name HB* ) 1.8 0.0 1.97 assign (segid B and resid 32 and name HA )(segid B and resid 35 and name HN ) 1.8 0.0 3 assign (segid B and resid 32 and name HA )(segid B and resid 90 and name HE* ) 1.8 0.0 2.43 assign (segid B and resid 32 and name HB* )(segid B and resid 33 and name HB* ) 1.8 0.0 3.66 assign (segid B and resid 32 and name HB* )(segid B and resid 33 and name HN ) 1.8 0.0 2.38 assign (segid B and resid 32 and name HN )(segid B and resid 32 and name HB* ) 1.8 0.0 1.97 assign (segid B and resid 32 and name HN )(segid B and resid 33 and name HN ) 1.8 0.0 2.49 assign (segid B and resid 32 and name HN )(segid B and resid 90 and name HZ ) 1.8 0.0 3.03 assign (segid B and resid 33 and name HA )(segid B and resid 33 and name HD* ) 1.8 0.0 1.8 assign (segid B and resid 33 and name HA )(segid B and resid 33 and name HD1* ) 1.8 0.0 2.59 assign (segid B and resid 33 and name HA )(segid B and resid 33 and name HD2* ) 1.8 0.0 2.59 assign (segid B and resid 33 and name HA )(segid B and resid 33 and name HG ) 1.8 0.0 2.4 assign (segid B and resid 33 and name HA )(segid B and resid 36 and name HE2* ) 1.8 0.0 3.44 assign (segid B and resid 33 and name HB* )(segid B and resid 34 and name HN ) 1.8 0.0 2.13 assign (segid B and resid 33 and name HD* )(segid B and resid 34 and name HN ) 1.8 0.0 2.95 assign (segid B and resid 33 and name HD* )(segid B and resid 36 and name HB* ) 1.8 0.0 3.89 assign (segid B and resid 33 and name HD* )(segid B and resid 36 and name HE2* ) 1.8 0.0 2.22 assign (segid B and resid 33 and name HD* )(segid B and resid 36 and name HG* ) 1.8 0.0 2.5 assign (segid B and resid 33 and name HD* )(segid B and resid 36 and name HN ) 1.8 0.0 4.39 assign (segid B and resid 33 and name HD* )(segid B and resid 37 and name HN ) 1.8 0.0 6.01 assign (segid B and resid 33 and name HD* )(segid B and resid 39 and name HD* ) 1.8 0.0 2.63 assign (segid B and resid 33 and name HD* )(segid B and resid 39 and name HE ) 1.8 0.0 4.25 assign (segid B and resid 33 and name HD* )(segid B and resid 43 and name HB* ) 1.8 0.0 2.75 assign (segid B and resid 33 and name HD* )(segid B and resid 44 and name HA ) 1.8 0.0 1.92 assign (segid B and resid 33 and name HD* )(segid B and resid 44 and name HN ) 1.8 0.0 3.11 assign (segid B and resid 33 and name HD* )(segid B and resid 47 and name HB* ) 1.8 0.0 1.18 assign (segid B and resid 33 and name HD* )(segid B and resid 47 and name HN ) 1.8 0.0 3.08 assign (segid B and resid 33 and name HD* )(segid B and resid 34 and name HN ) 1.8 0.0 3.95 assign (segid B and resid 33 and name HG )(segid B and resid 36 and name HE2* ) 1.8 0.0 3.71 assign (segid B and resid 33 and name HG )(segid B and resid 39 and name HE ) 1.8 0.0 4.25 assign (segid B and resid 33 and name HN )(segid B and resid 33 and name HB* ) 1.8 0.0 1.73 assign (segid B and resid 33 and name HN )(segid B and resid 33 and name HD1* ) 1.8 0.0 2.97 assign (segid B and resid 33 and name HN )(segid B and resid 33 and name HD2* ) 1.8 0.0 2.97 assign (segid B and resid 33 and name HN )(segid B and resid 33 and name HG ) 1.8 0.0 3.5 assign (segid B and resid 33 and name HN )(segid B and resid 34 and name HN ) 1.8 0.0 2.53 assign (segid B and resid 33 and name HN )(segid B and resid 35 and name HN ) 1.8 0.0 3.63 assign (segid B and resid 34 and name HA )(segid B and resid 34 and name HD1* ) 1.8 0.0 2.84 assign (segid B and resid 34 and name HA )(segid B and resid 34 and name HD2* ) 1.8 0.0 1.83 assign (segid B and resid 34 and name HA )(segid B and resid 37 and name HN ) 1.8 0.0 2.62 assign (segid B and resid 34 and name HB* )(segid B and resid 80 and name HA ) 1.8 0.0 2.77 assign (segid B and resid 34 and name HB1 )(segid B and resid 34 and name HD1* ) 1.8 0.0 2.63 assign (segid B and resid 34 and name HB2 )(segid B and resid 34 and name HD1* ) 1.8 0.0 2.63 assign (segid B and resid 34 and name HD1* )(segid B and resid 80 and name HA ) 1.8 0.0 3.4 assign (segid B and resid 34 and name HD2* )(segid B and resid 37 and name HN ) 1.8 0.0 3.34 assign (segid B and resid 34 and name HD2* )(segid B and resid 39 and name HB* ) 1.8 0.0 1.6 assign (segid B and resid 34 and name HD2* )(segid B and resid 39 and name HN ) 1.8 0.0 2.23 assign (segid B and resid 34 and name HD2* )(segid B and resid 80 and name HA ) 1.8 0.0 2.75 assign (segid B and resid 34 and name HG )(segid B and resid 59 and name HD2* ) 1.8 0.0 3.98 assign (segid B and resid 34 and name HN )(segid B and resid 34 and name HD1* ) 1.8 0.0 3.17 assign (segid B and resid 34 and name HN )(segid B and resid 34 and name HD2* ) 1.8 0.0 3.17 assign (segid B and resid 34 and name HN )(segid B and resid 34 and name HG ) 1.8 0.0 3.48 assign (segid B and resid 34 and name HN )(segid B and resid 81 and name HD1* ) 1.8 0.0 4.07 assign (segid B and resid 35 and name HA )(segid B and resid 37 and name HN ) 1.8 0.0 3.07 assign (segid B and resid 35 and name HA )(segid B and resid 81 and name HD1* ) 1.8 0.0 2.04 assign (segid B and resid 35 and name HB* )(segid B and resid 36 and name HA ) 1.8 0.0 2.63 assign (segid B and resid 35 and name HB* )(segid B and resid 36 and name HE2* ) 1.8 0.0 4.07 assign (segid B and resid 35 and name HB* )(segid B and resid 36 and name HN ) 1.8 0.0 2.07 assign (segid B and resid 35 and name HB* )(segid B and resid 37 and name HN ) 1.8 0.0 3.59 assign (segid B and resid 35 and name HB* )(segid B and resid 81 and name HD1* ) 1.8 0.0 2.77 assign (segid B and resid 35 and name HB* )(segid B and resid 90 and name HD* ) 1.8 0.0 2.46 assign (segid B and resid 35 and name HB* )(segid B and resid 90 and name HE* ) 1.8 0.0 2.64 assign (segid B and resid 35 and name HN )(segid B and resid 35 and name HB* ) 1.8 0.0 1.29 assign (segid B and resid 35 and name HN )(segid B and resid 36 and name HN ) 1.8 0.0 2.58 assign (segid B and resid 35 and name HN )(segid B and resid 81 and name HD1* ) 1.8 0.0 2.9 assign (segid B and resid 36 and name HB* )(segid B and resid 37 and name HN ) 1.8 0.0 2.51 assign (segid B and resid 36 and name HG* )(segid B and resid 36 and name HE2* ) 1.8 0.0 1.68 assign (segid B and resid 36 and name HG* )(segid B and resid 37 and name HN ) 1.8 0.0 2.88 assign (segid B and resid 36 and name HN )(segid B and resid 36 and name HB* ) 1.8 0.0 1.72 assign (segid B and resid 36 and name HN )(segid B and resid 36 and name HG* ) 1.8 0.0 2.29 assign (segid B and resid 37 and name HA* )(segid B and resid 38 and name HB* ) 1.8 0.0 2.73 assign (segid B and resid 37 and name HA1 )(segid B and resid 38 and name HN ) 1.8 0.0 1.81 assign (segid B and resid 37 and name HA2 )(segid B and resid 38 and name HN ) 1.8 0.0 1.81 assign (segid B and resid 37 and name HN )(segid B and resid 38 and name HN ) 1.8 0.0 3.64 assign (segid B and resid 38 and name HA )(segid B and resid 39 and name HN ) 1.8 0.0 1.99 assign (segid B and resid 38 and name HA )(segid B and resid 80 and name HA ) 1.8 0.0 2.77 assign (segid B and resid 38 and name HB* )(segid B and resid 80 and name HE ) 1.8 0.0 3.64 assign (segid B and resid 38 and name HB* )(segid B and resid 80 and name HG* ) 1.8 0.0 3.21 assign (segid B and resid 38 and name HG* )(segid B and resid 39 and name HN ) 1.8 0.0 2.74 assign (segid B and resid 38 and name HG* )(segid B and resid 78 and name HB* ) 1.8 0.0 2.62 assign (segid B and resid 38 and name HG* )(segid B and resid 78 and name HD* ) 1.8 0.0 3.33 assign (segid B and resid 38 and name HN )(segid B and resid 38 and name HB* ) 1.8 0.0 1.64 assign (segid B and resid 38 and name HN )(segid B and resid 38 and name HG* ) 1.8 0.0 2.61 assign (segid B and resid 38 and name HN )(segid B and resid 39 and name HN ) 1.8 0.0 3.48 assign (segid B and resid 39 and name HA )(segid B and resid 39 and name HD* ) 1.8 0.0 2.75 assign (segid B and resid 39 and name HA )(segid B and resid 40 and name HN ) 1.8 0.0 1.76 assign (segid B and resid 39 and name HA )(segid B and resid 43 and name HB* ) 1.8 0.0 2.8 assign (segid B and resid 39 and name HA )(segid B and resid 44 and name HD1* ) 1.8 0.0 4.25 assign (segid B and resid 39 and name HB* )(segid B and resid 39 and name HE ) 1.8 0.0 4.07 assign (segid B and resid 39 and name HB* )(segid B and resid 40 and name HN ) 1.8 0.0 2.64 assign (segid B and resid 39 and name HD* )(segid B and resid 40 and name HN ) 1.8 0.0 3.4 assign (segid B and resid 39 and name HD* )(segid B and resid 43 and name HB* ) 1.8 0.0 2.94 assign (segid B and resid 39 and name HG* )(segid B and resid 40 and name HN ) 1.8 0.0 3.24 assign (segid B and resid 39 and name HN )(segid B and resid 79 and name HN ) 1.8 0.0 3.05 assign (segid B and resid 40 and name HA )(segid B and resid 41 and name HG1* ) 1.8 0.0 4.25 assign (segid B and resid 40 and name HA )(segid B and resid 41 and name HG2* ) 1.8 0.0 2.57 assign (segid B and resid 40 and name HA )(segid B and resid 41 and name HN ) 1.8 0.0 2.12 assign (segid B and resid 40 and name HA )(segid B and resid 78 and name HA ) 1.8 0.0 2.24 assign (segid B and resid 40 and name HA )(segid B and resid 79 and name HN ) 1.8 0.0 2.61 assign (segid B and resid 40 and name HB* )(segid B and resid 41 and name HA ) 1.8 0.0 3.44 assign (segid B and resid 40 and name HB* )(segid B and resid 41 and name HG1* ) 1.8 0.0 4.12 assign (segid B and resid 40 and name HB* )(segid B and resid 41 and name HN ) 1.8 0.0 1.96 assign (segid B and resid 40 and name HB* )(segid B and resid 42 and name HB* ) 1.8 0.0 2.47 assign (segid B and resid 40 and name HB* )(segid B and resid 42 and name HG* ) 1.8 0.0 3.15 assign (segid B and resid 40 and name HB* )(segid B and resid 42 and name HN ) 1.8 0.0 2.37 assign (segid B and resid 40 and name HB* )(segid B and resid 43 and name HB* ) 1.8 0.0 2.21 assign (segid B and resid 40 and name HB* )(segid B and resid 43 and name HN ) 1.8 0.0 2.33 assign (segid B and resid 40 and name HB* )(segid B and resid 44 and name HD1* ) 1.8 0.0 3.48 assign (segid B and resid 40 and name HB* )(segid B and resid 44 and name HN ) 1.8 0.0 3.71 assign (segid B and resid 40 and name HB* )(segid B and resid 52 and name HD* ) 1.8 0.0 4.18 assign (segid B and resid 40 and name HB* )(segid B and resid 76 and name HD* ) 1.8 0.0 1.8 assign (segid B and resid 40 and name HB* )(segid B and resid 78 and name HB* ) 1.8 0.0 4.07 assign (segid B and resid 40 and name HB* )(segid B and resid 78 and name HD* ) 1.8 0.0 2.23 assign (segid B and resid 40 and name HB* )(segid B and resid 78 and name HE* ) 1.8 0.0 2.08 assign (segid B and resid 40 and name HN )(segid B and resid 40 and name HB* ) 1.8 0.0 1.75 assign (segid B and resid 40 and name HN )(segid B and resid 43 and name HB* ) 1.8 0.0 2.3 assign (segid B and resid 40 and name HN )(segid B and resid 78 and name HD* ) 1.8 0.0 2.81 assign (segid B and resid 40 and name HN )(segid B and resid 78 and name HE* ) 1.8 0.0 2.66 assign (segid B and resid 41 and name HA )(segid B and resid 41 and name HG1* ) 1.8 0.0 1.86 assign (segid B and resid 41 and name HA )(segid B and resid 41 and name HG2* ) 1.8 0.0 1.65 assign (segid B and resid 41 and name HA )(segid B and resid 44 and name HB ) 1.8 0.0 3.13 assign (segid B and resid 41 and name HA )(segid B and resid 44 and name HD1* ) 1.8 0.0 1.86 assign (segid B and resid 41 and name HA )(segid B and resid 44 and name HN ) 1.8 0.0 3.51 assign (segid B and resid 41 and name HA )(segid B and resid 45 and name HN ) 1.8 0.0 3.61 assign (segid B and resid 41 and name HA )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.66 assign (segid B and resid 41 and name HB )(segid B and resid 42 and name HN ) 1.8 0.0 2.34 assign (segid B and resid 41 and name HB )(segid B and resid 52 and name HD* ) 1.8 0.0 2.5 assign (segid B and resid 41 and name HB )(segid B and resid 59 and name HD1* ) 1.8 0.0 3.01 assign (segid B and resid 41 and name HB )(segid B and resid 79 and name HE* ) 1.8 0.0 3.48 assign (segid B and resid 41 and name HG1* )(segid B and resid 42 and name HN ) 1.8 0.0 2.26 assign (segid B and resid 41 and name HG1* )(segid B and resid 43 and name HN ) 1.8 0.0 3.68 assign (segid B and resid 41 and name HG1* )(segid B and resid 44 and name HN ) 1.8 0.0 3.8 assign (segid B and resid 41 and name HG1* )(segid B and resid 45 and name HB* ) 1.8 0.0 2.12 assign (segid B and resid 41 and name HG1* )(segid B and resid 45 and name HN ) 1.8 0.0 3.63 assign (segid B and resid 41 and name HG1* )(segid B and resid 52 and name HB* ) 1.8 0.0 3.44 assign (segid B and resid 41 and name HG1* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.03 assign (segid B and resid 41 and name HG1* )(segid B and resid 56 and name HA ) 1.8 0.0 2.33 assign (segid B and resid 41 and name HG1* )(segid B and resid 56 and name HB* ) 1.8 0.0 3.29 assign (segid B and resid 41 and name HG1* )(segid B and resid 56 and name HN ) 1.8 0.0 3.17 assign (segid B and resid 41 and name HG1* )(segid B and resid 59 and name HB* ) 1.8 0.0 4.06 assign (segid B and resid 41 and name HG1* )(segid B and resid 59 and name HD1* ) 1.8 0.0 1.73 assign (segid B and resid 41 and name HG1* )(segid B and resid 79 and name HE* ) 1.8 0.0 3.09 assign (segid B and resid 41 and name HG2* )(segid B and resid 42 and name HN ) 1.8 0.0 2.72 assign (segid B and resid 41 and name HG2* )(segid B and resid 44 and name HN ) 1.8 0.0 4.15 assign (segid B and resid 41 and name HG2* )(segid B and resid 56 and name HB* ) 1.8 0.0 3.23 assign (segid B and resid 41 and name HG2* )(segid B and resid 59 and name HD1* ) 1.8 0.0 1.41 assign (segid B and resid 41 and name HG2* )(segid B and resid 59 and name HD2* ) 1.8 0.0 2.67 assign (segid B and resid 41 and name HG2* )(segid B and resid 77 and name HB* ) 1.8 0.0 1.59 assign (segid B and resid 41 and name HG2* )(segid B and resid 77 and name HG* ) 1.8 0.0 2.67 assign (segid B and resid 41 and name HG2* )(segid B and resid 79 and name HD* ) 1.8 0.0 2.03 assign (segid B and resid 41 and name HG2* )(segid B and resid 79 and name HE* ) 1.8 0.0 1.7 assign (segid B and resid 41 and name HN )(segid B and resid 41 and name HB ) 1.8 0.0 2.12 assign (segid B and resid 41 and name HN )(segid B and resid 41 and name HG1* ) 1.8 0.0 2.4 assign (segid B and resid 41 and name HN )(segid B and resid 41 and name HG2* ) 1.8 0.0 1.43 assign (segid B and resid 41 and name HN )(segid B and resid 42 and name HN ) 1.8 0.0 2.78 assign (segid B and resid 41 and name HN )(segid B and resid 44 and name HD1* ) 1.8 0.0 3.09 assign (segid B and resid 42 and name HA )(segid B and resid 42 and name HG* ) 1.8 0.0 1.91 assign (segid B and resid 42 and name HA )(segid B and resid 45 and name HB* ) 1.8 0.0 2.36 assign (segid B and resid 42 and name HA )(segid B and resid 45 and name HN ) 1.8 0.0 2.81 assign (segid B and resid 42 and name HA )(segid B and resid 46 and name HN ) 1.8 0.0 3.53 assign (segid B and resid 42 and name HA )(segid B and resid 52 and name HD* ) 1.8 0.0 1.54 assign (segid B and resid 42 and name HB* )(segid B and resid 43 and name HA ) 1.8 0.0 3.84 assign (segid B and resid 42 and name HB* )(segid B and resid 43 and name HN ) 1.8 0.0 2.18 assign (segid B and resid 42 and name HB* )(segid B and resid 45 and name HB* ) 1.8 0.0 3.82 assign (segid B and resid 42 and name HB* )(segid B and resid 52 and name HD1* ) 1.8 0.0 3.35 assign (segid B and resid 42 and name HB* )(segid B and resid 52 and name HD2* ) 1.8 0.0 3.35 assign (segid B and resid 42 and name HG* )(segid B and resid 43 and name HN ) 1.8 0.0 3.23 assign (segid B and resid 42 and name HG* )(segid B and resid 45 and name HB* ) 1.8 0.0 2.89 assign (segid B and resid 42 and name HG* )(segid B and resid 52 and name HD* ) 1.8 0.0 1.18 assign (segid B and resid 42 and name HG* )(segid B and resid 52 and name HG ) 1.8 0.0 2.67 assign (segid B and resid 42 and name HG1 )(segid B and resid 52 and name HD1* ) 1.8 0.0 2.54 assign (segid B and resid 42 and name HG1 )(segid B and resid 52 and name HD2* ) 1.8 0.0 2.54 assign (segid B and resid 42 and name HG2 )(segid B and resid 52 and name HD1* ) 1.8 0.0 2.54 assign (segid B and resid 42 and name HG2 )(segid B and resid 52 and name HD2* ) 1.8 0.0 2.54 assign (segid B and resid 42 and name HN )(segid B and resid 42 and name HB* ) 1.8 0.0 1.8 assign (segid B and resid 42 and name HN )(segid B and resid 42 and name HG* ) 1.8 0.0 2.19 assign (segid B and resid 42 and name HN )(segid B and resid 43 and name HB* ) 1.8 0.0 3.24 assign (segid B and resid 42 and name HN )(segid B and resid 43 and name HN ) 1.8 0.0 2.3 assign (segid B and resid 42 and name HN )(segid B and resid 52 and name HD1* ) 1.8 0.0 3.99 assign (segid B and resid 42 and name HN )(segid B and resid 52 and name HD2* ) 1.8 0.0 3.99 assign (segid B and resid 43 and name HA )(segid B and resid 46 and name HB ) 1.8 0.0 2.3 assign (segid B and resid 43 and name HA )(segid B and resid 46 and name HG2* ) 1.8 0.0 4.24 assign (segid B and resid 43 and name HA )(segid B and resid 46 and name HN ) 1.8 0.0 2.68 assign (segid B and resid 43 and name HA )(segid B and resid 47 and name HN ) 1.8 0.0 3.55 assign (segid B and resid 43 and name HB* )(segid B and resid 44 and name HA ) 1.8 0.0 2.88 assign (segid B and resid 43 and name HB* )(segid B and resid 44 and name HD1* ) 1.8 0.0 3.13 assign (segid B and resid 43 and name HB* )(segid B and resid 44 and name HN ) 1.8 0.0 2.08 assign (segid B and resid 43 and name HB* )(segid B and resid 45 and name HN ) 1.8 0.0 3.29 assign (segid B and resid 43 and name HN )(segid B and resid 43 and name HB* ) 1.8 0.0 1.59 assign (segid B and resid 43 and name HN )(segid B and resid 44 and name HN ) 1.8 0.0 2.1 assign (segid B and resid 44 and name HA )(segid B and resid 44 and name HG2* ) 1.8 0.0 1.98 assign (segid B and resid 44 and name HA )(segid B and resid 47 and name HB* ) 1.8 0.0 1.98 assign (segid B and resid 44 and name HA )(segid B and resid 47 and name HN ) 1.8 0.0 3.07 assign (segid B and resid 44 and name HA )(segid B and resid 48 and name HG2* ) 1.8 0.0 3.37 assign (segid B and resid 44 and name HB )(segid B and resid 45 and name HN ) 1.8 0.0 2.34 assign (segid B and resid 44 and name HB )(segid B and resid 59 and name HD1* ) 1.8 0.0 3.94 assign (segid B and resid 44 and name HD1* )(segid B and resid 45 and name HB* ) 1.8 0.0 3.55 assign (segid B and resid 44 and name HD1* )(segid B and resid 45 and name HN ) 1.8 0.0 3.61 assign (segid B and resid 44 and name HD1* )(segid B and resid 59 and name HD1* ) 1.8 0.0 1.7 assign (segid B and resid 44 and name HD1* )(segid B and resid 59 and name HD2* ) 1.8 0.0 1.36 assign (segid B and resid 44 and name HD1* )(segid B and resid 79 and name HD* ) 1.8 0.0 2.92 assign (segid B and resid 44 and name HD1* )(segid B and resid 79 and name HN ) 1.8 0.0 3.56 assign (segid B and resid 44 and name HG2* )(segid B and resid 45 and name HA ) 1.8 0.0 2.96 assign (segid B and resid 44 and name HG2* )(segid B and resid 45 and name HN ) 1.8 0.0 2.48 assign (segid B and resid 44 and name HG2* )(segid B and resid 47 and name HB* ) 1.8 0.0 2.31 assign (segid B and resid 44 and name HG2* )(segid B and resid 48 and name HB ) 1.8 0.0 3.89 assign (segid B and resid 44 and name HG2* )(segid B and resid 48 and name HG2* ) 1.8 0.0 2.02 assign (segid B and resid 44 and name HG2* )(segid B and resid 48 and name HN ) 1.8 0.0 2.92 assign (segid B and resid 44 and name HG2* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.37 assign (segid B and resid 44 and name HG2* )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.86 assign (segid B and resid 44 and name HG2* )(segid B and resid 59 and name HD2* ) 1.8 0.0 3.16 assign (segid B and resid 44 and name HN )(segid B and resid 44 and name HB ) 1.8 0.0 2.28 assign (segid B and resid 44 and name HN )(segid B and resid 44 and name HD1* ) 1.8 0.0 2.31 assign (segid B and resid 44 and name HN )(segid B and resid 44 and name HG1* ) 1.8 0.0 3.28 assign (segid B and resid 44 and name HN )(segid B and resid 44 and name HG2* ) 1.8 0.0 2.46 assign (segid B and resid 44 and name HN )(segid B and resid 45 and name HN ) 1.8 0.0 2.33 assign (segid B and resid 44 and name HN )(segid B and resid 59 and name HD1* ) 1.8 0.0 4.25 assign (segid B and resid 45 and name HA )(segid B and resid 48 and name HN ) 1.8 0.0 3.41 assign (segid B and resid 45 and name HA )(segid B and resid 50 and name HN ) 1.8 0.0 2.24 assign (segid B and resid 45 and name HA )(segid B and resid 55 and name HB* ) 1.8 0.0 2.14 assign (segid B and resid 45 and name HB* )(segid B and resid 46 and name HN ) 1.8 0.0 1.78 assign (segid B and resid 45 and name HB* )(segid B and resid 50 and name HE* ) 1.8 0.0 4.06 assign (segid B and resid 45 and name HB* )(segid B and resid 55 and name HB* ) 1.8 0.0 1.62 assign (segid B and resid 45 and name HN )(segid B and resid 45 and name HB* ) 1.8 0.0 1.56 assign (segid B and resid 45 and name HN )(segid B and resid 46 and name HB ) 1.8 0.0 3.8 assign (segid B and resid 45 and name HN )(segid B and resid 46 and name HN ) 1.8 0.0 2.25 assign (segid B and resid 45 and name HN )(segid B and resid 52 and name HD* ) 1.8 0.0 3.52 assign (segid B and resid 45 and name HN )(segid B and resid 55 and name HB* ) 1.8 0.0 2.75 assign (segid B and resid 46 and name HA )(segid B and resid 46 and name HG2* ) 1.8 0.0 1.49 assign (segid B and resid 46 and name HA )(segid B and resid 48 and name HN ) 1.8 0.0 3.49 assign (segid B and resid 46 and name HA )(segid B and resid 49 and name HN ) 1.8 0.0 2.99 assign (segid B and resid 46 and name HB )(segid B and resid 47 and name HB* ) 1.8 0.0 3.01 assign (segid B and resid 46 and name HB )(segid B and resid 47 and name HN ) 1.8 0.0 1.8 assign (segid B and resid 46 and name HG2* )(segid B and resid 47 and name HN ) 1.8 0.0 2.16 assign (segid B and resid 46 and name HN )(segid B and resid 46 and name HB ) 1.8 0.0 1.69 assign (segid B and resid 46 and name HN )(segid B and resid 46 and name HG2* ) 1.8 0.0 2.52 assign (segid B and resid 46 and name HN )(segid B and resid 47 and name HN ) 1.8 0.0 1.89 assign (segid B and resid 47 and name HB* )(segid B and resid 48 and name HN ) 1.8 0.0 2.15 assign (segid B and resid 47 and name HB* )(segid B and resid 49 and name HN ) 1.8 0.0 3.25 assign (segid B and resid 47 and name HN )(segid B and resid 47 and name HB* ) 1.8 0.0 1.38 assign (segid B and resid 47 and name HN )(segid B and resid 48 and name HG2* ) 1.8 0.0 3.93 assign (segid B and resid 47 and name HN )(segid B and resid 48 and name HN ) 1.8 0.0 2.12 assign (segid B and resid 48 and name HA )(segid B and resid 48 and name HG2* ) 1.8 0.0 1.68 assign (segid B and resid 48 and name HA )(segid B and resid 50 and name HE* ) 1.8 0.0 3.12 assign (segid B and resid 48 and name HB )(segid B and resid 50 and name HE* ) 1.8 0.0 1.4 assign (segid B and resid 48 and name HB )(segid B and resid 50 and name HG* ) 1.8 0.0 3.03 assign (segid B and resid 48 and name HB )(segid B and resid 50 and name HN ) 1.8 0.0 3.53 assign (segid B and resid 48 and name HG2* )(segid B and resid 49 and name HN ) 1.8 0.0 3 assign (segid B and resid 48 and name HG2* )(segid B and resid 50 and name HE* ) 1.8 0.0 1.32 assign (segid B and resid 48 and name HG2* )(segid B and resid 50 and name HN ) 1.8 0.0 3.7 assign (segid B and resid 48 and name HN )(segid B and resid 48 and name HG2* ) 1.8 0.0 1.89 assign (segid B and resid 48 and name HN )(segid B and resid 49 and name HN ) 1.8 0.0 2.03 assign (segid B and resid 50 and name HA )(segid B and resid 50 and name HE* ) 1.8 0.0 3.57 assign (segid B and resid 50 and name HA )(segid B and resid 50 and name HG* ) 1.8 0.0 2.01 assign (segid B and resid 50 and name HA )(segid B and resid 51 and name HN ) 1.8 0.0 1.64 assign (segid B and resid 50 and name HA )(segid B and resid 54 and name HG2* ) 1.8 0.0 4.25 assign (segid B and resid 50 and name HA )(segid B and resid 55 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 50 and name HB* )(segid B and resid 54 and name HG2* ) 1.8 0.0 2.93 assign (segid B and resid 50 and name HB* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.03 assign (segid B and resid 50 and name HB* )(segid B and resid 55 and name HN ) 1.8 0.0 2.72 assign (segid B and resid 50 and name HB1 )(segid B and resid 51 and name HN ) 1.8 0.0 2.6 assign (segid B and resid 50 and name HB2 )(segid B and resid 51 and name HN ) 1.8 0.0 2.6 assign (segid B and resid 50 and name HE* )(segid B and resid 55 and name HA ) 1.8 0.0 2.84 assign (segid B and resid 50 and name HE* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.97 assign (segid B and resid 50 and name HE* )(segid B and resid 55 and name HN ) 1.8 0.0 3.83 assign (segid B and resid 50 and name HE* )(segid B and resid 58 and name HD2* ) 1.8 0.0 3.62 assign (segid B and resid 50 and name HG* )(segid B and resid 50 and name HE* ) 1.8 0.0 1.57 assign (segid B and resid 50 and name HG* )(segid B and resid 54 and name HG2* ) 1.8 0.0 2.81 assign (segid B and resid 50 and name HG* )(segid B and resid 55 and name HB* ) 1.8 0.0 3.23 assign (segid B and resid 50 and name HN )(segid B and resid 50 and name HB* ) 1.8 0.0 2.04 assign (segid B and resid 50 and name HN )(segid B and resid 50 and name HE* ) 1.8 0.0 2.93 assign (segid B and resid 50 and name HN )(segid B and resid 50 and name HG* ) 1.8 0.0 1.97 assign (segid B and resid 50 and name HN )(segid B and resid 55 and name HB* ) 1.8 0.0 3.96 assign (segid B and resid 51 and name HA )(segid B and resid 52 and name HN ) 1.8 0.0 1.99 assign (segid B and resid 51 and name HA )(segid B and resid 53 and name HN ) 1.8 0.0 3.6 assign (segid B and resid 51 and name HA )(segid B and resid 55 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 51 and name HB* )(segid B and resid 53 and name HN ) 1.8 0.0 2.93 assign (segid B and resid 51 and name HB1 )(segid B and resid 52 and name HN ) 1.8 0.0 2.46 assign (segid B and resid 51 and name HB2 )(segid B and resid 52 and name HN ) 1.8 0.0 2.46 assign (segid B and resid 51 and name HN )(segid B and resid 51 and name HB* ) 1.8 0.0 1.98 assign (segid B and resid 51 and name HN )(segid B and resid 54 and name HG2* ) 1.8 0.0 3.83 assign (segid B and resid 51 and name HN )(segid B and resid 54 and name HN ) 1.8 0.0 3.46 assign (segid B and resid 51 and name HN )(segid B and resid 55 and name HB* ) 1.8 0.0 3.64 assign (segid B and resid 52 and name HA )(segid B and resid 52 and name HD* ) 1.8 0.0 1.88 assign (segid B and resid 52 and name HA )(segid B and resid 52 and name HG ) 1.8 0.0 2.4 assign (segid B and resid 52 and name HA )(segid B and resid 55 and name HB* ) 1.8 0.0 2.04 assign (segid B and resid 52 and name HA )(segid B and resid 55 and name HN ) 1.8 0.0 2.95 assign (segid B and resid 52 and name HA )(segid B and resid 56 and name HN ) 1.8 0.0 2.72 assign (segid B and resid 52 and name HB* )(segid B and resid 52 and name HD1* ) 1.8 0.0 2.39 assign (segid B and resid 52 and name HB* )(segid B and resid 52 and name HD2* ) 1.8 0.0 2.39 assign (segid B and resid 52 and name HB* )(segid B and resid 53 and name HN ) 1.8 0.0 1.91 assign (segid B and resid 52 and name HB* )(segid B and resid 55 and name HB* ) 1.8 0.0 3.51 assign (segid B and resid 52 and name HB* )(segid B and resid 56 and name HN ) 1.8 0.0 3.78 assign (segid B and resid 52 and name HD* )(segid B and resid 53 and name HN ) 1.8 0.0 2.9 assign (segid B and resid 52 and name HD* )(segid B and resid 55 and name HB* ) 1.8 0.0 2.53 assign (segid B and resid 52 and name HD* )(segid B and resid 56 and name HB* ) 1.8 0.0 3.99 assign (segid B and resid 52 and name HD* )(segid B and resid 56 and name HN ) 1.8 0.0 3.69 assign (segid B and resid 52 and name HN )(segid B and resid 52 and name HB* ) 1.8 0.0 1.64 assign (segid B and resid 52 and name HN )(segid B and resid 52 and name HD* ) 1.8 0.0 2.41 assign (segid B and resid 52 and name HN )(segid B and resid 52 and name HG ) 1.8 0.0 2.62 assign (segid B and resid 52 and name HN )(segid B and resid 53 and name HN ) 1.8 0.0 2.33 assign (segid B and resid 53 and name HB )(segid B and resid 54 and name HN ) 1.8 0.0 2.17 assign (segid B and resid 53 and name HB )(segid B and resid 55 and name HN ) 1.8 0.0 4.23 assign (segid B and resid 53 and name HG2* )(segid B and resid 54 and name HN ) 1.8 0.0 2.13 assign (segid B and resid 53 and name HN )(segid B and resid 53 and name HB ) 1.8 0.0 1.8 assign (segid B and resid 53 and name HN )(segid B and resid 53 and name HG2* ) 1.8 0.0 2.51 assign (segid B and resid 53 and name HN )(segid B and resid 54 and name HN ) 1.8 0.0 1.99 assign (segid B and resid 54 and name HB )(segid B and resid 55 and name HN ) 1.8 0.0 2.48 assign (segid B and resid 54 and name HG2* )(segid B and resid 55 and name HN ) 1.8 0.0 2.6 assign (segid B and resid 54 and name HG2* )(segid B and resid 57 and name HN ) 1.8 0.0 3.26 assign (segid B and resid 54 and name HG2* )(segid B and resid 58 and name HD21 ) 1.8 0.0 2.1 assign (segid B and resid 54 and name HG2* )(segid B and resid 58 and name HD22 ) 1.8 0.0 2.1 assign (segid B and resid 54 and name HN )(segid B and resid 54 and name HB ) 1.8 0.0 2.48 assign (segid B and resid 54 and name HN )(segid B and resid 54 and name HG2* ) 1.8 0.0 3.34 assign (segid B and resid 54 and name HN )(segid B and resid 55 and name HN ) 1.8 0.0 2.13 assign (segid B and resid 55 and name HA )(segid B and resid 58 and name HB* ) 1.8 0.0 3.17 assign (segid B and resid 55 and name HA )(segid B and resid 58 and name HN ) 1.8 0.0 3.11 assign (segid B and resid 55 and name HB* )(segid B and resid 56 and name HA ) 1.8 0.0 3.15 assign (segid B and resid 55 and name HB* )(segid B and resid 56 and name HN ) 1.8 0.0 1.87 assign (segid B and resid 55 and name HB* )(segid B and resid 57 and name HN ) 1.8 0.0 4.01 assign (segid B and resid 55 and name HB* )(segid B and resid 58 and name HB* ) 1.8 0.0 4.07 assign (segid B and resid 55 and name HB* )(segid B and resid 58 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 55 and name HB* )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.57 assign (segid B and resid 55 and name HN )(segid B and resid 55 and name HB* ) 1.8 0.0 1.8 assign (segid B and resid 55 and name HN )(segid B and resid 56 and name HN ) 1.8 0.0 2.3 assign (segid B and resid 55 and name HN )(segid B and resid 57 and name HN ) 1.8 0.0 3.49 assign (segid B and resid 56 and name HA )(segid B and resid 57 and name HB* ) 1.8 0.0 3.79 assign (segid B and resid 56 and name HA )(segid B and resid 59 and name HB1 ) 1.8 0.0 3.38 assign (segid B and resid 56 and name HA )(segid B and resid 59 and name HB2 ) 1.8 0.0 3.38 assign (segid B and resid 56 and name HA )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.12 assign (segid B and resid 56 and name HA )(segid B and resid 59 and name HD2* ) 1.8 0.0 3.67 assign (segid B and resid 56 and name HA )(segid B and resid 59 and name HN ) 1.8 0.0 2.75 assign (segid B and resid 56 and name HB* )(segid B and resid 57 and name HB* ) 1.8 0.0 3.9 assign (segid B and resid 56 and name HN )(segid B and resid 56 and name HB* ) 1.8 0.0 1.92 assign (segid B and resid 56 and name HN )(segid B and resid 57 and name HB* ) 1.8 0.0 3.21 assign (segid B and resid 56 and name HN )(segid B and resid 57 and name HN ) 1.8 0.0 2.1 assign (segid B and resid 57 and name HA )(segid B and resid 60 and name HB* ) 1.8 0.0 2.23 assign (segid B and resid 57 and name HB* )(segid B and resid 58 and name HN ) 1.8 0.0 2.13 assign (segid B and resid 57 and name HB* )(segid B and resid 60 and name HB* ) 1.8 0.0 3.42 assign (segid B and resid 57 and name HB* )(segid B and resid 60 and name HN ) 1.8 0.0 3.8 assign (segid B and resid 57 and name HN )(segid B and resid 57 and name HB* ) 1.8 0.0 1.59 assign (segid B and resid 57 and name HN )(segid B and resid 58 and name HN ) 1.8 0.0 2.4 assign (segid B and resid 58 and name HA )(segid B and resid 61 and name HB* ) 1.8 0.0 1.62 assign (segid B and resid 58 and name HA )(segid B and resid 61 and name HN ) 1.8 0.0 2.93 assign (segid B and resid 58 and name HN )(segid B and resid 58 and name HB* ) 1.8 0.0 2.02 assign (segid B and resid 58 and name HN )(segid B and resid 59 and name HD1* ) 1.8 0.0 4.25 assign (segid B and resid 58 and name HN )(segid B and resid 59 and name HN ) 1.8 0.0 2.61 assign (segid B and resid 59 and name HA )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.73 assign (segid B and resid 59 and name HA )(segid B and resid 59 and name HD2* ) 1.8 0.0 1.92 assign (segid B and resid 59 and name HA )(segid B and resid 62 and name HB* ) 1.8 0.0 3.67 assign (segid B and resid 59 and name HA )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.47 assign (segid B and resid 59 and name HA )(segid B and resid 62 and name HD2* ) 1.8 0.0 4.72 assign (segid B and resid 59 and name HA )(segid B and resid 62 and name HN ) 1.8 0.0 3.7 assign (segid B and resid 59 and name HA )(segid B and resid 68 and name HG2* ) 1.8 0.0 4.25 assign (segid B and resid 59 and name HB* )(segid B and resid 59 and name HD1* ) 1.8 0.0 1.51 assign (segid B and resid 59 and name HB* )(segid B and resid 60 and name HN ) 1.8 0.0 2.27 assign (segid B and resid 59 and name HB* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.52 assign (segid B and resid 59 and name HD1* )(segid B and resid 60 and name HN ) 1.8 0.0 3.7 assign (segid B and resid 59 and name HD1* )(segid B and resid 79 and name HD* ) 1.8 0.0 3.03 assign (segid B and resid 59 and name HD1* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.84 assign (segid B and resid 59 and name HD2* )(segid B and resid 60 and name HN ) 1.8 0.0 3.88 assign (segid B and resid 59 and name HD2* )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.4 assign (segid B and resid 59 and name HD2* )(segid B and resid 79 and name HB* ) 1.8 0.0 2.61 assign (segid B and resid 59 and name HD2* )(segid B and resid 79 and name HD* ) 1.8 0.0 2.62 assign (segid B and resid 59 and name HD2* )(segid B and resid 79 and name HE* ) 1.8 0.0 3.26 assign (segid B and resid 59 and name HN )(segid B and resid 59 and name HD1* ) 1.8 0.0 2.43 assign (segid B and resid 59 and name HN )(segid B and resid 59 and name HD2* ) 1.8 0.0 2.67 assign (segid B and resid 59 and name HN )(segid B and resid 59 and name HG ) 1.8 0.0 2.63 assign (segid B and resid 59 and name HN )(segid B and resid 60 and name HB* ) 1.8 0.0 3.37 assign (segid B and resid 59 and name HN )(segid B and resid 60 and name HN ) 1.8 0.0 2.39 assign (segid B and resid 60 and name HA )(segid B and resid 60 and name HE2* ) 1.8 0.0 3.17 assign (segid B and resid 60 and name HA )(segid B and resid 60 and name HG* ) 1.8 0.0 1.69 assign (segid B and resid 60 and name HA )(segid B and resid 63 and name HB* ) 1.8 0.0 2.81 assign (segid B and resid 60 and name HA )(segid B and resid 63 and name HG* ) 1.8 0.0 2.93 assign (segid B and resid 60 and name HA )(segid B and resid 63 and name HN ) 1.8 0.0 3.02 assign (segid B and resid 60 and name HB* )(segid B and resid 61 and name HA ) 1.8 0.0 3.12 assign (segid B and resid 60 and name HB* )(segid B and resid 61 and name HB* ) 1.8 0.0 3.64 assign (segid B and resid 60 and name HB* )(segid B and resid 61 and name HN ) 1.8 0.0 2.16 assign (segid B and resid 60 and name HG* )(segid B and resid 61 and name HA ) 1.8 0.0 4 assign (segid B and resid 60 and name HG* )(segid B and resid 61 and name HN ) 1.8 0.0 3.44 assign (segid B and resid 60 and name HN )(segid B and resid 60 and name HB* ) 1.8 0.0 1.72 assign (segid B and resid 60 and name HN )(segid B and resid 60 and name HG* ) 1.8 0.0 2.74 assign (segid B and resid 60 and name HN )(segid B and resid 61 and name HB* ) 1.8 0.0 4.05 assign (segid B and resid 60 and name HN )(segid B and resid 61 and name HN ) 1.8 0.0 2.33 assign (segid B and resid 61 and name HB* )(segid B and resid 62 and name HN ) 1.8 0.0 2.49 assign (segid B and resid 61 and name HB* )(segid B and resid 64 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 61 and name HN )(segid B and resid 61 and name HB* ) 1.8 0.0 1.45 assign (segid B and resid 61 and name HN )(segid B and resid 62 and name HN ) 1.8 0.0 2.35 assign (segid B and resid 62 and name HA )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.77 assign (segid B and resid 62 and name HA )(segid B and resid 67 and name HD2* ) 1.8 0.0 3.33 assign (segid B and resid 62 and name HA )(segid B and resid 68 and name HG1* ) 1.8 0.0 4.25 assign (segid B and resid 62 and name HB* )(segid B and resid 62 and name HD2* ) 1.8 0.0 2.79 assign (segid B and resid 62 and name HB* )(segid B and resid 63 and name HN ) 1.8 0.0 2.64 assign (segid B and resid 62 and name HB* )(segid B and resid 67 and name HD2* ) 1.8 0.0 3.56 assign (segid B and resid 62 and name HB* )(segid B and resid 68 and name HG1* ) 1.8 0.0 2.5 assign (segid B and resid 62 and name HB1 )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.68 assign (segid B and resid 62 and name HB1 )(segid B and resid 68 and name HG2* ) 1.8 0.0 3.52 assign (segid B and resid 62 and name HB2 )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.68 assign (segid B and resid 62 and name HB2 )(segid B and resid 68 and name HG2* ) 1.8 0.0 3.52 assign (segid B and resid 62 and name HD1* )(segid B and resid 63 and name HN ) 1.8 0.0 3.28 assign (segid B and resid 62 and name HN )(segid B and resid 62 and name HD1* ) 1.8 0.0 2.66 assign (segid B and resid 62 and name HN )(segid B and resid 62 and name HD2* ) 1.8 0.0 3.05 assign (segid B and resid 62 and name HN )(segid B and resid 62 and name HG ) 1.8 0.0 2.49 assign (segid B and resid 62 and name HN )(segid B and resid 63 and name HN ) 1.8 0.0 2.72 assign (segid B and resid 63 and name HA )(segid B and resid 63 and name HG* ) 1.8 0.0 2.14 assign (segid B and resid 63 and name HA )(segid B and resid 67 and name HN ) 1.8 0.0 3.44 assign (segid B and resid 63 and name HA )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.14 assign (segid B and resid 63 and name HA )(segid B and resid 68 and name HN ) 1.8 0.0 2.48 assign (segid B and resid 63 and name HB* )(segid B and resid 63 and name HE* ) 1.8 0.0 2.13 assign (segid B and resid 63 and name HB* )(segid B and resid 64 and name HN ) 1.8 0.0 2.27 assign (segid B and resid 63 and name HB* )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.1 assign (segid B and resid 63 and name HB* )(segid B and resid 68 and name HN ) 1.8 0.0 3.48 assign (segid B and resid 63 and name HB* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.31 assign (segid B and resid 63 and name HB* )(segid B and resid 69 and name HA ) 1.8 0.0 3.37 assign (segid B and resid 63 and name HD* )(segid B and resid 70 and name HB* ) 1.8 0.0 3.12 assign (segid B and resid 63 and name HD* )(segid B and resid 70 and name HN ) 1.8 0.0 3.92 assign (segid B and resid 63 and name HD* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.64 assign (segid B and resid 63 and name HE* )(segid B and resid 69 and name HA ) 1.8 0.0 2.96 assign (segid B and resid 63 and name HE* )(segid B and resid 70 and name HB* ) 1.8 0.0 1.61 assign (segid B and resid 63 and name HE* )(segid B and resid 70 and name HN ) 1.8 0.0 2.38 assign (segid B and resid 63 and name HE* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.42 assign (segid B and resid 63 and name HG* )(segid B and resid 64 and name HA ) 1.8 0.0 3.3 assign (segid B and resid 63 and name HG* )(segid B and resid 64 and name HN ) 1.8 0.0 2.66 assign (segid B and resid 63 and name HG* )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.79 assign (segid B and resid 63 and name HG* )(segid B and resid 68 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 63 and name HG* )(segid B and resid 70 and name HB* ) 1.8 0.0 3.71 assign (segid B and resid 63 and name HG* )(segid B and resid 79 and name HE* ) 1.8 0.0 3.39 assign (segid B and resid 63 and name HN )(segid B and resid 63 and name HD* ) 1.8 0.0 3.6 assign (segid B and resid 63 and name HN )(segid B and resid 63 and name HG* ) 1.8 0.0 2.63 assign (segid B and resid 63 and name HN )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.69 assign (segid B and resid 64 and name HA )(segid B and resid 66 and name HN ) 1.8 0.0 3.11 assign (segid B and resid 64 and name HB* )(segid B and resid 65 and name HA* ) 1.8 0.0 3.51 assign (segid B and resid 64 and name HB* )(segid B and resid 65 and name HN ) 1.8 0.0 2.48 assign (segid B and resid 64 and name HN )(segid B and resid 64 and name HB* ) 1.8 0.0 1.61 assign (segid B and resid 64 and name HN )(segid B and resid 65 and name HN ) 1.8 0.0 2.38 assign (segid B and resid 65 and name HA* )(segid B and resid 67 and name HB* ) 1.8 0.0 3.69 assign (segid B and resid 65 and name HN )(segid B and resid 66 and name HA* ) 1.8 0.0 3.64 assign (segid B and resid 65 and name HN )(segid B and resid 66 and name HN ) 1.8 0.0 2.42 assign (segid B and resid 65 and name HN )(segid B and resid 67 and name HN ) 1.8 0.0 3.14 assign (segid B and resid 66 and name HA* )(segid B and resid 67 and name HD2* ) 1.8 0.0 3.7 assign (segid B and resid 66 and name HN )(segid B and resid 67 and name HB* ) 1.8 0.0 3.23 assign (segid B and resid 66 and name HN )(segid B and resid 67 and name HN ) 1.8 0.0 2.56 assign (segid B and resid 67 and name HA )(segid B and resid 67 and name HD1* ) 1.8 0.0 2.12 assign (segid B and resid 67 and name HA )(segid B and resid 67 and name HD2* ) 1.8 0.0 2.85 assign (segid B and resid 67 and name HA )(segid B and resid 82 and name HB* ) 1.8 0.0 2.7 assign (segid B and resid 67 and name HA )(segid B and resid 86 and name HG1* ) 1.8 0.0 3.4 assign (segid B and resid 67 and name HA )(segid B and resid 86 and name HG2* ) 1.8 0.0 1.96 assign (segid B and resid 67 and name HB* )(segid B and resid 67 and name HD1* ) 1.8 0.0 1.87 assign (segid B and resid 67 and name HB* )(segid B and resid 67 and name HD2* ) 1.8 0.0 1.87 assign (segid B and resid 67 and name HB* )(segid B and resid 68 and name HA ) 1.8 0.0 3.7 assign (segid B and resid 67 and name HB* )(segid B and resid 68 and name HG1* ) 1.8 0.0 2.46 assign (segid B and resid 67 and name HB* )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.95 assign (segid B and resid 67 and name HB* )(segid B and resid 68 and name HN ) 1.8 0.0 2.49 assign (segid B and resid 67 and name HD1* )(segid B and resid 86 and name HA ) 1.8 0.0 3.09 assign (segid B and resid 67 and name HD1* )(segid B and resid 86 and name HG1* ) 1.8 0.0 2.2 assign (segid B and resid 67 and name HD2* )(segid B and resid 68 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 67 and name HN )(segid B and resid 67 and name HD1* ) 1.8 0.0 2.81 assign (segid B and resid 67 and name HN )(segid B and resid 67 and name HD2* ) 1.8 0.0 2.57 assign (segid B and resid 67 and name HN )(segid B and resid 68 and name HG2* ) 1.8 0.0 3.3 assign (segid B and resid 67 and name HN )(segid B and resid 68 and name HN ) 1.8 0.0 2.18 assign (segid B and resid 68 and name HA )(segid B and resid 68 and name HG1* ) 1.8 0.0 2.28 assign (segid B and resid 68 and name HA )(segid B and resid 69 and name HB* ) 1.8 0.0 4.2 assign (segid B and resid 68 and name HA )(segid B and resid 80 and name HN ) 1.8 0.0 3.69 assign (segid B and resid 68 and name HA )(segid B and resid 81 and name HA ) 1.8 0.0 2.78 assign (segid B and resid 68 and name HA )(segid B and resid 81 and name HG2* ) 1.8 0.0 3.13 assign (segid B and resid 68 and name HA )(segid B and resid 82 and name HB* ) 1.8 0.0 2.47 assign (segid B and resid 68 and name HA )(segid B and resid 82 and name HN ) 1.8 0.0 2.88 assign (segid B and resid 68 and name HB )(segid B and resid 69 and name HN ) 1.8 0.0 2.41 assign (segid B and resid 68 and name HB )(segid B and resid 80 and name HN ) 1.8 0.0 3.35 assign (segid B and resid 68 and name HB )(segid B and resid 81 and name HA ) 1.8 0.0 3.71 assign (segid B and resid 68 and name HG1* )(segid B and resid 69 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 68 and name HG1* )(segid B and resid 69 and name HN ) 1.8 0.0 2.56 assign (segid B and resid 68 and name HG1* )(segid B and resid 80 and name HN ) 1.8 0.0 3.95 assign (segid B and resid 68 and name HG1* )(segid B and resid 81 and name HA ) 1.8 0.0 2.43 assign (segid B and resid 68 and name HG1* )(segid B and resid 82 and name HN ) 1.8 0.0 3.01 assign (segid B and resid 68 and name HG1* )(segid B and resid 86 and name HG1* ) 1.8 0.0 2.77 assign (segid B and resid 68 and name HG2* )(segid B and resid 69 and name HA ) 1.8 0.0 3.26 assign (segid B and resid 68 and name HG2* )(segid B and resid 69 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 68 and name HG2* )(segid B and resid 69 and name HN ) 1.8 0.0 3.08 assign (segid B and resid 68 and name HG2* )(segid B and resid 79 and name HD* ) 1.8 0.0 2.25 assign (segid B and resid 68 and name HG2* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.8 assign (segid B and resid 68 and name HG2* )(segid B and resid 80 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 68 and name HN )(segid B and resid 68 and name HG1* ) 1.8 0.0 3.04 assign (segid B and resid 68 and name HN )(segid B and resid 68 and name HG2* ) 1.8 0.0 2.03 assign (segid B and resid 68 and name HN )(segid B and resid 82 and name HB* ) 1.8 0.0 2.83 assign (segid B and resid 68 and name HN )(segid B and resid 86 and name HG1* ) 1.8 0.0 3.7 assign (segid B and resid 69 and name HA )(segid B and resid 69 and name HG1 ) 1.8 0.0 2.58 assign (segid B and resid 69 and name HA )(segid B and resid 69 and name HG2 ) 1.8 0.0 2.58 assign (segid B and resid 69 and name HA )(segid B and resid 70 and name HB* ) 1.8 0.0 3.08 assign (segid B and resid 69 and name HA )(segid B and resid 70 and name HN ) 1.8 0.0 1.57 assign (segid B and resid 69 and name HB1 )(segid B and resid 70 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 69 and name HB1 )(segid B and resid 70 and name HN ) 1.8 0.0 2.77 assign (segid B and resid 69 and name HB1 )(segid B and resid 82 and name HB* ) 1.8 0.0 4.02 assign (segid B and resid 69 and name HB2 )(segid B and resid 70 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 69 and name HB2 )(segid B and resid 70 and name HN ) 1.8 0.0 2.77 assign (segid B and resid 69 and name HB2 )(segid B and resid 82 and name HB* ) 1.8 0.0 4.02 assign (segid B and resid 69 and name HG* )(segid B and resid 70 and name HN ) 1.8 0.0 3.05 assign (segid B and resid 69 and name HG1 )(segid B and resid 82 and name HA ) 1.8 0.0 2.71 assign (segid B and resid 69 and name HG1 )(segid B and resid 82 and name HB* ) 1.8 0.0 1.94 assign (segid B and resid 69 and name HG2 )(segid B and resid 82 and name HA ) 1.8 0.0 2.71 assign (segid B and resid 69 and name HG2 )(segid B and resid 82 and name HB* ) 1.8 0.0 1.94 assign (segid B and resid 69 and name HN )(segid B and resid 69 and name HG* ) 1.8 0.0 2.96 assign (segid B and resid 69 and name HN )(segid B and resid 80 and name HN ) 1.8 0.0 2.7 assign (segid B and resid 69 and name HN )(segid B and resid 81 and name HA ) 1.8 0.0 3.23 assign (segid B and resid 69 and name HN )(segid B and resid 82 and name HB* ) 1.8 0.0 3.14 assign (segid B and resid 69 and name HN )(segid B and resid 82 and name HN ) 1.8 0.0 3.67 assign (segid B and resid 70 and name HA )(segid B and resid 71 and name HN ) 1.8 0.0 1.92 assign (segid B and resid 70 and name HA )(segid B and resid 79 and name HA ) 1.8 0.0 1.68 assign (segid B and resid 70 and name HA )(segid B and resid 80 and name HN ) 1.8 0.0 3.23 assign (segid B and resid 70 and name HB* )(segid B and resid 71 and name HA ) 1.8 0.0 3.46 assign (segid B and resid 70 and name HB* )(segid B and resid 71 and name HN ) 1.8 0.0 2.19 assign (segid B and resid 70 and name HB* )(segid B and resid 77 and name HB* ) 1.8 0.0 3.47 assign (segid B and resid 70 and name HB* )(segid B and resid 77 and name HE21 ) 1.8 0.0 2.95 assign (segid B and resid 70 and name HB* )(segid B and resid 77 and name HE22 ) 1.8 0.0 2.95 assign (segid B and resid 70 and name HB* )(segid B and resid 77 and name HG* ) 1.8 0.0 4.07 assign (segid B and resid 70 and name HB* )(segid B and resid 79 and name HA ) 1.8 0.0 2.68 assign (segid B and resid 70 and name HB* )(segid B and resid 79 and name HD* ) 1.8 0.0 3.01 assign (segid B and resid 70 and name HB* )(segid B and resid 79 and name HE* ) 1.8 0.0 1.92 assign (segid B and resid 70 and name HN )(segid B and resid 70 and name HB* ) 1.8 0.0 1.58 assign (segid B and resid 71 and name HA )(segid B and resid 72 and name HB* ) 1.8 0.0 3.3 assign (segid B and resid 71 and name HA )(segid B and resid 72 and name HN ) 1.8 0.0 1.61 assign (segid B and resid 71 and name HB* )(segid B and resid 71 and name HE ) 1.8 0.0 3.19 assign (segid B and resid 71 and name HB* )(segid B and resid 72 and name HN ) 1.8 0.0 2.6 assign (segid B and resid 71 and name HB* )(segid B and resid 79 and name HA ) 1.8 0.0 4.07 assign (segid B and resid 71 and name HD* )(segid B and resid 71 and name HH2* ) 1.8 0.0 3.05 assign (segid B and resid 71 and name HG* )(segid B and resid 72 and name HN ) 1.8 0.0 3.52 assign (segid B and resid 71 and name HG* )(segid B and resid 78 and name HB* ) 1.8 0.0 3.21 assign (segid B and resid 71 and name HN )(segid B and resid 71 and name HG* ) 1.8 0.0 2.89 assign (segid B and resid 71 and name HN )(segid B and resid 78 and name HN ) 1.8 0.0 2.67 assign (segid B and resid 71 and name HN )(segid B and resid 79 and name HA ) 1.8 0.0 3.33 assign (segid B and resid 72 and name HA )(segid B and resid 72 and name HD* ) 1.8 0.0 2.69 assign (segid B and resid 72 and name HA )(segid B and resid 72 and name HG1 ) 1.8 0.0 2.63 assign (segid B and resid 72 and name HA )(segid B and resid 72 and name HG2 ) 1.8 0.0 2.63 assign (segid B and resid 72 and name HA )(segid B and resid 73 and name HN ) 1.8 0.0 1.67 assign (segid B and resid 72 and name HA )(segid B and resid 77 and name HA ) 1.8 0.0 2.91 assign (segid B and resid 72 and name HA )(segid B and resid 77 and name HG* ) 1.8 0.0 3.09 assign (segid B and resid 72 and name HA )(segid B and resid 78 and name HN ) 1.8 0.0 2.94 assign (segid B and resid 72 and name HB* )(segid B and resid 73 and name HN ) 1.8 0.0 2.74 assign (segid B and resid 72 and name HB1 )(segid B and resid 72 and name HD* ) 1.8 0.0 2.22 assign (segid B and resid 72 and name HB2 )(segid B and resid 72 and name HD* ) 1.8 0.0 2.22 assign (segid B and resid 72 and name HD* )(segid B and resid 73 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 72 and name HD* )(segid B and resid 77 and name HG* ) 1.8 0.0 2.54 assign (segid B and resid 72 and name HG* )(segid B and resid 73 and name HN ) 1.8 0.0 3.61 assign (segid B and resid 72 and name HN )(segid B and resid 72 and name HB* ) 1.8 0.0 1.49 assign (segid B and resid 72 and name HN )(segid B and resid 72 and name HD* ) 1.8 0.0 4.03 assign (segid B and resid 72 and name HN )(segid B and resid 72 and name HG* ) 1.8 0.0 3.29 assign (segid B and resid 73 and name HA )(segid B and resid 73 and name HG* ) 1.8 0.0 1.95 assign (segid B and resid 73 and name HB* )(segid B and resid 76 and name HG* ) 1.8 0.0 4.06 assign (segid B and resid 73 and name HB* )(segid B and resid 78 and name HD* ) 1.8 0.0 1.98 assign (segid B and resid 73 and name HB* )(segid B and resid 78 and name HE* ) 1.8 0.0 2.23 assign (segid B and resid 73 and name HG* )(segid B and resid 78 and name HD* ) 1.8 0.0 3.14 assign (segid B and resid 73 and name HG* )(segid B and resid 78 and name HE* ) 1.8 0.0 3.25 assign (segid B and resid 73 and name HN )(segid B and resid 73 and name HG* ) 1.8 0.0 2.78 assign (segid B and resid 73 and name HN )(segid B and resid 76 and name HG* ) 1.8 0.0 4.75 assign (segid B and resid 73 and name HN )(segid B and resid 77 and name HA ) 1.8 0.0 2.69 assign (segid B and resid 73 and name HN )(segid B and resid 78 and name HD* ) 1.8 0.0 3.71 assign (segid B and resid 74 and name HA* )(segid B and resid 75 and name HB ) 1.8 0.0 3.46 assign (segid B and resid 74 and name HA* )(segid B and resid 76 and name HN ) 1.8 0.0 2.99 assign (segid B and resid 75 and name HA )(segid B and resid 75 and name HG2* ) 1.8 0.0 1.73 assign (segid B and resid 75 and name HG2* )(segid B and resid 76 and name HN ) 1.8 0.0 2.88 assign (segid B and resid 75 and name HN )(segid B and resid 75 and name HG2* ) 1.8 0.0 3.53 assign (segid B and resid 75 and name HN )(segid B and resid 76 and name HG* ) 1.8 0.0 4.13 assign (segid B and resid 75 and name HN )(segid B and resid 76 and name HN ) 1.8 0.0 2.27 assign (segid B and resid 76 and name HA )(segid B and resid 76 and name HD* ) 1.8 0.0 3.14 assign (segid B and resid 76 and name HA )(segid B and resid 76 and name HG1 ) 1.8 0.0 2.58 assign (segid B and resid 76 and name HA )(segid B and resid 76 and name HG2 ) 1.8 0.0 2.58 assign (segid B and resid 76 and name HA )(segid B and resid 77 and name HN ) 1.8 0.0 1.46 assign (segid B and resid 76 and name HB* )(segid B and resid 78 and name HD* ) 1.8 0.0 4.25 assign (segid B and resid 76 and name HB* )(segid B and resid 78 and name HE* ) 1.8 0.0 4.25 assign (segid B and resid 76 and name HB1 )(segid B and resid 76 and name HD* ) 1.8 0.0 2.5 assign (segid B and resid 76 and name HB1 )(segid B and resid 77 and name HN ) 1.8 0.0 3.16 assign (segid B and resid 76 and name HB2 )(segid B and resid 76 and name HD* ) 1.8 0.0 2.5 assign (segid B and resid 76 and name HB2 )(segid B and resid 77 and name HN ) 1.8 0.0 3.16 assign (segid B and resid 76 and name HD* )(segid B and resid 77 and name HN ) 1.8 0.0 3 assign (segid B and resid 76 and name HD* )(segid B and resid 78 and name HE* ) 1.8 0.0 2.29 assign (segid B and resid 76 and name HG* )(segid B and resid 77 and name HN ) 1.8 0.0 2.63 assign (segid B and resid 76 and name HG* )(segid B and resid 78 and name HE* ) 1.8 0.0 3.47 assign (segid B and resid 76 and name HN )(segid B and resid 76 and name HD* ) 1.8 0.0 2.94 assign (segid B and resid 76 and name HN )(segid B and resid 76 and name HG1 ) 1.8 0.0 2.45 assign (segid B and resid 76 and name HN )(segid B and resid 76 and name HG2 ) 1.8 0.0 2.45 assign (segid B and resid 76 and name HN )(segid B and resid 77 and name HN ) 1.8 0.0 3.17 assign (segid B and resid 77 and name HA )(segid B and resid 77 and name HG1 ) 1.8 0.0 2.43 assign (segid B and resid 77 and name HA )(segid B and resid 77 and name HG2 ) 1.8 0.0 2.43 assign (segid B and resid 77 and name HA )(segid B and resid 78 and name HN ) 1.8 0.0 1.99 assign (segid B and resid 77 and name HB* )(segid B and resid 77 and name HE2* ) 1.8 0.0 3.17 assign (segid B and resid 77 and name HB* )(segid B and resid 78 and name HN ) 1.8 0.0 2.68 assign (segid B and resid 77 and name HB* )(segid B and resid 79 and name HE* ) 1.8 0.0 2.88 assign (segid B and resid 77 and name HG* )(segid B and resid 77 and name HE2* ) 1.8 0.0 1.63 assign (segid B and resid 77 and name HG* )(segid B and resid 78 and name HN ) 1.8 0.0 3.57 assign (segid B and resid 77 and name HG* )(segid B and resid 79 and name HE* ) 1.8 0.0 3.11 assign (segid B and resid 77 and name HN )(segid B and resid 77 and name HB* ) 1.8 0.0 1.79 assign (segid B and resid 77 and name HN )(segid B and resid 77 and name HG* ) 1.8 0.0 2.29 assign (segid B and resid 78 and name HB* )(segid B and resid 79 and name HN ) 1.8 0.0 2.77 assign (segid B and resid 78 and name HN )(segid B and resid 78 and name HD* ) 1.8 0.0 2.77 assign (segid B and resid 79 and name HA )(segid B and resid 79 and name HD* ) 1.8 0.0 3.46 assign (segid B and resid 79 and name HA )(segid B and resid 80 and name HG* ) 1.8 0.0 4.07 assign (segid B and resid 79 and name HN )(segid B and resid 79 and name HD* ) 1.8 0.0 2.93 assign (segid B and resid 80 and name HA )(segid B and resid 81 and name HG1* ) 1.8 0.0 4.05 assign (segid B and resid 80 and name HB* )(segid B and resid 80 and name HE ) 1.8 0.0 2.74 assign (segid B and resid 80 and name HB* )(segid B and resid 81 and name HN ) 1.8 0.0 2.74 assign (segid B and resid 80 and name HN )(segid B and resid 80 and name HD* ) 1.8 0.0 3.58 assign (segid B and resid 80 and name HN )(segid B and resid 80 and name HG* ) 1.8 0.0 2.47 assign (segid B and resid 81 and name HA )(segid B and resid 81 and name HG2* ) 1.8 0.0 1.69 assign (segid B and resid 81 and name HA )(segid B and resid 82 and name HB* ) 1.8 0.0 2.68 assign (segid B and resid 81 and name HA )(segid B and resid 86 and name HB ) 1.8 0.0 4.25 assign (segid B and resid 81 and name HB )(segid B and resid 82 and name HN ) 1.8 0.0 3.59 assign (segid B and resid 81 and name HD1* )(segid B and resid 82 and name HN ) 1.8 0.0 3.22 assign (segid B and resid 81 and name HD1* )(segid B and resid 86 and name HB ) 1.8 0.0 3.01 assign (segid B and resid 81 and name HD1* )(segid B and resid 87 and name HA ) 1.8 0.0 2.27 assign (segid B and resid 81 and name HD1* )(segid B and resid 87 and name HB* ) 1.8 0.0 3.11 assign (segid B and resid 81 and name HD1* )(segid B and resid 87 and name HN ) 1.8 0.0 3.3 assign (segid B and resid 81 and name HD1* )(segid B and resid 90 and name HD* ) 1.8 0.0 3.51 assign (segid B and resid 81 and name HG1* )(segid B and resid 82 and name HN ) 1.8 0.0 3.45 assign (segid B and resid 81 and name HG1* )(segid B and resid 87 and name HA ) 1.8 0.0 2.81 assign (segid B and resid 81 and name HG1* )(segid B and resid 87 and name HB* ) 1.8 0.0 3.34 assign (segid B and resid 81 and name HG2* )(segid B and resid 81 and name HG1* ) 1.8 0.0 1.52 assign (segid B and resid 81 and name HG2* )(segid B and resid 82 and name HN ) 1.8 0.0 2.09 assign (segid B and resid 81 and name HG2* )(segid B and resid 83 and name HA* ) 1.8 0.0 2.81 assign (segid B and resid 81 and name HG2* )(segid B and resid 83 and name HN ) 1.8 0.0 1.74 assign (segid B and resid 81 and name HG2* )(segid B and resid 86 and name HA ) 1.8 0.0 3.21 assign (segid B and resid 81 and name HG2* )(segid B and resid 86 and name HB ) 1.8 0.0 1.79 assign (segid B and resid 81 and name HG2* )(segid B and resid 86 and name HG1* ) 1.8 0.0 1.36 assign (segid B and resid 81 and name HG2* )(segid B and resid 87 and name HA ) 1.8 0.0 2.15 assign (segid B and resid 81 and name HG2* )(segid B and resid 87 and name HB* ) 1.8 0.0 1.81 assign (segid B and resid 81 and name HG2* )(segid B and resid 87 and name HN ) 1.8 0.0 2.12 assign (segid B and resid 81 and name HG2* )(segid B and resid 88 and name HN ) 1.8 0.0 3.58 assign (segid B and resid 81 and name HN )(segid B and resid 81 and name HB ) 1.8 0.0 2.16 assign (segid B and resid 81 and name HN )(segid B and resid 81 and name HD1* ) 1.8 0.0 3.11 assign (segid B and resid 81 and name HN )(segid B and resid 81 and name HG11 ) 1.8 0.0 2.85 assign (segid B and resid 81 and name HN )(segid B and resid 81 and name HG12 ) 1.8 0.0 2.85 assign (segid B and resid 81 and name HN )(segid B and resid 81 and name HG2* ) 1.8 0.0 2.42 assign (segid B and resid 82 and name HB* )(segid B and resid 83 and name HN ) 1.8 0.0 1.82 assign (segid B and resid 82 and name HB* )(segid B and resid 86 and name HB ) 1.8 0.0 2.62 assign (segid B and resid 82 and name HN )(segid B and resid 83 and name HN ) 1.8 0.0 3.25 assign (segid B and resid 82 and name HN )(segid B and resid 86 and name HG1* ) 1.8 0.0 3.22 assign (segid B and resid 82 and name HN )(segid B and resid 86 and name HG2* ) 1.8 0.0 2.38 assign (segid B and resid 83 and name HN )(segid B and resid 84 and name HN ) 1.8 0.0 3.82 assign (segid B and resid 83 and name HN )(segid B and resid 85 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 83 and name HN )(segid B and resid 86 and name HB ) 1.8 0.0 2.56 assign (segid B and resid 83 and name HN )(segid B and resid 86 and name HG1* ) 1.8 0.0 3.13 assign (segid B and resid 83 and name HN )(segid B and resid 86 and name HG2* ) 1.8 0.0 2.5 assign (segid B and resid 84 and name HA )(segid B and resid 84 and name HG* ) 1.8 0.0 2.06 assign (segid B and resid 84 and name HA )(segid B and resid 86 and name HN ) 1.8 0.0 3.49 assign (segid B and resid 84 and name HA )(segid B and resid 87 and name HB* ) 1.8 0.0 1.3 assign (segid B and resid 84 and name HA )(segid B and resid 87 and name HN ) 1.8 0.0 2.64 assign (segid B and resid 84 and name HG* )(segid B and resid 85 and name HN ) 1.8 0.0 3.23 assign (segid B and resid 84 and name HG* )(segid B and resid 86 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 84 and name HG* )(segid B and resid 88 and name HD* ) 1.8 0.0 2.92 assign (segid B and resid 84 and name HG* )(segid B and resid 88 and name HE ) 1.8 0.0 4.25 assign (segid B and resid 84 and name HG* )(segid B and resid 88 and name HG* ) 1.8 0.0 3.13 assign (segid B and resid 84 and name HG* )(segid B and resid 88 and name HN ) 1.8 0.0 3.8 assign (segid B and resid 84 and name HN )(segid B and resid 84 and name HG* ) 1.8 0.0 3.03 assign (segid B and resid 84 and name HN )(segid B and resid 87 and name HB* ) 1.8 0.0 4.18 assign (segid B and resid 85 and name HA )(segid B and resid 88 and name HB* ) 1.8 0.0 4.07 assign (segid B and resid 85 and name HA )(segid B and resid 88 and name HN ) 1.8 0.0 3.23 assign (segid B and resid 85 and name HB* )(segid B and resid 86 and name HG2* ) 1.8 0.0 2.22 assign (segid B and resid 85 and name HN )(segid B and resid 86 and name HG2* ) 1.8 0.0 3.01 assign (segid B and resid 85 and name HN )(segid B and resid 86 and name HN ) 1.8 0.0 2.52 assign (segid B and resid 85 and name HN )(segid B and resid 87 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 85 and name HN )(segid B and resid 87 and name HN ) 1.8 0.0 3.89 assign (segid B and resid 86 and name HA )(segid B and resid 86 and name HG1* ) 1.8 0.0 2.02 assign (segid B and resid 86 and name HA )(segid B and resid 86 and name HG2* ) 1.8 0.0 1.81 assign (segid B and resid 86 and name HA )(segid B and resid 89 and name HB* ) 1.8 0.0 2.9 assign (segid B and resid 86 and name HA )(segid B and resid 89 and name HD2* ) 1.8 0.0 3.46 assign (segid B and resid 86 and name HA )(segid B and resid 89 and name HN ) 1.8 0.0 3.22 assign (segid B and resid 86 and name HA )(segid B and resid 90 and name HN ) 1.8 0.0 3.83 assign (segid B and resid 86 and name HB )(segid B and resid 87 and name HN ) 1.8 0.0 2.72 assign (segid B and resid 86 and name HG1* )(segid B and resid 87 and name HB* ) 1.8 0.0 3.83 assign (segid B and resid 86 and name HG1* )(segid B and resid 87 and name HN ) 1.8 0.0 2.56 assign (segid B and resid 86 and name HG2* )(segid B and resid 87 and name HN ) 1.8 0.0 2.67 assign (segid B and resid 86 and name HN )(segid B and resid 86 and name HG2* ) 1.8 0.0 1.63 assign (segid B and resid 87 and name HA )(segid B and resid 90 and name HB* ) 1.8 0.0 3.5 assign (segid B and resid 87 and name HA )(segid B and resid 90 and name HN ) 1.8 0.0 3.15 assign (segid B and resid 87 and name HB* )(segid B and resid 88 and name HN ) 1.8 0.0 1.79 assign (segid B and resid 87 and name HN )(segid B and resid 87 and name HB* ) 1.8 0.0 1.36 assign (segid B and resid 87 and name HN )(segid B and resid 88 and name HB* ) 1.8 0.0 3.73 assign (segid B and resid 87 and name HN )(segid B and resid 88 and name HG* ) 1.8 0.0 3.47 assign (segid B and resid 87 and name HN )(segid B and resid 88 and name HN ) 1.8 0.0 2.41 assign (segid B and resid 88 and name HA )(segid B and resid 88 and name HD1 ) 1.8 0.0 4.25 assign (segid B and resid 88 and name HA )(segid B and resid 88 and name HD2 ) 1.8 0.0 4.25 assign (segid B and resid 88 and name HA )(segid B and resid 90 and name HN ) 1.8 0.0 3.91 assign (segid B and resid 88 and name HA )(segid B and resid 91 and name HB* ) 1.8 0.0 2.17 assign (segid B and resid 88 and name HA )(segid B and resid 91 and name HN ) 1.8 0.0 3.21 assign (segid B and resid 88 and name HA )(segid B and resid 92 and name HN ) 1.8 0.0 4.15 assign (segid B and resid 88 and name HB* )(segid B and resid 88 and name HD* ) 1.8 0.0 1.73 assign (segid B and resid 88 and name HB* )(segid B and resid 92 and name HD2* ) 1.8 0.0 4.6 assign (segid B and resid 88 and name HN )(segid B and resid 88 and name HB* ) 1.8 0.0 2.02 assign (segid B and resid 88 and name HN )(segid B and resid 88 and name HD* ) 1.8 0.0 3.4 assign (segid B and resid 88 and name HN )(segid B and resid 88 and name HG1 ) 1.8 0.0 2.59 assign (segid B and resid 88 and name HN )(segid B and resid 88 and name HG2 ) 1.8 0.0 2.59 assign (segid B and resid 89 and name HA )(segid B and resid 89 and name HD2* ) 1.8 0.0 2.78 assign (segid B and resid 89 and name HA )(segid B and resid 92 and name HD2* ) 1.8 0.0 2.4 assign (segid B and resid 89 and name HA )(segid B and resid 92 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 89 and name HA )(segid B and resid 93 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 89 and name HB* )(segid B and resid 89 and name HD1* ) 1.8 0.0 1.52 assign (segid B and resid 89 and name HB* )(segid B and resid 90 and name HN ) 1.8 0.0 2.66 assign (segid B and resid 89 and name HD2* )(segid B and resid 90 and name HN ) 1.8 0.0 2.68 assign (segid B and resid 89 and name HD2* )(segid B and resid 92 and name HN ) 1.8 0.0 6.21 assign (segid B and resid 89 and name HD2* )(segid B and resid 93 and name HB ) 1.8 0.0 3.21 assign (segid B and resid 89 and name HD2* )(segid B and resid 93 and name HG1* ) 1.8 0.0 3.2 assign (segid B and resid 89 and name HN )(segid B and resid 89 and name HD1* ) 1.8 0.0 3.35 assign (segid B and resid 89 and name HN )(segid B and resid 89 and name HD2* ) 1.8 0.0 3.12 assign (segid B and resid 89 and name HN )(segid B and resid 90 and name HN ) 1.8 0.0 2.96 assign (segid B and resid 89 and name HN )(segid B and resid 91 and name HN ) 1.8 0.0 3.89 assign (segid B and resid 90 and name HA )(segid B and resid 90 and name HD* ) 1.8 0.0 2.26 assign (segid B and resid 90 and name HA )(segid B and resid 91 and name HB* ) 1.8 0.0 3.87 assign (segid B and resid 90 and name HA )(segid B and resid 93 and name HB ) 1.8 0.0 3.36 assign (segid B and resid 90 and name HA )(segid B and resid 93 and name HG1* ) 1.8 0.0 1.97 assign (segid B and resid 90 and name HB* )(segid B and resid 91 and name HB* ) 1.8 0.0 2.89 assign (segid B and resid 90 and name HB* )(segid B and resid 93 and name HG1* ) 1.8 0.0 3.36 assign (segid B and resid 90 and name HB1 )(segid B and resid 91 and name HN ) 1.8 0.0 3.14 assign (segid B and resid 90 and name HB2 )(segid B and resid 91 and name HN ) 1.8 0.0 3.14 assign (segid B and resid 90 and name HD* )(segid B and resid 91 and name HN ) 1.8 0.0 3.36 assign (segid B and resid 90 and name HD* )(segid B and resid 93 and name HG1* ) 1.8 0.0 2.75 assign (segid B and resid 90 and name HN )(segid B and resid 90 and name HD* ) 1.8 0.0 3.07 assign (segid B and resid 90 and name HN )(segid B and resid 91 and name HB* ) 1.8 0.0 3 assign (segid B and resid 90 and name HN )(segid B and resid 91 and name HN ) 1.8 0.0 2.26 assign (segid B and resid 91 and name HA )(segid B and resid 94 and name HB* ) 1.8 0.0 3.87 assign (segid B and resid 91 and name HA )(segid B and resid 94 and name HE21 ) 1.8 0.0 3.51 assign (segid B and resid 91 and name HA )(segid B and resid 94 and name HE22 ) 1.8 0.0 3.51 assign (segid B and resid 91 and name HA )(segid B and resid 94 and name HG* ) 1.8 0.0 2.99 assign (segid B and resid 91 and name HA )(segid B and resid 94 and name HN ) 1.8 0.0 3.45 assign (segid B and resid 91 and name HB* )(segid B and resid 93 and name HN ) 1.8 0.0 3.51 assign (segid B and resid 91 and name HN )(segid B and resid 91 and name HB* ) 1.8 0.0 1.45 assign (segid B and resid 91 and name HN )(segid B and resid 92 and name HN ) 1.8 0.0 2.37 assign (segid B and resid 92 and name HA )(segid B and resid 95 and name HB ) 1.8 0.0 2.48 assign (segid B and resid 92 and name HA )(segid B and resid 95 and name HG1* ) 1.8 0.0 3.15 assign (segid B and resid 92 and name HA )(segid B and resid 95 and name HG2* ) 1.8 0.0 1.79 assign (segid B and resid 92 and name HA )(segid B and resid 95 and name HN ) 1.8 0.0 2.92 assign (segid B and resid 92 and name HA )(segid B and resid 96 and name HN ) 1.8 0.0 4.12 assign (segid B and resid 92 and name HB* )(segid B and resid 93 and name HN ) 1.8 0.0 2.64 assign (segid B and resid 92 and name HG )(segid B and resid 93 and name HA ) 1.8 0.0 3.74 assign (segid B and resid 92 and name HG )(segid B and resid 93 and name HN ) 1.8 0.0 3.25 assign (segid B and resid 92 and name HN )(segid B and resid 93 and name HN ) 1.8 0.0 2.37 assign (segid B and resid 93 and name HA )(segid B and resid 93 and name HG1* ) 1.8 0.0 1.78 assign (segid B and resid 93 and name HA )(segid B and resid 93 and name HG2* ) 1.8 0.0 1.58 assign (segid B and resid 93 and name HB )(segid B and resid 94 and name HN ) 1.8 0.0 3.15 assign (segid B and resid 93 and name HG1* )(segid B and resid 94 and name HN ) 1.8 0.0 2.16 assign (segid B and resid 93 and name HG2* )(segid B and resid 94 and name HA ) 1.8 0.0 4.03 assign (segid B and resid 93 and name HN )(segid B and resid 93 and name HB ) 1.8 0.0 2.19 assign (segid B and resid 93 and name HN )(segid B and resid 93 and name HG1* ) 1.8 0.0 1.87 assign (segid B and resid 93 and name HN )(segid B and resid 93 and name HG2* ) 1.8 0.0 3.64 assign (segid B and resid 93 and name HN )(segid B and resid 94 and name HN ) 1.8 0.0 2.69 assign (segid B and resid 94 and name HA )(segid B and resid 94 and name HE2* ) 1.8 0.0 4.07 assign (segid B and resid 94 and name HA )(segid B and resid 97 and name HB* ) 1.8 0.0 2.12 assign (segid B and resid 94 and name HA )(segid B and resid 97 and name HN ) 1.8 0.0 2.89 assign (segid B and resid 94 and name HA )(segid B and resid 98 and name HN ) 1.8 0.0 3.25 assign (segid B and resid 94 and name HB* )(segid B and resid 94 and name HE2* ) 1.8 0.0 3.23 assign (segid B and resid 94 and name HB* )(segid B and resid 97 and name HB* ) 1.8 0.0 4 assign (segid B and resid 94 and name HG* )(segid B and resid 95 and name HN ) 1.8 0.0 2.79 assign (segid B and resid 94 and name HN )(segid B and resid 94 and name HG* ) 1.8 0.0 2.24 assign (segid B and resid 94 and name HN )(segid B and resid 95 and name HN ) 1.8 0.0 2.64 assign (segid B and resid 95 and name HA )(segid B and resid 95 and name HG1* ) 1.8 0.0 1.75 assign (segid B and resid 95 and name HA )(segid B and resid 95 and name HG2* ) 1.8 0.0 1.32 assign (segid B and resid 95 and name HA )(segid B and resid 98 and name HB1 ) 1.8 0.0 2.99 assign (segid B and resid 95 and name HA )(segid B and resid 98 and name HB2 ) 1.8 0.0 2.99 assign (segid B and resid 95 and name HA )(segid B and resid 98 and name HN ) 1.8 0.0 2.75 assign (segid B and resid 95 and name HA )(segid B and resid 99 and name HN ) 1.8 0.0 3.39 assign (segid B and resid 95 and name HB )(segid B and resid 96 and name HN ) 1.8 0.0 2.84 assign (segid B and resid 95 and name HB )(segid B and resid 97 and name HN ) 1.8 0.0 4.25 assign (segid B and resid 95 and name HG1* )(segid B and resid 96 and name HA ) 1.8 0.0 2.2 assign (segid B and resid 95 and name HG1* )(segid B and resid 96 and name HN ) 1.8 0.0 2.37 assign (segid B and resid 95 and name HG1* )(segid B and resid 98 and name HB* ) 1.8 0.0 4.25 assign (segid B and resid 95 and name HG1* )(segid B and resid 98 and name HN ) 1.8 0.0 3.78 assign (segid B and resid 95 and name HG1* )(segid B and resid 99 and name HB* ) 1.8 0.0 2.89 assign (segid B and resid 95 and name HG1* )(segid B and resid 99 and name HG* ) 1.8 0.0 3.09 assign (segid B and resid 95 and name HG1* )(segid B and resid 99 and name HN ) 1.8 0.0 3.34 assign (segid B and resid 95 and name HG2* )(segid B and resid 96 and name HN ) 1.8 0.0 2.75 assign (segid B and resid 95 and name HN )(segid B and resid 95 and name HB ) 1.8 0.0 2.29 assign (segid B and resid 95 and name HN )(segid B and resid 95 and name HG1* ) 1.8 0.0 2.42 assign (segid B and resid 95 and name HN )(segid B and resid 95 and name HG2* ) 1.8 0.0 1.5 assign (segid B and resid 95 and name HN )(segid B and resid 96 and name HN ) 1.8 0.0 2.7 assign (segid B and resid 96 and name HA )(segid B and resid 96 and name HG1* ) 1.8 0.0 1.78 assign (segid B and resid 96 and name HA )(segid B and resid 99 and name HB* ) 1.8 0.0 3.7 assign (segid B and resid 96 and name HA )(segid B and resid 100 and name HD2 ) 1.8 0.0 3.21 assign (segid B and resid 96 and name HB )(segid B and resid 97 and name HN ) 1.8 0.0 2.96 assign (segid B and resid 96 and name HG1* )(segid B and resid 97 and name HN ) 1.8 0.0 3.49 assign (segid B and resid 96 and name HG1* )(segid B and resid 100 and name HD2 ) 1.8 0.0 3.45 assign (segid B and resid 96 and name HG2* )(segid B and resid 97 and name HN ) 1.8 0.0 2.24 assign (segid B and resid 96 and name HG2* )(segid B and resid 100 and name HD2 ) 1.8 0.0 3.45 assign (segid B and resid 96 and name HN )(segid B and resid 96 and name HB ) 1.8 0.0 2.49 assign (segid B and resid 96 and name HN )(segid B and resid 96 and name HG1* ) 1.8 0.0 2.38 assign (segid B and resid 96 and name HN )(segid B and resid 96 and name HG2* ) 1.8 0.0 2.18 assign (segid B and resid 96 and name HN )(segid B and resid 97 and name HN ) 1.8 0.0 2.51 assign (segid B and resid 97 and name HA )(segid B and resid 101 and name HD2* ) 1.8 0.0 3.63 assign (segid B and resid 97 and name HB* )(segid B and resid 98 and name HA ) 1.8 0.0 3.74 assign (segid B and resid 97 and name HB* )(segid B and resid 98 and name HB* ) 1.8 0.0 3.56 assign (segid B and resid 97 and name HB* )(segid B and resid 98 and name HN ) 1.8 0.0 2.14 assign (segid B and resid 97 and name HB* )(segid B and resid 101 and name HD2* ) 1.8 0.0 2.34 assign (segid B and resid 97 and name HN )(segid B and resid 97 and name HB* ) 1.8 0.0 1.67 assign (segid B and resid 98 and name HB1 )(segid B and resid 99 and name HN ) 1.8 0.0 3.01 assign (segid B and resid 98 and name HB2 )(segid B and resid 99 and name HN ) 1.8 0.0 3.01 assign (segid B and resid 98 and name HN )(segid B and resid 98 and name HB1 ) 1.8 0.0 2.12 assign (segid B and resid 98 and name HN )(segid B and resid 98 and name HB2 ) 1.8 0.0 2.12 assign (segid B and resid 99 and name HB1 )(segid B and resid 100 and name HN ) 1.8 0.0 3.19 assign (segid B and resid 99 and name HB2 )(segid B and resid 100 and name HN ) 1.8 0.0 3.19 assign (segid B and resid 99 and name HG* )(segid B and resid 100 and name HN ) 1.8 0.0 3.22 assign (segid B and resid 99 and name HN )(segid B and resid 99 and name HB* ) 1.8 0.0 1.86 assign (segid B and resid 99 and name HN )(segid B and resid 99 and name HG1 ) 1.8 0.0 3.35 assign (segid B and resid 99 and name HN )(segid B and resid 99 and name HG2 ) 1.8 0.0 3.35 assign (segid B and resid 99 and name HN )(segid B and resid 100 and name HN ) 1.8 0.0 2.61 assign (segid B and resid 100 and name HN )(segid B and resid 100 and name HD2 ) 1.8 0.0 3.46 assign (segid B and resid 101 and name HA )(segid B and resid 101 and name HD2* ) 1.8 0.0 2.14 assign (segid B and resid 101 and name HB* )(segid B and resid 101 and name HD1* ) 1.8 0.0 1.89 assign (segid B and resid 101 and name HB* )(segid B and resid 101 and name HD2* ) 1.8 0.0 1.84 assign (segid B and resid 101 and name HB* )(segid B and resid 102 and name HN ) 1.8 0.0 2.41 assign (segid B and resid 101 and name HD2* )(segid B and resid 102 and name HN ) 1.8 0.0 3.22 assign (segid B and resid 101 and name HN )(segid B and resid 101 and name HD1* ) 1.8 0.0 3.07 assign (segid B and resid 101 and name HN )(segid B and resid 101 and name HD2* ) 1.8 0.0 3.27 assign (segid B and resid 101 and name HN )(segid B and resid 101 and name HG ) 1.8 0.0 3.17 assign (segid B and resid 101 and name HN )(segid B and resid 102 and name HN ) 1.8 0.0 2.56 assign (segid B and resid 102 and name HN )(segid B and resid 102 and name HG* ) 1.8 0.0 2.63 assign (segid B and resid 107 and name HB* )(segid B and resid 108 and name HN ) 1.8 0.0 2.58 ! Hydrogen Bond restraints used in refinement ! Restraint range is HN-O 1.7-2.3 Ang, N-O 2.5-3.3 Ang assign (segid A and resid 11 and name HN )(segid A and resid 8 and name O ) 1.7 0.0 0.6 assign (segid A and resid 11 and name N )(segid A and resid 8 and name O ) 2.5 0.0 0.8 assign (segid A and resid 14 and name HN )(segid A and resid 10 and name O ) 1.7 0.0 0.6 assign (segid A and resid 14 and name N )(segid A and resid 10 and name O ) 2.5 0.0 0.8 assign (segid A and resid 15 and name HN )(segid A and resid 11 and name O ) 1.7 0.0 0.6 assign (segid A and resid 15 and name N )(segid A and resid 11 and name O ) 2.5 0.0 0.8 assign (segid A and resid 16 and name HN )(segid A and resid 12 and name O ) 1.7 0.0 0.6 assign (segid A and resid 16 and name N )(segid A and resid 12 and name O ) 2.5 0.0 0.8 assign (segid A and resid 17 and name HN )(segid A and resid 13 and name O ) 1.7 0.0 0.6 assign (segid A and resid 17 and name N )(segid A and resid 13 and name O ) 2.5 0.0 0.8 assign (segid A and resid 18 and name HN )(segid A and resid 14 and name O ) 1.7 0.0 0.6 assign (segid A and resid 18 and name N )(segid A and resid 14 and name O ) 2.5 0.0 0.8 assign (segid A and resid 19 and name HN )(segid A and resid 15 and name O ) 1.7 0.0 0.6 assign (segid A and resid 19 and name N )(segid A and resid 15 and name O ) 2.5 0.0 0.8 assign (segid A and resid 20 and name HN )(segid A and resid 16 and name O ) 1.7 0.0 0.6 assign (segid A and resid 20 and name N )(segid A and resid 16 and name O ) 2.5 0.0 0.8 assign (segid A and resid 21 and name HN )(segid A and resid 17 and name O ) 1.7 0.0 0.6 assign (segid A and resid 21 and name N )(segid A and resid 17 and name O ) 2.5 0.0 0.8 assign (segid A and resid 22 and name HN )(segid A and resid 18 and name O ) 1.7 0.0 0.6 assign (segid A and resid 22 and name N )(segid A and resid 18 and name O ) 2.5 0.0 0.8 assign (segid A and resid 32 and name HN )(segid A and resid 28 and name O ) 1.7 0.0 0.6 assign (segid A and resid 32 and name N )(segid A and resid 28 and name O ) 2.5 0.0 0.8 assign (segid A and resid 33 and name HN )(segid A and resid 29 and name O ) 1.7 0.0 0.6 assign (segid A and resid 33 and name N )(segid A and resid 29 and name O ) 2.5 0.0 0.8 assign (segid A and resid 34 and name HN )(segid A and resid 30 and name O ) 1.7 0.0 0.6 assign (segid A and resid 34 and name N )(segid A and resid 30 and name O ) 2.5 0.0 0.8 assign (segid A and resid 35 and name HN )(segid A and resid 31 and name O ) 1.7 0.0 0.6 assign (segid A and resid 35 and name N )(segid A and resid 31 and name O ) 2.5 0.0 0.8 assign (segid A and resid 39 and name HN )(segid A and resid 79 and name O ) 1.7 0.0 0.6 assign (segid A and resid 39 and name N )(segid A and resid 79 and name O ) 2.5 0.0 0.8 assign (segid A and resid 41 and name HN )(segid A and resid 77 and name O ) 1.7 0.0 0.6 assign (segid A and resid 41 and name N )(segid A and resid 77 and name O ) 2.5 0.0 0.8 assign (segid A and resid 44 and name HN )(segid A and resid 40 and name O ) 1.7 0.0 0.6 assign (segid A and resid 44 and name N )(segid A and resid 40 and name O ) 2.5 0.0 0.8 assign (segid A and resid 45 and name HN )(segid A and resid 41 and name O ) 1.7 0.0 0.6 assign (segid A and resid 45 and name N )(segid A and resid 41 and name O ) 2.5 0.0 0.8 assign (segid A and resid 46 and name HN )(segid A and resid 42 and name O ) 1.7 0.0 0.6 assign (segid A and resid 46 and name N )(segid A and resid 42 and name O ) 2.5 0.0 0.8 assign (segid A and resid 47 and name HN )(segid A and resid 43 and name O ) 1.7 0.0 0.6 assign (segid A and resid 47 and name N )(segid A and resid 43 and name O ) 2.5 0.0 0.8 assign (segid A and resid 48 and name HN )(segid A and resid 44 and name O ) 1.7 0.0 0.6 assign (segid A and resid 48 and name N )(segid A and resid 44 and name O ) 2.5 0.0 0.8 assign (segid A and resid 49 and name HN )(segid A and resid 46 and name O ) 1.7 0.0 0.6 assign (segid A and resid 49 and name N )(segid A and resid 46 and name O ) 2.5 0.0 0.8 assign (segid A and resid 50 and name HN )(segid A and resid 45 and name O ) 1.7 0.0 0.6 assign (segid A and resid 50 and name N )(segid A and resid 45 and name O ) 2.5 0.0 0.8 assign (segid A and resid 55 and name HN )(segid A and resid 51 and name O ) 1.7 0.0 0.6 assign (segid A and resid 55 and name N )(segid A and resid 51 and name O ) 2.5 0.0 0.8 assign (segid A and resid 56 and name HN )(segid A and resid 52 and name O ) 1.7 0.0 0.6 assign (segid A and resid 56 and name N )(segid A and resid 52 and name O ) 2.5 0.0 0.8 assign (segid A and resid 57 and name HN )(segid A and resid 53 and name O ) 1.7 0.0 0.6 assign (segid A and resid 57 and name N )(segid A and resid 53 and name O ) 2.5 0.0 0.8 assign (segid A and resid 58 and name HN )(segid A and resid 54 and name O ) 1.7 0.0 0.6 assign (segid A and resid 58 and name N )(segid A and resid 54 and name O ) 2.5 0.0 0.8 assign (segid A and resid 59 and name HN )(segid A and resid 55 and name O ) 1.7 0.0 0.6 assign (segid A and resid 59 and name N )(segid A and resid 55 and name O ) 2.5 0.0 0.8 assign (segid A and resid 60 and name HN )(segid A and resid 56 and name O ) 1.7 0.0 0.6 assign (segid A and resid 60 and name N )(segid A and resid 56 and name O ) 2.5 0.0 0.8 assign (segid A and resid 61 and name HN )(segid A and resid 57 and name O ) 1.7 0.0 0.6 assign (segid A and resid 61 and name N )(segid A and resid 57 and name O ) 2.5 0.0 0.8 assign (segid A and resid 62 and name HN )(segid A and resid 58 and name O ) 1.7 0.0 0.6 assign (segid A and resid 62 and name N )(segid A and resid 58 and name O ) 2.5 0.0 0.8 assign (segid A and resid 63 and name HN )(segid A and resid 59 and name O ) 1.7 0.0 0.6 assign (segid A and resid 63 and name N )(segid A and resid 59 and name O ) 2.5 0.0 0.8 assign (segid A and resid 64 and name HN )(segid A and resid 60 and name O ) 1.7 0.0 0.6 assign (segid A and resid 64 and name N )(segid A and resid 60 and name O ) 2.5 0.0 0.8 assign (segid A and resid 65 and name HN )(segid A and resid 61 and name O ) 1.7 0.0 0.6 assign (segid A and resid 65 and name N )(segid A and resid 61 and name O ) 2.5 0.0 0.8 assign (segid A and resid 66 and name HN )(segid A and resid 63 and name O ) 1.7 0.0 0.6 assign (segid A and resid 66 and name N )(segid A and resid 63 and name O ) 2.5 0.0 0.8 assign (segid A and resid 67 and name HN )(segid A and resid 62 and name O ) 1.7 0.0 0.6 assign (segid A and resid 67 and name N )(segid A and resid 62 and name O ) 2.5 0.0 0.8 assign (segid A and resid 69 and name HN )(segid A and resid 80 and name O ) 1.6 0.0 0.6 assign (segid A and resid 69 and name N )(segid A and resid 80 and name O ) 2.5 0.0 0.8 assign (segid A and resid 71 and name HN )(segid A and resid 78 and name O ) 1.7 0.0 0.6 assign (segid A and resid 71 and name N )(segid A and resid 78 and name O ) 2.5 0.0 0.8 assign (segid A and resid 73 and name HN )(segid A and resid 76 and name O ) 1.7 0.0 0.6 assign (segid A and resid 73 and name N )(segid A and resid 76 and name O ) 2.5 0.0 0.8 assign (segid A and resid 76 and name HN )(segid A and resid 73 and name O ) 1.7 0.0 0.6 assign (segid A and resid 76 and name N )(segid A and resid 73 and name O ) 2.5 0.0 0.8 assign (segid A and resid 78 and name HN )(segid A and resid 71 and name O ) 1.7 0.0 0.6 assign (segid A and resid 78 and name N )(segid A and resid 71 and name O ) 2.5 0.0 0.8 assign (segid A and resid 79 and name HN )(segid A and resid 39 and name O ) 1.7 0.0 0.6 assign (segid A and resid 79 and name N )(segid A and resid 39 and name O ) 2.5 0.0 0.8 assign (segid A and resid 80 and name HN )(segid A and resid 69 and name O ) 1.7 0.0 0.6 assign (segid A and resid 80 and name N )(segid A and resid 69 and name O ) 2.5 0.0 0.8 assign (segid A and resid 82 and name HN )(segid A and resid 67 and name O ) 1.7 0.0 0.6 assign (segid A and resid 82 and name N )(segid A and resid 67 and name O ) 2.5 0.0 0.8 assign (segid A and resid 87 and name HN )(segid A and resid 83 and name O ) 1.7 0.0 0.6 assign (segid A and resid 87 and name N )(segid A and resid 83 and name O ) 2.5 0.0 0.8 assign (segid A and resid 88 and name HN )(segid A and resid 84 and name O ) 1.7 0.0 0.6 assign (segid A and resid 88 and name N )(segid A and resid 84 and name O ) 2.5 0.0 0.8 assign (segid A and resid 89 and name HN )(segid A and resid 85 and name O ) 1.7 0.0 0.6 assign (segid A and resid 89 and name N )(segid A and resid 85 and name O ) 2.5 0.0 0.8 assign (segid A and resid 90 and name HN )(segid A and resid 86 and name O ) 1.7 0.0 0.6 assign (segid A and resid 90 and name N )(segid A and resid 86 and name O ) 2.5 0.0 0.8 assign (segid A and resid 91 and name HN )(segid A and resid 87 and name O ) 1.7 0.0 0.6 assign (segid A and resid 91 and name N )(segid A and resid 87 and name O ) 2.5 0.0 0.8 assign (segid A and resid 92 and name HN )(segid A and resid 88 and name O ) 1.7 0.0 0.6 assign (segid A and resid 92 and name N )(segid A and resid 88 and name O ) 2.5 0.0 0.8 assign (segid A and resid 93 and name HN )(segid A and resid 89 and name O ) 1.7 0.0 0.6 assign (segid A and resid 93 and name N )(segid A and resid 89 and name O ) 2.5 0.0 0.8 assign (segid A and resid 94 and name HN )(segid A and resid 90 and name O ) 1.7 0.0 0.6 assign (segid A and resid 94 and name N )(segid A and resid 90 and name O ) 2.5 0.0 0.8 assign (segid A and resid 95 and name HN )(segid A and resid 91 and name O ) 1.7 0.0 0.6 assign (segid A and resid 95 and name N )(segid A and resid 91 and name O ) 2.5 0.0 0.8 assign (segid A and resid 96 and name HN )(segid A and resid 92 and name O ) 1.7 0.0 0.6 assign (segid A and resid 96 and name N )(segid A and resid 92 and name O ) 2.5 0.0 0.8 assign (segid A and resid 97 and name HN )(segid A and resid 93 and name O ) 1.7 0.0 0.6 assign (segid A and resid 97 and name N )(segid A and resid 93 and name O ) 2.5 0.0 0.8 assign (segid A and resid 98 and name HN )(segid A and resid 94 and name O ) 1.7 0.0 0.6 assign (segid A and resid 98 and name N )(segid A and resid 94 and name O ) 2.5 0.0 0.8 assign (segid A and resid 99 and name HN )(segid A and resid 95 and name O ) 1.7 0.0 0.6 assign (segid A and resid 99 and name N )(segid A and resid 95 and name O ) 2.5 0.0 0.8 assign (segid B and resid 11 and name HN )(segid B and resid 8 and name O ) 1.7 0.0 0.6 assign (segid B and resid 11 and name N )(segid B and resid 8 and name O ) 2.5 0.0 0.8 assign (segid B and resid 14 and name HN )(segid B and resid 10 and name O ) 1.7 0.0 0.6 assign (segid B and resid 14 and name N )(segid B and resid 10 and name O ) 2.5 0.0 0.8 assign (segid B and resid 15 and name HN )(segid B and resid 11 and name O ) 1.7 0.0 0.6 assign (segid B and resid 15 and name N )(segid B and resid 11 and name O ) 2.5 0.0 0.8 assign (segid B and resid 16 and name HN )(segid B and resid 12 and name O ) 1.7 0.0 0.6 assign (segid B and resid 16 and name N )(segid B and resid 12 and name O ) 2.5 0.0 0.8 assign (segid B and resid 17 and name HN )(segid B and resid 13 and name O ) 1.7 0.0 0.6 assign (segid B and resid 17 and name N )(segid B and resid 13 and name O ) 2.5 0.0 0.8 assign (segid B and resid 18 and name HN )(segid B and resid 14 and name O ) 1.7 0.0 0.6 assign (segid B and resid 18 and name N )(segid B and resid 14 and name O ) 2.5 0.0 0.8 assign (segid B and resid 19 and name HN )(segid B and resid 15 and name O ) 1.7 0.0 0.6 assign (segid B and resid 19 and name N )(segid B and resid 15 and name O ) 2.5 0.0 0.8 assign (segid B and resid 20 and name HN )(segid B and resid 16 and name O ) 1.7 0.0 0.6 assign (segid B and resid 20 and name N )(segid B and resid 16 and name O ) 2.5 0.0 0.8 assign (segid B and resid 21 and name HN )(segid B and resid 17 and name O ) 1.7 0.0 0.6 assign (segid B and resid 21 and name N )(segid B and resid 17 and name O ) 2.5 0.0 0.8 assign (segid B and resid 22 and name HN )(segid B and resid 18 and name O ) 1.7 0.0 0.6 assign (segid B and resid 22 and name N )(segid B and resid 18 and name O ) 2.5 0.0 0.8 assign (segid B and resid 32 and name HN )(segid B and resid 28 and name O ) 1.7 0.0 0.6 assign (segid B and resid 32 and name N )(segid B and resid 28 and name O ) 2.5 0.0 0.8 assign (segid B and resid 33 and name HN )(segid B and resid 29 and name O ) 1.7 0.0 0.6 assign (segid B and resid 33 and name N )(segid B and resid 29 and name O ) 2.5 0.0 0.8 assign (segid B and resid 34 and name HN )(segid B and resid 30 and name O ) 1.7 0.0 0.6 assign (segid B and resid 34 and name N )(segid B and resid 30 and name O ) 2.5 0.0 0.8 assign (segid B and resid 35 and name HN )(segid B and resid 31 and name O ) 1.7 0.0 0.6 assign (segid B and resid 35 and name N )(segid B and resid 31 and name O ) 2.5 0.0 0.8 assign (segid B and resid 39 and name HN )(segid B and resid 79 and name O ) 1.7 0.0 0.6 assign (segid B and resid 39 and name N )(segid B and resid 79 and name O ) 2.5 0.0 0.8 assign (segid B and resid 41 and name HN )(segid B and resid 77 and name O ) 1.7 0.0 0.6 assign (segid B and resid 41 and name N )(segid B and resid 77 and name O ) 2.5 0.0 0.8 assign (segid B and resid 44 and name HN )(segid B and resid 40 and name O ) 1.7 0.0 0.6 assign (segid B and resid 44 and name N )(segid B and resid 40 and name O ) 2.5 0.0 0.8 assign (segid B and resid 45 and name HN )(segid B and resid 41 and name O ) 1.7 0.0 0.6 assign (segid B and resid 45 and name N )(segid B and resid 41 and name O ) 2.5 0.0 0.8 assign (segid B and resid 46 and name HN )(segid B and resid 42 and name O ) 1.7 0.0 0.6 assign (segid B and resid 46 and name N )(segid B and resid 42 and name O ) 2.5 0.0 0.8 assign (segid B and resid 47 and name HN )(segid B and resid 43 and name O ) 1.7 0.0 0.6 assign (segid B and resid 47 and name N )(segid B and resid 43 and name O ) 2.5 0.0 0.8 assign (segid B and resid 48 and name HN )(segid B and resid 44 and name O ) 1.7 0.0 0.6 assign (segid B and resid 48 and name N )(segid B and resid 44 and name O ) 2.5 0.0 0.8 assign (segid B and resid 49 and name HN )(segid B and resid 46 and name O ) 1.7 0.0 0.6 assign (segid B and resid 49 and name N )(segid B and resid 46 and name O ) 2.5 0.0 0.8 assign (segid B and resid 50 and name HN )(segid B and resid 45 and name O ) 1.7 0.0 0.6 assign (segid B and resid 50 and name N )(segid B and resid 45 and name O ) 2.5 0.0 0.8 assign (segid B and resid 55 and name HN )(segid B and resid 51 and name O ) 1.7 0.0 0.6 assign (segid B and resid 55 and name N )(segid B and resid 51 and name O ) 2.5 0.0 0.8 assign (segid B and resid 56 and name HN )(segid B and resid 52 and name O ) 1.7 0.0 0.6 assign (segid B and resid 56 and name N )(segid B and resid 52 and name O ) 2.5 0.0 0.8 assign (segid B and resid 57 and name HN )(segid B and resid 53 and name O ) 1.7 0.0 0.6 assign (segid B and resid 57 and name N )(segid B and resid 53 and name O ) 2.5 0.0 0.8 assign (segid B and resid 58 and name HN )(segid B and resid 54 and name O ) 1.7 0.0 0.6 assign (segid B and resid 58 and name N )(segid B and resid 54 and name O ) 2.5 0.0 0.8 assign (segid B and resid 59 and name HN )(segid B and resid 55 and name O ) 1.7 0.0 0.6 assign (segid B and resid 59 and name N )(segid B and resid 55 and name O ) 2.5 0.0 0.8 assign (segid B and resid 60 and name HN )(segid B and resid 56 and name O ) 1.7 0.0 0.6 assign (segid B and resid 60 and name N )(segid B and resid 56 and name O ) 2.5 0.0 0.8 assign (segid B and resid 61 and name HN )(segid B and resid 57 and name O ) 1.7 0.0 0.6 assign (segid B and resid 61 and name N )(segid B and resid 57 and name O ) 2.5 0.0 0.8 assign (segid B and resid 62 and name HN )(segid B and resid 58 and name O ) 1.7 0.0 0.6 assign (segid B and resid 62 and name N )(segid B and resid 58 and name O ) 2.5 0.0 0.8 assign (segid B and resid 63 and name HN )(segid B and resid 59 and name O ) 1.7 0.0 0.6 assign (segid B and resid 63 and name N )(segid B and resid 59 and name O ) 2.5 0.0 0.8 assign (segid B and resid 64 and name HN )(segid B and resid 60 and name O ) 1.7 0.0 0.6 assign (segid B and resid 64 and name N )(segid B and resid 60 and name O ) 2.5 0.0 0.8 assign (segid B and resid 65 and name HN )(segid B and resid 61 and name O ) 1.7 0.0 0.6 assign (segid B and resid 65 and name N )(segid B and resid 61 and name O ) 2.5 0.0 0.8 assign (segid B and resid 66 and name HN )(segid B and resid 63 and name O ) 1.7 0.0 0.6 assign (segid B and resid 66 and name N )(segid B and resid 63 and name O ) 2.5 0.0 0.8 assign (segid B and resid 67 and name HN )(segid B and resid 62 and name O ) 1.7 0.0 0.6 assign (segid B and resid 67 and name N )(segid B and resid 62 and name O ) 2.5 0.0 0.8 assign (segid B and resid 69 and name HN )(segid B and resid 80 and name O ) 1.6 0.0 0.6 assign (segid B and resid 69 and name N )(segid B and resid 80 and name O ) 2.5 0.0 0.8 assign (segid B and resid 71 and name HN )(segid B and resid 78 and name O ) 1.7 0.0 0.6 assign (segid B and resid 71 and name N )(segid B and resid 78 and name O ) 2.5 0.0 0.8 assign (segid B and resid 73 and name HN )(segid B and resid 76 and name O ) 1.7 0.0 0.6 assign (segid B and resid 73 and name N )(segid B and resid 76 and name O ) 2.5 0.0 0.8 assign (segid B and resid 76 and name HN )(segid B and resid 73 and name O ) 1.7 0.0 0.6 assign (segid B and resid 76 and name N )(segid B and resid 73 and name O ) 2.5 0.0 0.8 assign (segid B and resid 78 and name HN )(segid B and resid 71 and name O ) 1.7 0.0 0.6 assign (segid B and resid 78 and name N )(segid B and resid 71 and name O ) 2.5 0.0 0.8 assign (segid B and resid 79 and name HN )(segid B and resid 39 and name O ) 1.7 0.0 0.6 assign (segid B and resid 79 and name N )(segid B and resid 39 and name O ) 2.5 0.0 0.8 assign (segid B and resid 80 and name HN )(segid B and resid 69 and name O ) 1.7 0.0 0.6 assign (segid B and resid 80 and name N )(segid B and resid 69 and name O ) 2.5 0.0 0.8 assign (segid B and resid 82 and name HN )(segid B and resid 67 and name O ) 1.7 0.0 0.6 assign (segid B and resid 82 and name N )(segid B and resid 67 and name O ) 2.5 0.0 0.8 assign (segid B and resid 87 and name HN )(segid B and resid 83 and name O ) 1.7 0.0 0.6 assign (segid B and resid 87 and name N )(segid B and resid 83 and name O ) 2.5 0.0 0.8 assign (segid B and resid 88 and name HN )(segid B and resid 84 and name O ) 1.7 0.0 0.6 assign (segid B and resid 88 and name N )(segid B and resid 84 and name O ) 2.5 0.0 0.8 assign (segid B and resid 89 and name HN )(segid B and resid 85 and name O ) 1.7 0.0 0.6 assign (segid B and resid 89 and name N )(segid B and resid 85 and name O ) 2.5 0.0 0.8 assign (segid B and resid 90 and name HN )(segid B and resid 86 and name O ) 1.7 0.0 0.6 assign (segid B and resid 90 and name N )(segid B and resid 86 and name O ) 2.5 0.0 0.8 assign (segid B and resid 91 and name HN )(segid B and resid 87 and name O ) 1.7 0.0 0.6 assign (segid B and resid 91 and name N )(segid B and resid 87 and name O ) 2.5 0.0 0.8 assign (segid B and resid 92 and name HN )(segid B and resid 88 and name O ) 1.7 0.0 0.6 assign (segid B and resid 92 and name N )(segid B and resid 88 and name O ) 2.5 0.0 0.8 assign (segid B and resid 93 and name HN )(segid B and resid 89 and name O ) 1.7 0.0 0.6 assign (segid B and resid 93 and name N )(segid B and resid 89 and name O ) 2.5 0.0 0.8 assign (segid B and resid 94 and name HN )(segid B and resid 90 and name O ) 1.7 0.0 0.6 assign (segid B and resid 94 and name N )(segid B and resid 90 and name O ) 2.5 0.0 0.8 assign (segid B and resid 95 and name HN )(segid B and resid 91 and name O ) 1.7 0.0 0.6 assign (segid B and resid 95 and name N )(segid B and resid 91 and name O ) 2.5 0.0 0.8 assign (segid B and resid 96 and name HN )(segid B and resid 92 and name O ) 1.7 0.0 0.6 assign (segid B and resid 96 and name N )(segid B and resid 92 and name O ) 2.5 0.0 0.8 assign (segid B and resid 97 and name HN )(segid B and resid 93 and name O ) 1.7 0.0 0.6 assign (segid B and resid 97 and name N )(segid B and resid 93 and name O ) 2.5 0.0 0.8 assign (segid B and resid 98 and name HN )(segid B and resid 94 and name O ) 1.7 0.0 0.6 assign (segid B and resid 98 and name N )(segid B and resid 94 and name O ) 2.5 0.0 0.8 assign (segid B and resid 99 and name HN )(segid B and resid 95 and name O ) 1.7 0.0 0.6 assign (segid B and resid 99 and name N )(segid B and resid 95 and name O ) 2.5 0.0 0.8 ! MbR242E dihedral angle restraints derived from Talos ! PHI for ARG 7 assign (segid A and resid 6 and name C ) (segid A and resid 7 and name N ) (segid A and resid 7 and name CA ) (segid A and resid 7 and name C ) 1.0 -64.82 30 2 ! PSI for ARG 7 assign (segid A and resid 7 and name N ) (segid A and resid 7 and name CA ) (segid A and resid 7 and name C ) (segid A and resid 8 and name N ) 1.0 -36.27 30 2 ! PHI for LYS 8 assign (segid A and resid 7 and name C ) (segid A and resid 8 and name N ) (segid A and resid 8 and name CA ) (segid A and resid 8 and name C ) 1.0 -61.82 30 2 ! PSI for LYS 8 assign (segid A and resid 8 and name N ) (segid A and resid 8 and name CA ) (segid A and resid 8 and name C ) (segid A and resid 9 and name N ) 1.0 -40.1 30 2 ! PHI for ALA 9 assign (segid A and resid 8 and name C ) (segid A and resid 9 and name N ) (segid A and resid 9 and name CA ) (segid A and resid 9 and name C ) 1.0 -63.14 30 2 ! PSI for ALA 9 assign (segid A and resid 9 and name N ) (segid A and resid 9 and name CA ) (segid A and resid 9 and name C ) (segid A and resid 10 and name N ) 1.0 -41.13 30 2 ! PHI for ALA 10 assign (segid A and resid 9 and name C ) (segid A and resid 10 and name N ) (segid A and resid 10 and name CA ) (segid A and resid 10 and name C ) 1.0 -62.36 30 2 ! PSI for ALA 10 assign (segid A and resid 10 and name N ) (segid A and resid 10 and name CA ) (segid A and resid 10 and name C ) (segid A and resid 11 and name N ) 1.0 -40.14 30 2 ! PHI for LEU 11 assign (segid A and resid 10 and name C ) (segid A and resid 11 and name N ) (segid A and resid 11 and name CA ) (segid A and resid 11 and name C ) 1.0 -66.82 30 2 ! PSI for LEU 11 assign (segid A and resid 11 and name N ) (segid A and resid 11 and name CA ) (segid A and resid 11 and name C ) (segid A and resid 12 and name N ) 1.0 -41.03 30 2 ! PHI for LEU 12 assign (segid A and resid 11 and name C ) (segid A and resid 12 and name N ) (segid A and resid 12 and name CA ) (segid A and resid 12 and name C ) 1.0 -65.28 30 2 ! PSI for LEU 12 assign (segid A and resid 12 and name N ) (segid A and resid 12 and name CA ) (segid A and resid 12 and name C ) (segid A and resid 13 and name N ) 1.0 -38.74 30 2 ! PHI for ASP 13 assign (segid A and resid 12 and name C ) (segid A and resid 13 and name N ) (segid A and resid 13 and name CA ) (segid A and resid 13 and name C ) 1.0 -64.13 30 2 ! PSI for ASP 13 assign (segid A and resid 13 and name N ) (segid A and resid 13 and name CA ) (segid A and resid 13 and name C ) (segid A and resid 14 and name N ) 1.0 -41.56 30 2 ! PHI for GLN 14 assign (segid A and resid 13 and name C ) (segid A and resid 14 and name N ) (segid A and resid 14 and name CA ) (segid A and resid 14 and name C ) 1.0 -69.24 30 2 ! PSI for GLN 14 assign (segid A and resid 14 and name N ) (segid A and resid 14 and name CA ) (segid A and resid 14 and name C ) (segid A and resid 15 and name N ) 1.0 -37.8 30 2 ! PHI for VAL 15 assign (segid A and resid 14 and name C ) (segid A and resid 15 and name N ) (segid A and resid 15 and name CA ) (segid A and resid 15 and name C ) 1.0 -64.99 30 2 ! PSI for VAL 15 assign (segid A and resid 15 and name N ) (segid A and resid 15 and name CA ) (segid A and resid 15 and name C ) (segid A and resid 16 and name N ) 1.0 -44.61 30 2 ! PHI for ALA 16 assign (segid A and resid 15 and name C ) (segid A and resid 16 and name N ) (segid A and resid 16 and name CA ) (segid A and resid 16 and name C ) 1.0 -58.84 30 2 ! PSI for ALA 16 assign (segid A and resid 16 and name N ) (segid A and resid 16 and name CA ) (segid A and resid 16 and name C ) (segid A and resid 17 and name N ) 1.0 -42.29 30 2 ! PHI for ARG 17 assign (segid A and resid 16 and name C ) (segid A and resid 17 and name N ) (segid A and resid 17 and name CA ) (segid A and resid 17 and name C ) 1.0 -64.43 30 2 ! PSI for ARG 17 assign (segid A and resid 17 and name N ) (segid A and resid 17 and name CA ) (segid A and resid 17 and name C ) (segid A and resid 18 and name N ) 1.0 -38.12 30 2 ! PHI for VAL 18 assign (segid A and resid 17 and name C ) (segid A and resid 18 and name N ) (segid A and resid 18 and name CA ) (segid A and resid 18 and name C ) 1.0 -67.06 30 2 ! PSI for VAL 18 assign (segid A and resid 18 and name N ) (segid A and resid 18 and name CA ) (segid A and resid 18 and name C ) (segid A and resid 19 and name N ) 1.0 -42.38 30 2 ! PHI for GLY 19 assign (segid A and resid 18 and name C ) (segid A and resid 19 and name N ) (segid A and resid 19 and name CA ) (segid A and resid 19 and name C ) 1.0 -63.51 30 2 ! PSI for GLY 19 assign (segid A and resid 19 and name N ) (segid A and resid 19 and name CA ) (segid A and resid 19 and name C ) (segid A and resid 20 and name N ) 1.0 -30.57 30 2 ! PHI for LYS 20 assign (segid A and resid 19 and name C ) (segid A and resid 20 and name N ) (segid A and resid 20 and name CA ) (segid A and resid 20 and name C ) 1.0 -62.97 30 2 ! PSI for LYS 20 assign (segid A and resid 20 and name N ) (segid A and resid 20 and name CA ) (segid A and resid 20 and name C ) (segid A and resid 21 and name N ) 1.0 -45.18 30 2 ! PHI for ALA 21 assign (segid A and resid 20 and name C ) (segid A and resid 21 and name N ) (segid A and resid 21 and name CA ) (segid A and resid 21 and name C ) 1.0 -69.38 30 2 ! PSI for ALA 21 assign (segid A and resid 21 and name N ) (segid A and resid 21 and name CA ) (segid A and resid 21 and name C ) (segid A and resid 22 and name N ) 1.0 -24.11 30 2 ! PHI for LEU 22 assign (segid A and resid 21 and name C ) (segid A and resid 22 and name N ) (segid A and resid 22 and name CA ) (segid A and resid 22 and name C ) 1.0 -93.07 30 2 ! PSI for LEU 22 assign (segid A and resid 22 and name N ) (segid A and resid 22 and name CA ) (segid A and resid 22 and name C ) (segid A and resid 23 and name N ) 1.0 -5.01 30 2 ! PHI for ARG 26 assign (segid A and resid 25 and name C ) (segid A and resid 26 and name N ) (segid A and resid 26 and name CA ) (segid A and resid 26 and name C ) 1.0 -65.84 30 2 ! PSI for ARG 26 assign (segid A and resid 26 and name N ) (segid A and resid 26 and name CA ) (segid A and resid 26 and name C ) (segid A and resid 27 and name N ) 1.0 -34.67 30 2 ! PHI for ARG 27 assign (segid A and resid 26 and name C ) (segid A and resid 27 and name N ) (segid A and resid 27 and name CA ) (segid A and resid 27 and name C ) 1.0 -63.88 30 2 ! PSI for ARG 27 assign (segid A and resid 27 and name N ) (segid A and resid 27 and name CA ) (segid A and resid 27 and name C ) (segid A and resid 28 and name N ) 1.0 -40.3 30 2 ! PHI for LEU 28 assign (segid A and resid 27 and name C ) (segid A and resid 28 and name N ) (segid A and resid 28 and name CA ) (segid A and resid 28 and name C ) 1.0 -59.32 30 2 ! PSI for LEU 28 assign (segid A and resid 28 and name N ) (segid A and resid 28 and name CA ) (segid A and resid 28 and name C ) (segid A and resid 29 and name N ) 1.0 -40.6 30 2 ! PHI for GLN 29 assign (segid A and resid 28 and name C ) (segid A and resid 29 and name N ) (segid A and resid 29 and name CA ) (segid A and resid 29 and name C ) 1.0 -62.66 30 2 ! PSI for GLN 29 assign (segid A and resid 29 and name N ) (segid A and resid 29 and name CA ) (segid A and resid 29 and name C ) (segid A and resid 30 and name N ) 1.0 -45.71 30 2 ! PHI for ILE 30 assign (segid A and resid 29 and name C ) (segid A and resid 30 and name N ) (segid A and resid 30 and name CA ) (segid A and resid 30 and name C ) 1.0 -65.16 30 2 ! PSI for ILE 30 assign (segid A and resid 30 and name N ) (segid A and resid 30 and name CA ) (segid A and resid 30 and name C ) (segid A and resid 31 and name N ) 1.0 -44.06 30 2 ! PHI for LEU 31 assign (segid A and resid 30 and name C ) (segid A and resid 31 and name N ) (segid A and resid 31 and name CA ) (segid A and resid 31 and name C ) 1.0 -59.91 30 2 ! PSI for LEU 31 assign (segid A and resid 31 and name N ) (segid A and resid 31 and name CA ) (segid A and resid 31 and name C ) (segid A and resid 32 and name N ) 1.0 -41 30 2 ! PHI for ASP 32 assign (segid A and resid 31 and name C ) (segid A and resid 32 and name N ) (segid A and resid 32 and name CA ) (segid A and resid 32 and name C ) 1.0 -66.49 30 2 ! PSI for ASP 32 assign (segid A and resid 32 and name N ) (segid A and resid 32 and name CA ) (segid A and resid 32 and name C ) (segid A and resid 33 and name N ) 1.0 -42.46 30 2 ! PHI for LEU 33 assign (segid A and resid 32 and name C ) (segid A and resid 33 and name N ) (segid A and resid 33 and name CA ) (segid A and resid 33 and name C ) 1.0 -63.5 30 2 ! PSI for LEU 33 assign (segid A and resid 33 and name N ) (segid A and resid 33 and name CA ) (segid A and resid 33 and name C ) (segid A and resid 34 and name N ) 1.0 -41.04 30 2 ! PHI for LEU 34 assign (segid A and resid 33 and name C ) (segid A and resid 34 and name N ) (segid A and resid 34 and name CA ) (segid A and resid 34 and name C ) 1.0 -72.87 30 2 ! PSI for LEU 34 assign (segid A and resid 34 and name N ) (segid A and resid 34 and name CA ) (segid A and resid 34 and name C ) (segid A and resid 35 and name N ) 1.0 -31.69 30 2 ! PHI for ALA 35 assign (segid A and resid 34 and name C ) (segid A and resid 35 and name N ) (segid A and resid 35 and name CA ) (segid A and resid 35 and name C ) 1.0 -65.13 30 2 ! PSI for ALA 35 assign (segid A and resid 35 and name N ) (segid A and resid 35 and name CA ) (segid A and resid 35 and name C ) (segid A and resid 36 and name N ) 1.0 -25.76 30 2 ! PHI for GLN 36 assign (segid A and resid 35 and name C ) (segid A and resid 36 and name N ) (segid A and resid 36 and name CA ) (segid A and resid 36 and name C ) 1.0 -83.92 30 2 ! PSI for GLN 36 assign (segid A and resid 36 and name N ) (segid A and resid 36 and name CA ) (segid A and resid 36 and name C ) (segid A and resid 37 and name N ) 1.0 -13.85 30 2 ! PHI for GLU 38 assign (segid A and resid 37 and name C ) (segid A and resid 38 and name N ) (segid A and resid 38 and name CA ) (segid A and resid 38 and name C ) 1.0 -102.58 30 2 ! PSI for GLU 38 assign (segid A and resid 38 and name N ) (segid A and resid 38 and name CA ) (segid A and resid 38 and name C ) (segid A and resid 39 and name N ) 1.0 130.29 30 2 ! PHI for ARG 39 assign (segid A and resid 38 and name C ) (segid A and resid 39 and name N ) (segid A and resid 39 and name CA ) (segid A and resid 39 and name C ) 1.0 -134.82 30 2 ! PSI for ARG 39 assign (segid A and resid 39 and name N ) (segid A and resid 39 and name CA ) (segid A and resid 39 and name C ) (segid A and resid 40 and name N ) 1.0 155.99 30 2 ! PHI for ALA 40 assign (segid A and resid 39 and name C ) (segid A and resid 40 and name N ) (segid A and resid 40 and name CA ) (segid A and resid 40 and name C ) 1.0 -81.49 30 2 ! PSI for ALA 40 assign (segid A and resid 40 and name N ) (segid A and resid 40 and name CA ) (segid A and resid 40 and name C ) (segid A and resid 41 and name N ) 1.0 141.31 30 2 ! PHI for VAL 41 assign (segid A and resid 40 and name C ) (segid A and resid 41 and name N ) (segid A and resid 41 and name CA ) (segid A and resid 41 and name C ) 1.0 -56.79 30 2 ! PSI for VAL 41 assign (segid A and resid 41 and name N ) (segid A and resid 41 and name CA ) (segid A and resid 41 and name C ) (segid A and resid 42 and name N ) 1.0 -43.72 30 2 ! PHI for GLU 42 assign (segid A and resid 41 and name C ) (segid A and resid 42 and name N ) (segid A and resid 42 and name CA ) (segid A and resid 42 and name C ) 1.0 -61.04 30 2 ! PSI for GLU 42 assign (segid A and resid 42 and name N ) (segid A and resid 42 and name CA ) (segid A and resid 42 and name C ) (segid A and resid 43 and name N ) 1.0 -42.98 30 2 ! PHI for ALA 43 assign (segid A and resid 42 and name C ) (segid A and resid 43 and name N ) (segid A and resid 43 and name CA ) (segid A and resid 43 and name C ) 1.0 -65.74 30 2 ! PSI for ALA 43 assign (segid A and resid 43 and name N ) (segid A and resid 43 and name CA ) (segid A and resid 43 and name C ) (segid A and resid 44 and name N ) 1.0 -43.09 30 2 ! PHI for ILE 44 assign (segid A and resid 43 and name C ) (segid A and resid 44 and name N ) (segid A and resid 44 and name CA ) (segid A and resid 44 and name C ) 1.0 -65.38 30 2 ! PSI for ILE 44 assign (segid A and resid 44 and name N ) (segid A and resid 44 and name CA ) (segid A and resid 44 and name C ) (segid A and resid 45 and name N ) 1.0 -43.39 30 2 ! PHI for ALA 45 assign (segid A and resid 44 and name C ) (segid A and resid 45 and name N ) (segid A and resid 45 and name CA ) (segid A and resid 45 and name C ) 1.0 -60.89 30 2 ! PSI for ALA 45 assign (segid A and resid 45 and name N ) (segid A and resid 45 and name CA ) (segid A and resid 45 and name C ) (segid A and resid 46 and name N ) 1.0 -41.52 30 2 ! PHI for THR 46 assign (segid A and resid 45 and name C ) (segid A and resid 46 and name N ) (segid A and resid 46 and name CA ) (segid A and resid 46 and name C ) 1.0 -61.45 30 2 ! PSI for THR 46 assign (segid A and resid 46 and name N ) (segid A and resid 46 and name CA ) (segid A and resid 46 and name C ) (segid A and resid 47 and name N ) 1.0 -42.89 30 2 ! PHI for ALA 47 assign (segid A and resid 46 and name C ) (segid A and resid 47 and name N ) (segid A and resid 47 and name CA ) (segid A and resid 47 and name C ) 1.0 -69.89 30 2 ! PSI for ALA 47 assign (segid A and resid 47 and name N ) (segid A and resid 47 and name CA ) (segid A and resid 47 and name C ) (segid A and resid 48 and name N ) 1.0 -31.85 30 2 ! PHI for THR 48 assign (segid A and resid 47 and name C ) (segid A and resid 48 and name N ) (segid A and resid 48 and name CA ) (segid A and resid 48 and name C ) 1.0 -109.45 30 2 ! PSI for THR 48 assign (segid A and resid 48 and name N ) (segid A and resid 48 and name CA ) (segid A and resid 48 and name C ) (segid A and resid 49 and name N ) 1.0 -4.87 30 2 ! PHI for GLY 49 assign (segid A and resid 48 and name C ) (segid A and resid 49 and name N ) (segid A and resid 49 and name CA ) (segid A and resid 49 and name C ) 1.0 81.01 30 2 ! PSI for GLY 49 assign (segid A and resid 49 and name N ) (segid A and resid 49 and name CA ) (segid A and resid 49 and name C ) (segid A and resid 50 and name N ) 1.0 5.19 30 2 ! PHI for MET 50 assign (segid A and resid 49 and name C ) (segid A and resid 50 and name N ) (segid A and resid 50 and name CA ) (segid A and resid 50 and name C ) 1.0 -124.4 30 2 ! PSI for MET 50 assign (segid A and resid 50 and name N ) (segid A and resid 50 and name CA ) (segid A and resid 50 and name C ) (segid A and resid 51 and name N ) 1.0 154.01 30 2 ! PHI for ASN 51 assign (segid A and resid 50 and name C ) (segid A and resid 51 and name N ) (segid A and resid 51 and name CA ) (segid A and resid 51 and name C ) 1.0 -75.96 30 2 ! PSI for ASN 51 assign (segid A and resid 51 and name N ) (segid A and resid 51 and name CA ) (segid A and resid 51 and name C ) (segid A and resid 52 and name N ) 1.0 160.99 30 2 ! PHI for LEU 52 assign (segid A and resid 51 and name C ) (segid A and resid 52 and name N ) (segid A and resid 52 and name CA ) (segid A and resid 52 and name C ) 1.0 -61.84 30 2 ! PSI for LEU 52 assign (segid A and resid 52 and name N ) (segid A and resid 52 and name CA ) (segid A and resid 52 and name C ) (segid A and resid 53 and name N ) 1.0 -38.59 30 2 ! PHI for THR 53 assign (segid A and resid 52 and name C ) (segid A and resid 53 and name N ) (segid A and resid 53 and name CA ) (segid A and resid 53 and name C ) 1.0 -65.13 30 2 ! PSI for THR 53 assign (segid A and resid 53 and name N ) (segid A and resid 53 and name CA ) (segid A and resid 53 and name C ) (segid A and resid 54 and name N ) 1.0 -40.38 30 2 ! PHI for THR 54 assign (segid A and resid 53 and name C ) (segid A and resid 54 and name N ) (segid A and resid 54 and name CA ) (segid A and resid 54 and name C ) 1.0 -66.13 30 2 ! PSI for THR 54 assign (segid A and resid 54 and name N ) (segid A and resid 54 and name CA ) (segid A and resid 54 and name C ) (segid A and resid 55 and name N ) 1.0 -39.91 30 2 ! PHI for ALA 55 assign (segid A and resid 54 and name C ) (segid A and resid 55 and name N ) (segid A and resid 55 and name CA ) (segid A and resid 55 and name C ) 1.0 -62.25 30 2 ! PSI for ALA 55 assign (segid A and resid 55 and name N ) (segid A and resid 55 and name CA ) (segid A and resid 55 and name C ) (segid A and resid 56 and name N ) 1.0 -43.49 30 2 ! PHI for SER 56 assign (segid A and resid 55 and name C ) (segid A and resid 56 and name N ) (segid A and resid 56 and name CA ) (segid A and resid 56 and name C ) 1.0 -63.36 30 2 ! PSI for SER 56 assign (segid A and resid 56 and name N ) (segid A and resid 56 and name CA ) (segid A and resid 56 and name C ) (segid A and resid 57 and name N ) 1.0 -40.89 30 2 ! PHI for ALA 57 assign (segid A and resid 56 and name C ) (segid A and resid 57 and name N ) (segid A and resid 57 and name CA ) (segid A and resid 57 and name C ) 1.0 -65.23 30 2 ! PSI for ALA 57 assign (segid A and resid 57 and name N ) (segid A and resid 57 and name CA ) (segid A and resid 57 and name C ) (segid A and resid 58 and name N ) 1.0 -41.81 30 2 ! PHI for ASN 58 assign (segid A and resid 57 and name C ) (segid A and resid 58 and name N ) (segid A and resid 58 and name CA ) (segid A and resid 58 and name C ) 1.0 -63.88 30 2 ! PSI for ASN 58 assign (segid A and resid 58 and name N ) (segid A and resid 58 and name CA ) (segid A and resid 58 and name C ) (segid A and resid 59 and name N ) 1.0 -42.56 30 2 ! PHI for LEU 59 assign (segid A and resid 58 and name C ) (segid A and resid 59 and name N ) (segid A and resid 59 and name CA ) (segid A and resid 59 and name C ) 1.0 -63.18 30 2 ! PSI for LEU 59 assign (segid A and resid 59 and name N ) (segid A and resid 59 and name CA ) (segid A and resid 59 and name C ) (segid A and resid 60 and name N ) 1.0 -43.85 30 2 ! PHI for GLN 60 assign (segid A and resid 59 and name C ) (segid A and resid 60 and name N ) (segid A and resid 60 and name CA ) (segid A and resid 60 and name C ) 1.0 -63.94 30 2 ! PSI for GLN 60 assign (segid A and resid 60 and name N ) (segid A and resid 60 and name CA ) (segid A and resid 60 and name C ) (segid A and resid 61 and name N ) 1.0 -41.67 30 2 ! PHI for ALA 61 assign (segid A and resid 60 and name C ) (segid A and resid 61 and name N ) (segid A and resid 61 and name CA ) (segid A and resid 61 and name C ) 1.0 -64.6 30 2 ! PSI for ALA 61 assign (segid A and resid 61 and name N ) (segid A and resid 61 and name CA ) (segid A and resid 61 and name C ) (segid A and resid 62 and name N ) 1.0 -42.06 30 2 ! PHI for LEU 62 assign (segid A and resid 61 and name C ) (segid A and resid 62 and name N ) (segid A and resid 62 and name CA ) (segid A and resid 62 and name C ) 1.0 -64.65 30 2 ! PSI for LEU 62 assign (segid A and resid 62 and name N ) (segid A and resid 62 and name CA ) (segid A and resid 62 and name C ) (segid A and resid 63 and name N ) 1.0 -39.74 30 2 ! PHI for LYS 63 assign (segid A and resid 62 and name C ) (segid A and resid 63 and name N ) (segid A and resid 63 and name CA ) (segid A and resid 63 and name C ) 1.0 -68.49 30 2 ! PSI for LYS 63 assign (segid A and resid 63 and name N ) (segid A and resid 63 and name CA ) (segid A and resid 63 and name C ) (segid A and resid 64 and name N ) 1.0 -38.25 30 2 ! PHI for SER 64 assign (segid A and resid 63 and name C ) (segid A and resid 64 and name N ) (segid A and resid 64 and name CA ) (segid A and resid 64 and name C ) 1.0 -65.75 30 2 ! PSI for SER 64 assign (segid A and resid 64 and name N ) (segid A and resid 64 and name CA ) (segid A and resid 64 and name C ) (segid A and resid 65 and name N ) 1.0 -33.24 30 2 ! PHI for VAL 68 assign (segid A and resid 67 and name C ) (segid A and resid 68 and name N ) (segid A and resid 68 and name CA ) (segid A and resid 68 and name C ) 1.0 -130.6 30 2 ! PSI for VAL 68 assign (segid A and resid 68 and name N ) (segid A and resid 68 and name CA ) (segid A and resid 68 and name C ) (segid A and resid 69 and name N ) 1.0 168.4 30 2 ! PHI for GLU 69 assign (segid A and resid 68 and name C ) (segid A and resid 69 and name N ) (segid A and resid 69 and name CA ) (segid A and resid 69 and name C ) 1.0 -132.29 30 2 ! PSI for GLU 69 assign (segid A and resid 69 and name N ) (segid A and resid 69 and name CA ) (segid A and resid 69 and name C ) (segid A and resid 70 and name N ) 1.0 147.15 30 2 ! PHI for ALA 70 assign (segid A and resid 69 and name C ) (segid A and resid 70 and name N ) (segid A and resid 70 and name CA ) (segid A and resid 70 and name C ) 1.0 -123.78 30 2 ! PSI for ALA 70 assign (segid A and resid 70 and name N ) (segid A and resid 70 and name CA ) (segid A and resid 70 and name C ) (segid A and resid 71 and name N ) 1.0 139.66 30 2 ! PHI for ARG 71 assign (segid A and resid 70 and name C ) (segid A and resid 71 and name N ) (segid A and resid 71 and name CA ) (segid A and resid 71 and name C ) 1.0 -128.35 30 2 ! PSI for ARG 71 assign (segid A and resid 71 and name N ) (segid A and resid 71 and name CA ) (segid A and resid 71 and name C ) (segid A and resid 72 and name N ) 1.0 136.2 30 2 ! PHI for ARG 72 assign (segid A and resid 71 and name C ) (segid A and resid 72 and name N ) (segid A and resid 72 and name CA ) (segid A and resid 72 and name C ) 1.0 -109.16 30 2 ! PSI for ARG 72 assign (segid A and resid 72 and name N ) (segid A and resid 72 and name CA ) (segid A and resid 72 and name C ) (segid A and resid 73 and name N ) 1.0 127.12 30 2 ! PHI for GLU 73 assign (segid A and resid 72 and name C ) (segid A and resid 73 and name N ) (segid A and resid 73 and name CA ) (segid A and resid 73 and name C ) 1.0 -131.18 30 2 ! PSI for GLU 73 assign (segid A and resid 73 and name N ) (segid A and resid 73 and name CA ) (segid A and resid 73 and name C ) (segid A and resid 74 and name N ) 1.0 117.57 30 2 ! PHI for GLY 74 assign (segid A and resid 73 and name C ) (segid A and resid 74 and name N ) (segid A and resid 74 and name CA ) (segid A and resid 74 and name C ) 1.0 70.96 30 2 ! PSI for GLY 74 assign (segid A and resid 74 and name N ) (segid A and resid 74 and name CA ) (segid A and resid 74 and name C ) (segid A and resid 75 and name N ) 1.0 -124.5 30 2 ! PHI for THR 75 assign (segid A and resid 74 and name C ) (segid A and resid 75 and name N ) (segid A and resid 75 and name CA ) (segid A and resid 75 and name C ) 1.0 -101.11 30 2 ! PSI for THR 75 assign (segid A and resid 75 and name N ) (segid A and resid 75 and name CA ) (segid A and resid 75 and name C ) (segid A and resid 76 and name N ) 1.0 -3.41 30 2 ! PHI for ARG 76 assign (segid A and resid 75 and name C ) (segid A and resid 76 and name N ) (segid A and resid 76 and name CA ) (segid A and resid 76 and name C ) 1.0 -124.92 30 2 ! PSI for ARG 76 assign (segid A and resid 76 and name N ) (segid A and resid 76 and name CA ) (segid A and resid 76 and name C ) (segid A and resid 77 and name N ) 1.0 141.36 30 2 ! PHI for GLN 77 assign (segid A and resid 76 and name C ) (segid A and resid 77 and name N ) (segid A and resid 77 and name CA ) (segid A and resid 77 and name C ) 1.0 -114.69 30 2 ! PSI for GLN 77 assign (segid A and resid 77 and name N ) (segid A and resid 77 and name CA ) (segid A and resid 77 and name C ) (segid A and resid 78 and name N ) 1.0 134.69 30 2 ! PHI for TYR 78 assign (segid A and resid 77 and name C ) (segid A and resid 78 and name N ) (segid A and resid 78 and name CA ) (segid A and resid 78 and name C ) 1.0 -119.79 30 2 ! PSI for TYR 78 assign (segid A and resid 78 and name N ) (segid A and resid 78 and name CA ) (segid A and resid 78 and name C ) (segid A and resid 79 and name N ) 1.0 135.47 30 2 ! PHI for TYR 79 assign (segid A and resid 78 and name C ) (segid A and resid 79 and name N ) (segid A and resid 79 and name CA ) (segid A and resid 79 and name C ) 1.0 -131.36 30 2 ! PSI for TYR 79 assign (segid A and resid 79 and name N ) (segid A and resid 79 and name CA ) (segid A and resid 79 and name C ) (segid A and resid 80 and name N ) 1.0 158.05 30 2 ! PHI for ARG 80 assign (segid A and resid 79 and name C ) (segid A and resid 80 and name N ) (segid A and resid 80 and name CA ) (segid A and resid 80 and name C ) 1.0 -134.27 30 2 ! PSI for ARG 80 assign (segid A and resid 80 and name N ) (segid A and resid 80 and name CA ) (segid A and resid 80 and name C ) (segid A and resid 81 and name N ) 1.0 148.09 30 2 ! PHI for GLU 84 assign (segid A and resid 83 and name C ) (segid A and resid 84 and name N ) (segid A and resid 84 and name CA ) (segid A and resid 84 and name C ) 1.0 -59.7 30 2 ! PSI for GLU 84 assign (segid A and resid 84 and name N ) (segid A and resid 84 and name CA ) (segid A and resid 84 and name C ) (segid A and resid 85 and name N ) 1.0 -39.84 30 2 ! PHI for ASP 85 assign (segid A and resid 84 and name C ) (segid A and resid 85 and name N ) (segid A and resid 85 and name CA ) (segid A and resid 85 and name C ) 1.0 -67.87 30 2 ! PSI for ASP 85 assign (segid A and resid 85 and name N ) (segid A and resid 85 and name CA ) (segid A and resid 85 and name C ) (segid A and resid 86 and name N ) 1.0 -37.04 30 2 ! PHI for VAL 86 assign (segid A and resid 85 and name C ) (segid A and resid 86 and name N ) (segid A and resid 86 and name CA ) (segid A and resid 86 and name C ) 1.0 -65.44 30 2 ! PSI for VAL 86 assign (segid A and resid 86 and name N ) (segid A and resid 86 and name CA ) (segid A and resid 86 and name C ) (segid A and resid 87 and name N ) 1.0 -42.35 30 2 ! PHI for ALA 87 assign (segid A and resid 86 and name C ) (segid A and resid 87 and name N ) (segid A and resid 87 and name CA ) (segid A and resid 87 and name C ) 1.0 -61.05 30 2 ! PSI for ALA 87 assign (segid A and resid 87 and name N ) (segid A and resid 87 and name CA ) (segid A and resid 87 and name C ) (segid A and resid 88 and name N ) 1.0 -41.43 30 2 ! PHI for ARG 88 assign (segid A and resid 87 and name C ) (segid A and resid 88 and name N ) (segid A and resid 88 and name CA ) (segid A and resid 88 and name C ) 1.0 -68.12 30 2 ! PSI for ARG 88 assign (segid A and resid 88 and name N ) (segid A and resid 88 and name CA ) (segid A and resid 88 and name C ) (segid A and resid 89 and name N ) 1.0 -34.9 30 2 ! PHI for LEU 89 assign (segid A and resid 88 and name C ) (segid A and resid 89 and name N ) (segid A and resid 89 and name CA ) (segid A and resid 89 and name C ) 1.0 -62.07 30 2 ! PSI for LEU 89 assign (segid A and resid 89 and name N ) (segid A and resid 89 and name CA ) (segid A and resid 89 and name C ) (segid A and resid 90 and name N ) 1.0 -42.64 30 2 ! PHI for PHE 90 assign (segid A and resid 89 and name C ) (segid A and resid 90 and name N ) (segid A and resid 90 and name CA ) (segid A and resid 90 and name C ) 1.0 -65.07 30 2 ! PSI for PHE 90 assign (segid A and resid 90 and name N ) (segid A and resid 90 and name CA ) (segid A and resid 90 and name C ) (segid A and resid 91 and name N ) 1.0 -39.67 30 2 ! PHI for ALA 91 assign (segid A and resid 90 and name C ) (segid A and resid 91 and name N ) (segid A and resid 91 and name CA ) (segid A and resid 91 and name C ) 1.0 -64.33 30 2 ! PSI for ALA 91 assign (segid A and resid 91 and name N ) (segid A and resid 91 and name CA ) (segid A and resid 91 and name C ) (segid A and resid 92 and name N ) 1.0 -46.76 30 2 ! PHI for LEU 92 assign (segid A and resid 91 and name C ) (segid A and resid 92 and name N ) (segid A and resid 92 and name CA ) (segid A and resid 92 and name C ) 1.0 -63.01 30 2 ! PSI for LEU 92 assign (segid A and resid 92 and name N ) (segid A and resid 92 and name CA ) (segid A and resid 92 and name C ) (segid A and resid 93 and name N ) 1.0 -42.02 30 2 ! PHI for VAL 93 assign (segid A and resid 92 and name C ) (segid A and resid 93 and name N ) (segid A and resid 93 and name CA ) (segid A and resid 93 and name C ) 1.0 -64.23 30 2 ! PSI for VAL 93 assign (segid A and resid 93 and name N ) (segid A and resid 93 and name CA ) (segid A and resid 93 and name C ) (segid A and resid 94 and name N ) 1.0 -46.87 30 2 ! PHI for GLN 94 assign (segid A and resid 93 and name C ) (segid A and resid 94 and name N ) (segid A and resid 94 and name CA ) (segid A and resid 94 and name C ) 1.0 -62.42 30 2 ! PSI for GLN 94 assign (segid A and resid 94 and name N ) (segid A and resid 94 and name CA ) (segid A and resid 94 and name C ) (segid A and resid 95 and name N ) 1.0 -44.11 30 2 ! PHI for VAL 95 assign (segid A and resid 94 and name C ) (segid A and resid 95 and name N ) (segid A and resid 95 and name CA ) (segid A and resid 95 and name C ) 1.0 -63.42 30 2 ! PSI for VAL 95 assign (segid A and resid 95 and name N ) (segid A and resid 95 and name CA ) (segid A and resid 95 and name C ) (segid A and resid 96 and name N ) 1.0 -46.36 30 2 ! PHI for VAL 96 assign (segid A and resid 95 and name C ) (segid A and resid 96 and name N ) (segid A and resid 96 and name CA ) (segid A and resid 96 and name C ) 1.0 -63.65 30 2 ! PSI for VAL 96 assign (segid A and resid 96 and name N ) (segid A and resid 96 and name CA ) (segid A and resid 96 and name C ) (segid A and resid 97 and name N ) 1.0 -43.82 30 2 ! PHI for ALA 97 assign (segid A and resid 96 and name C ) (segid A and resid 97 and name N ) (segid A and resid 97 and name CA ) (segid A and resid 97 and name C ) 1.0 -63.69 30 2 ! PSI for ALA 97 assign (segid A and resid 97 and name N ) (segid A and resid 97 and name CA ) (segid A and resid 97 and name C ) (segid A and resid 98 and name N ) 1.0 -42.98 30 2 ! PHI for ASP 98 assign (segid A and resid 97 and name C ) (segid A and resid 98 and name N ) (segid A and resid 98 and name CA ) (segid A and resid 98 and name C ) 1.0 -61.79 30 2 ! PSI for ASP 98 assign (segid A and resid 98 and name N ) (segid A and resid 98 and name CA ) (segid A and resid 98 and name C ) (segid A and resid 99 and name N ) 1.0 -40.36 30 2 ! PHI for GLU 99 assign (segid A and resid 98 and name C ) (segid A and resid 99 and name N ) (segid A and resid 99 and name CA ) (segid A and resid 99 and name C ) 1.0 -73.56 30 2 ! PSI for GLU 99 assign (segid A and resid 99 and name N ) (segid A and resid 99 and name CA ) (segid A and resid 99 and name C ) (segid A and resid 100 and name N ) 1.0 -31.96 30 2 ! PHI for HIS 100 assign (segid A and resid 99 and name C ) (segid A and resid 100 and name N ) (segid A and resid 100 and name CA ) (segid A and resid 100 and name C ) 1.0 -80.35 30 2 ! PSI for HIS 100 assign (segid A and resid 100 and name N ) (segid A and resid 100 and name CA ) (segid A and resid 100 and name C ) (segid A and resid 101 and name N ) 1.0 -33.98 30 2 ! PHI for ARG 7 assign (segid B and resid 6 and name C ) (segid B and resid 7 and name N ) (segid B and resid 7 and name CA ) (segid B and resid 7 and name C ) 1.0 -64.82 30 2 ! PSI for ARG 7 assign (segid B and resid 7 and name N ) (segid B and resid 7 and name CA ) (segid B and resid 7 and name C ) (segid B and resid 8 and name N ) 1.0 -36.27 30 2 ! PHI for LYS 8 assign (segid B and resid 7 and name C ) (segid B and resid 8 and name N ) (segid B and resid 8 and name CA ) (segid B and resid 8 and name C ) 1.0 -61.82 30 2 ! PSI for LYS 8 assign (segid B and resid 8 and name N ) (segid B and resid 8 and name CA ) (segid B and resid 8 and name C ) (segid B and resid 9 and name N ) 1.0 -40.1 30 2 ! PHI for ALA 9 assign (segid B and resid 8 and name C ) (segid B and resid 9 and name N ) (segid B and resid 9 and name CA ) (segid B and resid 9 and name C ) 1.0 -63.14 30 2 ! PSI for ALA 9 assign (segid B and resid 9 and name N ) (segid B and resid 9 and name CA ) (segid B and resid 9 and name C ) (segid B and resid 10 and name N ) 1.0 -41.13 30 2 ! PHI for ALA 10 assign (segid B and resid 9 and name C ) (segid B and resid 10 and name N ) (segid B and resid 10 and name CA ) (segid B and resid 10 and name C ) 1.0 -62.36 30 2 ! PSI for ALA 10 assign (segid B and resid 10 and name N ) (segid B and resid 10 and name CA ) (segid B and resid 10 and name C ) (segid B and resid 11 and name N ) 1.0 -40.14 30 2 ! PHI for LEU 11 assign (segid B and resid 10 and name C ) (segid B and resid 11 and name N ) (segid B and resid 11 and name CA ) (segid B and resid 11 and name C ) 1.0 -66.82 30 2 ! PSI for LEU 11 assign (segid B and resid 11 and name N ) (segid B and resid 11 and name CA ) (segid B and resid 11 and name C ) (segid B and resid 12 and name N ) 1.0 -41.03 30 2 ! PHI for LEU 12 assign (segid B and resid 11 and name C ) (segid B and resid 12 and name N ) (segid B and resid 12 and name CA ) (segid B and resid 12 and name C ) 1.0 -65.28 30 2 ! PSI for LEU 12 assign (segid B and resid 12 and name N ) (segid B and resid 12 and name CA ) (segid B and resid 12 and name C ) (segid B and resid 13 and name N ) 1.0 -38.74 30 2 ! PHI for ASP 13 assign (segid B and resid 12 and name C ) (segid B and resid 13 and name N ) (segid B and resid 13 and name CA ) (segid B and resid 13 and name C ) 1.0 -64.13 30 2 ! PSI for ASP 13 assign (segid B and resid 13 and name N ) (segid B and resid 13 and name CA ) (segid B and resid 13 and name C ) (segid B and resid 14 and name N ) 1.0 -41.56 30 2 ! PHI for GLN 14 assign (segid B and resid 13 and name C ) (segid B and resid 14 and name N ) (segid B and resid 14 and name CA ) (segid B and resid 14 and name C ) 1.0 -69.24 30 2 ! PSI for GLN 14 assign (segid B and resid 14 and name N ) (segid B and resid 14 and name CA ) (segid B and resid 14 and name C ) (segid B and resid 15 and name N ) 1.0 -37.8 30 2 ! PHI for VAL 15 assign (segid B and resid 14 and name C ) (segid B and resid 15 and name N ) (segid B and resid 15 and name CA ) (segid B and resid 15 and name C ) 1.0 -64.99 30 2 ! PSI for VAL 15 assign (segid B and resid 15 and name N ) (segid B and resid 15 and name CA ) (segid B and resid 15 and name C ) (segid B and resid 16 and name N ) 1.0 -44.61 30 2 ! PHI for ALA 16 assign (segid B and resid 15 and name C ) (segid B and resid 16 and name N ) (segid B and resid 16 and name CA ) (segid B and resid 16 and name C ) 1.0 -58.84 30 2 ! PSI for ALA 16 assign (segid B and resid 16 and name N ) (segid B and resid 16 and name CA ) (segid B and resid 16 and name C ) (segid B and resid 17 and name N ) 1.0 -42.29 30 2 ! PHI for ARG 17 assign (segid B and resid 16 and name C ) (segid B and resid 17 and name N ) (segid B and resid 17 and name CA ) (segid B and resid 17 and name C ) 1.0 -64.43 30 2 ! PSI for ARG 17 assign (segid B and resid 17 and name N ) (segid B and resid 17 and name CA ) (segid B and resid 17 and name C ) (segid B and resid 18 and name N ) 1.0 -38.12 30 2 ! PHI for VAL 18 assign (segid B and resid 17 and name C ) (segid B and resid 18 and name N ) (segid B and resid 18 and name CA ) (segid B and resid 18 and name C ) 1.0 -67.06 30 2 ! PSI for VAL 18 assign (segid B and resid 18 and name N ) (segid B and resid 18 and name CA ) (segid B and resid 18 and name C ) (segid B and resid 19 and name N ) 1.0 -42.38 30 2 ! PHI for GLY 19 assign (segid B and resid 18 and name C ) (segid B and resid 19 and name N ) (segid B and resid 19 and name CA ) (segid B and resid 19 and name C ) 1.0 -63.51 30 2 ! PSI for GLY 19 assign (segid B and resid 19 and name N ) (segid B and resid 19 and name CA ) (segid B and resid 19 and name C ) (segid B and resid 20 and name N ) 1.0 -30.57 30 2 ! PHI for LYS 20 assign (segid B and resid 19 and name C ) (segid B and resid 20 and name N ) (segid B and resid 20 and name CA ) (segid B and resid 20 and name C ) 1.0 -62.97 30 2 ! PSI for LYS 20 assign (segid B and resid 20 and name N ) (segid B and resid 20 and name CA ) (segid B and resid 20 and name C ) (segid B and resid 21 and name N ) 1.0 -45.18 30 2 ! PHI for ALA 21 assign (segid B and resid 20 and name C ) (segid B and resid 21 and name N ) (segid B and resid 21 and name CA ) (segid B and resid 21 and name C ) 1.0 -69.38 30 2 ! PSI for ALA 21 assign (segid B and resid 21 and name N ) (segid B and resid 21 and name CA ) (segid B and resid 21 and name C ) (segid B and resid 22 and name N ) 1.0 -24.11 30 2 ! PHI for LEU 22 assign (segid B and resid 21 and name C ) (segid B and resid 22 and name N ) (segid B and resid 22 and name CA ) (segid B and resid 22 and name C ) 1.0 -93.07 30 2 ! PSI for LEU 22 assign (segid B and resid 22 and name N ) (segid B and resid 22 and name CA ) (segid B and resid 22 and name C ) (segid B and resid 23 and name N ) 1.0 -5.01 30 2 ! PHI for ARG 26 assign (segid B and resid 25 and name C ) (segid B and resid 26 and name N ) (segid B and resid 26 and name CA ) (segid B and resid 26 and name C ) 1.0 -65.84 30 2 ! PSI for ARG 26 assign (segid B and resid 26 and name N ) (segid B and resid 26 and name CA ) (segid B and resid 26 and name C ) (segid B and resid 27 and name N ) 1.0 -34.67 30 2 ! PHI for ARG 27 assign (segid B and resid 26 and name C ) (segid B and resid 27 and name N ) (segid B and resid 27 and name CA ) (segid B and resid 27 and name C ) 1.0 -63.88 30 2 ! PSI for ARG 27 assign (segid B and resid 27 and name N ) (segid B and resid 27 and name CA ) (segid B and resid 27 and name C ) (segid B and resid 28 and name N ) 1.0 -40.3 30 2 ! PHI for LEU 28 assign (segid B and resid 27 and name C ) (segid B and resid 28 and name N ) (segid B and resid 28 and name CA ) (segid B and resid 28 and name C ) 1.0 -59.32 30 2 ! PSI for LEU 28 assign (segid B and resid 28 and name N ) (segid B and resid 28 and name CA ) (segid B and resid 28 and name C ) (segid B and resid 29 and name N ) 1.0 -40.6 30 2 ! PHI for GLN 29 assign (segid B and resid 28 and name C ) (segid B and resid 29 and name N ) (segid B and resid 29 and name CA ) (segid B and resid 29 and name C ) 1.0 -62.66 30 2 ! PSI for GLN 29 assign (segid B and resid 29 and name N ) (segid B and resid 29 and name CA ) (segid B and resid 29 and name C ) (segid B and resid 30 and name N ) 1.0 -45.71 30 2 ! PHI for ILE 30 assign (segid B and resid 29 and name C ) (segid B and resid 30 and name N ) (segid B and resid 30 and name CA ) (segid B and resid 30 and name C ) 1.0 -65.16 30 2 ! PSI for ILE 30 assign (segid B and resid 30 and name N ) (segid B and resid 30 and name CA ) (segid B and resid 30 and name C ) (segid B and resid 31 and name N ) 1.0 -44.06 30 2 ! PHI for LEU 31 assign (segid B and resid 30 and name C ) (segid B and resid 31 and name N ) (segid B and resid 31 and name CA ) (segid B and resid 31 and name C ) 1.0 -59.91 30 2 ! PSI for LEU 31 assign (segid B and resid 31 and name N ) (segid B and resid 31 and name CA ) (segid B and resid 31 and name C ) (segid B and resid 32 and name N ) 1.0 -41 30 2 ! PHI for ASP 32 assign (segid B and resid 31 and name C ) (segid B and resid 32 and name N ) (segid B and resid 32 and name CA ) (segid B and resid 32 and name C ) 1.0 -66.49 30 2 ! PSI for ASP 32 assign (segid B and resid 32 and name N ) (segid B and resid 32 and name CA ) (segid B and resid 32 and name C ) (segid B and resid 33 and name N ) 1.0 -42.46 30 2 ! PHI for LEU 33 assign (segid B and resid 32 and name C ) (segid B and resid 33 and name N ) (segid B and resid 33 and name CA ) (segid B and resid 33 and name C ) 1.0 -63.5 30 2 ! PSI for LEU 33 assign (segid B and resid 33 and name N ) (segid B and resid 33 and name CA ) (segid B and resid 33 and name C ) (segid B and resid 34 and name N ) 1.0 -41.04 30 2 ! PHI for LEU 34 assign (segid B and resid 33 and name C ) (segid B and resid 34 and name N ) (segid B and resid 34 and name CA ) (segid B and resid 34 and name C ) 1.0 -72.87 30 2 ! PSI for LEU 34 assign (segid B and resid 34 and name N ) (segid B and resid 34 and name CA ) (segid B and resid 34 and name C ) (segid B and resid 35 and name N ) 1.0 -31.69 30 2 ! PHI for ALA 35 assign (segid B and resid 34 and name C ) (segid B and resid 35 and name N ) (segid B and resid 35 and name CA ) (segid B and resid 35 and name C ) 1.0 -65.13 30 2 ! PSI for ALA 35 assign (segid B and resid 35 and name N ) (segid B and resid 35 and name CA ) (segid B and resid 35 and name C ) (segid B and resid 36 and name N ) 1.0 -25.76 30 2 ! PHI for GLN 36 assign (segid B and resid 35 and name C ) (segid B and resid 36 and name N ) (segid B and resid 36 and name CA ) (segid B and resid 36 and name C ) 1.0 -83.92 30 2 ! PSI for GLN 36 assign (segid B and resid 36 and name N ) (segid B and resid 36 and name CA ) (segid B and resid 36 and name C ) (segid B and resid 37 and name N ) 1.0 -13.85 30 2 ! PHI for GLU 38 assign (segid B and resid 37 and name C ) (segid B and resid 38 and name N ) (segid B and resid 38 and name CA ) (segid B and resid 38 and name C ) 1.0 -102.58 30 2 ! PSI for GLU 38 assign (segid B and resid 38 and name N ) (segid B and resid 38 and name CA ) (segid B and resid 38 and name C ) (segid B and resid 39 and name N ) 1.0 130.29 30 2 ! PHI for ARG 39 assign (segid B and resid 38 and name C ) (segid B and resid 39 and name N ) (segid B and resid 39 and name CA ) (segid B and resid 39 and name C ) 1.0 -134.82 30 2 ! PSI for ARG 39 assign (segid B and resid 39 and name N ) (segid B and resid 39 and name CA ) (segid B and resid 39 and name C ) (segid B and resid 40 and name N ) 1.0 155.99 30 2 ! PHI for ALA 40 assign (segid B and resid 39 and name C ) (segid B and resid 40 and name N ) (segid B and resid 40 and name CA ) (segid B and resid 40 and name C ) 1.0 -81.49 30 2 ! PSI for ALA 40 assign (segid B and resid 40 and name N ) (segid B and resid 40 and name CA ) (segid B and resid 40 and name C ) (segid B and resid 41 and name N ) 1.0 141.31 30 2 ! PHI for VAL 41 assign (segid B and resid 40 and name C ) (segid B and resid 41 and name N ) (segid B and resid 41 and name CA ) (segid B and resid 41 and name C ) 1.0 -56.79 30 2 ! PSI for VAL 41 assign (segid B and resid 41 and name N ) (segid B and resid 41 and name CA ) (segid B and resid 41 and name C ) (segid B and resid 42 and name N ) 1.0 -43.72 30 2 ! PHI for GLU 42 assign (segid B and resid 41 and name C ) (segid B and resid 42 and name N ) (segid B and resid 42 and name CA ) (segid B and resid 42 and name C ) 1.0 -61.04 30 2 ! PSI for GLU 42 assign (segid B and resid 42 and name N ) (segid B and resid 42 and name CA ) (segid B and resid 42 and name C ) (segid B and resid 43 and name N ) 1.0 -42.98 30 2 ! PHI for ALA 43 assign (segid B and resid 42 and name C ) (segid B and resid 43 and name N ) (segid B and resid 43 and name CA ) (segid B and resid 43 and name C ) 1.0 -65.74 30 2 ! PSI for ALA 43 assign (segid B and resid 43 and name N ) (segid B and resid 43 and name CA ) (segid B and resid 43 and name C ) (segid B and resid 44 and name N ) 1.0 -43.09 30 2 ! PHI for ILE 44 assign (segid B and resid 43 and name C ) (segid B and resid 44 and name N ) (segid B and resid 44 and name CA ) (segid B and resid 44 and name C ) 1.0 -65.38 30 2 ! PSI for ILE 44 assign (segid B and resid 44 and name N ) (segid B and resid 44 and name CA ) (segid B and resid 44 and name C ) (segid B and resid 45 and name N ) 1.0 -43.39 30 2 ! PHI for ALA 45 assign (segid B and resid 44 and name C ) (segid B and resid 45 and name N ) (segid B and resid 45 and name CA ) (segid B and resid 45 and name C ) 1.0 -60.89 30 2 ! PSI for ALA 45 assign (segid B and resid 45 and name N ) (segid B and resid 45 and name CA ) (segid B and resid 45 and name C ) (segid B and resid 46 and name N ) 1.0 -41.52 30 2 ! PHI for THR 46 assign (segid B and resid 45 and name C ) (segid B and resid 46 and name N ) (segid B and resid 46 and name CA ) (segid B and resid 46 and name C ) 1.0 -61.45 30 2 ! PSI for THR 46 assign (segid B and resid 46 and name N ) (segid B and resid 46 and name CA ) (segid B and resid 46 and name C ) (segid B and resid 47 and name N ) 1.0 -42.89 30 2 ! PHI for ALA 47 assign (segid B and resid 46 and name C ) (segid B and resid 47 and name N ) (segid B and resid 47 and name CA ) (segid B and resid 47 and name C ) 1.0 -69.89 30 2 ! PSI for ALA 47 assign (segid B and resid 47 and name N ) (segid B and resid 47 and name CA ) (segid B and resid 47 and name C ) (segid B and resid 48 and name N ) 1.0 -31.85 30 2 ! PHI for THR 48 assign (segid B and resid 47 and name C ) (segid B and resid 48 and name N ) (segid B and resid 48 and name CA ) (segid B and resid 48 and name C ) 1.0 -109.45 30 2 ! PSI for THR 48 assign (segid B and resid 48 and name N ) (segid B and resid 48 and name CA ) (segid B and resid 48 and name C ) (segid B and resid 49 and name N ) 1.0 -4.87 30 2 ! PHI for GLY 49 assign (segid B and resid 48 and name C ) (segid B and resid 49 and name N ) (segid B and resid 49 and name CA ) (segid B and resid 49 and name C ) 1.0 81.01 30 2 ! PSI for GLY 49 assign (segid B and resid 49 and name N ) (segid B and resid 49 and name CA ) (segid B and resid 49 and name C ) (segid B and resid 50 and name N ) 1.0 5.19 30 2 ! PHI for MET 50 assign (segid B and resid 49 and name C ) (segid B and resid 50 and name N ) (segid B and resid 50 and name CA ) (segid B and resid 50 and name C ) 1.0 -124.4 30 2 ! PSI for MET 50 assign (segid B and resid 50 and name N ) (segid B and resid 50 and name CA ) (segid B and resid 50 and name C ) (segid B and resid 51 and name N ) 1.0 154.01 30 2 ! PHI for ASN 51 assign (segid B and resid 50 and name C ) (segid B and resid 51 and name N ) (segid B and resid 51 and name CA ) (segid B and resid 51 and name C ) 1.0 -75.96 30 2 ! PSI for ASN 51 assign (segid B and resid 51 and name N ) (segid B and resid 51 and name CA ) (segid B and resid 51 and name C ) (segid B and resid 52 and name N ) 1.0 160.99 30 2 ! PHI for LEU 52 assign (segid B and resid 51 and name C ) (segid B and resid 52 and name N ) (segid B and resid 52 and name CA ) (segid B and resid 52 and name C ) 1.0 -61.84 30 2 ! PSI for LEU 52 assign (segid B and resid 52 and name N ) (segid B and resid 52 and name CA ) (segid B and resid 52 and name C ) (segid B and resid 53 and name N ) 1.0 -38.59 30 2 ! PHI for THR 53 assign (segid B and resid 52 and name C ) (segid B and resid 53 and name N ) (segid B and resid 53 and name CA ) (segid B and resid 53 and name C ) 1.0 -65.13 30 2 ! PSI for THR 53 assign (segid B and resid 53 and name N ) (segid B and resid 53 and name CA ) (segid B and resid 53 and name C ) (segid B and resid 54 and name N ) 1.0 -40.38 30 2 ! PHI for THR 54 assign (segid B and resid 53 and name C ) (segid B and resid 54 and name N ) (segid B and resid 54 and name CA ) (segid B and resid 54 and name C ) 1.0 -66.13 30 2 ! PSI for THR 54 assign (segid B and resid 54 and name N ) (segid B and resid 54 and name CA ) (segid B and resid 54 and name C ) (segid B and resid 55 and name N ) 1.0 -39.91 30 2 ! PHI for ALA 55 assign (segid B and resid 54 and name C ) (segid B and resid 55 and name N ) (segid B and resid 55 and name CA ) (segid B and resid 55 and name C ) 1.0 -62.25 30 2 ! PSI for ALA 55 assign (segid B and resid 55 and name N ) (segid B and resid 55 and name CA ) (segid B and resid 55 and name C ) (segid B and resid 56 and name N ) 1.0 -43.49 30 2 ! PHI for SER 56 assign (segid B and resid 55 and name C ) (segid B and resid 56 and name N ) (segid B and resid 56 and name CA ) (segid B and resid 56 and name C ) 1.0 -63.36 30 2 ! PSI for SER 56 assign (segid B and resid 56 and name N ) (segid B and resid 56 and name CA ) (segid B and resid 56 and name C ) (segid B and resid 57 and name N ) 1.0 -40.89 30 2 ! PHI for ALA 57 assign (segid B and resid 56 and name C ) (segid B and resid 57 and name N ) (segid B and resid 57 and name CA ) (segid B and resid 57 and name C ) 1.0 -65.23 30 2 ! PSI for ALA 57 assign (segid B and resid 57 and name N ) (segid B and resid 57 and name CA ) (segid B and resid 57 and name C ) (segid B and resid 58 and name N ) 1.0 -41.81 30 2 ! PHI for ASN 58 assign (segid B and resid 57 and name C ) (segid B and resid 58 and name N ) (segid B and resid 58 and name CA ) (segid B and resid 58 and name C ) 1.0 -63.88 30 2 ! PSI for ASN 58 assign (segid B and resid 58 and name N ) (segid B and resid 58 and name CA ) (segid B and resid 58 and name C ) (segid B and resid 59 and name N ) 1.0 -42.56 30 2 ! PHI for LEU 59 assign (segid B and resid 58 and name C ) (segid B and resid 59 and name N ) (segid B and resid 59 and name CA ) (segid B and resid 59 and name C ) 1.0 -63.18 30 2 ! PSI for LEU 59 assign (segid B and resid 59 and name N ) (segid B and resid 59 and name CA ) (segid B and resid 59 and name C ) (segid B and resid 60 and name N ) 1.0 -43.85 30 2 ! PHI for GLN 60 assign (segid B and resid 59 and name C ) (segid B and resid 60 and name N ) (segid B and resid 60 and name CA ) (segid B and resid 60 and name C ) 1.0 -63.94 30 2 ! PSI for GLN 60 assign (segid B and resid 60 and name N ) (segid B and resid 60 and name CA ) (segid B and resid 60 and name C ) (segid B and resid 61 and name N ) 1.0 -41.67 30 2 ! PHI for ALA 61 assign (segid B and resid 60 and name C ) (segid B and resid 61 and name N ) (segid B and resid 61 and name CA ) (segid B and resid 61 and name C ) 1.0 -64.6 30 2 ! PSI for ALA 61 assign (segid B and resid 61 and name N ) (segid B and resid 61 and name CA ) (segid B and resid 61 and name C ) (segid B and resid 62 and name N ) 1.0 -42.06 30 2 ! PHI for LEU 62 assign (segid B and resid 61 and name C ) (segid B and resid 62 and name N ) (segid B and resid 62 and name CA ) (segid B and resid 62 and name C ) 1.0 -64.65 30 2 ! PSI for LEU 62 assign (segid B and resid 62 and name N ) (segid B and resid 62 and name CA ) (segid B and resid 62 and name C ) (segid B and resid 63 and name N ) 1.0 -39.74 30 2 ! PHI for LYS 63 assign (segid B and resid 62 and name C ) (segid B and resid 63 and name N ) (segid B and resid 63 and name CA ) (segid B and resid 63 and name C ) 1.0 -68.49 30 2 ! PSI for LYS 63 assign (segid B and resid 63 and name N ) (segid B and resid 63 and name CA ) (segid B and resid 63 and name C ) (segid B and resid 64 and name N ) 1.0 -38.25 30 2 ! PHI for SER 64 assign (segid B and resid 63 and name C ) (segid B and resid 64 and name N ) (segid B and resid 64 and name CA ) (segid B and resid 64 and name C ) 1.0 -65.75 30 2 ! PSI for SER 64 assign (segid B and resid 64 and name N ) (segid B and resid 64 and name CA ) (segid B and resid 64 and name C ) (segid B and resid 65 and name N ) 1.0 -33.24 30 2 ! PHI for VAL 68 assign (segid B and resid 67 and name C ) (segid B and resid 68 and name N ) (segid B and resid 68 and name CA ) (segid B and resid 68 and name C ) 1.0 -130.6 30 2 ! PSI for VAL 68 assign (segid B and resid 68 and name N ) (segid B and resid 68 and name CA ) (segid B and resid 68 and name C ) (segid B and resid 69 and name N ) 1.0 168.4 30 2 ! PHI for GLU 69 assign (segid B and resid 68 and name C ) (segid B and resid 69 and name N ) (segid B and resid 69 and name CA ) (segid B and resid 69 and name C ) 1.0 -132.29 30 2 ! PSI for GLU 69 assign (segid B and resid 69 and name N ) (segid B and resid 69 and name CA ) (segid B and resid 69 and name C ) (segid B and resid 70 and name N ) 1.0 147.15 30 2 ! PHI for ALA 70 assign (segid B and resid 69 and name C ) (segid B and resid 70 and name N ) (segid B and resid 70 and name CA ) (segid B and resid 70 and name C ) 1.0 -123.78 30 2 ! PSI for ALA 70 assign (segid B and resid 70 and name N ) (segid B and resid 70 and name CA ) (segid B and resid 70 and name C ) (segid B and resid 71 and name N ) 1.0 139.66 30 2 ! PHI for ARG 71 assign (segid B and resid 70 and name C ) (segid B and resid 71 and name N ) (segid B and resid 71 and name CA ) (segid B and resid 71 and name C ) 1.0 -128.35 30 2 ! PSI for ARG 71 assign (segid B and resid 71 and name N ) (segid B and resid 71 and name CA ) (segid B and resid 71 and name C ) (segid B and resid 72 and name N ) 1.0 136.2 40 2 ! PHI for ARG 72 assign (segid B and resid 71 and name C ) (segid B and resid 72 and name N ) (segid B and resid 72 and name CA ) (segid B and resid 72 and name C ) 1.0 -109.16 30 2 ! PSI for ARG 72 assign (segid B and resid 72 and name N ) (segid B and resid 72 and name CA ) (segid B and resid 72 and name C ) (segid B and resid 73 and name N ) 1.0 127.12 30 2 ! PHI for GLU 73 assign (segid B and resid 72 and name C ) (segid B and resid 73 and name N ) (segid B and resid 73 and name CA ) (segid B and resid 73 and name C ) 1.0 -131.18 30 2 ! PSI for GLU 73 assign (segid B and resid 73 and name N ) (segid B and resid 73 and name CA ) (segid B and resid 73 and name C ) (segid B and resid 74 and name N ) 1.0 117.57 30 2 ! PHI for GLY 74 assign (segid B and resid 73 and name C ) (segid B and resid 74 and name N ) (segid B and resid 74 and name CA ) (segid B and resid 74 and name C ) 1.0 70.96 30 2 ! PSI for GLY 74 assign (segid B and resid 74 and name N ) (segid B and resid 74 and name CA ) (segid B and resid 74 and name C ) (segid B and resid 75 and name N ) 1.0 -124.5 30 2 ! PHI for THR 75 assign (segid B and resid 74 and name C ) (segid B and resid 75 and name N ) (segid B and resid 75 and name CA ) (segid B and resid 75 and name C ) 1.0 -101.11 30 2 ! PSI for THR 75 assign (segid B and resid 75 and name N ) (segid B and resid 75 and name CA ) (segid B and resid 75 and name C ) (segid B and resid 76 and name N ) 1.0 -3.41 30 2 ! PHI for ARG 76 assign (segid B and resid 75 and name C ) (segid B and resid 76 and name N ) (segid B and resid 76 and name CA ) (segid B and resid 76 and name C ) 1.0 -124.92 30 2 ! PSI for ARG 76 assign (segid B and resid 76 and name N ) (segid B and resid 76 and name CA ) (segid B and resid 76 and name C ) (segid B and resid 77 and name N ) 1.0 141.36 40 2 ! PHI for GLN 77 assign (segid B and resid 76 and name C ) (segid B and resid 77 and name N ) (segid B and resid 77 and name CA ) (segid B and resid 77 and name C ) 1.0 -114.69 30 2 ! PSI for GLN 77 assign (segid B and resid 77 and name N ) (segid B and resid 77 and name CA ) (segid B and resid 77 and name C ) (segid B and resid 78 and name N ) 1.0 134.69 30 2 ! PHI for TYR 78 assign (segid B and resid 77 and name C ) (segid B and resid 78 and name N ) (segid B and resid 78 and name CA ) (segid B and resid 78 and name C ) 1.0 -119.79 30 2 ! PSI for TYR 78 assign (segid B and resid 78 and name N ) (segid B and resid 78 and name CA ) (segid B and resid 78 and name C ) (segid B and resid 79 and name N ) 1.0 135.47 30 2 ! PHI for TYR 79 assign (segid B and resid 78 and name C ) (segid B and resid 79 and name N ) (segid B and resid 79 and name CA ) (segid B and resid 79 and name C ) 1.0 -131.36 30 2 ! PSI for TYR 79 assign (segid B and resid 79 and name N ) (segid B and resid 79 and name CA ) (segid B and resid 79 and name C ) (segid B and resid 80 and name N ) 1.0 158.05 30 2 ! PHI for ARG 80 assign (segid B and resid 79 and name C ) (segid B and resid 80 and name N ) (segid B and resid 80 and name CA ) (segid B and resid 80 and name C ) 1.0 -134.27 30 2 ! PSI for ARG 80 assign (segid B and resid 80 and name N ) (segid B and resid 80 and name CA ) (segid B and resid 80 and name C ) (segid B and resid 81 and name N ) 1.0 148.09 30 2 ! PHI for GLU 84 assign (segid B and resid 83 and name C ) (segid B and resid 84 and name N ) (segid B and resid 84 and name CA ) (segid B and resid 84 and name C ) 1.0 -59.7 30 2 ! PSI for GLU 84 assign (segid B and resid 84 and name N ) (segid B and resid 84 and name CA ) (segid B and resid 84 and name C ) (segid B and resid 85 and name N ) 1.0 -39.84 30 2 ! PHI for ASP 85 assign (segid B and resid 84 and name C ) (segid B and resid 85 and name N ) (segid B and resid 85 and name CA ) (segid B and resid 85 and name C ) 1.0 -67.87 30 2 ! PSI for ASP 85 assign (segid B and resid 85 and name N ) (segid B and resid 85 and name CA ) (segid B and resid 85 and name C ) (segid B and resid 86 and name N ) 1.0 -37.04 30 2 ! PHI for VAL 86 assign (segid B and resid 85 and name C ) (segid B and resid 86 and name N ) (segid B and resid 86 and name CA ) (segid B and resid 86 and name C ) 1.0 -65.44 30 2 ! PSI for VAL 86 assign (segid B and resid 86 and name N ) (segid B and resid 86 and name CA ) (segid B and resid 86 and name C ) (segid B and resid 87 and name N ) 1.0 -42.35 30 2 ! PHI for ALA 87 assign (segid B and resid 86 and name C ) (segid B and resid 87 and name N ) (segid B and resid 87 and name CA ) (segid B and resid 87 and name C ) 1.0 -61.05 30 2 ! PSI for ALA 87 assign (segid B and resid 87 and name N ) (segid B and resid 87 and name CA ) (segid B and resid 87 and name C ) (segid B and resid 88 and name N ) 1.0 -41.43 30 2 ! PHI for ARG 88 assign (segid B and resid 87 and name C ) (segid B and resid 88 and name N ) (segid B and resid 88 and name CA ) (segid B and resid 88 and name C ) 1.0 -68.12 30 2 ! PSI for ARG 88 assign (segid B and resid 88 and name N ) (segid B and resid 88 and name CA ) (segid B and resid 88 and name C ) (segid B and resid 89 and name N ) 1.0 -34.9 30 2 ! PHI for LEU 89 assign (segid B and resid 88 and name C ) (segid B and resid 89 and name N ) (segid B and resid 89 and name CA ) (segid B and resid 89 and name C ) 1.0 -62.07 30 2 ! PSI for LEU 89 assign (segid B and resid 89 and name N ) (segid B and resid 89 and name CA ) (segid B and resid 89 and name C ) (segid B and resid 90 and name N ) 1.0 -42.64 30 2 ! PHI for PHE 90 assign (segid B and resid 89 and name C ) (segid B and resid 90 and name N ) (segid B and resid 90 and name CA ) (segid B and resid 90 and name C ) 1.0 -65.07 30 2 ! PSI for PHE 90 assign (segid B and resid 90 and name N ) (segid B and resid 90 and name CA ) (segid B and resid 90 and name C ) (segid B and resid 91 and name N ) 1.0 -39.67 30 2 ! PHI for ALA 91 assign (segid B and resid 90 and name C ) (segid B and resid 91 and name N ) (segid B and resid 91 and name CA ) (segid B and resid 91 and name C ) 1.0 -64.33 30 2 ! PSI for ALA 91 assign (segid B and resid 91 and name N ) (segid B and resid 91 and name CA ) (segid B and resid 91 and name C ) (segid B and resid 92 and name N ) 1.0 -46.76 30 2 ! PHI for LEU 92 assign (segid B and resid 91 and name C ) (segid B and resid 92 and name N ) (segid B and resid 92 and name CA ) (segid B and resid 92 and name C ) 1.0 -63.01 30 2 ! PSI for LEU 92 assign (segid B and resid 92 and name N ) (segid B and resid 92 and name CA ) (segid B and resid 92 and name C ) (segid B and resid 93 and name N ) 1.0 -42.02 30 2 ! PHI for VAL 93 assign (segid B and resid 92 and name C ) (segid B and resid 93 and name N ) (segid B and resid 93 and name CA ) (segid B and resid 93 and name C ) 1.0 -64.23 30 2 ! PSI for VAL 93 assign (segid B and resid 93 and name N ) (segid B and resid 93 and name CA ) (segid B and resid 93 and name C ) (segid B and resid 94 and name N ) 1.0 -46.87 30 2 ! PHI for GLN 94 assign (segid B and resid 93 and name C ) (segid B and resid 94 and name N ) (segid B and resid 94 and name CA ) (segid B and resid 94 and name C ) 1.0 -62.42 30 2 ! PSI for GLN 94 assign (segid B and resid 94 and name N ) (segid B and resid 94 and name CA ) (segid B and resid 94 and name C ) (segid B and resid 95 and name N ) 1.0 -44.11 30 2 ! PHI for VAL 95 assign (segid B and resid 94 and name C ) (segid B and resid 95 and name N ) (segid B and resid 95 and name CA ) (segid B and resid 95 and name C ) 1.0 -63.42 30 2 ! PSI for VAL 95 assign (segid B and resid 95 and name N ) (segid B and resid 95 and name CA ) (segid B and resid 95 and name C ) (segid B and resid 96 and name N ) 1.0 -46.36 30 2 ! PHI for VAL 96 assign (segid B and resid 95 and name C ) (segid B and resid 96 and name N ) (segid B and resid 96 and name CA ) (segid B and resid 96 and name C ) 1.0 -63.65 30 2 ! PSI for VAL 96 assign (segid B and resid 96 and name N ) (segid B and resid 96 and name CA ) (segid B and resid 96 and name C ) (segid B and resid 97 and name N ) 1.0 -43.82 30 2 ! PHI for ALA 97 assign (segid B and resid 96 and name C ) (segid B and resid 97 and name N ) (segid B and resid 97 and name CA ) (segid B and resid 97 and name C ) 1.0 -63.69 30 2 ! PSI for ALA 97 assign (segid B and resid 97 and name N ) (segid B and resid 97 and name CA ) (segid B and resid 97 and name C ) (segid B and resid 98 and name N ) 1.0 -42.98 30 2 ! PHI for ASP 98 assign (segid B and resid 97 and name C ) (segid B and resid 98 and name N ) (segid B and resid 98 and name CA ) (segid B and resid 98 and name C ) 1.0 -61.79 30 2 ! PSI for ASP 98 assign (segid B and resid 98 and name N ) (segid B and resid 98 and name CA ) (segid B and resid 98 and name C ) (segid B and resid 99 and name N ) 1.0 -40.36 30 2 ! PHI for GLU 99 assign (segid B and resid 98 and name C ) (segid B and resid 99 and name N ) (segid B and resid 99 and name CA ) (segid B and resid 99 and name C ) 1.0 -73.56 30 2 ! PSI for GLU 99 assign (segid B and resid 99 and name N ) (segid B and resid 99 and name CA ) (segid B and resid 99 and name C ) (segid B and resid 100 and name N ) 1.0 -31.96 30 2 ! PHI for HIS 100 assign (segid B and resid 99 and name C ) (segid B and resid 100 and name N ) (segid B and resid 100 and name CA ) (segid B and resid 100 and name C ) 1.0 -80.35 30 2 ! PSI for HIS 100 assign (segid B and resid 100 and name N ) (segid B and resid 100 and name CA ) (segid B and resid 100 and name C ) (segid B and resid 101 and name N ) 1.0 -33.98 30 2 ! ALA 2 assign (segid A and resid 1 and name C ) (segid A and resid 2 and name N ) (segid A and resid 2 and name CA ) (segid A and resid 2 and name C ) (segid A and resid 3 and name N ) 52.5 19.2 ! GLY 3 assign (segid A and resid 2 and name C ) (segid A and resid 3 and name N ) (segid A and resid 3 and name CA ) (segid A and resid 3 and name C ) (segid A and resid 4 and name N ) 45.2 $noexpectation ! GLN 4 assign (segid A and resid 3 and name C ) (segid A and resid 4 and name N ) (segid A and resid 4 and name CA ) (segid A and resid 4 and name C ) (segid A and resid 5 and name N ) 56.6 29.37 ! SER 5 assign (segid A and resid 4 and name C ) (segid A and resid 5 and name N ) (segid A and resid 5 and name CA ) (segid A and resid 5 and name C ) (segid A and resid 6 and name N ) 59.1 63.55 ! ASP 6 assign (segid A and resid 5 and name C ) (segid A and resid 6 and name N ) (segid A and resid 6 and name CA ) (segid A and resid 6 and name C ) (segid A and resid 7 and name N ) 55.1 40.88 ! ARG 7 assign (segid A and resid 6 and name C ) (segid A and resid 7 and name N ) (segid A and resid 7 and name CA ) (segid A and resid 7 and name C ) (segid A and resid 8 and name N ) 58 30.1 ! LYS 8 assign (segid A and resid 7 and name C ) (segid A and resid 8 and name N ) (segid A and resid 8 and name CA ) (segid A and resid 8 and name C ) (segid A and resid 9 and name N ) 58.45 31.7 ! ALA 9 assign (segid A and resid 8 and name C ) (segid A and resid 9 and name N ) (segid A and resid 9 and name CA ) (segid A and resid 9 and name C ) (segid A and resid 10 and name N ) 55.15 18.1 ! ALA 10 assign (segid A and resid 9 and name C ) (segid A and resid 10 and name N ) (segid A and resid 10 and name CA ) (segid A and resid 10 and name C ) (segid A and resid 11 and name N ) 54.66 18.1 ! LEU 11 assign (segid A and resid 10 and name C ) (segid A and resid 11 and name N ) (segid A and resid 11 and name CA ) (segid A and resid 11 and name C ) (segid A and resid 12 and name N ) 57.8 41.7 ! LEU 12 assign (segid A and resid 11 and name C ) (segid A and resid 12 and name N ) (segid A and resid 12 and name CA ) (segid A and resid 12 and name C ) (segid A and resid 13 and name N ) 58.23 40.19 ! ASP 13 assign (segid A and resid 12 and name C ) (segid A and resid 13 and name N ) (segid A and resid 13 and name CA ) (segid A and resid 13 and name C ) (segid A and resid 14 and name N ) 57.5 40.61 ! GLN 14 assign (segid A and resid 13 and name C ) (segid A and resid 14 and name N ) (segid A and resid 14 and name CA ) (segid A and resid 14 and name C ) (segid A and resid 15 and name N ) 58.16 27.85 ! VAL 15 assign (segid A and resid 14 and name C ) (segid A and resid 15 and name N ) (segid A and resid 15 and name CA ) (segid A and resid 15 and name C ) (segid A and resid 16 and name N ) 66.72 30.5 ! ALA 16 assign (segid A and resid 15 and name C ) (segid A and resid 16 and name N ) (segid A and resid 16 and name CA ) (segid A and resid 16 and name C ) (segid A and resid 17 and name N ) 54.68 17.63 ! ARG 17 assign (segid A and resid 16 and name C ) (segid A and resid 17 and name N ) (segid A and resid 17 and name CA ) (segid A and resid 17 and name C ) (segid A and resid 18 and name N ) 59.7 30.3 ! VAL 18 assign (segid A and resid 17 and name C ) (segid A and resid 18 and name N ) (segid A and resid 18 and name CA ) (segid A and resid 18 and name C ) (segid A and resid 19 and name N ) 66.7 31.3 ! GLY 19 assign (segid A and resid 18 and name C ) (segid A and resid 19 and name N ) (segid A and resid 19 and name CA ) (segid A and resid 19 and name C ) (segid A and resid 20 and name N ) 48.5 $noexpectation ! LYS 20 assign (segid A and resid 19 and name C ) (segid A and resid 20 and name N ) (segid A and resid 20 and name CA ) (segid A and resid 20 and name C ) (segid A and resid 21 and name N ) 59.38 32.67 ! ALA 21 assign (segid A and resid 20 and name C ) (segid A and resid 21 and name N ) (segid A and resid 21 and name CA ) (segid A and resid 21 and name C ) (segid A and resid 22 and name N ) 55.26 19.26 ! LEU 22 assign (segid A and resid 21 and name C ) (segid A and resid 22 and name N ) (segid A and resid 22 and name CA ) (segid A and resid 22 and name C ) (segid A and resid 23 and name N ) 54.6 42.9 ! ALA 23 assign (segid A and resid 22 and name C ) (segid A and resid 23 and name N ) (segid A and resid 23 and name CA ) (segid A and resid 23 and name C ) (segid A and resid 24 and name N ) 53 18.2 ! ASN 24 assign (segid A and resid 23 and name C ) (segid A and resid 24 and name N ) (segid A and resid 24 and name CA ) (segid A and resid 24 and name C ) (segid A and resid 25 and name N ) 53.5 41.75 ! GLY 25 assign (segid A and resid 24 and name C ) (segid A and resid 25 and name N ) (segid A and resid 25 and name CA ) (segid A and resid 25 and name C ) (segid A and resid 26 and name N ) 47.69 $noexpectation ! ARG 26 assign (segid A and resid 25 and name C ) (segid A and resid 26 and name N ) (segid A and resid 26 and name CA ) (segid A and resid 26 and name C ) (segid A and resid 27 and name N ) 57.11 29.9 ! ARG 27 assign (segid A and resid 26 and name C ) (segid A and resid 27 and name N ) (segid A and resid 27 and name CA ) (segid A and resid 27 and name C ) (segid A and resid 28 and name N ) 61 30.33 ! LEU 28 assign (segid A and resid 27 and name C ) (segid A and resid 28 and name N ) (segid A and resid 28 and name CA ) (segid A and resid 28 and name C ) (segid A and resid 29 and name N ) 57.6 41.81 ! GLN 29 assign (segid A and resid 28 and name C ) (segid A and resid 29 and name N ) (segid A and resid 29 and name CA ) (segid A and resid 29 and name C ) (segid A and resid 30 and name N ) 59.16 28.88 ! ILE 30 assign (segid A and resid 29 and name C ) (segid A and resid 30 and name N ) (segid A and resid 30 and name CA ) (segid A and resid 30 and name C ) (segid A and resid 31 and name N ) 65.9 37.4 ! LEU 31 assign (segid A and resid 30 and name C ) (segid A and resid 31 and name N ) (segid A and resid 31 and name CA ) (segid A and resid 31 and name C ) (segid A and resid 32 and name N ) 58.17 41.19 ! ASP 32 assign (segid A and resid 31 and name C ) (segid A and resid 32 and name N ) (segid A and resid 32 and name CA ) (segid A and resid 32 and name C ) (segid A and resid 33 and name N ) 57.4 42.4 ! LEU 33 assign (segid A and resid 32 and name C ) (segid A and resid 33 and name N ) (segid A and resid 33 and name CA ) (segid A and resid 33 and name C ) (segid A and resid 34 and name N ) 57.67 42.38 ! LEU 34 assign (segid A and resid 33 and name C ) (segid A and resid 34 and name N ) (segid A and resid 34 and name CA ) (segid A and resid 34 and name C ) (segid A and resid 35 and name N ) 55.8 41.42 ! ALA 35 assign (segid A and resid 34 and name C ) (segid A and resid 35 and name N ) (segid A and resid 35 and name CA ) (segid A and resid 35 and name C ) (segid A and resid 36 and name N ) 54.9 17.5 ! GLN 36 assign (segid A and resid 35 and name C ) (segid A and resid 36 and name N ) (segid A and resid 36 and name CA ) (segid A and resid 36 and name C ) (segid A and resid 37 and name N ) 55.86 29.07 ! GLY 37 assign (segid A and resid 36 and name C ) (segid A and resid 37 and name N ) (segid A and resid 37 and name CA ) (segid A and resid 37 and name C ) (segid A and resid 38 and name N ) 44.5 $noexpectation ! GLU 38 assign (segid A and resid 37 and name C ) (segid A and resid 38 and name N ) (segid A and resid 38 and name CA ) (segid A and resid 38 and name C ) (segid A and resid 39 and name N ) 56.4 31.2 ! ARG 39 assign (segid A and resid 38 and name C ) (segid A and resid 39 and name N ) (segid A and resid 39 and name CA ) (segid A and resid 39 and name C ) (segid A and resid 40 and name N ) 53.9 36.4 ! ALA 40 assign (segid A and resid 39 and name C ) (segid A and resid 40 and name N ) (segid A and resid 40 and name CA ) (segid A and resid 40 and name C ) (segid A and resid 41 and name N ) 51.16 19.2 ! VAL 41 assign (segid A and resid 40 and name C ) (segid A and resid 41 and name N ) (segid A and resid 41 and name CA ) (segid A and resid 41 and name C ) (segid A and resid 42 and name N ) 67.6 31.6 ! GLU 42 assign (segid A and resid 41 and name C ) (segid A and resid 42 and name N ) (segid A and resid 42 and name CA ) (segid A and resid 42 and name C ) (segid A and resid 43 and name N ) 60.72 28.3 ! ALA 43 assign (segid A and resid 42 and name C ) (segid A and resid 43 and name N ) (segid A and resid 43 and name CA ) (segid A and resid 43 and name C ) (segid A and resid 44 and name N ) 54.19 19.1 ! ILE 44 assign (segid A and resid 43 and name C ) (segid A and resid 44 and name N ) (segid A and resid 44 and name CA ) (segid A and resid 44 and name C ) (segid A and resid 45 and name N ) 64.82 38.1 ! ALA 45 assign (segid A and resid 44 and name C ) (segid A and resid 45 and name N ) (segid A and resid 45 and name CA ) (segid A and resid 45 and name C ) (segid A and resid 46 and name N ) 56.25 17.45 ! THR 46 assign (segid A and resid 45 and name C ) (segid A and resid 46 and name N ) (segid A and resid 46 and name CA ) (segid A and resid 46 and name C ) (segid A and resid 47 and name N ) 66.4 68.85 ! ALA 47 assign (segid A and resid 46 and name C ) (segid A and resid 47 and name N ) (segid A and resid 47 and name CA ) (segid A and resid 47 and name C ) (segid A and resid 48 and name N ) 54.85 19.8 ! THR 48 assign (segid A and resid 47 and name C ) (segid A and resid 48 and name N ) (segid A and resid 48 and name CA ) (segid A and resid 48 and name C ) (segid A and resid 49 and name N ) 61.89 71.07 ! GLY 49 assign (segid A and resid 48 and name C ) (segid A and resid 49 and name N ) (segid A and resid 49 and name CA ) (segid A and resid 49 and name C ) (segid A and resid 50 and name N ) 46.37 $noexpectation ! MET 50 assign (segid A and resid 49 and name C ) (segid A and resid 50 and name N ) (segid A and resid 50 and name CA ) (segid A and resid 50 and name C ) (segid A and resid 51 and name N ) 55.1 37.27 ! ASN 51 assign (segid A and resid 50 and name C ) (segid A and resid 51 and name N ) (segid A and resid 51 and name CA ) (segid A and resid 51 and name C ) (segid A and resid 52 and name N ) 52.8 41.15 ! LEU 52 assign (segid A and resid 51 and name C ) (segid A and resid 52 and name N ) (segid A and resid 52 and name CA ) (segid A and resid 52 and name C ) (segid A and resid 53 and name N ) 59 41.88 ! THR 53 assign (segid A and resid 52 and name C ) (segid A and resid 53 and name N ) (segid A and resid 53 and name CA ) (segid A and resid 53 and name C ) (segid A and resid 54 and name N ) 66.56 68.4 ! THR 54 assign (segid A and resid 53 and name C ) (segid A and resid 54 and name N ) (segid A and resid 54 and name CA ) (segid A and resid 54 and name C ) (segid A and resid 55 and name N ) 66.6 66.6 ! ALA 55 assign (segid A and resid 54 and name C ) (segid A and resid 55 and name N ) (segid A and resid 55 and name CA ) (segid A and resid 55 and name C ) (segid A and resid 56 and name N ) 56.1 17 ! SER 56 assign (segid A and resid 55 and name C ) (segid A and resid 56 and name N ) (segid A and resid 56 and name CA ) (segid A and resid 56 and name C ) (segid A and resid 57 and name N ) 62.6 62.7 ! ALA 57 assign (segid A and resid 56 and name C ) (segid A and resid 57 and name N ) (segid A and resid 57 and name CA ) (segid A and resid 57 and name C ) (segid A and resid 58 and name N ) 55.29 17.99 ! ASN 58 assign (segid A and resid 57 and name C ) (segid A and resid 58 and name N ) (segid A and resid 58 and name CA ) (segid A and resid 58 and name C ) (segid A and resid 59 and name N ) 57 39.89 ! LEU 59 assign (segid A and resid 58 and name C ) (segid A and resid 59 and name N ) (segid A and resid 59 and name CA ) (segid A and resid 59 and name C ) (segid A and resid 60 and name N ) 58.5 40.55 ! GLN 60 assign (segid A and resid 59 and name C ) (segid A and resid 60 and name N ) (segid A and resid 60 and name CA ) (segid A and resid 60 and name C ) (segid A and resid 61 and name N ) 58.8 27.7 ! ALA 61 assign (segid A and resid 60 and name C ) (segid A and resid 61 and name N ) (segid A and resid 61 and name CA ) (segid A and resid 61 and name C ) (segid A and resid 62 and name N ) 55.04 17.6 ! LEU 62 assign (segid A and resid 61 and name C ) (segid A and resid 62 and name N ) (segid A and resid 62 and name CA ) (segid A and resid 62 and name C ) (segid A and resid 63 and name N ) 58.1 43.4 ! LYS 63 assign (segid A and resid 62 and name C ) (segid A and resid 63 and name N ) (segid A and resid 63 and name CA ) (segid A and resid 63 and name C ) (segid A and resid 64 and name N ) 59.7 32.65 ! SER 64 assign (segid A and resid 63 and name C ) (segid A and resid 64 and name N ) (segid A and resid 64 and name CA ) (segid A and resid 64 and name C ) (segid A and resid 65 and name N ) 61.48 63 ! GLY 65 assign (segid A and resid 64 and name C ) (segid A and resid 65 and name N ) (segid A and resid 65 and name CA ) (segid A and resid 65 and name C ) (segid A and resid 66 and name N ) 45.1 $noexpectation ! GLY 66 assign (segid A and resid 65 and name C ) (segid A and resid 66 and name N ) (segid A and resid 66 and name CA ) (segid A and resid 66 and name C ) (segid A and resid 67 and name N ) 45.4 $noexpectation ! LEU 67 assign (segid A and resid 66 and name C ) (segid A and resid 67 and name N ) (segid A and resid 67 and name CA ) (segid A and resid 67 and name C ) (segid A and resid 68 and name N ) 55.5 42.46 ! VAL 68 assign (segid A and resid 67 and name C ) (segid A and resid 68 and name N ) (segid A and resid 68 and name CA ) (segid A and resid 68 and name C ) (segid A and resid 69 and name N ) 57.48 36.29 ! GLU 69 assign (segid A and resid 68 and name C ) (segid A and resid 69 and name N ) (segid A and resid 69 and name CA ) (segid A and resid 69 and name C ) (segid A and resid 70 and name N ) 54.3 34.17 ! ALA 70 assign (segid A and resid 69 and name C ) (segid A and resid 70 and name N ) (segid A and resid 70 and name CA ) (segid A and resid 70 and name C ) (segid A and resid 71 and name N ) 50 22.39 ! ARG 71 assign (segid A and resid 70 and name C ) (segid A and resid 71 and name N ) (segid A and resid 71 and name CA ) (segid A and resid 71 and name C ) (segid A and resid 72 and name N ) 54.6 33.6 ! ARG 72 assign (segid A and resid 71 and name C ) (segid A and resid 72 and name N ) (segid A and resid 72 and name CA ) (segid A and resid 72 and name C ) (segid A and resid 73 and name N ) 54.96 32.5 ! GLU 73 assign (segid A and resid 72 and name C ) (segid A and resid 73 and name N ) (segid A and resid 73 and name CA ) (segid A and resid 73 and name C ) (segid A and resid 74 and name N ) 55.7 31.8 ! GLY 74 assign (segid A and resid 73 and name C ) (segid A and resid 74 and name N ) (segid A and resid 74 and name CA ) (segid A and resid 74 and name C ) (segid A and resid 75 and name N ) 47.1 $noexpectation ! THR 75 assign (segid A and resid 74 and name C ) (segid A and resid 75 and name N ) (segid A and resid 75 and name CA ) (segid A and resid 75 and name C ) (segid A and resid 76 and name N ) 62.05 69 ! ARG 76 assign (segid A and resid 75 and name C ) (segid A and resid 76 and name N ) (segid A and resid 76 and name CA ) (segid A and resid 76 and name C ) (segid A and resid 77 and name N ) 55.5 32.77 ! GLN 77 assign (segid A and resid 76 and name C ) (segid A and resid 77 and name N ) (segid A and resid 77 and name CA ) (segid A and resid 77 and name C ) (segid A and resid 78 and name N ) 54.7 31.88 ! TYR 78 assign (segid A and resid 77 and name C ) (segid A and resid 78 and name N ) (segid A and resid 78 and name CA ) (segid A and resid 78 and name C ) (segid A and resid 79 and name N ) 57 41.47 ! TYR 79 assign (segid A and resid 78 and name C ) (segid A and resid 79 and name N ) (segid A and resid 79 and name CA ) (segid A and resid 79 and name C ) (segid A and resid 80 and name N ) 57.3 43.3 ! ARG 80 assign (segid A and resid 79 and name C ) (segid A and resid 80 and name N ) (segid A and resid 80 and name CA ) (segid A and resid 80 and name C ) (segid A and resid 81 and name N ) 53.2 34.01 ! ILE 81 assign (segid A and resid 80 and name C ) (segid A and resid 81 and name N ) (segid A and resid 81 and name CA ) (segid A and resid 81 and name C ) (segid A and resid 82 and name N ) 62.3 37.8 ! ALA 82 assign (segid A and resid 81 and name C ) (segid A and resid 82 and name N ) (segid A and resid 82 and name CA ) (segid A and resid 82 and name C ) (segid A and resid 83 and name N ) 54.2 18.5 ! GLY 83 assign (segid A and resid 82 and name C ) (segid A and resid 83 and name N ) (segid A and resid 83 and name CA ) (segid A and resid 83 and name C ) (segid A and resid 84 and name N ) 45.2 $noexpectation ! GLU 84 assign (segid A and resid 83 and name C ) (segid A and resid 84 and name N ) (segid A and resid 84 and name CA ) (segid A and resid 84 and name C ) (segid A and resid 85 and name N ) 58.97 29.47 ! ASP 85 assign (segid A and resid 84 and name C ) (segid A and resid 85 and name N ) (segid A and resid 85 and name CA ) (segid A and resid 85 and name C ) (segid A and resid 86 and name N ) 57.1 38.95 ! VAL 86 assign (segid A and resid 85 and name C ) (segid A and resid 86 and name N ) (segid A and resid 86 and name CA ) (segid A and resid 86 and name C ) (segid A and resid 87 and name N ) 66.87 31.3 ! ALA 87 assign (segid A and resid 86 and name C ) (segid A and resid 87 and name N ) (segid A and resid 87 and name CA ) (segid A and resid 87 and name C ) (segid A and resid 88 and name N ) 55.88 17.6 ! ARG 88 assign (segid A and resid 87 and name C ) (segid A and resid 88 and name N ) (segid A and resid 88 and name CA ) (segid A and resid 88 and name C ) (segid A and resid 89 and name N ) 59.66 30.5 ! LEU 89 assign (segid A and resid 88 and name C ) (segid A and resid 89 and name N ) (segid A and resid 89 and name CA ) (segid A and resid 89 and name C ) (segid A and resid 90 and name N ) 58.35 41.3 ! PHE 90 assign (segid A and resid 89 and name C ) (segid A and resid 90 and name N ) (segid A and resid 90 and name CA ) (segid A and resid 90 and name C ) (segid A and resid 91 and name N ) 59.47 38.6 ! ALA 91 assign (segid A and resid 90 and name C ) (segid A and resid 91 and name N ) (segid A and resid 91 and name CA ) (segid A and resid 91 and name C ) (segid A and resid 92 and name N ) 55.1 18 ! LEU 92 assign (segid A and resid 91 and name C ) (segid A and resid 92 and name N ) (segid A and resid 92 and name CA ) (segid A and resid 92 and name C ) (segid A and resid 93 and name N ) 57.43 41.99 ! VAL 93 assign (segid A and resid 92 and name C ) (segid A and resid 93 and name N ) (segid A and resid 93 and name CA ) (segid A and resid 93 and name C ) (segid A and resid 94 and name N ) 66.13 31.25 ! GLN 94 assign (segid A and resid 93 and name C ) (segid A and resid 94 and name N ) (segid A and resid 94 and name CA ) (segid A and resid 94 and name C ) (segid A and resid 95 and name N ) 60 30.21 ! VAL 95 assign (segid A and resid 94 and name C ) (segid A and resid 95 and name N ) (segid A and resid 95 and name CA ) (segid A and resid 95 and name C ) (segid A and resid 96 and name N ) 66.6 32.03 ! VAL 96 assign (segid A and resid 95 and name C ) (segid A and resid 96 and name N ) (segid A and resid 96 and name CA ) (segid A and resid 96 and name C ) (segid A and resid 97 and name N ) 66.1 32.2 ! ALA 97 assign (segid A and resid 96 and name C ) (segid A and resid 97 and name N ) (segid A and resid 97 and name CA ) (segid A and resid 97 and name C ) (segid A and resid 98 and name N ) 54.9 19.98 ! ASP 98 assign (segid A and resid 97 and name C ) (segid A and resid 98 and name N ) (segid A and resid 98 and name CA ) (segid A and resid 98 and name C ) (segid A and resid 99 and name N ) 57.28 41.87 ! GLU 99 assign (segid A and resid 98 and name C ) (segid A and resid 99 and name N ) (segid A and resid 99 and name CA ) (segid A and resid 99 and name C ) (segid A and resid 100 and name N ) 58.3 29.8 ! HIS 100 assign (segid A and resid 99 and name C ) (segid A and resid 100 and name N ) (segid A and resid 100 and name CA ) (segid A and resid 100 and name C ) (segid A and resid 101 and name N ) 57.5 30.8 ! LEU 101 assign (segid A and resid 100 and name C ) (segid A and resid 101 and name N ) (segid A and resid 101 and name CA ) (segid A and resid 101 and name C ) (segid A and resid 102 and name N ) 55.9 42.17 ! GLU 102 assign (segid A and resid 101 and name C ) (segid A and resid 102 and name N ) (segid A and resid 102 and name CA ) (segid A and resid 102 and name C ) (segid A and resid 103 and name N ) 57.1 29.9 ! HIS 103 assign (segid A and resid 102 and name C ) (segid A and resid 103 and name N ) (segid A and resid 103 and name CA ) (segid A and resid 103 and name C ) (segid A and resid 104 and name N ) 56.1 29.7 ! HIS 107 assign (segid A and resid 106 and name C ) (segid A and resid 107 and name N ) (segid A and resid 107 and name CA ) (segid A and resid 107 and name C ) (segid A and resid 108 and name N ) 55.9 30.2 ! ALA 2 assign (segid B and resid 1 and name C ) (segid B and resid 2 and name N ) (segid B and resid 2 and name CA ) (segid B and resid 2 and name C ) (segid B and resid 3 and name N ) 52.5 19.2 ! GLY 3 assign (segid B and resid 2 and name C ) (segid B and resid 3 and name N ) (segid B and resid 3 and name CA ) (segid B and resid 3 and name C ) (segid B and resid 4 and name N ) 45.2 $noexpectation ! GLN 4 assign (segid B and resid 3 and name C ) (segid B and resid 4 and name N ) (segid B and resid 4 and name CA ) (segid B and resid 4 and name C ) (segid B and resid 5 and name N ) 56.6 29.37 ! SER 5 assign (segid B and resid 4 and name C ) (segid B and resid 5 and name N ) (segid B and resid 5 and name CA ) (segid B and resid 5 and name C ) (segid B and resid 6 and name N ) 59.1 63.55 ! ASP 6 assign (segid B and resid 5 and name C ) (segid B and resid 6 and name N ) (segid B and resid 6 and name CA ) (segid B and resid 6 and name C ) (segid B and resid 7 and name N ) 55.1 40.88 ! ARG 7 assign (segid B and resid 6 and name C ) (segid B and resid 7 and name N ) (segid B and resid 7 and name CA ) (segid B and resid 7 and name C ) (segid B and resid 8 and name N ) 58 30.1 ! LYS 8 assign (segid B and resid 7 and name C ) (segid B and resid 8 and name N ) (segid B and resid 8 and name CA ) (segid B and resid 8 and name C ) (segid B and resid 9 and name N ) 58.45 31.7 ! ALA 9 assign (segid B and resid 8 and name C ) (segid B and resid 9 and name N ) (segid B and resid 9 and name CA ) (segid B and resid 9 and name C ) (segid B and resid 10 and name N ) 55.15 18.1 ! ALA 10 assign (segid B and resid 9 and name C ) (segid B and resid 10 and name N ) (segid B and resid 10 and name CA ) (segid B and resid 10 and name C ) (segid B and resid 11 and name N ) 54.66 18.1 ! LEU 11 assign (segid B and resid 10 and name C ) (segid B and resid 11 and name N ) (segid B and resid 11 and name CA ) (segid B and resid 11 and name C ) (segid B and resid 12 and name N ) 57.8 41.7 ! LEU 12 assign (segid B and resid 11 and name C ) (segid B and resid 12 and name N ) (segid B and resid 12 and name CA ) (segid B and resid 12 and name C ) (segid B and resid 13 and name N ) 58.23 40.19 ! ASP 13 assign (segid B and resid 12 and name C ) (segid B and resid 13 and name N ) (segid B and resid 13 and name CA ) (segid B and resid 13 and name C ) (segid B and resid 14 and name N ) 57.5 40.61 ! GLN 14 assign (segid B and resid 13 and name C ) (segid B and resid 14 and name N ) (segid B and resid 14 and name CA ) (segid B and resid 14 and name C ) (segid B and resid 15 and name N ) 58.16 27.85 ! VAL 15 assign (segid B and resid 14 and name C ) (segid B and resid 15 and name N ) (segid B and resid 15 and name CA ) (segid B and resid 15 and name C ) (segid B and resid 16 and name N ) 66.72 30.5 ! ALA 16 assign (segid B and resid 15 and name C ) (segid B and resid 16 and name N ) (segid B and resid 16 and name CA ) (segid B and resid 16 and name C ) (segid B and resid 17 and name N ) 54.68 17.63 ! ARG 17 assign (segid B and resid 16 and name C ) (segid B and resid 17 and name N ) (segid B and resid 17 and name CA ) (segid B and resid 17 and name C ) (segid B and resid 18 and name N ) 59.7 30.3 ! VAL 18 assign (segid B and resid 17 and name C ) (segid B and resid 18 and name N ) (segid B and resid 18 and name CA ) (segid B and resid 18 and name C ) (segid B and resid 19 and name N ) 66.7 31.3 ! GLY 19 assign (segid B and resid 18 and name C ) (segid B and resid 19 and name N ) (segid B and resid 19 and name CA ) (segid B and resid 19 and name C ) (segid B and resid 20 and name N ) 48.5 $noexpectation ! LYS 20 assign (segid B and resid 19 and name C ) (segid B and resid 20 and name N ) (segid B and resid 20 and name CA ) (segid B and resid 20 and name C ) (segid B and resid 21 and name N ) 59.38 32.67 ! ALA 21 assign (segid B and resid 20 and name C ) (segid B and resid 21 and name N ) (segid B and resid 21 and name CA ) (segid B and resid 21 and name C ) (segid B and resid 22 and name N ) 55.26 19.26 ! LEU 22 assign (segid B and resid 21 and name C ) (segid B and resid 22 and name N ) (segid B and resid 22 and name CA ) (segid B and resid 22 and name C ) (segid B and resid 23 and name N ) 54.6 42.9 ! ALA 23 assign (segid B and resid 22 and name C ) (segid B and resid 23 and name N ) (segid B and resid 23 and name CA ) (segid B and resid 23 and name C ) (segid B and resid 24 and name N ) 53 18.2 ! ASN 24 assign (segid B and resid 23 and name C ) (segid B and resid 24 and name N ) (segid B and resid 24 and name CA ) (segid B and resid 24 and name C ) (segid B and resid 25 and name N ) 53.5 41.75 ! GLY 25 assign (segid B and resid 24 and name C ) (segid B and resid 25 and name N ) (segid B and resid 25 and name CA ) (segid B and resid 25 and name C ) (segid B and resid 26 and name N ) 47.69 $noexpectation ! ARG 26 assign (segid B and resid 25 and name C ) (segid B and resid 26 and name N ) (segid B and resid 26 and name CA ) (segid B and resid 26 and name C ) (segid B and resid 27 and name N ) 57.11 29.9 ! ARG 27 assign (segid B and resid 26 and name C ) (segid B and resid 27 and name N ) (segid B and resid 27 and name CA ) (segid B and resid 27 and name C ) (segid B and resid 28 and name N ) 61 30.33 ! LEU 28 assign (segid B and resid 27 and name C ) (segid B and resid 28 and name N ) (segid B and resid 28 and name CA ) (segid B and resid 28 and name C ) (segid B and resid 29 and name N ) 57.6 41.81 ! GLN 29 assign (segid B and resid 28 and name C ) (segid B and resid 29 and name N ) (segid B and resid 29 and name CA ) (segid B and resid 29 and name C ) (segid B and resid 30 and name N ) 59.16 28.88 ! ILE 30 assign (segid B and resid 29 and name C ) (segid B and resid 30 and name N ) (segid B and resid 30 and name CA ) (segid B and resid 30 and name C ) (segid B and resid 31 and name N ) 65.9 37.4 ! LEU 31 assign (segid B and resid 30 and name C ) (segid B and resid 31 and name N ) (segid B and resid 31 and name CA ) (segid B and resid 31 and name C ) (segid B and resid 32 and name N ) 58.17 41.19 ! ASP 32 assign (segid B and resid 31 and name C ) (segid B and resid 32 and name N ) (segid B and resid 32 and name CA ) (segid B and resid 32 and name C ) (segid B and resid 33 and name N ) 57.4 42.4 ! LEU 33 assign (segid B and resid 32 and name C ) (segid B and resid 33 and name N ) (segid B and resid 33 and name CA ) (segid B and resid 33 and name C ) (segid B and resid 34 and name N ) 57.67 42.38 ! LEU 34 assign (segid B and resid 33 and name C ) (segid B and resid 34 and name N ) (segid B and resid 34 and name CA ) (segid B and resid 34 and name C ) (segid B and resid 35 and name N ) 55.8 41.42 ! ALA 35 assign (segid B and resid 34 and name C ) (segid B and resid 35 and name N ) (segid B and resid 35 and name CA ) (segid B and resid 35 and name C ) (segid B and resid 36 and name N ) 54.9 17.5 ! GLN 36 assign (segid B and resid 35 and name C ) (segid B and resid 36 and name N ) (segid B and resid 36 and name CA ) (segid B and resid 36 and name C ) (segid B and resid 37 and name N ) 55.86 29.07 ! GLY 37 assign (segid B and resid 36 and name C ) (segid B and resid 37 and name N ) (segid B and resid 37 and name CA ) (segid B and resid 37 and name C ) (segid B and resid 38 and name N ) 44.5 $noexpectation ! GLU 38 assign (segid B and resid 37 and name C ) (segid B and resid 38 and name N ) (segid B and resid 38 and name CA ) (segid B and resid 38 and name C ) (segid B and resid 39 and name N ) 56.4 31.2 ! ARG 39 assign (segid B and resid 38 and name C ) (segid B and resid 39 and name N ) (segid B and resid 39 and name CA ) (segid B and resid 39 and name C ) (segid B and resid 40 and name N ) 53.9 36.4 ! ALA 40 assign (segid B and resid 39 and name C ) (segid B and resid 40 and name N ) (segid B and resid 40 and name CA ) (segid B and resid 40 and name C ) (segid B and resid 41 and name N ) 51.16 19.2 ! VAL 41 assign (segid B and resid 40 and name C ) (segid B and resid 41 and name N ) (segid B and resid 41 and name CA ) (segid B and resid 41 and name C ) (segid B and resid 42 and name N ) 67.6 31.6 ! GLU 42 assign (segid B and resid 41 and name C ) (segid B and resid 42 and name N ) (segid B and resid 42 and name CA ) (segid B and resid 42 and name C ) (segid B and resid 43 and name N ) 60.72 28.3 ! ALA 43 assign (segid B and resid 42 and name C ) (segid B and resid 43 and name N ) (segid B and resid 43 and name CA ) (segid B and resid 43 and name C ) (segid B and resid 44 and name N ) 54.19 19.1 ! ILE 44 assign (segid B and resid 43 and name C ) (segid B and resid 44 and name N ) (segid B and resid 44 and name CA ) (segid B and resid 44 and name C ) (segid B and resid 45 and name N ) 64.82 38.1 ! ALA 45 assign (segid B and resid 44 and name C ) (segid B and resid 45 and name N ) (segid B and resid 45 and name CA ) (segid B and resid 45 and name C ) (segid B and resid 46 and name N ) 56.25 17.45 ! THR 46 assign (segid B and resid 45 and name C ) (segid B and resid 46 and name N ) (segid B and resid 46 and name CA ) (segid B and resid 46 and name C ) (segid B and resid 47 and name N ) 66.4 68.85 ! ALA 47 assign (segid B and resid 46 and name C ) (segid B and resid 47 and name N ) (segid B and resid 47 and name CA ) (segid B and resid 47 and name C ) (segid B and resid 48 and name N ) 54.85 19.8 ! THR 48 assign (segid B and resid 47 and name C ) (segid B and resid 48 and name N ) (segid B and resid 48 and name CA ) (segid B and resid 48 and name C ) (segid B and resid 49 and name N ) 61.89 71.07 ! GLY 49 assign (segid B and resid 48 and name C ) (segid B and resid 49 and name N ) (segid B and resid 49 and name CA ) (segid B and resid 49 and name C ) (segid B and resid 50 and name N ) 46.37 $noexpectation ! MET 50 assign (segid B and resid 49 and name C ) (segid B and resid 50 and name N ) (segid B and resid 50 and name CA ) (segid B and resid 50 and name C ) (segid B and resid 51 and name N ) 55.1 37.27 ! ASN 51 assign (segid B and resid 50 and name C ) (segid B and resid 51 and name N ) (segid B and resid 51 and name CA ) (segid B and resid 51 and name C ) (segid B and resid 52 and name N ) 52.8 41.15 ! LEU 52 assign (segid B and resid 51 and name C ) (segid B and resid 52 and name N ) (segid B and resid 52 and name CA ) (segid B and resid 52 and name C ) (segid B and resid 53 and name N ) 59 41.88 ! THR 53 assign (segid B and resid 52 and name C ) (segid B and resid 53 and name N ) (segid B and resid 53 and name CA ) (segid B and resid 53 and name C ) (segid B and resid 54 and name N ) 66.56 68.4 ! THR 54 assign (segid B and resid 53 and name C ) (segid B and resid 54 and name N ) (segid B and resid 54 and name CA ) (segid B and resid 54 and name C ) (segid B and resid 55 and name N ) 66.6 66.6 ! ALA 55 assign (segid B and resid 54 and name C ) (segid B and resid 55 and name N ) (segid B and resid 55 and name CA ) (segid B and resid 55 and name C ) (segid B and resid 56 and name N ) 56.1 17 ! SER 56 assign (segid B and resid 55 and name C ) (segid B and resid 56 and name N ) (segid B and resid 56 and name CA ) (segid B and resid 56 and name C ) (segid B and resid 57 and name N ) 62.6 62.7 ! ALA 57 assign (segid B and resid 56 and name C ) (segid B and resid 57 and name N ) (segid B and resid 57 and name CA ) (segid B and resid 57 and name C ) (segid B and resid 58 and name N ) 55.29 17.99 ! ASN 58 assign (segid B and resid 57 and name C ) (segid B and resid 58 and name N ) (segid B and resid 58 and name CA ) (segid B and resid 58 and name C ) (segid B and resid 59 and name N ) 57 39.89 ! LEU 59 assign (segid B and resid 58 and name C ) (segid B and resid 59 and name N ) (segid B and resid 59 and name CA ) (segid B and resid 59 and name C ) (segid B and resid 60 and name N ) 58.5 40.55 ! GLN 60 assign (segid B and resid 59 and name C ) (segid B and resid 60 and name N ) (segid B and resid 60 and name CA ) (segid B and resid 60 and name C ) (segid B and resid 61 and name N ) 58.8 27.7 ! ALA 61 assign (segid B and resid 60 and name C ) (segid B and resid 61 and name N ) (segid B and resid 61 and name CA ) (segid B and resid 61 and name C ) (segid B and resid 62 and name N ) 55.04 17.6 ! LEU 62 assign (segid B and resid 61 and name C ) (segid B and resid 62 and name N ) (segid B and resid 62 and name CA ) (segid B and resid 62 and name C ) (segid B and resid 63 and name N ) 58.1 43.4 ! LYS 63 assign (segid B and resid 62 and name C ) (segid B and resid 63 and name N ) (segid B and resid 63 and name CA ) (segid B and resid 63 and name C ) (segid B and resid 64 and name N ) 59.7 32.65 ! SER 64 assign (segid B and resid 63 and name C ) (segid B and resid 64 and name N ) (segid B and resid 64 and name CA ) (segid B and resid 64 and name C ) (segid B and resid 65 and name N ) 61.48 63 ! GLY 65 assign (segid B and resid 64 and name C ) (segid B and resid 65 and name N ) (segid B and resid 65 and name CA ) (segid B and resid 65 and name C ) (segid B and resid 66 and name N ) 45.1 $noexpectation ! GLY 66 assign (segid B and resid 65 and name C ) (segid B and resid 66 and name N ) (segid B and resid 66 and name CA ) (segid B and resid 66 and name C ) (segid B and resid 67 and name N ) 45.4 $noexpectation ! LEU 67 assign (segid B and resid 66 and name C ) (segid B and resid 67 and name N ) (segid B and resid 67 and name CA ) (segid B and resid 67 and name C ) (segid B and resid 68 and name N ) 55.5 42.46 ! VAL 68 assign (segid B and resid 67 and name C ) (segid B and resid 68 and name N ) (segid B and resid 68 and name CA ) (segid B and resid 68 and name C ) (segid B and resid 69 and name N ) 57.48 36.29 ! GLU 69 assign (segid B and resid 68 and name C ) (segid B and resid 69 and name N ) (segid B and resid 69 and name CA ) (segid B and resid 69 and name C ) (segid B and resid 70 and name N ) 54.3 34.17 ! ALA 70 assign (segid B and resid 69 and name C ) (segid B and resid 70 and name N ) (segid B and resid 70 and name CA ) (segid B and resid 70 and name C ) (segid B and resid 71 and name N ) 50 22.39 ! ARG 71 assign (segid B and resid 70 and name C ) (segid B and resid 71 and name N ) (segid B and resid 71 and name CA ) (segid B and resid 71 and name C ) (segid B and resid 72 and name N ) 54.6 33.6 ! ARG 72 assign (segid B and resid 71 and name C ) (segid B and resid 72 and name N ) (segid B and resid 72 and name CA ) (segid B and resid 72 and name C ) (segid B and resid 73 and name N ) 54.96 32.5 ! GLU 73 assign (segid B and resid 72 and name C ) (segid B and resid 73 and name N ) (segid B and resid 73 and name CA ) (segid B and resid 73 and name C ) (segid B and resid 74 and name N ) 55.7 31.8 ! GLY 74 assign (segid B and resid 73 and name C ) (segid B and resid 74 and name N ) (segid B and resid 74 and name CA ) (segid B and resid 74 and name C ) (segid B and resid 75 and name N ) 47.1 $noexpectation ! THR 75 assign (segid B and resid 74 and name C ) (segid B and resid 75 and name N ) (segid B and resid 75 and name CA ) (segid B and resid 75 and name C ) (segid B and resid 76 and name N ) 62.05 69 ! ARG 76 assign (segid B and resid 75 and name C ) (segid B and resid 76 and name N ) (segid B and resid 76 and name CA ) (segid B and resid 76 and name C ) (segid B and resid 77 and name N ) 55.5 32.77 ! GLN 77 assign (segid B and resid 76 and name C ) (segid B and resid 77 and name N ) (segid B and resid 77 and name CA ) (segid B and resid 77 and name C ) (segid B and resid 78 and name N ) 54.7 31.88 ! TYR 78 assign (segid B and resid 77 and name C ) (segid B and resid 78 and name N ) (segid B and resid 78 and name CA ) (segid B and resid 78 and name C ) (segid B and resid 79 and name N ) 57 41.47 ! TYR 79 assign (segid B and resid 78 and name C ) (segid B and resid 79 and name N ) (segid B and resid 79 and name CA ) (segid B and resid 79 and name C ) (segid B and resid 80 and name N ) 57.3 43.3 ! ARG 80 assign (segid B and resid 79 and name C ) (segid B and resid 80 and name N ) (segid B and resid 80 and name CA ) (segid B and resid 80 and name C ) (segid B and resid 81 and name N ) 53.2 34.01 ! ILE 81 assign (segid B and resid 80 and name C ) (segid B and resid 81 and name N ) (segid B and resid 81 and name CA ) (segid B and resid 81 and name C ) (segid B and resid 82 and name N ) 62.3 37.8 ! ALA 82 assign (segid B and resid 81 and name C ) (segid B and resid 82 and name N ) (segid B and resid 82 and name CA ) (segid B and resid 82 and name C ) (segid B and resid 83 and name N ) 54.2 18.5 ! GLY 83 assign (segid B and resid 82 and name C ) (segid B and resid 83 and name N ) (segid B and resid 83 and name CA ) (segid B and resid 83 and name C ) (segid B and resid 84 and name N ) 45.2 $noexpectation ! GLU 84 assign (segid B and resid 83 and name C ) (segid B and resid 84 and name N ) (segid B and resid 84 and name CA ) (segid B and resid 84 and name C ) (segid B and resid 85 and name N ) 58.97 29.47 ! ASP 85 assign (segid B and resid 84 and name C ) (segid B and resid 85 and name N ) (segid B and resid 85 and name CA ) (segid B and resid 85 and name C ) (segid B and resid 86 and name N ) 57.1 38.95 ! VAL 86 assign (segid B and resid 85 and name C ) (segid B and resid 86 and name N ) (segid B and resid 86 and name CA ) (segid B and resid 86 and name C ) (segid B and resid 87 and name N ) 66.87 31.3 ! ALA 87 assign (segid B and resid 86 and name C ) (segid B and resid 87 and name N ) (segid B and resid 87 and name CA ) (segid B and resid 87 and name C ) (segid B and resid 88 and name N ) 55.88 17.6 ! ARG 88 assign (segid B and resid 87 and name C ) (segid B and resid 88 and name N ) (segid B and resid 88 and name CA ) (segid B and resid 88 and name C ) (segid B and resid 89 and name N ) 59.66 30.5 ! LEU 89 assign (segid B and resid 88 and name C ) (segid B and resid 89 and name N ) (segid B and resid 89 and name CA ) (segid B and resid 89 and name C ) (segid B and resid 90 and name N ) 58.35 41.3 ! PHE 90 assign (segid B and resid 89 and name C ) (segid B and resid 90 and name N ) (segid B and resid 90 and name CA ) (segid B and resid 90 and name C ) (segid B and resid 91 and name N ) 59.47 38.6 ! ALA 91 assign (segid B and resid 90 and name C ) (segid B and resid 91 and name N ) (segid B and resid 91 and name CA ) (segid B and resid 91 and name C ) (segid B and resid 92 and name N ) 55.1 18 ! LEU 92 assign (segid B and resid 91 and name C ) (segid B and resid 92 and name N ) (segid B and resid 92 and name CA ) (segid B and resid 92 and name C ) (segid B and resid 93 and name N ) 57.43 41.99 ! VAL 93 assign (segid B and resid 92 and name C ) (segid B and resid 93 and name N ) (segid B and resid 93 and name CA ) (segid B and resid 93 and name C ) (segid B and resid 94 and name N ) 66.13 31.25 ! GLN 94 assign (segid B and resid 93 and name C ) (segid B and resid 94 and name N ) (segid B and resid 94 and name CA ) (segid B and resid 94 and name C ) (segid B and resid 95 and name N ) 60 30.21 ! VAL 95 assign (segid B and resid 94 and name C ) (segid B and resid 95 and name N ) (segid B and resid 95 and name CA ) (segid B and resid 95 and name C ) (segid B and resid 96 and name N ) 66.6 32.03 ! VAL 96 assign (segid B and resid 95 and name C ) (segid B and resid 96 and name N ) (segid B and resid 96 and name CA ) (segid B and resid 96 and name C ) (segid B and resid 97 and name N ) 66.1 32.2 ! ALA 97 assign (segid B and resid 96 and name C ) (segid B and resid 97 and name N ) (segid B and resid 97 and name CA ) (segid B and resid 97 and name C ) (segid B and resid 98 and name N ) 54.9 19.98 ! ASP 98 assign (segid B and resid 97 and name C ) (segid B and resid 98 and name N ) (segid B and resid 98 and name CA ) (segid B and resid 98 and name C ) (segid B and resid 99 and name N ) 57.28 41.87 ! GLU 99 assign (segid B and resid 98 and name C ) (segid B and resid 99 and name N ) (segid B and resid 99 and name CA ) (segid B and resid 99 and name C ) (segid B and resid 100 and name N ) 58.3 29.8 ! HIS 100 assign (segid B and resid 99 and name C ) (segid B and resid 100 and name N ) (segid B and resid 100 and name CA ) (segid B and resid 100 and name C ) (segid B and resid 101 and name N ) 57.5 30.8 ! LEU 101 assign (segid B and resid 100 and name C ) (segid B and resid 101 and name N ) (segid B and resid 101 and name CA ) (segid B and resid 101 and name C ) (segid B and resid 102 and name N ) 55.9 42.17 ! GLU 102 assign (segid B and resid 101 and name C ) (segid B and resid 102 and name N ) (segid B and resid 102 and name CA ) (segid B and resid 102 and name C ) (segid B and resid 103 and name N ) 57.1 29.9 ! HIS 103 assign (segid B and resid 102 and name C ) (segid B and resid 103 and name N ) (segid B and resid 103 and name CA ) (segid B and resid 103 and name C ) (segid B and resid 104 and name N ) 56.1 29.7 ! HIS 107 assign (segid B and resid 106 and name C ) (segid B and resid 107 and name N ) (segid B and resid 107 and name CA ) (segid B and resid 107 and name C ) (segid B and resid 108 and name N ) 55.9 30.2 Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 0.123 2.397 -29.349 2 H2 MET 1 HT2 MET 1 1.462 1.426 -29.723 3 H3 MET 1 HT3 MET 1 0.470 2.018 -30.965 4 HA MET 1 HA MET 1 2.185 3.631 -29.167 5 HB2 MET 1 HB2 MET 1 3.393 2.309 -30.893 6 HB3 MET 1 HB1 MET 1 2.424 3.092 -32.134 7 HG2 MET 1 HG2 MET 1 3.347 5.276 -31.392 8 HG3 MET 1 HG1 MET 1 4.405 4.404 -30.286 9 HE1 MET 1 HE1 MET 1 4.600 4.065 -34.883 10 HE2 MET 1 HE2 MET 1 3.533 5.180 -34.029 11 HE3 MET 1 HE3 MET 1 3.260 3.440 -33.919 12 H ALA 2 HN ALA 2 -0.473 3.505 -31.389 13 HA ALA 2 HA ALA 2 -0.516 6.135 -32.324 14 HB1 ALA 2 HB1 ALA 2 -2.867 4.338 -31.736 15 HB2 ALA 2 HB2 ALA 2 -1.924 4.348 -33.226 16 HB3 ALA 2 HB3 ALA 2 -2.878 5.763 -32.777 17 H GLY 3 HN GLY 3 -0.527 7.932 -31.185 18 HA2 GLY 3 HA2 GLY 3 -1.124 9.509 -29.615 19 HA3 GLY 3 HA1 GLY 3 -2.470 8.470 -29.159 20 H GLN 4 HN GLN 4 -2.408 7.701 -27.176 21 HA GLN 4 HA GLN 4 -0.169 6.445 -26.031 22 HB2 GLN 4 HB2 GLN 4 0.195 8.009 -24.111 23 HB3 GLN 4 HB1 GLN 4 0.766 8.618 -25.657 24 HG2 GLN 4 HG2 GLN 4 -1.319 9.952 -25.835 25 HG3 GLN 4 HG1 GLN 4 -1.746 9.419 -24.208 26 HE21 GLN 4 HE21 GLN 4 -1.184 12.100 -25.275 27 HE22 GLN 4 HE22 GLN 4 0.096 12.735 -24.305 28 H SER 5 HN SER 5 -0.758 5.202 -24.309 29 HA SER 5 HA SER 5 -3.622 5.182 -23.722 30 HB2 SER 5 HB2 SER 5 -1.531 3.139 -22.943 31 HB3 SER 5 HB1 SER 5 -3.282 2.928 -22.930 32 HG SER 5 HG SER 5 -2.510 3.701 -25.382 33 H ASP 6 HN ASP 6 -4.167 6.481 -22.074 34 HA ASP 6 HA ASP 6 -2.333 6.719 -19.800 35 HB2 ASP 6 HB2 ASP 6 -4.771 8.316 -20.584 36 HB3 ASP 6 HB1 ASP 6 -3.923 8.537 -19.058 37 H ARG 7 HN ARG 7 -4.486 4.559 -20.597 38 HA ARG 7 HA ARG 7 -6.363 4.487 -18.499 39 HB2 ARG 7 HB2 ARG 7 -5.229 2.133 -20.016 40 HB3 ARG 7 HB1 ARG 7 -6.725 2.153 -19.096 41 HG2 ARG 7 HG2 ARG 7 -7.506 3.967 -20.690 42 HG3 ARG 7 HG1 ARG 7 -6.115 3.537 -21.687 43 HD2 ARG 7 HD2 ARG 7 -7.912 2.287 -22.550 44 HD3 ARG 7 HD1 ARG 7 -6.968 1.150 -21.588 45 HE ARG 7 HE ARG 7 -9.245 2.454 -20.305 46 HH11 ARG 7 HH11 ARG 7 -7.896 -0.445 -21.743 47 HH12 ARG 7 HH12 ARG 7 -9.127 -1.487 -21.094 48 HH21 ARG 7 HH21 ARG 7 -10.850 1.108 -19.455 49 HH22 ARG 7 HH22 ARG 7 -10.810 -0.606 -19.782 50 H LYS 8 HN LYS 8 -3.018 3.847 -18.542 51 HA LYS 8 HA LYS 8 -2.807 1.998 -16.430 52 HB2 LYS 8 HB2 LYS 8 -0.990 2.725 -18.062 53 HB3 LYS 8 HB1 LYS 8 -0.797 4.159 -17.065 54 HG2 LYS 8 HG2 LYS 8 -0.156 2.816 -15.168 55 HG3 LYS 8 HG1 LYS 8 -0.485 1.334 -16.070 56 HD2 LYS 8 HD2 LYS 8 1.257 2.094 -17.730 57 HD3 LYS 8 HD1 LYS 8 1.681 3.365 -16.582 58 HE2 LYS 8 HE2 LYS 8 2.248 1.720 -14.909 59 HE3 LYS 8 HE1 LYS 8 1.700 0.415 -15.961 60 HZ1 LYS 8 HZ1 LYS 8 3.461 1.260 -17.570 61 HZ2 LYS 8 HZ2 LYS 8 4.003 0.444 -16.188 62 HZ3 LYS 8 HZ3 LYS 8 4.098 2.133 -16.253 63 H ALA 9 HN ALA 9 -3.573 5.357 -16.514 64 HA ALA 9 HA ALA 9 -2.908 6.045 -13.850 65 HB1 ALA 9 HB1 ALA 9 -4.431 7.924 -14.143 66 HB2 ALA 9 HB2 ALA 9 -5.081 7.184 -15.605 67 HB3 ALA 9 HB3 ALA 9 -3.403 7.728 -15.562 68 H ALA 10 HN ALA 10 -5.609 4.388 -15.317 69 HA ALA 10 HA ALA 10 -7.262 4.421 -12.976 70 HB1 ALA 10 HB1 ALA 10 -8.235 4.134 -15.198 71 HB2 ALA 10 HB2 ALA 10 -8.616 2.761 -14.159 72 HB3 ALA 10 HB3 ALA 10 -7.363 2.613 -15.391 73 H LEU 11 HN LEU 11 -4.659 2.489 -14.179 74 HA LEU 11 HA LEU 11 -5.047 0.274 -12.415 75 HB2 LEU 11 HB2 LEU 11 -3.722 0.244 -14.561 76 HB3 LEU 11 HB1 LEU 11 -2.496 1.196 -13.753 77 HG LEU 11 HG LEU 11 -3.319 -1.496 -12.688 78 HD11 LEU 11 HD11 LEU 11 -1.203 -0.925 -14.759 79 HD12 LEU 11 HD12 LEU 11 -2.705 -1.809 -15.027 80 HD13 LEU 11 HD13 LEU 11 -1.471 -2.472 -13.956 81 HD21 LEU 11 HD21 LEU 11 -1.982 -0.059 -11.227 82 HD22 LEU 11 HD22 LEU 11 -0.768 0.103 -12.493 83 HD23 LEU 11 HD23 LEU 11 -1.063 -1.469 -11.751 84 H LEU 12 HN LEU 12 -3.059 3.200 -12.418 85 HA LEU 12 HA LEU 12 -1.892 2.830 -9.874 86 HB2 LEU 12 HB2 LEU 12 -2.489 5.392 -11.359 87 HB3 LEU 12 HB1 LEU 12 -1.454 5.263 -9.951 88 HG LEU 12 HG LEU 12 -0.934 4.018 -12.655 89 HD11 LEU 12 HD11 LEU 12 0.932 5.583 -12.751 90 HD12 LEU 12 HD12 LEU 12 0.451 6.263 -11.197 91 HD13 LEU 12 HD13 LEU 12 -0.604 6.437 -12.600 92 HD21 LEU 12 HD21 LEU 12 -0.112 2.593 -10.845 93 HD22 LEU 12 HD22 LEU 12 0.734 3.968 -10.138 94 HD23 LEU 12 HD23 LEU 12 1.224 3.346 -11.715 95 H ASP 13 HN ASP 13 -4.926 4.231 -10.945 96 HA ASP 13 HA ASP 13 -5.842 5.352 -8.563 97 HB2 ASP 13 HB2 ASP 13 -7.068 5.672 -10.620 98 HB3 ASP 13 HB1 ASP 13 -7.373 3.945 -10.764 99 H GLN 14 HN GLN 14 -6.051 2.017 -9.737 100 HA GLN 14 HA GLN 14 -7.498 1.031 -7.503 101 HB2 GLN 14 HB2 GLN 14 -7.347 -0.074 -9.748 102 HB3 GLN 14 HB1 GLN 14 -5.693 -0.526 -9.365 103 HG2 GLN 14 HG2 GLN 14 -7.198 -2.381 -8.991 104 HG3 GLN 14 HG1 GLN 14 -6.486 -1.843 -7.471 105 HE21 GLN 14 HE21 GLN 14 -9.403 -2.053 -9.364 106 HE22 GLN 14 HE22 GLN 14 -10.488 -1.649 -8.078 107 H VAL 15 HN VAL 15 -4.046 1.220 -8.266 108 HA VAL 15 HA VAL 15 -3.102 -0.198 -6.017 109 HB VAL 15 HB VAL 15 -1.744 2.048 -7.523 110 HG11 VAL 15 HG11 VAL 15 -0.577 -0.039 -5.682 111 HG12 VAL 15 HG12 VAL 15 -0.717 1.686 -5.344 112 HG13 VAL 15 HG13 VAL 15 0.344 1.124 -6.635 113 HG21 VAL 15 HG21 VAL 15 -2.336 0.191 -8.977 114 HG22 VAL 15 HG22 VAL 15 -1.556 -0.942 -7.873 115 HG23 VAL 15 HG23 VAL 15 -0.591 0.257 -8.732 116 H ALA 16 HN ALA 16 -3.697 3.268 -6.536 117 HA ALA 16 HA ALA 16 -2.983 4.081 -3.924 118 HB1 ALA 16 HB1 ALA 16 -4.900 5.412 -5.840 119 HB2 ALA 16 HB2 ALA 16 -3.151 5.641 -5.815 120 HB3 ALA 16 HB3 ALA 16 -4.129 6.160 -4.443 121 H ARG 17 HN ARG 17 -5.903 2.792 -5.320 122 HA ARG 17 HA ARG 17 -7.731 3.530 -3.305 123 HB2 ARG 17 HB2 ARG 17 -8.172 2.609 -5.661 124 HB3 ARG 17 HB1 ARG 17 -7.912 1.020 -4.962 125 HG2 ARG 17 HG2 ARG 17 -9.787 1.355 -3.452 126 HG3 ARG 17 HG1 ARG 17 -10.030 2.983 -4.093 127 HD2 ARG 17 HD2 ARG 17 -10.320 1.918 -6.358 128 HD3 ARG 17 HD1 ARG 17 -10.340 0.359 -5.541 129 HE ARG 17 HE ARG 17 -12.271 1.762 -4.260 130 HH11 ARG 17 HH11 ARG 17 -11.593 1.105 -7.628 131 HH12 ARG 17 HH12 ARG 17 -13.268 1.087 -8.099 132 HH21 ARG 17 HH21 ARG 17 -14.470 1.777 -4.865 133 HH22 ARG 17 HH22 ARG 17 -14.913 1.466 -6.522 134 H VAL 18 HN VAL 18 -5.944 0.481 -3.833 135 HA VAL 18 HA VAL 18 -6.810 -0.695 -1.403 136 HB VAL 18 HB VAL 18 -5.067 -2.365 -1.719 137 HG11 VAL 18 HG11 VAL 18 -5.728 -3.211 -3.911 138 HG12 VAL 18 HG12 VAL 18 -6.397 -1.631 -4.322 139 HG13 VAL 18 HG13 VAL 18 -7.115 -2.579 -3.020 140 HG21 VAL 18 HG21 VAL 18 -3.228 -0.966 -2.439 141 HG22 VAL 18 HG22 VAL 18 -4.066 -0.598 -3.947 142 HG23 VAL 18 HG23 VAL 18 -3.514 -2.242 -3.623 143 H GLY 19 HN GLY 19 -4.152 1.408 -2.246 144 HA2 GLY 19 HA2 GLY 19 -2.663 1.180 0.140 145 HA3 GLY 19 HA1 GLY 19 -2.647 2.554 -0.958 146 H LYS 20 HN LYS 20 -5.286 3.370 -0.803 147 HA LYS 20 HA LYS 20 -5.311 4.935 1.527 148 HB2 LYS 20 HB2 LYS 20 -7.553 4.229 -0.369 149 HB3 LYS 20 HB1 LYS 20 -7.675 5.453 0.887 150 HG2 LYS 20 HG2 LYS 20 -6.076 6.835 -0.169 151 HG3 LYS 20 HG1 LYS 20 -5.596 5.550 -1.280 152 HD2 LYS 20 HD2 LYS 20 -7.867 5.600 -2.258 153 HD3 LYS 20 HD1 LYS 20 -8.263 6.958 -1.204 154 HE2 LYS 20 HE2 LYS 20 -6.551 8.309 -2.245 155 HE3 LYS 20 HE1 LYS 20 -6.028 6.940 -3.227 156 HZ1 LYS 20 HZ1 LYS 20 -7.450 8.476 -4.460 157 HZ2 LYS 20 HZ2 LYS 20 -8.712 8.209 -3.356 158 HZ3 LYS 20 HZ3 LYS 20 -8.155 6.939 -4.335 159 H ALA 21 HN ALA 21 -6.835 1.862 0.767 160 HA ALA 21 HA ALA 21 -8.426 1.729 3.122 161 HB1 ALA 21 HB1 ALA 21 -7.421 -0.501 1.357 162 HB2 ALA 21 HB2 ALA 21 -8.922 0.398 1.129 163 HB3 ALA 21 HB3 ALA 21 -8.714 -0.629 2.549 164 H LEU 22 HN LEU 22 -5.212 0.549 2.265 165 HA LEU 22 HA LEU 22 -4.820 -0.890 4.704 166 HB2 LEU 22 HB2 LEU 22 -3.734 -1.505 2.593 167 HB3 LEU 22 HB1 LEU 22 -2.851 0.006 2.596 168 HG LEU 22 HG LEU 22 -2.486 -1.838 4.915 169 HD11 LEU 22 HD11 LEU 22 -2.329 -3.322 2.991 170 HD12 LEU 22 HD12 LEU 22 -0.734 -3.042 3.690 171 HD13 LEU 22 HD13 LEU 22 -1.204 -2.209 2.208 172 HD21 LEU 22 HD21 LEU 22 -1.417 0.361 4.898 173 HD22 LEU 22 HD22 LEU 22 -0.632 -0.026 3.366 174 HD23 LEU 22 HD23 LEU 22 -0.218 -0.931 4.823 175 H ALA 23 HN ALA 23 -3.979 2.327 3.549 176 HA ALA 23 HA ALA 23 -2.197 2.948 5.679 177 HB1 ALA 23 HB1 ALA 23 -3.704 4.806 3.840 178 HB2 ALA 23 HB2 ALA 23 -2.101 4.127 3.548 179 HB3 ALA 23 HB3 ALA 23 -2.352 5.252 4.882 180 H ASN 24 HN ASN 24 -3.136 2.532 7.628 181 HA ASN 24 HA ASN 24 -4.698 4.590 8.785 182 HB2 ASN 24 HB2 ASN 24 -6.567 3.502 7.668 183 HB3 ASN 24 HB1 ASN 24 -6.084 1.938 8.316 184 HD21 ASN 24 HD21 ASN 24 -7.531 5.012 9.023 185 HD22 ASN 24 HD22 ASN 24 -8.202 4.569 10.553 186 H GLY 25 HN GLY 25 -3.662 1.216 8.964 187 HA2 GLY 25 HA2 GLY 25 -2.160 0.391 10.586 188 HA3 GLY 25 HA1 GLY 25 -2.531 1.778 11.600 189 H ARG 26 HN ARG 26 -5.098 1.771 12.077 190 HA ARG 26 HA ARG 26 -5.402 -0.416 13.866 191 HB2 ARG 26 HB2 ARG 26 -7.487 1.608 13.034 192 HB3 ARG 26 HB1 ARG 26 -7.519 0.605 14.479 193 HG2 ARG 26 HG2 ARG 26 -5.483 1.739 15.277 194 HG3 ARG 26 HG1 ARG 26 -5.532 2.780 13.856 195 HD2 ARG 26 HD2 ARG 26 -7.559 2.611 16.076 196 HD3 ARG 26 HD1 ARG 26 -6.495 3.965 15.700 197 HE ARG 26 HE ARG 26 -8.975 3.260 14.391 198 HH11 ARG 26 HH11 ARG 26 -5.964 5.050 14.115 199 HH12 ARG 26 HH12 ARG 26 -6.612 6.211 12.998 200 HH21 ARG 26 HH21 ARG 26 -9.840 4.804 12.953 201 HH22 ARG 26 HH22 ARG 26 -8.825 6.087 12.343 202 H ARG 27 HN ARG 27 -6.769 0.365 10.718 203 HA ARG 27 HA ARG 27 -8.617 -1.805 10.697 204 HB2 ARG 27 HB2 ARG 27 -7.468 -0.203 8.403 205 HB3 ARG 27 HB1 ARG 27 -8.792 -1.351 8.259 206 HG2 ARG 27 HG2 ARG 27 -10.041 0.042 9.941 207 HG3 ARG 27 HG1 ARG 27 -8.763 1.247 9.767 208 HD2 ARG 27 HD2 ARG 27 -10.544 0.201 7.569 209 HD3 ARG 27 HD1 ARG 27 -10.677 1.774 8.350 210 HE ARG 27 HE ARG 27 -8.211 1.080 6.914 211 HH11 ARG 27 HH11 ARG 27 -11.083 3.058 7.237 212 HH12 ARG 27 HH12 ARG 27 -10.615 4.166 5.978 213 HH21 ARG 27 HH21 ARG 27 -7.576 2.557 5.285 214 HH22 ARG 27 HH22 ARG 27 -8.613 3.889 4.889 215 H LEU 28 HN LEU 28 -5.258 -1.689 10.412 216 HA LEU 28 HA LEU 28 -4.949 -3.959 8.676 217 HB2 LEU 28 HB2 LEU 28 -2.992 -2.661 10.581 218 HB3 LEU 28 HB1 LEU 28 -2.586 -3.904 9.413 219 HG LEU 28 HG LEU 28 -3.595 -1.137 8.751 220 HD11 LEU 28 HD11 LEU 28 -1.346 -0.751 7.905 221 HD12 LEU 28 HD12 LEU 28 -0.861 -2.367 8.423 222 HD13 LEU 28 HD13 LEU 28 -1.311 -1.154 9.622 223 HD21 LEU 28 HD21 LEU 28 -3.102 -1.738 6.435 224 HD22 LEU 28 HD22 LEU 28 -4.324 -2.809 7.121 225 HD23 LEU 28 HD23 LEU 28 -2.661 -3.368 6.946 226 H GLN 29 HN GLN 29 -5.522 -3.402 12.022 227 HA GLN 29 HA GLN 29 -4.758 -5.871 13.113 228 HB2 GLN 29 HB2 GLN 29 -6.859 -3.846 13.827 229 HB3 GLN 29 HB1 GLN 29 -6.740 -5.354 14.717 230 HG2 GLN 29 HG2 GLN 29 -4.418 -3.479 14.367 231 HG3 GLN 29 HG1 GLN 29 -5.554 -3.357 15.708 232 HE21 GLN 29 HE21 GLN 29 -5.898 -6.227 15.958 233 HE22 GLN 29 HE22 GLN 29 -4.453 -6.839 16.666 234 H ILE 30 HN ILE 30 -7.488 -4.913 11.184 235 HA ILE 30 HA ILE 30 -9.072 -7.241 11.614 236 HB ILE 30 HB ILE 30 -9.090 -5.345 9.258 237 HG12 ILE 30 HG12 ILE 30 -10.817 -5.333 11.745 238 HG13 ILE 30 HG11 ILE 30 -9.467 -4.242 11.463 239 HG21 ILE 30 HG21 ILE 30 -10.198 -7.459 8.768 240 HG22 ILE 30 HG22 ILE 30 -11.376 -6.154 8.898 241 HG23 ILE 30 HG23 ILE 30 -11.176 -7.297 10.228 242 HD11 ILE 30 HD11 ILE 30 -11.951 -4.413 9.774 243 HD12 ILE 30 HD12 ILE 30 -10.614 -3.284 9.556 244 HD13 ILE 30 HD13 ILE 30 -11.620 -3.191 11.002 245 H LEU 31 HN LEU 31 -6.876 -6.214 9.018 246 HA LEU 31 HA LEU 31 -7.080 -8.507 7.422 247 HB2 LEU 31 HB2 LEU 31 -4.794 -6.561 7.749 248 HB3 LEU 31 HB1 LEU 31 -4.873 -7.787 6.497 249 HG LEU 31 HG LEU 31 -6.833 -5.513 6.827 250 HD11 LEU 31 HD11 LEU 31 -5.801 -4.629 4.792 251 HD12 LEU 31 HD12 LEU 31 -4.614 -5.931 4.831 252 HD13 LEU 31 HD13 LEU 31 -4.643 -4.728 6.118 253 HD21 LEU 31 HD21 LEU 31 -7.687 -6.221 4.661 254 HD22 LEU 31 HD22 LEU 31 -7.834 -7.520 5.846 255 HD23 LEU 31 HD23 LEU 31 -6.548 -7.568 4.640 256 H ASP 32 HN ASP 32 -4.830 -7.687 10.027 257 HA ASP 32 HA ASP 32 -3.215 -9.984 9.873 258 HB2 ASP 32 HB2 ASP 32 -2.557 -8.003 11.147 259 HB3 ASP 32 HB1 ASP 32 -3.889 -8.257 12.269 260 H LEU 33 HN LEU 33 -6.243 -9.344 11.553 261 HA LEU 33 HA LEU 33 -6.234 -11.802 13.016 262 HB2 LEU 33 HB2 LEU 33 -7.430 -9.710 13.711 263 HB3 LEU 33 HB1 LEU 33 -8.571 -9.990 12.410 264 HG LEU 33 HG LEU 33 -9.206 -12.144 13.482 265 HD11 LEU 33 HD11 LEU 33 -8.519 -12.562 15.787 266 HD12 LEU 33 HD12 LEU 33 -7.459 -11.155 15.735 267 HD13 LEU 33 HD13 LEU 33 -7.125 -12.548 14.707 268 HD21 LEU 33 HD21 LEU 33 -10.491 -11.136 15.297 269 HD22 LEU 33 HD22 LEU 33 -10.511 -10.114 13.860 270 HD23 LEU 33 HD23 LEU 33 -9.475 -9.697 15.225 271 H LEU 34 HN LEU 34 -7.586 -10.704 9.960 272 HA LEU 34 HA LEU 34 -9.157 -13.063 9.533 273 HB2 LEU 34 HB2 LEU 34 -8.304 -10.858 7.666 274 HB3 LEU 34 HB1 LEU 34 -9.344 -12.188 7.192 275 HG LEU 34 HG LEU 34 -9.966 -10.086 9.268 276 HD11 LEU 34 HD11 LEU 34 -11.701 -9.394 7.719 277 HD12 LEU 34 HD12 LEU 34 -11.215 -10.652 6.583 278 HD13 LEU 34 HD13 LEU 34 -10.119 -9.318 6.943 279 HD21 LEU 34 HD21 LEU 34 -10.857 -12.297 9.887 280 HD22 LEU 34 HD22 LEU 34 -11.669 -12.388 8.323 281 HD23 LEU 34 HD23 LEU 34 -12.130 -11.144 9.486 282 H ALA 35 HN ALA 35 -5.892 -12.095 8.827 283 HA ALA 35 HA ALA 35 -5.293 -14.124 6.946 284 HB1 ALA 35 HB1 ALA 35 -3.871 -12.144 7.302 285 HB2 ALA 35 HB2 ALA 35 -2.962 -13.648 7.440 286 HB3 ALA 35 HB3 ALA 35 -3.429 -12.764 8.893 287 H GLN 36 HN GLN 36 -5.900 -14.177 10.283 288 HA GLN 36 HA GLN 36 -4.590 -16.762 10.677 289 HB2 GLN 36 HB2 GLN 36 -6.164 -15.110 12.663 290 HB3 GLN 36 HB1 GLN 36 -5.131 -16.486 13.023 291 HG2 GLN 36 HG2 GLN 36 -3.179 -15.219 12.321 292 HG3 GLN 36 HG1 GLN 36 -4.206 -13.842 11.923 293 HE21 GLN 36 HE21 GLN 36 -3.254 -12.459 13.365 294 HE22 GLN 36 HE22 GLN 36 -3.418 -12.628 15.079 295 H GLY 37 HN GLY 37 -7.324 -15.775 9.289 296 HA2 GLY 37 HA2 GLY 37 -8.759 -17.859 8.821 297 HA3 GLY 37 HA1 GLY 37 -9.059 -17.789 10.552 298 H GLU 38 HN GLU 38 -10.818 -17.478 8.149 299 HA GLU 38 HA GLU 38 -11.708 -14.767 8.091 300 HB2 GLU 38 HB2 GLU 38 -13.654 -15.735 6.843 301 HB3 GLU 38 HB1 GLU 38 -12.082 -16.125 6.160 302 HG2 GLU 38 HG2 GLU 38 -12.264 -18.303 7.499 303 HG3 GLU 38 HG1 GLU 38 -13.972 -17.899 7.654 304 H ARG 39 HN ARG 39 -13.429 -13.805 9.151 305 HA ARG 39 HA ARG 39 -14.709 -15.363 11.287 306 HB2 ARG 39 HB2 ARG 39 -13.217 -12.783 11.809 307 HB3 ARG 39 HB1 ARG 39 -14.041 -13.782 13.001 308 HG2 ARG 39 HG2 ARG 39 -12.445 -15.544 12.718 309 HG3 ARG 39 HG1 ARG 39 -11.692 -14.705 11.362 310 HD2 ARG 39 HD2 ARG 39 -11.173 -12.832 12.976 311 HD3 ARG 39 HD1 ARG 39 -11.668 -13.928 14.269 312 HE ARG 39 HE ARG 39 -9.377 -14.337 12.453 313 HH11 ARG 39 HH11 ARG 39 -11.034 -14.949 15.473 314 HH12 ARG 39 HH12 ARG 39 -9.772 -15.956 16.109 315 HH21 ARG 39 HH21 ARG 39 -7.707 -15.653 13.291 316 HH22 ARG 39 HH22 ARG 39 -7.883 -16.379 14.860 317 H ALA 40 HN ALA 40 -16.519 -14.280 12.279 318 HA ALA 40 HA ALA 40 -18.026 -12.705 10.396 319 HB1 ALA 40 HB1 ALA 40 -18.704 -13.525 13.225 320 HB2 ALA 40 HB2 ALA 40 -19.110 -14.423 11.760 321 HB3 ALA 40 HB3 ALA 40 -19.822 -12.836 12.047 322 H VAL 41 HN VAL 41 -19.072 -10.668 10.976 323 HA VAL 41 HA VAL 41 -17.254 -8.668 11.601 324 HB VAL 41 HB VAL 41 -20.257 -8.482 11.905 325 HG11 VAL 41 HG11 VAL 41 -19.096 -6.587 12.880 326 HG12 VAL 41 HG12 VAL 41 -19.921 -6.101 11.398 327 HG13 VAL 41 HG13 VAL 41 -18.176 -6.358 11.392 328 HG21 VAL 41 HG21 VAL 41 -19.694 -9.359 9.717 329 HG22 VAL 41 HG22 VAL 41 -18.532 -8.055 9.468 330 HG23 VAL 41 HG23 VAL 41 -20.255 -7.693 9.577 331 H GLU 42 HN GLU 42 -19.761 -10.109 13.653 332 HA GLU 42 HA GLU 42 -19.419 -8.545 15.929 333 HB2 GLU 42 HB2 GLU 42 -21.278 -10.161 15.474 334 HB3 GLU 42 HB1 GLU 42 -20.172 -11.474 15.841 335 HG2 GLU 42 HG2 GLU 42 -20.728 -9.309 17.831 336 HG3 GLU 42 HG1 GLU 42 -21.809 -10.685 17.649 337 H ALA 43 HN ALA 43 -17.728 -11.460 14.901 338 HA ALA 43 HA ALA 43 -16.243 -11.794 17.302 339 HB1 ALA 43 HB1 ALA 43 -15.646 -12.874 14.553 340 HB2 ALA 43 HB2 ALA 43 -16.704 -13.637 15.741 341 HB3 ALA 43 HB3 ALA 43 -14.981 -13.457 16.079 342 H ILE 44 HN ILE 44 -15.450 -10.430 14.119 343 HA ILE 44 HA ILE 44 -12.752 -9.848 14.619 344 HB ILE 44 HB ILE 44 -14.662 -8.358 12.806 345 HG12 ILE 44 HG12 ILE 44 -12.762 -10.624 12.160 346 HG13 ILE 44 HG11 ILE 44 -14.502 -10.806 12.357 347 HG21 ILE 44 HG21 ILE 44 -12.635 -7.082 13.247 348 HG22 ILE 44 HG22 ILE 44 -12.635 -7.682 11.589 349 HG23 ILE 44 HG23 ILE 44 -11.645 -8.475 12.813 350 HD11 ILE 44 HD11 ILE 44 -13.126 -9.142 10.261 351 HD12 ILE 44 HD12 ILE 44 -14.869 -9.318 10.456 352 HD13 ILE 44 HD13 ILE 44 -13.885 -10.714 10.014 353 H ALA 45 HN ALA 45 -15.646 -7.822 14.946 354 HA ALA 45 HA ALA 45 -14.346 -5.448 15.658 355 HB1 ALA 45 HB1 ALA 45 -17.123 -6.352 16.412 356 HB2 ALA 45 HB2 ALA 45 -16.672 -5.523 14.922 357 HB3 ALA 45 HB3 ALA 45 -16.519 -4.696 16.473 358 H THR 46 HN THR 46 -15.897 -7.874 17.759 359 HA THR 46 HA THR 46 -15.280 -6.583 20.175 360 HB THR 46 HB THR 46 -15.686 -9.551 19.792 361 HG1 THR 46 HG1 THR 46 -17.550 -8.858 19.014 362 HG21 THR 46 HG21 THR 46 -16.608 -9.435 22.072 363 HG22 THR 46 HG22 THR 46 -16.202 -7.722 22.142 364 HG23 THR 46 HG23 THR 46 -14.918 -8.924 22.026 365 H ALA 47 HN ALA 47 -13.515 -9.005 18.294 366 HA ALA 47 HA ALA 47 -11.581 -9.618 20.257 367 HB1 ALA 47 HB1 ALA 47 -10.292 -10.600 18.436 368 HB2 ALA 47 HB2 ALA 47 -11.342 -9.811 17.257 369 HB3 ALA 47 HB3 ALA 47 -11.994 -11.054 18.325 370 H THR 48 HN THR 48 -11.745 -7.112 17.796 371 HA THR 48 HA THR 48 -9.023 -6.261 18.367 372 HB THR 48 HB THR 48 -9.556 -4.491 16.611 373 HG1 THR 48 HG1 THR 48 -11.752 -6.195 16.000 374 HG21 THR 48 HG21 THR 48 -8.257 -6.482 16.086 375 HG22 THR 48 HG22 THR 48 -9.336 -6.087 14.748 376 HG23 THR 48 HG23 THR 48 -9.738 -7.408 15.847 377 H GLY 49 HN GLY 49 -12.039 -5.724 19.664 378 HA2 GLY 49 HA2 GLY 49 -12.633 -4.305 21.389 379 HA3 GLY 49 HA1 GLY 49 -11.072 -3.515 21.231 380 H MET 50 HN MET 50 -13.309 -3.914 18.560 381 HA MET 50 HA MET 50 -13.793 -1.004 18.620 382 HB2 MET 50 HB2 MET 50 -13.507 -2.832 16.228 383 HB3 MET 50 HB1 MET 50 -14.050 -1.164 16.132 384 HG2 MET 50 HG2 MET 50 -11.888 -0.469 17.145 385 HG3 MET 50 HG1 MET 50 -11.355 -2.145 17.038 386 HE1 MET 50 HE1 MET 50 -11.395 -2.729 13.148 387 HE2 MET 50 HE2 MET 50 -12.746 -3.003 14.247 388 HE3 MET 50 HE3 MET 50 -11.112 -3.461 14.728 389 H ASN 51 HN ASN 51 -15.830 -0.276 17.841 390 HA ASN 51 HA ASN 51 -18.016 -1.932 18.667 391 HB2 ASN 51 HB2 ASN 51 -18.032 0.503 19.002 392 HB3 ASN 51 HB1 ASN 51 -17.996 0.751 17.260 393 HD21 ASN 51 HD21 ASN 51 -19.912 1.852 17.174 394 HD22 ASN 51 HD22 ASN 51 -21.445 1.102 17.462 395 H LEU 52 HN LEU 52 -19.530 -2.982 17.429 396 HA LEU 52 HA LEU 52 -18.762 -4.071 14.993 397 HB2 LEU 52 HB2 LEU 52 -21.378 -3.908 16.426 398 HB3 LEU 52 HB1 LEU 52 -21.332 -4.550 14.797 399 HG LEU 52 HG LEU 52 -19.687 -6.263 15.585 400 HD11 LEU 52 HD11 LEU 52 -19.525 -6.672 17.997 401 HD12 LEU 52 HD12 LEU 52 -20.389 -5.164 18.298 402 HD13 LEU 52 HD13 LEU 52 -18.802 -5.133 17.530 403 HD21 LEU 52 HD21 LEU 52 -22.056 -6.780 15.360 404 HD22 LEU 52 HD22 LEU 52 -22.344 -6.206 17.002 405 HD23 LEU 52 HD23 LEU 52 -21.349 -7.635 16.730 406 H THR 53 HN THR 53 -20.888 -1.321 15.634 407 HA THR 53 HA THR 53 -21.787 -0.886 13.024 408 HB THR 53 HB THR 53 -21.248 1.295 15.046 409 HG1 THR 53 HG1 THR 53 -23.514 -0.455 14.847 410 HG21 THR 53 HG21 THR 53 -23.272 2.291 14.022 411 HG22 THR 53 HG22 THR 53 -23.304 0.966 12.858 412 HG23 THR 53 HG23 THR 53 -21.951 2.097 12.869 413 H THR 54 HN THR 54 -18.973 0.467 14.731 414 HA THR 54 HA THR 54 -18.052 2.023 12.548 415 HB THR 54 HB THR 54 -16.447 0.975 14.887 416 HG1 THR 54 HG1 THR 54 -18.316 3.075 14.631 417 HG21 THR 54 HG21 THR 54 -15.065 2.967 14.512 418 HG22 THR 54 HG22 THR 54 -16.060 3.394 13.120 419 HG23 THR 54 HG23 THR 54 -15.085 1.924 13.090 420 H ALA 55 HN ALA 55 -17.410 -1.245 13.683 421 HA ALA 55 HA ALA 55 -15.232 -1.851 12.021 422 HB1 ALA 55 HB1 ALA 55 -15.889 -3.235 13.934 423 HB2 ALA 55 HB2 ALA 55 -15.768 -4.189 12.455 424 HB3 ALA 55 HB3 ALA 55 -17.352 -3.721 13.076 425 H SER 56 HN SER 56 -18.728 -2.431 11.535 426 HA SER 56 HA SER 56 -18.542 -3.584 9.005 427 HB2 SER 56 HB2 SER 56 -20.614 -3.460 10.418 428 HB3 SER 56 HB1 SER 56 -20.769 -1.767 9.958 429 HG SER 56 HG SER 56 -20.672 -2.684 7.700 430 H ALA 57 HN ALA 57 -18.598 -0.199 9.978 431 HA ALA 57 HA ALA 57 -18.863 0.967 7.446 432 HB1 ALA 57 HB1 ALA 57 -17.403 2.067 9.844 433 HB2 ALA 57 HB2 ALA 57 -19.136 2.198 9.548 434 HB3 ALA 57 HB3 ALA 57 -17.995 2.993 8.464 435 H ASN 58 HN ASN 58 -15.879 0.188 9.278 436 HA ASN 58 HA ASN 58 -14.288 1.146 7.068 437 HB2 ASN 58 HB2 ASN 58 -12.326 0.585 8.439 438 HB3 ASN 58 HB1 ASN 58 -13.469 1.606 9.290 439 HD21 ASN 58 HD21 ASN 58 -12.684 1.064 11.278 440 HD22 ASN 58 HD22 ASN 58 -12.939 -0.494 11.997 441 H LEU 59 HN LEU 59 -15.492 -1.922 8.136 442 HA LEU 59 HA LEU 59 -13.807 -3.562 6.577 443 HB2 LEU 59 HB2 LEU 59 -16.653 -3.883 7.507 444 HB3 LEU 59 HB1 LEU 59 -15.850 -5.105 6.539 445 HG LEU 59 HG LEU 59 -14.846 -4.143 9.217 446 HD11 LEU 59 HD11 LEU 59 -16.996 -5.290 9.445 447 HD12 LEU 59 HD12 LEU 59 -15.672 -6.248 10.108 448 HD13 LEU 59 HD13 LEU 59 -16.357 -6.661 8.537 449 HD21 LEU 59 HD21 LEU 59 -14.056 -6.500 7.509 450 HD22 LEU 59 HD22 LEU 59 -13.404 -6.102 9.099 451 HD23 LEU 59 HD23 LEU 59 -13.114 -5.025 7.734 452 H GLN 60 HN GLN 60 -16.790 -1.820 5.851 453 HA GLN 60 HA GLN 60 -17.015 -2.614 3.150 454 HB2 GLN 60 HB2 GLN 60 -17.945 -0.094 4.540 455 HB3 GLN 60 HB1 GLN 60 -18.406 -0.550 2.905 456 HG2 GLN 60 HG2 GLN 60 -19.561 -2.478 3.692 457 HG3 GLN 60 HG1 GLN 60 -18.938 -2.248 5.324 458 HE21 GLN 60 HE21 GLN 60 -20.070 0.366 3.288 459 HE22 GLN 60 HE22 GLN 60 -21.484 0.731 4.221 460 H ALA 61 HN ALA 61 -15.219 -0.048 4.750 461 HA ALA 61 HA ALA 61 -14.307 1.284 2.438 462 HB1 ALA 61 HB1 ALA 61 -14.103 2.230 4.690 463 HB2 ALA 61 HB2 ALA 61 -12.547 2.193 3.859 464 HB3 ALA 61 HB3 ALA 61 -12.913 0.994 5.099 465 H LEU 62 HN LEU 62 -12.975 -1.442 4.277 466 HA LEU 62 HA LEU 62 -10.676 -1.766 2.624 467 HB2 LEU 62 HB2 LEU 62 -12.040 -3.751 4.449 468 HB3 LEU 62 HB1 LEU 62 -10.446 -3.948 3.745 469 HG LEU 62 HG LEU 62 -11.215 -1.779 5.702 470 HD11 LEU 62 HD11 LEU 62 -9.871 -3.017 7.308 471 HD12 LEU 62 HD12 LEU 62 -9.581 -4.281 6.110 472 HD13 LEU 62 HD13 LEU 62 -11.212 -4.003 6.722 473 HD21 LEU 62 HD21 LEU 62 -8.535 -2.564 4.555 474 HD22 LEU 62 HD22 LEU 62 -8.808 -1.350 5.806 475 HD23 LEU 62 HD23 LEU 62 -9.436 -1.095 4.179 476 H LYS 63 HN LYS 63 -13.937 -3.003 2.579 477 HA LYS 63 HA LYS 63 -13.535 -5.066 0.681 478 HB2 LYS 63 HB2 LYS 63 -15.515 -4.813 2.233 479 HB3 LYS 63 HB1 LYS 63 -16.097 -3.537 1.172 480 HG2 LYS 63 HG2 LYS 63 -16.127 -5.178 -0.690 481 HG3 LYS 63 HG1 LYS 63 -15.694 -6.436 0.469 482 HD2 LYS 63 HD2 LYS 63 -17.743 -5.879 1.754 483 HD3 LYS 63 HD1 LYS 63 -18.185 -4.732 0.489 484 HE2 LYS 63 HE2 LYS 63 -17.918 -7.724 0.255 485 HE3 LYS 63 HE1 LYS 63 -19.381 -6.756 0.085 486 HZ1 LYS 63 HZ1 LYS 63 -18.718 -7.277 -2.083 487 HZ2 LYS 63 HZ2 LYS 63 -17.082 -6.950 -1.772 488 HZ3 LYS 63 HZ3 LYS 63 -18.202 -5.674 -1.862 489 H SER 64 HN SER 64 -14.669 -1.710 0.382 490 HA SER 64 HA SER 64 -15.012 -1.769 -2.420 491 HB2 SER 64 HB2 SER 64 -14.822 0.780 -2.164 492 HB3 SER 64 HB1 SER 64 -16.125 -0.025 -1.291 493 HG SER 64 HG SER 64 -15.042 0.222 0.595 494 H GLY 65 HN GLY 65 -12.241 -1.173 -0.369 495 HA2 GLY 65 HA2 GLY 65 -10.491 -0.212 -2.381 496 HA3 GLY 65 HA1 GLY 65 -10.008 -0.968 -0.867 497 H GLY 66 HN GLY 66 -11.501 -3.420 -1.411 498 HA2 GLY 66 HA2 GLY 66 -11.441 -5.208 -3.016 499 HA3 GLY 66 HA1 GLY 66 -9.976 -4.504 -3.684 500 H LEU 67 HN LEU 67 -10.135 -4.525 -0.286 501 HA LEU 67 HA LEU 67 -7.966 -6.446 -0.200 502 HB2 LEU 67 HB2 LEU 67 -9.081 -4.412 1.652 503 HB3 LEU 67 HB1 LEU 67 -8.257 -5.781 2.370 504 HG LEU 67 HG LEU 67 -6.210 -5.235 1.207 505 HD11 LEU 67 HD11 LEU 67 -7.789 -3.019 -0.081 506 HD12 LEU 67 HD12 LEU 67 -7.069 -4.416 -0.884 507 HD13 LEU 67 HD13 LEU 67 -6.035 -3.186 -0.156 508 HD21 LEU 67 HD21 LEU 67 -6.606 -4.115 3.321 509 HD22 LEU 67 HD22 LEU 67 -7.450 -2.808 2.489 510 HD23 LEU 67 HD23 LEU 67 -5.725 -3.057 2.218 511 H VAL 68 HN VAL 68 -11.195 -6.102 1.257 512 HA VAL 68 HA VAL 68 -11.077 -8.981 1.847 513 HB VAL 68 HB VAL 68 -12.443 -8.617 3.854 514 HG11 VAL 68 HG11 VAL 68 -10.042 -8.776 4.102 515 HG12 VAL 68 HG12 VAL 68 -10.694 -7.621 5.263 516 HG13 VAL 68 HG13 VAL 68 -9.873 -7.045 3.813 517 HG21 VAL 68 HG21 VAL 68 -12.016 -5.685 3.298 518 HG22 VAL 68 HG22 VAL 68 -12.716 -6.355 4.771 519 HG23 VAL 68 HG23 VAL 68 -13.551 -6.551 3.230 520 H GLU 69 HN GLU 69 -13.056 -10.089 1.878 521 HA GLU 69 HA GLU 69 -15.343 -8.724 0.638 522 HB2 GLU 69 HB2 GLU 69 -13.992 -11.257 -0.201 523 HB3 GLU 69 HB1 GLU 69 -15.738 -11.139 -0.374 524 HG2 GLU 69 HG2 GLU 69 -13.759 -9.201 -1.557 525 HG3 GLU 69 HG1 GLU 69 -14.508 -10.542 -2.425 526 H ALA 70 HN ALA 70 -17.363 -10.205 0.913 527 HA ALA 70 HA ALA 70 -17.258 -11.349 3.621 528 HB1 ALA 70 HB1 ALA 70 -18.246 -9.102 3.674 529 HB2 ALA 70 HB2 ALA 70 -19.408 -10.351 4.125 530 HB3 ALA 70 HB3 ALA 70 -19.470 -9.626 2.519 531 H ARG 71 HN ARG 71 -18.437 -13.141 4.002 532 HA ARG 71 HA ARG 71 -20.110 -14.182 1.810 533 HB2 ARG 71 HB2 ARG 71 -18.097 -15.503 1.856 534 HB3 ARG 71 HB1 ARG 71 -18.187 -15.682 3.602 535 HG2 ARG 71 HG2 ARG 71 -20.097 -17.106 3.426 536 HG3 ARG 71 HG1 ARG 71 -20.228 -16.794 1.692 537 HD2 ARG 71 HD2 ARG 71 -17.858 -18.106 3.014 538 HD3 ARG 71 HD1 ARG 71 -19.187 -18.988 2.266 539 HE ARG 71 HE ARG 71 -18.468 -17.534 0.213 540 HH11 ARG 71 HH11 ARG 71 -16.395 -19.076 2.581 541 HH12 ARG 71 HH12 ARG 71 -15.077 -19.302 1.463 542 HH21 ARG 71 HH21 ARG 71 -16.742 -17.851 -1.265 543 HH22 ARG 71 HH22 ARG 71 -15.283 -18.616 -0.714 544 H ARG 72 HN ARG 72 -22.067 -15.092 2.422 545 HA ARG 72 HA ARG 72 -22.824 -14.472 5.186 546 HB2 ARG 72 HB2 ARG 72 -24.066 -13.512 3.144 547 HB3 ARG 72 HB1 ARG 72 -24.748 -15.125 2.969 548 HG2 ARG 72 HG2 ARG 72 -26.324 -13.896 4.200 549 HG3 ARG 72 HG1 ARG 72 -25.500 -14.923 5.377 550 HD2 ARG 72 HD2 ARG 72 -25.590 -12.836 6.419 551 HD3 ARG 72 HD1 ARG 72 -23.956 -12.910 5.757 552 HE ARG 72 HE ARG 72 -26.189 -11.298 4.729 553 HH11 ARG 72 HH11 ARG 72 -22.788 -12.160 4.580 554 HH12 ARG 72 HH12 ARG 72 -22.356 -10.768 3.637 555 HH21 ARG 72 HH21 ARG 72 -25.604 -9.472 3.510 556 HH22 ARG 72 HH22 ARG 72 -23.947 -9.238 3.036 557 H GLU 73 HN GLU 73 -22.616 -16.162 6.489 558 HA GLU 73 HA GLU 73 -23.645 -18.760 5.567 559 HB2 GLU 73 HB2 GLU 73 -21.298 -18.807 6.324 560 HB3 GLU 73 HB1 GLU 73 -21.784 -18.146 7.877 561 HG2 GLU 73 HG2 GLU 73 -23.156 -20.161 8.259 562 HG3 GLU 73 HG1 GLU 73 -22.544 -20.826 6.746 563 H GLY 74 HN GLY 74 -25.760 -18.769 6.040 564 HA2 GLY 74 HA2 GLY 74 -27.640 -18.901 7.378 565 HA3 GLY 74 HA1 GLY 74 -26.608 -18.673 8.785 566 H THR 75 HN THR 75 -26.663 -16.777 9.799 567 HA THR 75 HA THR 75 -27.855 -14.487 8.368 568 HB THR 75 HB THR 75 -28.544 -13.772 10.779 569 HG1 THR 75 HG1 THR 75 -28.474 -16.609 11.095 570 HG21 THR 75 HG21 THR 75 -30.687 -14.929 10.547 571 HG22 THR 75 HG22 THR 75 -29.974 -16.029 9.367 572 HG23 THR 75 HG23 THR 75 -30.131 -14.312 8.991 573 H ARG 76 HN ARG 76 -25.045 -15.605 9.351 574 HA ARG 76 HA ARG 76 -24.113 -13.098 10.563 575 HB2 ARG 76 HB2 ARG 76 -22.814 -15.819 10.434 576 HB3 ARG 76 HB1 ARG 76 -22.057 -14.388 11.116 577 HG2 ARG 76 HG2 ARG 76 -23.804 -14.246 12.800 578 HG3 ARG 76 HG1 ARG 76 -24.589 -15.671 12.113 579 HD2 ARG 76 HD2 ARG 76 -22.575 -16.986 12.586 580 HD3 ARG 76 HD1 ARG 76 -21.819 -15.559 13.294 581 HE ARG 76 HE ARG 76 -23.882 -15.661 14.852 582 HH11 ARG 76 HH11 ARG 76 -22.109 -18.386 13.566 583 HH12 ARG 76 HH12 ARG 76 -22.505 -19.445 14.886 584 HH21 ARG 76 HH21 ARG 76 -24.411 -17.032 16.602 585 HH22 ARG 76 HH22 ARG 76 -23.796 -18.663 16.632 586 H GLN 77 HN GLN 77 -22.504 -11.910 9.667 587 HA GLN 77 HA GLN 77 -21.817 -12.568 6.890 588 HB2 GLN 77 HB2 GLN 77 -22.873 -10.373 7.283 589 HB3 GLN 77 HB1 GLN 77 -21.569 -9.947 8.382 590 HG2 GLN 77 HG2 GLN 77 -19.971 -10.061 6.554 591 HG3 GLN 77 HG1 GLN 77 -21.259 -10.528 5.447 592 HE21 GLN 77 HE21 GLN 77 -21.678 -8.163 7.984 593 HE22 GLN 77 HE22 GLN 77 -21.829 -6.792 6.946 594 H TYR 78 HN TYR 78 -20.023 -13.744 6.811 595 HA TYR 78 HA TYR 78 -17.853 -13.220 8.691 596 HB2 TYR 78 HB2 TYR 78 -18.224 -15.395 6.620 597 HB3 TYR 78 HB1 TYR 78 -16.827 -15.256 7.679 598 HD1 TYR 78 HD2 TYR 78 -20.491 -15.827 7.646 599 HD2 TYR 78 HD1 TYR 78 -16.882 -16.117 9.878 600 HE1 TYR 78 HE2 TYR 78 -21.657 -17.161 9.348 601 HE2 TYR 78 HE1 TYR 78 -18.040 -17.459 11.585 602 HH TYR 78 HH TYR 78 -21.074 -18.852 11.070 603 H TYR 79 HN TYR 79 -16.038 -12.182 8.142 604 HA TYR 79 HA TYR 79 -15.777 -11.335 5.350 605 HB2 TYR 79 HB2 TYR 79 -14.931 -10.135 7.946 606 HB3 TYR 79 HB1 TYR 79 -13.968 -9.791 6.512 607 HD1 TYR 79 HD1 TYR 79 -17.262 -9.370 8.092 608 HD2 TYR 79 HD2 TYR 79 -14.814 -8.403 4.752 609 HE1 TYR 79 HE1 TYR 79 -18.854 -7.614 7.438 610 HE2 TYR 79 HE2 TYR 79 -16.398 -6.645 4.090 611 HH TYR 79 HH TYR 79 -18.860 -6.164 4.437 612 H ARG 80 HN ARG 80 -14.029 -11.726 4.175 613 HA ARG 80 HA ARG 80 -11.739 -13.114 5.358 614 HB2 ARG 80 HB2 ARG 80 -13.447 -14.781 4.421 615 HB3 ARG 80 HB1 ARG 80 -13.093 -14.104 2.839 616 HG2 ARG 80 HG2 ARG 80 -10.696 -14.732 3.205 617 HG3 ARG 80 HG1 ARG 80 -11.215 -15.584 4.663 618 HD2 ARG 80 HD2 ARG 80 -12.879 -16.786 3.127 619 HD3 ARG 80 HD1 ARG 80 -11.903 -16.165 1.798 620 HE ARG 80 HE ARG 80 -10.942 -18.003 3.893 621 HH11 ARG 80 HH11 ARG 80 -10.725 -16.670 0.657 622 HH12 ARG 80 HH12 ARG 80 -9.540 -17.827 0.125 623 HH21 ARG 80 HH21 ARG 80 -9.375 -19.519 3.191 624 HH22 ARG 80 HH22 ARG 80 -8.786 -19.447 1.564 625 H ILE 81 HN ILE 81 -9.823 -12.822 4.072 626 HA ILE 81 HA ILE 81 -9.633 -10.446 2.608 627 HB ILE 81 HB ILE 81 -7.824 -12.868 2.390 628 HG12 ILE 81 HG12 ILE 81 -7.660 -10.465 4.228 629 HG13 ILE 81 HG11 ILE 81 -8.126 -12.089 4.718 630 HG21 ILE 81 HG21 ILE 81 -6.115 -11.241 1.706 631 HG22 ILE 81 HG22 ILE 81 -7.320 -9.956 1.773 632 HG23 ILE 81 HG23 ILE 81 -7.482 -11.254 0.592 633 HD11 ILE 81 HD11 ILE 81 -5.905 -12.903 4.142 634 HD12 ILE 81 HD12 ILE 81 -5.829 -11.596 5.323 635 HD13 ILE 81 HD13 ILE 81 -5.440 -11.280 3.633 636 H ALA 82 HN ALA 82 -9.861 -9.969 0.451 637 HA ALA 82 HA ALA 82 -11.783 -11.303 -1.004 638 HB1 ALA 82 HB1 ALA 82 -9.602 -9.540 -2.110 639 HB2 ALA 82 HB2 ALA 82 -11.126 -8.985 -1.420 640 HB3 ALA 82 HB3 ALA 82 -11.125 -9.931 -2.908 641 H GLY 83 HN GLY 83 -8.272 -11.533 -1.376 642 HA2 GLY 83 HA2 GLY 83 -8.513 -14.256 -2.297 643 HA3 GLY 83 HA1 GLY 83 -7.920 -13.136 -3.522 644 H GLU 84 HN GLU 84 -6.251 -15.137 -2.810 645 HA GLU 84 HA GLU 84 -4.560 -14.558 -0.621 646 HB2 GLU 84 HB2 GLU 84 -2.989 -16.115 -1.630 647 HB3 GLU 84 HB1 GLU 84 -4.624 -16.755 -1.718 648 HG2 GLU 84 HG2 GLU 84 -4.765 -16.024 -4.060 649 HG3 GLU 84 HG1 GLU 84 -3.097 -15.456 -3.961 650 H ASP 85 HN ASP 85 -4.889 -13.174 -3.712 651 HA ASP 85 HA ASP 85 -2.402 -12.106 -4.285 652 HB2 ASP 85 HB2 ASP 85 -4.961 -10.530 -4.594 653 HB3 ASP 85 HB1 ASP 85 -3.535 -10.509 -5.626 654 H VAL 86 HN VAL 86 -5.023 -10.618 -2.412 655 HA VAL 86 HA VAL 86 -3.441 -8.420 -1.508 656 HB VAL 86 HB VAL 86 -6.058 -9.437 -0.385 657 HG11 VAL 86 HG11 VAL 86 -4.711 -6.745 -0.184 658 HG12 VAL 86 HG12 VAL 86 -4.930 -7.909 1.123 659 HG13 VAL 86 HG13 VAL 86 -6.332 -7.121 0.400 660 HG21 VAL 86 HG21 VAL 86 -5.537 -7.400 -2.549 661 HG22 VAL 86 HG22 VAL 86 -7.109 -7.747 -1.830 662 HG23 VAL 86 HG23 VAL 86 -6.273 -8.989 -2.762 663 H ALA 87 HN ALA 87 -4.345 -11.556 -0.201 664 HA ALA 87 HA ALA 87 -3.554 -11.159 2.463 665 HB1 ALA 87 HB1 ALA 87 -3.485 -13.743 0.912 666 HB2 ALA 87 HB2 ALA 87 -4.922 -13.058 1.669 667 HB3 ALA 87 HB3 ALA 87 -3.555 -13.562 2.664 668 H ARG 88 HN ARG 88 -1.755 -12.537 -0.284 669 HA ARG 88 HA ARG 88 0.649 -12.926 1.182 670 HB2 ARG 88 HB2 ARG 88 0.167 -12.745 -1.802 671 HB3 ARG 88 HB1 ARG 88 1.674 -13.271 -1.061 672 HG2 ARG 88 HG2 ARG 88 0.632 -15.197 -0.123 673 HG3 ARG 88 HG1 ARG 88 -0.970 -14.621 -0.588 674 HD2 ARG 88 HD2 ARG 88 -0.287 -16.336 -2.123 675 HD3 ARG 88 HD1 ARG 88 -0.285 -14.787 -2.963 676 HE ARG 88 HE ARG 88 2.202 -14.809 -2.545 677 HH11 ARG 88 HH11 ARG 88 0.320 -17.748 -2.837 678 HH12 ARG 88 HH12 ARG 88 1.662 -18.711 -3.373 679 HH21 ARG 88 HH21 ARG 88 3.965 -16.054 -3.250 680 HH22 ARG 88 HH22 ARG 88 3.755 -17.745 -3.601 681 H LEU 89 HN LEU 89 -0.699 -10.265 -0.633 682 HA LEU 89 HA LEU 89 1.639 -8.677 -0.777 683 HB2 LEU 89 HB2 LEU 89 -0.525 -8.368 -2.055 684 HB3 LEU 89 HB1 LEU 89 -1.214 -7.697 -0.592 685 HG LEU 89 HG LEU 89 1.254 -6.483 -1.803 686 HD11 LEU 89 HD11 LEU 89 -0.175 -4.969 -3.072 687 HD12 LEU 89 HD12 LEU 89 -1.602 -5.867 -2.556 688 HD13 LEU 89 HD13 LEU 89 -0.403 -6.637 -3.596 689 HD21 LEU 89 HD21 LEU 89 0.608 -5.753 0.435 690 HD22 LEU 89 HD22 LEU 89 -1.015 -5.378 -0.142 691 HD23 LEU 89 HD23 LEU 89 0.366 -4.456 -0.736 692 H PHE 90 HN PHE 90 -0.991 -8.875 1.612 693 HA PHE 90 HA PHE 90 0.031 -6.874 3.333 694 HB2 PHE 90 HB2 PHE 90 -2.303 -7.624 3.449 695 HB3 PHE 90 HB1 PHE 90 -1.774 -9.216 3.983 696 HD1 PHE 90 HD2 PHE 90 -1.505 -5.623 4.939 697 HD2 PHE 90 HD1 PHE 90 -1.698 -9.668 6.244 698 HE1 PHE 90 HE2 PHE 90 -1.583 -4.861 7.278 699 HE2 PHE 90 HE1 PHE 90 -1.775 -8.915 8.585 700 HZ PHE 90 HZ PHE 90 -1.716 -6.509 9.102 701 H ALA 91 HN ALA 91 0.489 -10.383 3.195 702 HA ALA 91 HA ALA 91 2.103 -10.626 5.489 703 HB1 ALA 91 HB1 ALA 91 2.216 -12.253 2.946 704 HB2 ALA 91 HB2 ALA 91 1.141 -12.556 4.310 705 HB3 ALA 91 HB3 ALA 91 2.885 -12.717 4.510 706 H LEU 92 HN LEU 92 2.830 -9.826 2.146 707 HA LEU 92 HA LEU 92 5.628 -9.854 2.290 708 HB2 LEU 92 HB2 LEU 92 4.164 -9.776 0.228 709 HB3 LEU 92 HB1 LEU 92 3.938 -8.069 0.539 710 HG LEU 92 HG LEU 92 6.683 -9.241 0.126 711 HD11 LEU 92 HD11 LEU 92 6.488 -8.575 -2.227 712 HD12 LEU 92 HD12 LEU 92 4.787 -8.183 -1.967 713 HD13 LEU 92 HD13 LEU 92 5.342 -9.849 -1.807 714 HD21 LEU 92 HD21 LEU 92 6.573 -6.991 1.081 715 HD22 LEU 92 HD22 LEU 92 5.553 -6.470 -0.260 716 HD23 LEU 92 HD23 LEU 92 7.222 -6.956 -0.560 717 H VAL 93 HN VAL 93 3.344 -7.114 2.627 718 HA VAL 93 HA VAL 93 5.350 -5.186 3.077 719 HB VAL 93 HB VAL 93 3.587 -3.710 3.927 720 HG11 VAL 93 HG11 VAL 93 2.173 -3.685 1.926 721 HG12 VAL 93 HG12 VAL 93 2.774 -5.286 1.496 722 HG13 VAL 93 HG13 VAL 93 3.879 -3.910 1.532 723 HG21 VAL 93 HG21 VAL 93 2.274 -5.301 5.207 724 HG22 VAL 93 HG22 VAL 93 1.794 -6.121 3.721 725 HG23 VAL 93 HG23 VAL 93 1.260 -4.469 4.028 726 H GLN 94 HN GLN 94 3.688 -7.368 5.249 727 HA GLN 94 HA GLN 94 4.540 -6.153 7.664 728 HB2 GLN 94 HB2 GLN 94 2.708 -7.780 7.603 729 HB3 GLN 94 HB1 GLN 94 3.826 -9.039 7.096 730 HG2 GLN 94 HG2 GLN 94 5.025 -8.823 9.223 731 HG3 GLN 94 HG1 GLN 94 3.885 -7.578 9.729 732 HE21 GLN 94 HE21 GLN 94 1.632 -8.958 8.469 733 HE22 GLN 94 HE22 GLN 94 1.240 -10.278 9.520 734 H VAL 95 HN VAL 95 5.830 -8.855 5.753 735 HA VAL 95 HA VAL 95 8.029 -9.396 7.424 736 HB VAL 95 HB VAL 95 7.625 -9.988 4.488 737 HG11 VAL 95 HG11 VAL 95 9.713 -11.069 6.377 738 HG12 VAL 95 HG12 VAL 95 10.003 -9.992 5.011 739 HG13 VAL 95 HG13 VAL 95 9.422 -11.633 4.731 740 HG21 VAL 95 HG21 VAL 95 5.997 -11.060 5.940 741 HG22 VAL 95 HG22 VAL 95 7.291 -11.699 6.953 742 HG23 VAL 95 HG23 VAL 95 7.118 -12.255 5.289 743 H VAL 96 HN VAL 96 7.773 -7.392 4.480 744 HA VAL 96 HA VAL 96 10.539 -6.839 4.320 745 HB VAL 96 HB VAL 96 8.945 -6.524 2.426 746 HG11 VAL 96 HG11 VAL 96 7.127 -5.417 3.600 747 HG12 VAL 96 HG12 VAL 96 7.688 -4.434 2.248 748 HG13 VAL 96 HG13 VAL 96 8.155 -4.015 3.896 749 HG21 VAL 96 HG21 VAL 96 10.651 -4.146 3.152 750 HG22 VAL 96 HG22 VAL 96 10.026 -4.495 1.541 751 HG23 VAL 96 HG23 VAL 96 11.173 -5.598 2.298 752 H ALA 97 HN ALA 97 7.905 -5.277 6.052 753 HA ALA 97 HA ALA 97 9.476 -3.034 6.897 754 HB1 ALA 97 HB1 ALA 97 7.054 -2.863 6.801 755 HB2 ALA 97 HB2 ALA 97 7.613 -2.599 8.453 756 HB3 ALA 97 HB3 ALA 97 6.893 -4.143 7.999 757 H ASP 98 HN ASP 98 8.547 -6.146 8.276 758 HA ASP 98 HA ASP 98 9.499 -5.791 10.868 759 HB2 ASP 98 HB2 ASP 98 8.083 -7.675 10.277 760 HB3 ASP 98 HB1 ASP 98 9.344 -8.331 9.239 761 H GLU 99 HN GLU 99 11.187 -7.267 8.083 762 HA GLU 99 HA GLU 99 13.555 -7.693 9.632 763 HB2 GLU 99 HB2 GLU 99 13.043 -7.954 6.671 764 HB3 GLU 99 HB1 GLU 99 14.568 -8.372 7.443 765 HG2 GLU 99 HG2 GLU 99 13.194 -9.909 8.937 766 HG3 GLU 99 HG1 GLU 99 11.889 -9.670 7.775 767 H HIS 100 HN HIS 100 12.340 -4.902 8.289 768 HA HIS 100 HA HIS 100 15.013 -3.763 7.931 769 HB2 HIS 100 HB2 HIS 100 12.287 -2.877 7.134 770 HB3 HIS 100 HB1 HIS 100 13.482 -1.629 7.474 771 HD1 HIS 100 HD1 HIS 100 15.872 -2.069 6.094 772 HD2 HIS 100 HD2 HIS 100 12.376 -3.734 4.561 773 HE1 HIS 100 HE1 HIS 100 16.357 -2.569 3.677 774 HE2 HIS 100 HE2 HIS 100 14.240 -3.587 2.765 775 H LEU 101 HN LEU 101 12.115 -3.406 9.937 776 HA LEU 101 HA LEU 101 13.254 -1.453 11.670 777 HB2 LEU 101 HB2 LEU 101 11.008 -3.417 12.160 778 HB3 LEU 101 HB1 LEU 101 11.409 -2.068 13.204 779 HG LEU 101 HG LEU 101 10.411 -1.862 10.360 780 HD11 LEU 101 HD11 LEU 101 8.692 -2.584 11.924 781 HD12 LEU 101 HD12 LEU 101 8.398 -0.930 11.386 782 HD13 LEU 101 HD13 LEU 101 9.074 -1.232 12.988 783 HD21 LEU 101 HD21 LEU 101 11.030 0.294 12.377 784 HD22 LEU 101 HD22 LEU 101 10.295 0.541 10.792 785 HD23 LEU 101 HD23 LEU 101 11.952 -0.053 10.915 786 H GLU 102 HN GLU 102 13.107 -4.950 11.621 787 HA GLU 102 HA GLU 102 14.903 -5.078 13.940 788 HB2 GLU 102 HB2 GLU 102 12.690 -6.511 13.559 789 HB3 GLU 102 HB1 GLU 102 13.776 -7.514 12.614 790 HG2 GLU 102 HG2 GLU 102 14.274 -6.770 15.481 791 HG3 GLU 102 HG1 GLU 102 13.424 -8.228 14.981 792 H HIS 103 HN HIS 103 16.314 -4.016 12.143 793 HA HIS 103 HA HIS 103 17.464 -5.852 10.253 794 HB2 HIS 103 HB2 HIS 103 17.336 -3.348 9.905 795 HB3 HIS 103 HB1 HIS 103 18.573 -3.178 11.144 796 HD1 HIS 103 HD1 HIS 103 18.216 -3.415 7.588 797 HD2 HIS 103 HD2 HIS 103 21.041 -4.709 10.350 798 HE1 HIS 103 HE1 HIS 103 20.309 -3.845 6.265 799 HE2 HIS 103 HE2 HIS 103 21.979 -4.725 7.938 800 H HIS 104 HN HIS 104 18.279 -7.557 11.336 801 HA HIS 104 HA HIS 104 19.619 -7.246 13.850 802 HB2 HIS 104 HB2 HIS 104 18.105 -9.203 12.871 803 HB3 HIS 104 HB1 HIS 104 19.668 -9.822 12.352 804 HD1 HIS 104 HD1 HIS 104 17.766 -8.887 15.458 805 HD2 HIS 104 HD2 HIS 104 21.164 -11.019 14.347 806 HE1 HIS 104 HE1 HIS 104 18.536 -10.078 17.542 807 HE2 HIS 104 HE2 HIS 104 20.509 -11.470 16.815 808 H HIS 105 HN HIS 105 21.743 -7.324 14.287 809 HA HIS 105 HA HIS 105 23.608 -7.212 12.077 810 HB2 HIS 105 HB2 HIS 105 24.076 -7.118 15.066 811 HB3 HIS 105 HB1 HIS 105 25.336 -6.928 13.856 812 HD1 HIS 105 HD1 HIS 105 25.010 -4.680 15.789 813 HD2 HIS 105 HD2 HIS 105 22.851 -4.892 12.238 814 HE1 HIS 105 HE1 HIS 105 24.297 -2.325 15.285 815 HE2 HIS 105 HE2 HIS 105 23.202 -2.446 13.023 816 H HIS 106 HN HIS 106 22.991 -9.374 11.376 817 HA HIS 106 HA HIS 106 23.519 -11.696 12.829 818 HB2 HIS 106 HB2 HIS 106 23.583 -12.847 10.635 819 HB3 HIS 106 HB1 HIS 106 22.198 -11.776 10.799 820 HD1 HIS 106 HD1 HIS 106 24.138 -12.836 8.228 821 HD2 HIS 106 HD2 HIS 106 23.382 -9.005 9.661 822 HE1 HIS 106 HE1 HIS 106 24.623 -11.284 6.316 823 HE2 HIS 106 HE2 HIS 106 24.403 -8.970 7.285 824 H HIS 107 HN HIS 107 25.326 -12.391 13.639 825 HA HIS 107 HA HIS 107 27.839 -12.222 12.250 826 HB2 HIS 107 HB2 HIS 107 27.630 -9.938 13.174 827 HB3 HIS 107 HB1 HIS 107 27.407 -10.610 14.783 828 HD1 HIS 107 HD1 HIS 107 29.991 -9.712 12.301 829 HD2 HIS 107 HD2 HIS 107 29.770 -11.709 15.943 830 HE1 HIS 107 HE1 HIS 107 32.365 -9.880 13.132 831 HE2 HIS 107 HE2 HIS 107 32.205 -11.073 15.352 832 H HIS 108 HN HIS 108 28.863 -14.049 12.737 833 HA HIS 108 HA HIS 108 28.512 -15.174 15.429 834 HB2 HIS 108 HB2 HIS 108 28.647 -17.453 14.403 835 HB3 HIS 108 HB1 HIS 108 27.192 -16.563 13.981 836 HD1 HIS 108 HD1 HIS 108 26.775 -16.077 11.537 837 HD2 HIS 108 HD2 HIS 108 30.511 -17.765 12.252 838 HE1 HIS 108 HE1 HIS 108 27.693 -16.686 9.274 839 HE2 HIS 108 HE2 HIS 108 29.920 -17.780 9.736 840 H1 MET 1 HT1 MET 1 6.980 -13.096 33.905 841 H2 MET 1 HT2 MET 1 8.423 -13.159 33.023 842 H3 MET 1 HT3 MET 1 7.950 -14.483 33.965 843 HA MET 1 HA MET 1 7.580 -14.809 31.571 844 HB2 MET 1 HB2 MET 1 5.228 -15.591 31.817 845 HB3 MET 1 HB1 MET 1 6.270 -16.098 33.137 846 HG2 MET 1 HG2 MET 1 5.371 -14.284 34.523 847 HG3 MET 1 HG1 MET 1 4.296 -13.827 33.201 848 HE1 MET 1 HE1 MET 1 1.871 -15.445 35.836 849 HE2 MET 1 HE2 MET 1 2.218 -14.010 34.870 850 HE3 MET 1 HE3 MET 1 3.309 -14.480 36.173 851 H ALA 2 HN ALA 2 5.847 -14.416 29.868 852 HA ALA 2 HA ALA 2 5.312 -11.514 29.750 853 HB1 ALA 2 HB1 ALA 2 5.453 -11.691 27.330 854 HB2 ALA 2 HB2 ALA 2 5.719 -13.430 27.456 855 HB3 ALA 2 HB3 ALA 2 6.928 -12.307 28.079 856 H GLY 3 HN GLY 3 3.256 -11.133 30.231 857 HA2 GLY 3 HA2 GLY 3 1.199 -13.094 29.592 858 HA3 GLY 3 HA1 GLY 3 0.982 -11.615 30.518 859 H GLN 4 HN GLN 4 1.385 -9.564 29.122 860 HA GLN 4 HA GLN 4 0.354 -9.915 26.415 861 HB2 GLN 4 HB2 GLN 4 -1.376 -8.183 26.769 862 HB3 GLN 4 HB1 GLN 4 -1.660 -9.620 27.740 863 HG2 GLN 4 HG2 GLN 4 -0.803 -8.506 29.703 864 HG3 GLN 4 HG1 GLN 4 -0.401 -7.079 28.748 865 HE21 GLN 4 HE21 GLN 4 -2.057 -5.765 27.972 866 HE22 GLN 4 HE22 GLN 4 -3.648 -5.813 28.656 867 H SER 5 HN SER 5 1.237 -8.545 25.010 868 HA SER 5 HA SER 5 2.098 -5.904 25.751 869 HB2 SER 5 HB2 SER 5 4.150 -7.957 24.873 870 HB3 SER 5 HB1 SER 5 4.444 -6.222 24.969 871 HG SER 5 HG SER 5 3.390 -7.169 27.282 872 H ASP 6 HN ASP 6 1.158 -4.815 24.151 873 HA ASP 6 HA ASP 6 0.811 -6.056 21.549 874 HB2 ASP 6 HB2 ASP 6 -0.142 -3.392 22.626 875 HB3 ASP 6 HB1 ASP 6 -0.534 -4.024 21.029 876 H ARG 7 HN ARG 7 2.940 -6.122 20.826 877 HA ARG 7 HA ARG 7 4.341 -3.577 20.454 878 HB2 ARG 7 HB2 ARG 7 5.381 -5.772 21.390 879 HB3 ARG 7 HB1 ARG 7 5.416 -6.283 19.708 880 HG2 ARG 7 HG2 ARG 7 6.786 -4.324 19.159 881 HG3 ARG 7 HG1 ARG 7 6.780 -3.858 20.862 882 HD2 ARG 7 HD2 ARG 7 7.755 -6.150 21.342 883 HD3 ARG 7 HD1 ARG 7 8.012 -6.299 19.604 884 HE ARG 7 HE ARG 7 9.433 -4.557 21.453 885 HH11 ARG 7 HH11 ARG 7 8.843 -5.474 18.126 886 HH12 ARG 7 HH12 ARG 7 10.290 -4.730 17.521 887 HH21 ARG 7 HH21 ARG 7 11.327 -3.561 20.664 888 HH22 ARG 7 HH22 ARG 7 11.703 -3.628 18.969 889 H LYS 8 HN LYS 8 2.551 -5.962 18.754 890 HA LYS 8 HA LYS 8 3.574 -5.617 16.152 891 HB2 LYS 8 HB2 LYS 8 1.465 -6.656 15.409 892 HB3 LYS 8 HB1 LYS 8 2.212 -7.533 16.736 893 HG2 LYS 8 HG2 LYS 8 0.645 -6.438 18.297 894 HG3 LYS 8 HG1 LYS 8 -0.141 -5.663 16.920 895 HD2 LYS 8 HD2 LYS 8 -0.687 -7.867 15.999 896 HD3 LYS 8 HD1 LYS 8 0.103 -8.636 17.376 897 HE2 LYS 8 HE2 LYS 8 -1.506 -7.583 18.886 898 HE3 LYS 8 HE1 LYS 8 -2.294 -6.806 17.516 899 HZ1 LYS 8 HZ1 LYS 8 -3.527 -8.733 18.132 900 HZ2 LYS 8 HZ2 LYS 8 -2.154 -9.722 18.074 901 HZ3 LYS 8 HZ3 LYS 8 -2.781 -9.059 16.645 902 H ALA 9 HN ALA 9 1.500 -3.648 18.065 903 HA ALA 9 HA ALA 9 -0.005 -2.358 16.096 904 HB1 ALA 9 HB1 ALA 9 -0.349 -0.594 17.723 905 HB2 ALA 9 HB2 ALA 9 0.994 -1.201 18.693 906 HB3 ALA 9 HB3 ALA 9 -0.463 -2.175 18.496 907 H ALA 10 HN ALA 10 3.167 -1.503 17.470 908 HA ALA 10 HA ALA 10 3.602 0.822 15.964 909 HB1 ALA 10 HB1 ALA 10 4.964 0.262 17.899 910 HB2 ALA 10 HB2 ALA 10 5.985 0.495 16.480 911 HB3 ALA 10 HB3 ALA 10 5.626 -1.134 17.052 912 H LEU 11 HN LEU 11 3.994 -2.552 15.183 913 HA LEU 11 HA LEU 11 5.584 -2.231 12.856 914 HB2 LEU 11 HB2 LEU 11 5.273 -4.349 14.188 915 HB3 LEU 11 HB1 LEU 11 3.659 -4.468 13.530 916 HG LEU 11 HG LEU 11 5.459 -5.934 12.489 917 HD11 LEU 11 HD11 LEU 11 4.568 -5.696 10.242 918 HD12 LEU 11 HD12 LEU 11 3.902 -4.118 10.662 919 HD13 LEU 11 HD13 LEU 11 3.286 -5.572 11.447 920 HD21 LEU 11 HD21 LEU 11 6.825 -4.882 10.739 921 HD22 LEU 11 HD22 LEU 11 7.238 -4.304 12.353 922 HD23 LEU 11 HD23 LEU 11 6.267 -3.297 11.278 923 H LEU 12 HN LEU 12 2.140 -2.245 13.526 924 HA LEU 12 HA LEU 12 1.296 -2.229 10.814 925 HB2 LEU 12 HB2 LEU 12 -0.143 -1.354 13.319 926 HB3 LEU 12 HB1 LEU 12 -0.894 -1.519 11.742 927 HG LEU 12 HG LEU 12 0.319 -3.743 13.385 928 HD11 LEU 12 HD11 LEU 12 -2.542 -3.159 12.628 929 HD12 LEU 12 HD12 LEU 12 -1.825 -2.940 14.226 930 HD13 LEU 12 HD13 LEU 12 -1.971 -4.557 13.539 931 HD21 LEU 12 HD21 LEU 12 0.671 -4.116 10.992 932 HD22 LEU 12 HD22 LEU 12 -1.049 -3.866 10.697 933 HD23 LEU 12 HD23 LEU 12 -0.510 -5.245 11.654 934 H ASP 13 HN ASP 13 2.195 0.282 13.103 935 HA ASP 13 HA ASP 13 1.255 2.506 11.660 936 HB2 ASP 13 HB2 ASP 13 3.515 2.149 13.605 937 HB3 ASP 13 HB1 ASP 13 3.285 3.684 12.776 938 H GLN 14 HN GLN 14 4.321 0.745 11.510 939 HA GLN 14 HA GLN 14 5.535 2.338 9.527 940 HB2 GLN 14 HB2 GLN 14 6.783 0.717 10.889 941 HB3 GLN 14 HB1 GLN 14 5.931 -0.604 10.102 942 HG2 GLN 14 HG2 GLN 14 8.162 -0.337 9.192 943 HG3 GLN 14 HG1 GLN 14 6.937 -0.003 7.970 944 HE21 GLN 14 HE21 GLN 14 8.345 1.222 6.723 945 HE22 GLN 14 HE22 GLN 14 8.871 2.796 7.198 946 H VAL 15 HN VAL 15 3.415 -0.484 9.305 947 HA VAL 15 HA VAL 15 3.583 -0.786 6.495 948 HB VAL 15 HB VAL 15 1.348 -1.598 8.364 949 HG11 VAL 15 HG11 VAL 15 0.591 -1.538 6.050 950 HG12 VAL 15 HG12 VAL 15 0.730 -3.202 6.616 951 HG13 VAL 15 HG13 VAL 15 1.969 -2.524 5.560 952 HG21 VAL 15 HG21 VAL 15 3.512 -2.581 8.958 953 HG22 VAL 15 HG22 VAL 15 3.683 -3.192 7.312 954 HG23 VAL 15 HG23 VAL 15 2.389 -3.796 8.346 955 H ALA 16 HN ALA 16 1.353 1.010 8.590 956 HA ALA 16 HA ALA 16 -0.360 1.951 6.567 957 HB1 ALA 16 HB1 ALA 16 -1.025 3.669 8.175 958 HB2 ALA 16 HB2 ALA 16 0.359 3.259 9.190 959 HB3 ALA 16 HB3 ALA 16 -0.930 2.081 8.934 960 H ARG 17 HN ARG 17 2.755 3.027 7.693 961 HA ARG 17 HA ARG 17 2.793 5.596 6.541 962 HB2 ARG 17 HB2 ARG 17 4.368 4.625 8.274 963 HB3 ARG 17 HB1 ARG 17 5.178 3.798 6.954 964 HG2 ARG 17 HG2 ARG 17 5.709 5.950 5.928 965 HG3 ARG 17 HG1 ARG 17 4.890 6.779 7.255 966 HD2 ARG 17 HD2 ARG 17 6.463 5.577 8.815 967 HD3 ARG 17 HD1 ARG 17 7.366 5.079 7.387 968 HE ARG 17 HE ARG 17 7.046 7.867 7.326 969 HH11 ARG 17 HH11 ARG 17 8.718 5.395 9.151 970 HH12 ARG 17 HH12 ARG 17 10.022 6.437 9.633 971 HH21 ARG 17 HH21 ARG 17 8.741 9.256 7.962 972 HH22 ARG 17 HH22 ARG 17 10.038 8.635 8.938 973 H VAL 18 HN VAL 18 4.034 2.471 5.330 974 HA VAL 18 HA VAL 18 4.869 3.549 2.830 975 HB VAL 18 HB VAL 18 5.204 1.285 2.067 976 HG11 VAL 18 HG11 VAL 18 6.681 0.424 3.810 977 HG12 VAL 18 HG12 VAL 18 5.940 1.516 4.979 978 HG13 VAL 18 HG13 VAL 18 6.855 2.170 3.621 979 HG21 VAL 18 HG21 VAL 18 3.711 0.376 4.522 980 HG22 VAL 18 HG22 VAL 18 4.520 -0.671 3.356 981 HG23 VAL 18 HG23 VAL 18 3.123 0.287 2.862 982 H GLY 19 HN GLY 19 1.870 2.308 4.068 983 HA2 GLY 19 HA2 GLY 19 0.518 1.924 1.619 984 HA3 GLY 19 HA1 GLY 19 -0.242 2.240 3.173 985 H LYS 20 HN LYS 20 0.873 4.761 3.716 986 HA LYS 20 HA LYS 20 -0.820 6.479 2.270 987 HB2 LYS 20 HB2 LYS 20 1.631 7.139 3.913 988 HB3 LYS 20 HB1 LYS 20 0.484 8.325 3.313 989 HG2 LYS 20 HG2 LYS 20 -1.290 7.179 4.626 990 HG3 LYS 20 HG1 LYS 20 -0.035 6.154 5.325 991 HD2 LYS 20 HD2 LYS 20 1.101 8.122 6.204 992 HD3 LYS 20 HD1 LYS 20 -0.128 9.164 5.481 993 HE2 LYS 20 HE2 LYS 20 -1.833 8.040 6.877 994 HE3 LYS 20 HE1 LYS 20 -0.548 7.106 7.647 995 HZ1 LYS 20 HZ1 LYS 20 -0.884 10.058 7.716 996 HZ2 LYS 20 HZ2 LYS 20 0.451 9.231 8.355 997 HZ3 LYS 20 HZ3 LYS 20 -1.092 8.979 9.011 998 H ALA 21 HN ALA 21 2.619 5.739 1.954 999 HA ALA 21 HA ALA 21 3.221 7.622 -0.049 1000 HB1 ALA 21 HB1 ALA 21 4.489 4.930 0.450 1001 HB2 ALA 21 HB2 ALA 21 4.938 6.447 1.231 1002 HB3 ALA 21 HB3 ALA 21 5.185 6.240 -0.503 1003 H LEU 22 HN LEU 22 1.797 4.417 -0.189 1004 HA LEU 22 HA LEU 22 1.946 4.293 -3.078 1005 HB2 LEU 22 HB2 LEU 22 0.613 2.473 -1.071 1006 HB3 LEU 22 HB1 LEU 22 0.681 2.166 -2.796 1007 HG LEU 22 HG LEU 22 3.078 2.357 -0.970 1008 HD11 LEU 22 HD11 LEU 22 1.762 -0.045 -2.233 1009 HD12 LEU 22 HD12 LEU 22 1.733 0.372 -0.520 1010 HD13 LEU 22 HD13 LEU 22 3.257 -0.054 -1.299 1011 HD21 LEU 22 HD21 LEU 22 2.845 1.596 -3.881 1012 HD22 LEU 22 HD22 LEU 22 4.310 1.485 -2.905 1013 HD23 LEU 22 HD23 LEU 22 3.589 3.060 -3.238 1014 H ALA 23 HN ALA 23 -0.045 5.839 -0.917 1015 HA ALA 23 HA ALA 23 -2.517 5.421 -2.407 1016 HB1 ALA 23 HB1 ALA 23 -2.012 7.108 0.044 1017 HB2 ALA 23 HB2 ALA 23 -2.581 5.438 0.050 1018 HB3 ALA 23 HB3 ALA 23 -3.586 6.711 -0.647 1019 H ASN 24 HN ASN 24 0.009 7.050 -3.221 1020 HA ASN 24 HA ASN 24 -1.457 9.477 -4.016 1021 HB2 ASN 24 HB2 ASN 24 1.438 9.107 -3.278 1022 HB3 ASN 24 HB1 ASN 24 0.907 10.474 -4.250 1023 HD21 ASN 24 HD21 ASN 24 0.717 8.946 -1.105 1024 HD22 ASN 24 HD22 ASN 24 0.131 10.339 -0.265 1025 H GLY 25 HN GLY 25 -2.140 9.078 -6.011 1026 HA2 GLY 25 HA2 GLY 25 -1.051 7.254 -7.818 1027 HA3 GLY 25 HA1 GLY 25 -2.166 8.542 -8.236 1028 H ARG 26 HN ARG 26 -0.493 10.748 -7.570 1029 HA ARG 26 HA ARG 26 0.908 11.017 -10.011 1030 HB2 ARG 26 HB2 ARG 26 0.955 12.651 -7.475 1031 HB3 ARG 26 HB1 ARG 26 1.860 13.097 -8.913 1032 HG2 ARG 26 HG2 ARG 26 -0.209 13.278 -10.179 1033 HG3 ARG 26 HG1 ARG 26 -1.131 12.782 -8.756 1034 HD2 ARG 26 HD2 ARG 26 -0.514 14.752 -7.574 1035 HD3 ARG 26 HD1 ARG 26 0.677 15.190 -8.797 1036 HE ARG 26 HE ARG 26 -1.741 15.084 -10.111 1037 HH11 ARG 26 HH11 ARG 26 -0.479 16.863 -7.362 1038 HH12 ARG 26 HH12 ARG 26 -1.365 18.311 -7.750 1039 HH21 ARG 26 HH21 ARG 26 -2.906 16.981 -10.592 1040 HH22 ARG 26 HH22 ARG 26 -2.766 18.362 -9.545 1041 H ARG 27 HN ARG 27 1.844 9.877 -6.882 1042 HA ARG 27 HA ARG 27 4.676 10.117 -7.523 1043 HB2 ARG 27 HB2 ARG 27 3.225 9.287 -5.005 1044 HB3 ARG 27 HB1 ARG 27 4.978 9.242 -5.174 1045 HG2 ARG 27 HG2 ARG 27 5.038 11.629 -5.565 1046 HG3 ARG 27 HG1 ARG 27 3.277 11.701 -5.515 1047 HD2 ARG 27 HD2 ARG 27 4.317 10.446 -3.138 1048 HD3 ARG 27 HD1 ARG 27 5.059 12.027 -3.386 1049 HE ARG 27 HE ARG 27 2.136 11.631 -3.331 1050 HH11 ARG 27 HH11 ARG 27 4.998 13.432 -2.457 1051 HH12 ARG 27 HH12 ARG 27 4.130 14.649 -1.575 1052 HH21 ARG 27 HH21 ARG 27 0.975 13.206 -2.156 1053 HH22 ARG 27 HH22 ARG 27 1.834 14.503 -1.370 1054 H LEU 28 HN LEU 28 2.139 7.794 -7.518 1055 HA LEU 28 HA LEU 28 3.719 5.440 -7.450 1056 HB2 LEU 28 HB2 LEU 28 1.015 5.968 -8.684 1057 HB3 LEU 28 HB1 LEU 28 1.743 4.377 -8.557 1058 HG LEU 28 HG LEU 28 0.919 6.154 -6.260 1059 HD11 LEU 28 HD11 LEU 28 -0.943 5.107 -7.448 1060 HD12 LEU 28 HD12 LEU 28 -0.735 4.426 -5.834 1061 HD13 LEU 28 HD13 LEU 28 -0.181 3.528 -7.246 1062 HD21 LEU 28 HD21 LEU 28 1.525 4.267 -4.837 1063 HD22 LEU 28 HD22 LEU 28 2.924 4.884 -5.714 1064 HD23 LEU 28 HD23 LEU 28 2.138 3.396 -6.242 1065 H GLN 29 HN GLN 29 2.716 7.631 -10.006 1066 HA GLN 29 HA GLN 29 3.588 6.102 -12.202 1067 HB2 GLN 29 HB2 GLN 29 2.160 8.152 -12.345 1068 HB3 GLN 29 HB1 GLN 29 3.580 9.118 -11.966 1069 HG2 GLN 29 HG2 GLN 29 4.675 8.203 -13.994 1070 HG3 GLN 29 HG1 GLN 29 3.164 7.386 -14.392 1071 HE21 GLN 29 HE21 GLN 29 1.404 8.610 -15.075 1072 HE22 GLN 29 HE22 GLN 29 1.577 10.242 -15.620 1073 H ILE 30 HN ILE 30 5.236 8.270 -10.005 1074 HA ILE 30 HA ILE 30 7.693 8.406 -11.397 1075 HB ILE 30 HB ILE 30 7.219 8.709 -8.426 1076 HG12 ILE 30 HG12 ILE 30 7.251 10.804 -10.611 1077 HG13 ILE 30 HG11 ILE 30 5.809 10.219 -9.789 1078 HG21 ILE 30 HG21 ILE 30 9.276 10.033 -8.459 1079 HG22 ILE 30 HG22 ILE 30 9.471 9.687 -10.177 1080 HG23 ILE 30 HG23 ILE 30 9.566 8.379 -8.998 1081 HD11 ILE 30 HD11 ILE 30 6.655 11.113 -7.679 1082 HD12 ILE 30 HD12 ILE 30 6.515 12.368 -8.910 1083 HD13 ILE 30 HD13 ILE 30 8.097 11.697 -8.509 1084 H LEU 31 HN LEU 31 6.410 6.220 -8.941 1085 HA LEU 31 HA LEU 31 8.763 4.752 -8.466 1086 HB2 LEU 31 HB2 LEU 31 5.876 3.878 -8.310 1087 HB3 LEU 31 HB1 LEU 31 7.229 2.961 -7.676 1088 HG LEU 31 HG LEU 31 6.422 5.713 -6.730 1089 HD11 LEU 31 HD11 LEU 31 6.004 3.009 -5.465 1090 HD12 LEU 31 HD12 LEU 31 4.749 4.050 -6.139 1091 HD13 LEU 31 HD13 LEU 31 5.650 4.566 -4.713 1092 HD21 LEU 31 HD21 LEU 31 8.804 5.266 -6.471 1093 HD22 LEU 31 HD22 LEU 31 8.438 3.747 -5.654 1094 HD23 LEU 31 HD23 LEU 31 7.990 5.279 -4.907 1095 H ASP 32 HN ASP 32 6.184 4.367 -10.837 1096 HA ASP 32 HA ASP 32 7.118 1.942 -11.974 1097 HB2 ASP 32 HB2 ASP 32 4.797 2.860 -12.214 1098 HB3 ASP 32 HB1 ASP 32 5.440 4.097 -13.285 1099 H LEU 33 HN LEU 33 7.899 5.288 -12.444 1100 HA LEU 33 HA LEU 33 9.373 4.907 -14.880 1101 HB2 LEU 33 HB2 LEU 33 8.277 7.044 -14.274 1102 HB3 LEU 33 HB1 LEU 33 9.397 7.220 -12.936 1103 HG LEU 33 HG LEU 33 11.270 7.270 -14.604 1104 HD11 LEU 33 HD11 LEU 33 10.712 7.721 -16.943 1105 HD12 LEU 33 HD12 LEU 33 9.006 7.459 -16.581 1106 HD13 LEU 33 HD13 LEU 33 10.151 6.127 -16.436 1107 HD21 LEU 33 HD21 LEU 33 10.847 9.569 -15.311 1108 HD22 LEU 33 HD22 LEU 33 10.369 9.317 -13.632 1109 HD23 LEU 33 HD23 LEU 33 9.143 9.386 -14.898 1110 H LEU 34 HN LEU 34 10.176 5.300 -11.449 1111 HA LEU 34 HA LEU 34 13.002 5.283 -11.879 1112 HB2 LEU 34 HB2 LEU 34 11.379 4.890 -9.370 1113 HB3 LEU 34 HB1 LEU 34 13.128 5.011 -9.400 1114 HG LEU 34 HG LEU 34 11.174 7.166 -10.202 1115 HD11 LEU 34 HD11 LEU 34 12.109 8.350 -8.275 1116 HD12 LEU 34 HD12 LEU 34 13.082 6.931 -7.884 1117 HD13 LEU 34 HD13 LEU 34 11.322 6.844 -7.804 1118 HD21 LEU 34 HD21 LEU 34 13.163 7.222 -11.612 1119 HD22 LEU 34 HD22 LEU 34 14.190 7.195 -10.179 1120 HD23 LEU 34 HD23 LEU 34 13.146 8.582 -10.489 1121 H ALA 35 HN ALA 35 10.648 2.832 -11.715 1122 HA ALA 35 HA ALA 35 12.334 0.716 -10.811 1123 HB1 ALA 35 HB1 ALA 35 9.889 0.566 -10.705 1124 HB2 ALA 35 HB2 ALA 35 10.578 -0.770 -11.625 1125 HB3 ALA 35 HB3 ALA 35 9.812 0.576 -12.467 1126 H GLN 36 HN GLN 36 12.397 2.562 -13.554 1127 HA GLN 36 HA GLN 36 13.359 0.416 -15.295 1128 HB2 GLN 36 HB2 GLN 36 12.895 3.335 -15.936 1129 HB3 GLN 36 HB1 GLN 36 13.176 2.033 -17.089 1130 HG2 GLN 36 HG2 GLN 36 11.078 1.007 -16.527 1131 HG3 GLN 36 HG1 GLN 36 10.814 2.167 -15.229 1132 HE21 GLN 36 HE21 GLN 36 8.895 2.906 -16.037 1133 HE22 GLN 36 HE22 GLN 36 8.780 3.854 -17.480 1134 H GLY 37 HN GLY 37 14.544 2.633 -13.094 1135 HA2 GLY 37 HA2 GLY 37 17.129 2.022 -13.049 1136 HA3 GLY 37 HA1 GLY 37 17.083 3.082 -14.451 1137 H GLU 38 HN GLU 38 18.641 3.745 -12.273 1138 HA GLU 38 HA GLU 38 17.158 5.623 -10.646 1139 HB2 GLU 38 HB2 GLU 38 19.784 6.222 -10.163 1140 HB3 GLU 38 HB1 GLU 38 18.822 5.077 -9.248 1141 HG2 GLU 38 HG2 GLU 38 20.912 4.080 -9.774 1142 HG3 GLU 38 HG1 GLU 38 19.648 3.274 -10.695 1143 H ARG 39 HN ARG 39 17.038 7.741 -10.891 1144 HA ARG 39 HA ARG 39 18.559 9.014 -13.043 1145 HB2 ARG 39 HB2 ARG 39 15.538 8.985 -12.916 1146 HB3 ARG 39 HB1 ARG 39 16.486 10.017 -13.985 1147 HG2 ARG 39 HG2 ARG 39 17.406 8.066 -15.090 1148 HG3 ARG 39 HG1 ARG 39 16.529 7.005 -13.988 1149 HD2 ARG 39 HD2 ARG 39 14.411 7.912 -14.836 1150 HD3 ARG 39 HD1 ARG 39 15.314 8.924 -15.966 1151 HE ARG 39 HE ARG 39 16.174 6.330 -16.403 1152 HH11 ARG 39 HH11 ARG 39 13.156 8.093 -16.628 1153 HH12 ARG 39 HH12 ARG 39 12.504 7.069 -17.872 1154 HH21 ARG 39 HH21 ARG 39 15.307 4.986 -18.034 1155 HH22 ARG 39 HH22 ARG 39 13.719 5.313 -18.662 1156 H ALA 40 HN ALA 40 18.655 11.273 -12.934 1157 HA ALA 40 HA ALA 40 18.640 12.286 -10.268 1158 HB1 ALA 40 HB1 ALA 40 19.129 13.739 -12.867 1159 HB2 ALA 40 HB2 ALA 40 20.357 12.925 -11.897 1160 HB3 ALA 40 HB3 ALA 40 19.514 14.334 -11.252 1161 H VAL 41 HN VAL 41 17.547 14.182 -9.544 1162 HA VAL 41 HA VAL 41 14.802 14.134 -9.756 1163 HB VAL 41 HB VAL 41 16.448 16.584 -9.105 1164 HG11 VAL 41 HG11 VAL 41 13.646 15.811 -8.298 1165 HG12 VAL 41 HG12 VAL 41 14.085 17.070 -9.451 1166 HG13 VAL 41 HG13 VAL 41 14.520 17.243 -7.751 1167 HG21 VAL 41 HG21 VAL 41 17.171 14.671 -7.778 1168 HG22 VAL 41 HG22 VAL 41 15.504 14.362 -7.294 1169 HG23 VAL 41 HG23 VAL 41 16.314 15.841 -6.774 1170 H GLU 42 HN GLU 42 17.068 16.147 -11.585 1171 HA GLU 42 HA GLU 42 15.204 17.811 -12.842 1172 HB2 GLU 42 HB2 GLU 42 17.683 18.157 -12.762 1173 HB3 GLU 42 HB1 GLU 42 17.860 16.887 -13.963 1174 HG2 GLU 42 HG2 GLU 42 16.073 19.171 -14.594 1175 HG3 GLU 42 HG1 GLU 42 17.813 19.446 -14.606 1176 H ALA 43 HN ALA 43 16.566 14.708 -13.851 1177 HA ALA 43 HA ALA 43 15.255 14.584 -16.352 1178 HB1 ALA 43 HB1 ALA 43 16.264 12.312 -14.641 1179 HB2 ALA 43 HB2 ALA 43 17.224 13.224 -15.807 1180 HB3 ALA 43 HB3 ALA 43 15.873 12.231 -16.358 1181 H ILE 44 HN ILE 44 14.429 13.364 -13.136 1182 HA ILE 44 HA ILE 44 12.125 11.916 -13.869 1183 HB ILE 44 HB ILE 44 12.698 13.270 -11.225 1184 HG12 ILE 44 HG12 ILE 44 13.300 10.431 -12.091 1185 HG13 ILE 44 HG11 ILE 44 14.496 11.721 -11.992 1186 HG21 ILE 44 HG21 ILE 44 10.368 12.608 -11.456 1187 HG22 ILE 44 HG22 ILE 44 11.191 11.580 -10.284 1188 HG23 ILE 44 HG23 ILE 44 10.860 10.976 -11.907 1189 HD11 ILE 44 HD11 ILE 44 14.100 11.903 -9.593 1190 HD12 ILE 44 HD12 ILE 44 14.598 10.275 -10.048 1191 HD13 ILE 44 HD13 ILE 44 12.903 10.612 -9.691 1192 H ALA 45 HN ALA 45 12.527 15.231 -12.667 1193 HA ALA 45 HA ALA 45 9.813 15.909 -12.513 1194 HB1 ALA 45 HB1 ALA 45 11.605 17.203 -11.459 1195 HB2 ALA 45 HB2 ALA 45 10.576 18.219 -12.468 1196 HB3 ALA 45 HB3 ALA 45 12.165 17.720 -13.050 1197 H THR 46 HN THR 46 12.164 16.537 -15.109 1198 HA THR 46 HA THR 46 10.400 17.840 -16.843 1199 HB THR 46 HB THR 46 12.808 16.194 -17.637 1200 HG1 THR 46 HG1 THR 46 13.818 17.619 -16.420 1201 HG21 THR 46 HG21 THR 46 11.405 16.931 -19.515 1202 HG22 THR 46 HG22 THR 46 12.959 17.763 -19.507 1203 HG23 THR 46 HG23 THR 46 11.511 18.594 -18.938 1204 H ALA 47 HN ALA 47 11.280 14.403 -16.606 1205 HA ALA 47 HA ALA 47 9.973 13.543 -18.935 1206 HB1 ALA 47 HB1 ALA 47 10.143 11.298 -18.010 1207 HB2 ALA 47 HB2 ALA 47 10.518 11.968 -16.421 1208 HB3 ALA 47 HB3 ALA 47 11.642 12.194 -17.762 1209 H THR 48 HN THR 48 8.794 13.979 -15.646 1210 HA THR 48 HA THR 48 6.239 12.765 -16.284 1211 HB THR 48 HB THR 48 5.673 13.471 -13.907 1212 HG1 THR 48 HG1 THR 48 8.469 13.840 -13.607 1213 HG21 THR 48 HG21 THR 48 8.071 11.684 -14.329 1214 HG22 THR 48 HG22 THR 48 6.382 11.196 -14.457 1215 HG23 THR 48 HG23 THR 48 7.039 11.698 -12.899 1216 H GLY 49 HN GLY 49 7.659 15.867 -16.389 1217 HA2 GLY 49 HA2 GLY 49 6.723 17.835 -17.196 1218 HA3 GLY 49 HA1 GLY 49 5.141 17.067 -17.165 1219 H MET 50 HN MET 50 7.379 17.243 -14.459 1220 HA MET 50 HA MET 50 5.513 19.086 -13.123 1221 HB2 MET 50 HB2 MET 50 6.835 16.614 -12.002 1222 HB3 MET 50 HB1 MET 50 6.174 17.878 -10.973 1223 HG2 MET 50 HG2 MET 50 3.977 17.551 -12.082 1224 HG3 MET 50 HG1 MET 50 4.669 16.184 -12.951 1225 HE1 MET 50 HE1 MET 50 5.236 13.526 -10.204 1226 HE2 MET 50 HE2 MET 50 6.422 14.595 -10.958 1227 HE3 MET 50 HE3 MET 50 5.150 13.859 -11.935 1228 H ASN 51 HN ASN 51 6.447 20.412 -11.459 1229 HA ASN 51 HA ASN 51 8.925 21.554 -12.216 1230 HB2 ASN 51 HB2 ASN 51 7.199 21.903 -9.759 1231 HB3 ASN 51 HB1 ASN 51 8.678 22.818 -10.023 1232 HD21 ASN 51 HD21 ASN 51 5.403 22.280 -11.075 1233 HD22 ASN 51 HD22 ASN 51 5.262 23.732 -12.022 1234 H LEU 52 HN LEU 52 10.932 21.522 -11.188 1235 HA LEU 52 HA LEU 52 11.764 19.025 -10.215 1236 HB2 LEU 52 HB2 LEU 52 13.058 21.734 -10.226 1237 HB3 LEU 52 HB1 LEU 52 13.842 20.366 -9.465 1238 HG LEU 52 HG LEU 52 13.671 19.175 -11.699 1239 HD11 LEU 52 HD11 LEU 52 13.420 20.548 -13.682 1240 HD12 LEU 52 HD12 LEU 52 13.087 21.962 -12.681 1241 HD13 LEU 52 HD13 LEU 52 11.955 20.609 -12.699 1242 HD21 LEU 52 HD21 LEU 52 15.635 20.325 -12.593 1243 HD22 LEU 52 HD22 LEU 52 15.748 20.111 -10.846 1244 HD23 LEU 52 HD23 LEU 52 15.326 21.688 -11.517 1245 H THR 53 HN THR 53 11.039 22.039 -8.518 1246 HA THR 53 HA THR 53 11.753 21.179 -5.941 1247 HB THR 53 HB THR 53 9.672 23.239 -6.705 1248 HG1 THR 53 HG1 THR 53 11.481 24.683 -6.589 1249 HG21 THR 53 HG21 THR 53 10.226 24.257 -4.544 1250 HG22 THR 53 HG22 THR 53 11.343 22.934 -4.203 1251 HG23 THR 53 HG23 THR 53 9.612 22.615 -4.331 1252 H THR 54 HN THR 54 8.640 21.143 -7.649 1253 HA THR 54 HA THR 54 7.148 19.994 -5.544 1254 HB THR 54 HB THR 54 6.594 19.808 -8.511 1255 HG1 THR 54 HG1 THR 54 5.418 21.724 -6.797 1256 HG21 THR 54 HG21 THR 54 4.242 19.640 -7.791 1257 HG22 THR 54 HG22 THR 54 4.770 19.624 -6.109 1258 HG23 THR 54 HG23 THR 54 5.214 18.300 -7.184 1259 H ALA 55 HN ALA 55 8.885 18.601 -8.306 1260 HA ALA 55 HA ALA 55 8.173 15.917 -7.885 1261 HB1 ALA 55 HB1 ALA 55 9.257 16.717 -9.936 1262 HB2 ALA 55 HB2 ALA 55 10.123 15.353 -9.226 1263 HB3 ALA 55 HB3 ALA 55 10.747 16.992 -9.033 1264 H SER 56 HN SER 56 10.825 17.865 -6.577 1265 HA SER 56 HA SER 56 12.174 15.878 -5.170 1266 HB2 SER 56 HB2 SER 56 11.800 18.790 -4.425 1267 HB3 SER 56 HB1 SER 56 13.012 17.712 -3.733 1268 HG SER 56 HG SER 56 12.787 18.477 -6.468 1269 H ALA 57 HN ALA 57 9.376 17.831 -4.229 1270 HA ALA 57 HA ALA 57 9.151 16.879 -1.579 1271 HB1 ALA 57 HB1 ALA 57 8.009 18.894 -2.367 1272 HB2 ALA 57 HB2 ALA 57 6.867 17.746 -1.665 1273 HB3 ALA 57 HB3 ALA 57 6.992 17.908 -3.418 1274 H ASN 58 HN ASN 58 7.634 15.849 -4.611 1275 HA ASN 58 HA ASN 58 6.113 13.725 -3.613 1276 HB2 ASN 58 HB2 ASN 58 7.371 14.227 -6.308 1277 HB3 ASN 58 HB1 ASN 58 6.409 12.788 -5.990 1278 HD21 ASN 58 HD21 ASN 58 5.973 15.079 -7.800 1279 HD22 ASN 58 HD22 ASN 58 4.417 15.699 -7.384 1280 H LEU 59 HN LEU 59 9.426 13.775 -4.857 1281 HA LEU 59 HA LEU 59 9.938 11.019 -4.557 1282 HB2 LEU 59 HB2 LEU 59 11.801 13.391 -4.624 1283 HB3 LEU 59 HB1 LEU 59 12.337 11.722 -4.681 1284 HG LEU 59 HG LEU 59 10.481 12.934 -6.726 1285 HD11 LEU 59 HD11 LEU 59 12.613 14.108 -6.786 1286 HD12 LEU 59 HD12 LEU 59 12.424 13.068 -8.198 1287 HD13 LEU 59 HD13 LEU 59 13.469 12.567 -6.869 1288 HD21 LEU 59 HD21 LEU 59 10.379 10.499 -6.518 1289 HD22 LEU 59 HD22 LEU 59 12.128 10.406 -6.739 1290 HD23 LEU 59 HD23 LEU 59 11.102 10.987 -8.050 1291 H GLN 60 HN GLN 60 10.524 13.786 -2.418 1292 HA GLN 60 HA GLN 60 11.920 12.422 -0.411 1293 HB2 GLN 60 HB2 GLN 60 11.747 14.888 -0.577 1294 HB3 GLN 60 HB1 GLN 60 10.062 14.784 -0.084 1295 HG2 GLN 60 HG2 GLN 60 10.731 13.852 2.060 1296 HG3 GLN 60 HG1 GLN 60 12.421 13.909 1.564 1297 HE21 GLN 60 HE21 GLN 60 13.021 15.249 3.225 1298 HE22 GLN 60 HE22 GLN 60 12.581 16.927 3.278 1299 H ALA 61 HN ALA 61 8.453 12.935 -0.879 1300 HA ALA 61 HA ALA 61 7.552 11.767 1.505 1301 HB1 ALA 61 HB1 ALA 61 6.090 13.070 0.055 1302 HB2 ALA 61 HB2 ALA 61 5.408 11.469 0.347 1303 HB3 ALA 61 HB3 ALA 61 6.195 11.826 -1.190 1304 H LEU 62 HN LEU 62 8.149 10.323 -1.683 1305 HA LEU 62 HA LEU 62 7.379 7.692 -1.010 1306 HB2 LEU 62 HB2 LEU 62 9.347 8.671 -3.084 1307 HB3 LEU 62 HB1 LEU 62 8.722 7.034 -2.998 1308 HG LEU 62 HG LEU 62 7.026 9.492 -3.453 1309 HD11 LEU 62 HD11 LEU 62 6.879 8.731 -5.765 1310 HD12 LEU 62 HD12 LEU 62 8.005 7.420 -5.412 1311 HD13 LEU 62 HD13 LEU 62 8.547 9.095 -5.321 1312 HD21 LEU 62 HD21 LEU 62 5.295 7.883 -4.048 1313 HD22 LEU 62 HD22 LEU 62 5.840 7.636 -2.388 1314 HD23 LEU 62 HD23 LEU 62 6.387 6.552 -3.668 1315 H LYS 63 HN LYS 63 10.456 9.393 -0.857 1316 HA LYS 63 HA LYS 63 12.018 7.174 -0.060 1317 HB2 LYS 63 HB2 LYS 63 13.096 9.089 -1.010 1318 HB3 LYS 63 HB1 LYS 63 12.421 10.150 0.218 1319 HG2 LYS 63 HG2 LYS 63 13.819 9.231 1.899 1320 HG3 LYS 63 HG1 LYS 63 14.343 7.925 0.834 1321 HD2 LYS 63 HD2 LYS 63 15.609 9.389 -0.507 1322 HD3 LYS 63 HD1 LYS 63 14.831 10.818 0.178 1323 HE2 LYS 63 HE2 LYS 63 17.147 10.440 0.997 1324 HE3 LYS 63 HE1 LYS 63 15.938 10.492 2.277 1325 HZ1 LYS 63 HZ1 LYS 63 17.458 8.701 2.670 1326 HZ2 LYS 63 HZ2 LYS 63 17.191 8.049 1.130 1327 HZ3 LYS 63 HZ3 LYS 63 15.944 8.048 2.282 1328 H SER 64 HN SER 64 10.134 9.549 1.731 1329 HA SER 64 HA SER 64 11.092 8.832 4.311 1330 HB2 SER 64 HB2 SER 64 8.460 10.123 3.545 1331 HB3 SER 64 HB1 SER 64 9.172 10.102 5.158 1332 HG SER 64 HG SER 64 10.299 11.308 2.837 1333 H GLY 65 HN GLY 65 8.637 7.557 2.195 1334 HA2 GLY 65 HA2 GLY 65 7.452 5.873 4.214 1335 HA3 GLY 65 HA1 GLY 65 7.133 5.817 2.486 1336 H GLY 66 HN GLY 66 10.210 5.707 2.201 1337 HA2 GLY 66 HA2 GLY 66 11.878 4.059 2.401 1338 HA3 GLY 66 HA1 GLY 66 10.686 2.963 3.083 1339 H LEU 67 HN LEU 67 9.777 4.687 0.269 1340 HA LEU 67 HA LEU 67 9.649 2.228 -1.249 1341 HB2 LEU 67 HB2 LEU 67 8.691 5.031 -1.693 1342 HB3 LEU 67 HB1 LEU 67 8.770 3.917 -3.041 1343 HG LEU 67 HG LEU 67 6.516 4.035 -2.100 1344 HD11 LEU 67 HD11 LEU 67 6.128 1.649 -1.819 1345 HD12 LEU 67 HD12 LEU 67 7.857 1.388 -1.588 1346 HD13 LEU 67 HD13 LEU 67 7.252 1.962 -3.141 1347 HD21 LEU 67 HD21 LEU 67 7.068 4.568 0.208 1348 HD22 LEU 67 HD22 LEU 67 7.773 2.965 0.422 1349 HD23 LEU 67 HD23 LEU 67 6.041 3.135 0.126 1350 H VAL 68 HN VAL 68 11.308 5.354 -1.505 1351 HA VAL 68 HA VAL 68 13.175 4.093 -3.395 1352 HB VAL 68 HB VAL 68 13.482 6.271 -4.509 1353 HG11 VAL 68 HG11 VAL 68 11.939 4.646 -5.459 1354 HG12 VAL 68 HG12 VAL 68 11.374 6.292 -5.746 1355 HG13 VAL 68 HG13 VAL 68 10.626 5.310 -4.486 1356 HG21 VAL 68 HG21 VAL 68 12.811 7.734 -2.667 1357 HG22 VAL 68 HG22 VAL 68 11.146 7.172 -2.823 1358 HG23 VAL 68 HG23 VAL 68 11.893 8.089 -4.131 1359 H GLU 69 HN GLU 69 15.305 5.021 -3.429 1360 HA GLU 69 HA GLU 69 16.055 6.317 -0.890 1361 HB2 GLU 69 HB2 GLU 69 16.826 3.784 -1.820 1362 HB3 GLU 69 HB1 GLU 69 18.212 4.821 -2.127 1363 HG2 GLU 69 HG2 GLU 69 16.837 4.609 0.537 1364 HG3 GLU 69 HG1 GLU 69 18.236 3.644 0.070 1365 H ALA 70 HN ALA 70 18.069 7.604 -1.055 1366 HA ALA 70 HA ALA 70 18.130 8.978 -3.657 1367 HB1 ALA 70 HB1 ALA 70 19.049 9.991 -0.968 1368 HB2 ALA 70 HB2 ALA 70 17.489 10.345 -1.710 1369 HB3 ALA 70 HB3 ALA 70 18.975 10.913 -2.471 1370 H ARG 71 HN ARG 71 19.718 8.275 -4.899 1371 HA ARG 71 HA ARG 71 22.306 7.624 -3.658 1372 HB2 ARG 71 HB2 ARG 71 21.117 5.812 -4.938 1373 HB3 ARG 71 HB1 ARG 71 21.290 6.799 -6.382 1374 HG2 ARG 71 HG2 ARG 71 23.721 6.683 -6.168 1375 HG3 ARG 71 HG1 ARG 71 23.542 5.684 -4.722 1376 HD2 ARG 71 HD2 ARG 71 22.360 3.995 -6.066 1377 HD3 ARG 71 HD1 ARG 71 22.595 4.989 -7.504 1378 HE ARG 71 HE ARG 71 24.627 3.445 -6.076 1379 HH11 ARG 71 HH11 ARG 71 23.828 5.677 -8.645 1380 HH12 ARG 71 HH12 ARG 71 25.325 5.453 -9.487 1381 HH21 ARG 71 HH21 ARG 71 26.569 3.095 -7.209 1382 HH22 ARG 71 HH22 ARG 71 26.868 3.939 -8.700 1383 H ARG 72 HN ARG 72 23.569 9.363 -3.735 1384 HA ARG 72 HA ARG 72 23.237 11.260 -5.947 1385 HB2 ARG 72 HB2 ARG 72 24.448 11.536 -3.197 1386 HB3 ARG 72 HB1 ARG 72 24.503 12.805 -4.414 1387 HG2 ARG 72 HG2 ARG 72 22.185 13.118 -4.355 1388 HG3 ARG 72 HG1 ARG 72 21.914 11.589 -3.519 1389 HD2 ARG 72 HD2 ARG 72 23.477 13.836 -2.279 1390 HD3 ARG 72 HD1 ARG 72 21.721 13.734 -2.150 1391 HE ARG 72 HE ARG 72 22.755 11.272 -1.360 1392 HH11 ARG 72 HH11 ARG 72 22.868 14.600 -0.284 1393 HH12 ARG 72 HH12 ARG 72 22.993 14.182 1.403 1394 HH21 ARG 72 HH21 ARG 72 22.902 10.715 0.847 1395 HH22 ARG 72 HH22 ARG 72 23.024 11.977 2.037 1396 H GLU 73 HN GLU 73 24.738 11.504 -7.454 1397 HA GLU 73 HA GLU 73 27.525 10.874 -6.808 1398 HB2 GLU 73 HB2 GLU 73 26.130 10.028 -9.357 1399 HB3 GLU 73 HB1 GLU 73 27.856 9.897 -9.057 1400 HG2 GLU 73 HG2 GLU 73 27.289 8.414 -7.105 1401 HG3 GLU 73 HG1 GLU 73 25.630 8.404 -7.703 1402 H GLY 74 HN GLY 74 28.840 12.483 -7.315 1403 HA2 GLY 74 HA2 GLY 74 29.683 14.368 -8.321 1404 HA3 GLY 74 HA1 GLY 74 28.572 14.081 -9.653 1405 H THR 75 HN THR 75 27.114 15.604 -9.969 1406 HA THR 75 HA THR 75 26.325 17.287 -7.688 1407 HB THR 75 HB THR 75 25.728 18.959 -9.553 1408 HG1 THR 75 HG1 THR 75 26.953 18.646 -11.482 1409 HG21 THR 75 HG21 THR 75 27.611 19.253 -8.007 1410 HG22 THR 75 HG22 THR 75 28.014 19.825 -9.627 1411 HG23 THR 75 HG23 THR 75 28.631 18.273 -9.062 1412 H ARG 76 HN ARG 76 25.194 14.726 -9.117 1413 HA ARG 76 HA ARG 76 22.474 15.789 -9.519 1414 HB2 ARG 76 HB2 ARG 76 23.628 13.229 -10.627 1415 HB3 ARG 76 HB1 ARG 76 22.017 13.861 -10.930 1416 HG2 ARG 76 HG2 ARG 76 23.014 15.801 -12.060 1417 HG3 ARG 76 HG1 ARG 76 24.615 15.099 -11.801 1418 HD2 ARG 76 HD2 ARG 76 23.753 13.043 -12.996 1419 HD3 ARG 76 HD1 ARG 76 22.360 14.017 -13.466 1420 HE ARG 76 HE ARG 76 24.006 15.527 -14.574 1421 HH11 ARG 76 HH11 ARG 76 24.790 12.166 -13.952 1422 HH12 ARG 76 HH12 ARG 76 25.970 12.068 -15.230 1423 HH21 ARG 76 HH21 ARG 76 25.538 15.398 -16.267 1424 HH22 ARG 76 HH22 ARG 76 26.400 13.916 -16.541 1425 H GLN 77 HN GLN 77 20.779 14.832 -8.504 1426 HA GLN 77 HA GLN 77 21.458 12.816 -6.475 1427 HB2 GLN 77 HB2 GLN 77 20.582 14.997 -5.637 1428 HB3 GLN 77 HB1 GLN 77 19.096 14.708 -6.532 1429 HG2 GLN 77 HG2 GLN 77 18.548 12.841 -5.168 1430 HG3 GLN 77 HG1 GLN 77 20.133 12.866 -4.395 1431 HE21 GLN 77 HE21 GLN 77 17.009 14.359 -4.582 1432 HE22 GLN 77 HE22 GLN 77 17.150 15.304 -3.145 1433 H TYR 78 HN TYR 78 21.054 10.878 -7.319 1434 HA TYR 78 HA TYR 78 18.864 10.537 -9.207 1435 HB2 TYR 78 HB2 TYR 78 20.899 8.506 -8.272 1436 HB3 TYR 78 HB1 TYR 78 19.800 8.337 -9.633 1437 HD1 TYR 78 HD2 TYR 78 22.883 9.895 -8.425 1438 HD2 TYR 78 HD1 TYR 78 20.261 9.454 -11.745 1439 HE1 TYR 78 HE2 TYR 78 24.617 10.799 -9.909 1440 HE2 TYR 78 HE1 TYR 78 21.995 10.350 -13.240 1441 HH TYR 78 HH TYR 78 25.225 10.659 -12.307 1442 H TYR 79 HN TYR 79 16.993 9.563 -8.718 1443 HA TYR 79 HA TYR 79 16.785 8.273 -6.090 1444 HB2 TYR 79 HB2 TYR 79 14.744 9.581 -7.864 1445 HB3 TYR 79 HB1 TYR 79 14.254 8.431 -6.624 1446 HD1 TYR 79 HD1 TYR 79 15.816 11.718 -7.222 1447 HD2 TYR 79 HD2 TYR 79 14.306 9.012 -4.305 1448 HE1 TYR 79 HE1 TYR 79 15.873 13.504 -5.538 1449 HE2 TYR 79 HE2 TYR 79 14.359 10.797 -2.613 1450 HH TYR 79 HH TYR 79 15.540 12.944 -2.220 1451 H ARG 80 HN ARG 80 16.003 6.253 -5.874 1452 HA ARG 80 HA ARG 80 15.311 4.649 -8.185 1453 HB2 ARG 80 HB2 ARG 80 17.663 4.433 -8.365 1454 HB3 ARG 80 HB1 ARG 80 17.873 4.352 -6.625 1455 HG2 ARG 80 HG2 ARG 80 16.898 2.128 -6.588 1456 HG3 ARG 80 HG1 ARG 80 16.613 2.211 -8.328 1457 HD2 ARG 80 HD2 ARG 80 18.907 2.174 -8.814 1458 HD3 ARG 80 HD1 ARG 80 19.351 2.555 -7.152 1459 HE ARG 80 HE ARG 80 18.522 0.287 -6.573 1460 HH11 ARG 80 HH11 ARG 80 19.431 0.973 -9.892 1461 HH12 ARG 80 HH12 ARG 80 19.895 -0.665 -10.236 1462 HH21 ARG 80 HH21 ARG 80 19.178 -1.854 -7.020 1463 HH22 ARG 80 HH22 ARG 80 19.787 -2.258 -8.597 1464 H ILE 81 HN ILE 81 14.388 2.599 -7.538 1465 HA ILE 81 HA ILE 81 12.879 2.648 -5.192 1466 HB ILE 81 HB ILE 81 13.757 0.186 -6.720 1467 HG12 ILE 81 HG12 ILE 81 12.690 1.801 -8.217 1468 HG13 ILE 81 HG11 ILE 81 11.627 0.426 -7.947 1469 HG21 ILE 81 HG21 ILE 81 11.410 0.641 -4.884 1470 HG22 ILE 81 HG22 ILE 81 12.824 -0.357 -4.549 1471 HG23 ILE 81 HG23 ILE 81 11.704 -0.820 -5.828 1472 HD11 ILE 81 HD11 ILE 81 10.362 1.757 -6.314 1473 HD12 ILE 81 HD12 ILE 81 10.363 2.476 -7.924 1474 HD13 ILE 81 HD13 ILE 81 11.401 3.140 -6.661 1475 H ALA 82 HN ALA 82 13.265 2.030 -3.130 1476 HA ALA 82 HA ALA 82 15.816 2.171 -2.108 1477 HB1 ALA 82 HB1 ALA 82 14.888 1.434 -0.002 1478 HB2 ALA 82 HB2 ALA 82 13.480 0.763 -0.828 1479 HB3 ALA 82 HB3 ALA 82 13.751 2.506 -0.819 1480 H GLY 83 HN GLY 83 13.958 -0.764 -2.795 1481 HA2 GLY 83 HA2 GLY 83 16.421 -2.234 -3.147 1482 HA3 GLY 83 HA1 GLY 83 15.456 -2.750 -1.770 1483 H GLU 84 HN GLU 84 16.032 -4.472 -3.842 1484 HA GLU 84 HA GLU 84 14.110 -4.628 -5.867 1485 HB2 GLU 84 HB2 GLU 84 14.673 -7.028 -5.971 1486 HB3 GLU 84 HB1 GLU 84 16.106 -6.011 -5.886 1487 HG2 GLU 84 HG2 GLU 84 16.337 -6.513 -3.519 1488 HG3 GLU 84 HG1 GLU 84 14.878 -7.502 -3.577 1489 H ASP 85 HN ASP 85 13.989 -5.575 -2.506 1490 HA ASP 85 HA ASP 85 11.680 -7.157 -2.497 1491 HB2 ASP 85 HB2 ASP 85 12.380 -5.227 -0.282 1492 HB3 ASP 85 HB1 ASP 85 11.603 -6.800 -0.148 1493 H VAL 86 HN VAL 86 12.112 -3.671 -2.205 1494 HA VAL 86 HA VAL 86 9.363 -3.050 -1.830 1495 HB VAL 86 HB VAL 86 11.540 -1.240 -2.899 1496 HG11 VAL 86 HG11 VAL 86 9.284 -0.367 -3.211 1497 HG12 VAL 86 HG12 VAL 86 10.170 0.571 -2.009 1498 HG13 VAL 86 HG13 VAL 86 8.950 -0.595 -1.494 1499 HG21 VAL 86 HG21 VAL 86 12.259 -2.208 -0.800 1500 HG22 VAL 86 HG22 VAL 86 10.726 -1.772 -0.045 1501 HG23 VAL 86 HG23 VAL 86 11.840 -0.511 -0.571 1502 H ALA 87 HN ALA 87 11.515 -3.223 -4.609 1503 HA ALA 87 HA ALA 87 9.754 -2.209 -6.550 1504 HB1 ALA 87 HB1 ALA 87 11.193 -3.320 -8.186 1505 HB2 ALA 87 HB2 ALA 87 11.969 -4.229 -6.887 1506 HB3 ALA 87 HB3 ALA 87 12.141 -2.474 -6.963 1507 H ARG 88 HN ARG 88 10.257 -5.480 -5.301 1508 HA ARG 88 HA ARG 88 8.495 -6.768 -7.101 1509 HB2 ARG 88 HB2 ARG 88 9.347 -7.592 -4.319 1510 HB3 ARG 88 HB1 ARG 88 8.499 -8.626 -5.461 1511 HG2 ARG 88 HG2 ARG 88 10.410 -8.402 -7.013 1512 HG3 ARG 88 HG1 ARG 88 11.259 -7.474 -5.774 1513 HD2 ARG 88 HD2 ARG 88 10.370 -10.349 -5.637 1514 HD3 ARG 88 HD1 ARG 88 12.022 -9.733 -5.649 1515 HE ARG 88 HE ARG 88 10.116 -9.394 -3.417 1516 HH11 ARG 88 HH11 ARG 88 13.385 -9.726 -4.646 1517 HH12 ARG 88 HH12 ARG 88 14.115 -9.703 -3.076 1518 HH21 ARG 88 HH21 ARG 88 11.063 -9.346 -1.349 1519 HH22 ARG 88 HH22 ARG 88 12.795 -9.446 -1.191 1520 H LEU 89 HN LEU 89 8.021 -5.084 -4.071 1521 HA LEU 89 HA LEU 89 5.349 -5.914 -3.620 1522 HB2 LEU 89 HB2 LEU 89 6.627 -4.899 -1.838 1523 HB3 LEU 89 HB1 LEU 89 6.814 -3.419 -2.760 1524 HG LEU 89 HG LEU 89 4.366 -3.060 -2.629 1525 HD11 LEU 89 HD11 LEU 89 3.659 -5.368 -2.372 1526 HD12 LEU 89 HD12 LEU 89 3.047 -4.375 -1.048 1527 HD13 LEU 89 HD13 LEU 89 4.427 -5.442 -0.787 1528 HD21 LEU 89 HD21 LEU 89 4.314 -2.429 -0.264 1529 HD22 LEU 89 HD22 LEU 89 5.835 -1.977 -1.031 1530 HD23 LEU 89 HD23 LEU 89 5.765 -3.391 0.021 1531 H PHE 90 HN PHE 90 6.704 -2.988 -5.148 1532 HA PHE 90 HA PHE 90 4.216 -1.890 -5.888 1533 HB2 PHE 90 HB2 PHE 90 6.293 -0.567 -5.861 1534 HB3 PHE 90 HB1 PHE 90 6.914 -1.510 -7.211 1535 HD1 PHE 90 HD1 PHE 90 4.060 0.690 -6.265 1536 HD2 PHE 90 HD2 PHE 90 6.566 -0.778 -9.375 1537 HE1 PHE 90 HE1 PHE 90 3.020 2.262 -7.842 1538 HE2 PHE 90 HE2 PHE 90 5.529 0.792 -10.958 1539 HZ PHE 90 HZ PHE 90 3.754 2.315 -10.192 1540 H ALA 91 HN ALA 91 6.420 -4.097 -7.552 1541 HA ALA 91 HA ALA 91 5.001 -4.271 -9.975 1542 HB1 ALA 91 HB1 ALA 91 6.205 -6.370 -10.324 1543 HB2 ALA 91 HB2 ALA 91 6.699 -6.374 -8.631 1544 HB3 ALA 91 HB3 ALA 91 7.283 -5.113 -9.717 1545 H LEU 92 HN LEU 92 4.779 -6.137 -6.969 1546 HA LEU 92 HA LEU 92 2.886 -8.014 -7.819 1547 HB2 LEU 92 HB2 LEU 92 4.175 -8.220 -5.733 1548 HB3 LEU 92 HB1 LEU 92 3.285 -6.873 -5.052 1549 HG LEU 92 HG LEU 92 1.197 -8.206 -5.222 1550 HD11 LEU 92 HD11 LEU 92 3.056 -10.462 -5.960 1551 HD12 LEU 92 HD12 LEU 92 1.895 -9.693 -7.042 1552 HD13 LEU 92 HD13 LEU 92 1.327 -10.593 -5.635 1553 HD21 LEU 92 HD21 LEU 92 2.401 -8.117 -3.130 1554 HD22 LEU 92 HD22 LEU 92 3.453 -9.434 -3.647 1555 HD23 LEU 92 HD23 LEU 92 1.737 -9.734 -3.368 1556 H VAL 93 HN VAL 93 2.399 -4.933 -6.077 1557 HA VAL 93 HA VAL 93 -0.416 -5.154 -6.030 1558 HB VAL 93 HB VAL 93 0.879 -3.681 -4.505 1559 HG11 VAL 93 HG11 VAL 93 1.557 -1.459 -5.241 1560 HG12 VAL 93 HG12 VAL 93 1.108 -1.866 -6.898 1561 HG13 VAL 93 HG13 VAL 93 2.435 -2.718 -6.109 1562 HG21 VAL 93 HG21 VAL 93 -0.747 -1.837 -4.493 1563 HG22 VAL 93 HG22 VAL 93 -1.513 -3.411 -4.701 1564 HG23 VAL 93 HG23 VAL 93 -1.306 -2.341 -6.087 1565 H GLN 94 HN GLN 94 1.810 -3.853 -8.411 1566 HA GLN 94 HA GLN 94 -0.131 -2.549 -10.013 1567 HB2 GLN 94 HB2 GLN 94 2.338 -2.178 -10.167 1568 HB3 GLN 94 HB1 GLN 94 2.494 -3.768 -10.896 1569 HG2 GLN 94 HG2 GLN 94 1.140 -3.060 -12.785 1570 HG3 GLN 94 HG1 GLN 94 0.909 -1.479 -12.044 1571 HE21 GLN 94 HE21 GLN 94 2.629 -0.033 -11.977 1572 HE22 GLN 94 HE22 GLN 94 4.018 -0.199 -12.997 1573 H VAL 95 HN VAL 95 1.247 -5.813 -10.036 1574 HA VAL 95 HA VAL 95 -0.211 -6.769 -12.261 1575 HB VAL 95 HB VAL 95 0.976 -8.268 -9.916 1576 HG11 VAL 95 HG11 VAL 95 -0.775 -9.619 -10.891 1577 HG12 VAL 95 HG12 VAL 95 0.799 -10.278 -11.337 1578 HG13 VAL 95 HG13 VAL 95 -0.130 -9.343 -12.509 1579 HG21 VAL 95 HG21 VAL 95 1.977 -7.833 -12.733 1580 HG22 VAL 95 HG22 VAL 95 2.754 -8.845 -11.515 1581 HG23 VAL 95 HG23 VAL 95 2.630 -7.102 -11.265 1582 H VAL 96 HN VAL 96 -0.845 -6.877 -8.764 1583 HA VAL 96 HA VAL 96 -3.255 -8.306 -8.870 1584 HB VAL 96 HB VAL 96 -2.383 -6.214 -6.867 1585 HG11 VAL 96 HG11 VAL 96 -4.799 -6.515 -6.778 1586 HG12 VAL 96 HG12 VAL 96 -4.032 -7.231 -5.360 1587 HG13 VAL 96 HG13 VAL 96 -4.589 -8.264 -6.676 1588 HG21 VAL 96 HG21 VAL 96 -2.262 -9.223 -6.755 1589 HG22 VAL 96 HG22 VAL 96 -1.732 -8.111 -5.494 1590 HG23 VAL 96 HG23 VAL 96 -0.892 -8.154 -7.044 1591 H ALA 97 HN ALA 97 -2.645 -4.806 -8.982 1592 HA ALA 97 HA ALA 97 -5.309 -3.964 -9.157 1593 HB1 ALA 97 HB1 ALA 97 -4.426 -1.895 -10.093 1594 HB2 ALA 97 HB2 ALA 97 -2.874 -2.679 -10.389 1595 HB3 ALA 97 HB3 ALA 97 -3.440 -2.439 -8.735 1596 H ASP 98 HN ASP 98 -2.958 -4.531 -11.771 1597 HA ASP 98 HA ASP 98 -4.652 -4.075 -13.931 1598 HB2 ASP 98 HB2 ASP 98 -2.300 -4.242 -14.304 1599 HB3 ASP 98 HB1 ASP 98 -2.248 -5.872 -13.642 1600 H GLU 99 HN GLU 99 -4.180 -6.995 -12.030 1601 HA GLU 99 HA GLU 99 -5.568 -8.799 -13.693 1602 HB2 GLU 99 HB2 GLU 99 -4.205 -8.876 -11.242 1603 HB3 GLU 99 HB1 GLU 99 -5.832 -9.433 -10.882 1604 HG2 GLU 99 HG2 GLU 99 -4.165 -10.562 -13.108 1605 HG3 GLU 99 HG1 GLU 99 -4.150 -11.203 -11.468 1606 H HIS 100 HN HIS 100 -6.666 -6.389 -11.455 1607 HA HIS 100 HA HIS 100 -9.383 -7.495 -11.534 1608 HB2 HIS 100 HB2 HIS 100 -8.090 -5.475 -9.706 1609 HB3 HIS 100 HB1 HIS 100 -9.831 -5.739 -9.741 1610 HD1 HIS 100 HD1 HIS 100 -10.648 -7.426 -8.103 1611 HD2 HIS 100 HD2 HIS 100 -6.663 -8.049 -9.139 1612 HE1 HIS 100 HE1 HIS 100 -9.868 -9.357 -6.696 1613 HE2 HIS 100 HE2 HIS 100 -7.549 -9.868 -7.529 1614 H LEU 101 HN LEU 101 -7.455 -5.154 -12.994 1615 HA LEU 101 HA LEU 101 -9.598 -3.341 -13.652 1616 HB2 LEU 101 HB2 LEU 101 -6.721 -3.536 -14.236 1617 HB3 LEU 101 HB1 LEU 101 -7.679 -2.888 -15.552 1618 HG LEU 101 HG LEU 101 -6.784 -1.086 -14.211 1619 HD11 LEU 101 HD11 LEU 101 -9.750 -1.422 -13.791 1620 HD12 LEU 101 HD12 LEU 101 -8.966 -0.742 -15.218 1621 HD13 LEU 101 HD13 LEU 101 -8.857 0.094 -13.668 1622 HD21 LEU 101 HD21 LEU 101 -7.413 -0.774 -11.877 1623 HD22 LEU 101 HD22 LEU 101 -6.523 -2.281 -12.101 1624 HD23 LEU 101 HD23 LEU 101 -8.274 -2.314 -11.897 1625 H GLU 102 HN GLU 102 -11.190 -4.571 -14.530 1626 HA GLU 102 HA GLU 102 -12.383 -5.746 -16.032 1627 HB2 GLU 102 HB2 GLU 102 -10.332 -4.608 -17.931 1628 HB3 GLU 102 HB1 GLU 102 -11.784 -5.461 -18.442 1629 HG2 GLU 102 HG2 GLU 102 -13.096 -3.748 -17.134 1630 HG3 GLU 102 HG1 GLU 102 -11.592 -2.840 -16.992 1631 H HIS 103 HN HIS 103 -12.203 -7.801 -15.407 1632 HA HIS 103 HA HIS 103 -9.823 -9.360 -15.871 1633 HB2 HIS 103 HB2 HIS 103 -11.397 -9.585 -13.887 1634 HB3 HIS 103 HB1 HIS 103 -12.536 -10.355 -14.983 1635 HD1 HIS 103 HD1 HIS 103 -12.343 -12.817 -15.189 1636 HD2 HIS 103 HD2 HIS 103 -8.863 -11.084 -13.709 1637 HE1 HIS 103 HE1 HIS 103 -10.827 -14.737 -14.588 1638 HE2 HIS 103 HE2 HIS 103 -8.652 -13.651 -13.915 1639 H HIS 104 HN HIS 104 -12.459 -8.466 -17.707 1640 HA HIS 104 HA HIS 104 -13.130 -8.937 -19.817 1641 HB2 HIS 104 HB2 HIS 104 -10.779 -10.831 -20.007 1642 HB3 HIS 104 HB1 HIS 104 -11.663 -10.093 -21.340 1643 HD1 HIS 104 HD1 HIS 104 -11.561 -7.203 -20.966 1644 HD2 HIS 104 HD2 HIS 104 -8.413 -9.617 -19.705 1645 HE1 HIS 104 HE1 HIS 104 -9.559 -5.690 -20.815 1646 HE2 HIS 104 HE2 HIS 104 -7.727 -7.132 -19.853 1647 H HIS 105 HN HIS 105 -13.321 -11.173 -21.327 1648 HA HIS 105 HA HIS 105 -14.519 -13.170 -19.535 1649 HB2 HIS 105 HB2 HIS 105 -15.687 -11.960 -22.029 1650 HB3 HIS 105 HB1 HIS 105 -16.196 -13.545 -21.459 1651 HD1 HIS 105 HD1 HIS 105 -17.964 -10.851 -21.566 1652 HD2 HIS 105 HD2 HIS 105 -16.231 -12.606 -18.216 1653 HE1 HIS 105 HE1 HIS 105 -19.297 -10.025 -19.597 1654 HE2 HIS 105 HE2 HIS 105 -18.331 -11.230 -17.602 1655 H HIS 106 HN HIS 106 -13.505 -15.009 -19.688 1656 HA HIS 106 HA HIS 106 -12.144 -15.730 -22.184 1657 HB2 HIS 106 HB2 HIS 106 -10.828 -15.863 -20.094 1658 HB3 HIS 106 HB1 HIS 106 -11.995 -17.000 -19.429 1659 HD1 HIS 106 HD1 HIS 106 -9.171 -16.734 -21.857 1660 HD2 HIS 106 HD2 HIS 106 -11.788 -19.627 -20.416 1661 HE1 HIS 106 HE1 HIS 106 -8.250 -18.938 -22.646 1662 HE2 HIS 106 HE2 HIS 106 -10.028 -20.617 -22.029 1663 H HIS 107 HN HIS 107 -13.441 -16.761 -23.575 1664 HA HIS 107 HA HIS 107 -15.300 -18.752 -22.456 1665 HB2 HIS 107 HB2 HIS 107 -16.788 -18.277 -24.415 1666 HB3 HIS 107 HB1 HIS 107 -16.642 -16.962 -23.259 1667 HD1 HIS 107 HD1 HIS 107 -15.983 -17.864 -26.803 1668 HD2 HIS 107 HD2 HIS 107 -15.292 -14.675 -24.222 1669 HE1 HIS 107 HE1 HIS 107 -15.315 -15.930 -28.271 1670 HE2 HIS 107 HE2 HIS 107 -15.161 -13.961 -26.705 1671 H HIS 108 HN HIS 108 -12.490 -18.861 -23.699 1672 HA HIS 108 HA HIS 108 -13.132 -20.990 -25.613 1673 HB2 HIS 108 HB2 HIS 108 -11.516 -19.417 -26.511 1674 HB3 HIS 108 HB1 HIS 108 -10.496 -19.595 -25.085 1675 HD1 HIS 108 HD1 HIS 108 -8.510 -20.960 -25.623 1676 HD2 HIS 108 HD2 HIS 108 -11.888 -22.286 -27.658 1677 HE1 HIS 108 HE1 HIS 108 -7.772 -22.987 -26.921 1678 HE2 HIS 108 HE2 HIS 108 -9.889 -23.902 -27.938 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 -5.229 14.792 -17.256 2 H2 MET 1 HT2 MET 1 -5.543 16.033 -18.369 3 H3 MET 1 HT3 MET 1 -4.420 14.822 -18.746 4 HA MET 1 HA MET 1 -7.337 14.488 -18.400 5 HB2 MET 1 HB2 MET 1 -5.550 14.221 -20.829 6 HB3 MET 1 HB1 MET 1 -7.260 13.815 -20.792 7 HG2 MET 1 HG2 MET 1 -7.760 16.168 -20.217 8 HG3 MET 1 HG1 MET 1 -6.047 16.540 -20.390 9 HE1 MET 1 HE1 MET 1 -9.336 15.445 -22.184 10 HE2 MET 1 HE2 MET 1 -8.274 14.084 -22.549 11 HE3 MET 1 HE3 MET 1 -8.793 15.173 -23.839 12 H ALA 2 HN ALA 2 -8.006 12.273 -19.225 13 HA ALA 2 HA ALA 2 -6.533 10.330 -17.685 14 HB1 ALA 2 HB1 ALA 2 -9.019 9.996 -19.361 15 HB2 ALA 2 HB2 ALA 2 -8.975 10.371 -17.639 16 HB3 ALA 2 HB3 ALA 2 -8.373 8.819 -18.219 17 H GLY 3 HN GLY 3 -7.239 10.886 -21.108 18 HA2 GLY 3 HA2 GLY 3 -5.848 10.308 -22.903 19 HA3 GLY 3 HA1 GLY 3 -4.894 9.310 -21.816 20 H GLN 4 HN GLN 4 -6.641 7.599 -20.763 21 HA GLN 4 HA GLN 4 -7.996 5.801 -21.022 22 HB2 GLN 4 HB2 GLN 4 -8.680 6.975 -23.719 23 HB3 GLN 4 HB1 GLN 4 -9.467 5.580 -22.996 24 HG2 GLN 4 HG2 GLN 4 -10.223 6.980 -21.134 25 HG3 GLN 4 HG1 GLN 4 -9.457 8.378 -21.889 26 HE21 GLN 4 HE21 GLN 4 -10.346 9.235 -23.774 27 HE22 GLN 4 HE22 GLN 4 -11.965 8.886 -24.260 28 H SER 5 HN SER 5 -5.900 6.585 -23.738 29 HA SER 5 HA SER 5 -5.652 3.941 -24.719 30 HB2 SER 5 HB2 SER 5 -3.534 4.861 -25.776 31 HB3 SER 5 HB1 SER 5 -5.015 5.741 -26.154 32 HG SER 5 HG SER 5 -2.935 6.463 -24.366 33 H ASP 6 HN ASP 6 -4.193 5.676 -22.104 34 HA ASP 6 HA ASP 6 -2.095 3.710 -21.731 35 HB2 ASP 6 HB2 ASP 6 -2.758 6.342 -20.483 36 HB3 ASP 6 HB1 ASP 6 -1.764 5.204 -19.580 37 H ARG 7 HN ARG 7 -2.761 1.840 -20.963 38 HA ARG 7 HA ARG 7 -4.813 1.614 -18.973 39 HB2 ARG 7 HB2 ARG 7 -2.850 -0.396 -20.092 40 HB3 ARG 7 HB1 ARG 7 -4.072 -0.794 -18.891 41 HG2 ARG 7 HG2 ARG 7 -4.640 0.323 -21.628 42 HG3 ARG 7 HG1 ARG 7 -4.769 -1.378 -21.169 43 HD2 ARG 7 HD2 ARG 7 -6.642 -1.036 -19.896 44 HD3 ARG 7 HD1 ARG 7 -6.230 0.640 -19.543 45 HE ARG 7 HE ARG 7 -6.756 0.540 -22.254 46 HH11 ARG 7 HH11 ARG 7 -8.491 -0.207 -19.314 47 HH12 ARG 7 HH12 ARG 7 -10.038 0.284 -19.928 48 HH21 ARG 7 HH21 ARG 7 -8.795 1.194 -23.088 49 HH22 ARG 7 HH22 ARG 7 -10.207 1.103 -22.071 50 H LYS 8 HN LYS 8 -1.420 2.119 -19.032 51 HA LYS 8 HA LYS 8 -0.636 1.355 -16.477 52 HB2 LYS 8 HB2 LYS 8 0.155 3.783 -18.099 53 HB3 LYS 8 HB1 LYS 8 0.964 3.297 -16.616 54 HG2 LYS 8 HG2 LYS 8 1.731 1.268 -17.619 55 HG3 LYS 8 HG1 LYS 8 0.751 1.554 -19.061 56 HD2 LYS 8 HD2 LYS 8 3.076 2.130 -19.488 57 HD3 LYS 8 HD1 LYS 8 2.066 3.573 -19.539 58 HE2 LYS 8 HE2 LYS 8 4.038 4.140 -18.336 59 HE3 LYS 8 HE1 LYS 8 2.732 4.007 -17.160 60 HZ1 LYS 8 HZ1 LYS 8 4.792 2.942 -16.411 61 HZ2 LYS 8 HZ2 LYS 8 4.730 1.882 -17.729 62 HZ3 LYS 8 HZ3 LYS 8 3.523 1.826 -16.542 63 H ALA 9 HN ALA 9 -2.229 4.335 -17.551 64 HA ALA 9 HA ALA 9 -2.250 5.713 -15.129 65 HB1 ALA 9 HB1 ALA 9 -2.836 6.735 -17.278 66 HB2 ALA 9 HB2 ALA 9 -4.091 7.009 -16.069 67 HB3 ALA 9 HB3 ALA 9 -4.322 5.789 -17.320 68 H ALA 10 HN ALA 10 -4.655 3.483 -16.493 69 HA ALA 10 HA ALA 10 -6.402 3.639 -14.244 70 HB1 ALA 10 HB1 ALA 10 -6.262 1.543 -16.410 71 HB2 ALA 10 HB2 ALA 10 -7.208 3.031 -16.474 72 HB3 ALA 10 HB3 ALA 10 -7.595 1.788 -15.282 73 H LEU 11 HN LEU 11 -3.587 1.807 -15.007 74 HA LEU 11 HA LEU 11 -4.083 -0.367 -13.202 75 HB2 LEU 11 HB2 LEU 11 -2.653 -0.610 -15.185 76 HB3 LEU 11 HB1 LEU 11 -1.533 0.567 -14.528 77 HG LEU 11 HG LEU 11 -1.025 -0.964 -12.665 78 HD11 LEU 11 HD11 LEU 11 -3.164 -2.143 -12.593 79 HD12 LEU 11 HD12 LEU 11 -1.812 -3.264 -12.739 80 HD13 LEU 11 HD13 LEU 11 -2.803 -2.894 -14.148 81 HD21 LEU 11 HD21 LEU 11 -0.716 -2.218 -15.391 82 HD22 LEU 11 HD22 LEU 11 0.249 -2.583 -13.959 83 HD23 LEU 11 HD23 LEU 11 0.339 -0.985 -14.699 84 H LEU 12 HN LEU 12 -1.914 2.449 -13.186 85 HA LEU 12 HA LEU 12 -0.936 2.013 -10.570 86 HB2 LEU 12 HB2 LEU 12 -1.095 4.566 -12.177 87 HB3 LEU 12 HB1 LEU 12 -0.178 4.373 -10.694 88 HG LEU 12 HG LEU 12 0.327 2.874 -13.268 89 HD11 LEU 12 HD11 LEU 12 1.831 5.137 -11.966 90 HD12 LEU 12 HD12 LEU 12 0.931 5.207 -13.482 91 HD13 LEU 12 HD13 LEU 12 2.384 4.213 -13.362 92 HD21 LEU 12 HD21 LEU 12 0.901 1.580 -11.261 93 HD22 LEU 12 HD22 LEU 12 1.904 2.916 -10.697 94 HD23 LEU 12 HD23 LEU 12 2.333 2.053 -12.172 95 H ASP 13 HN ASP 13 -3.688 3.797 -11.835 96 HA ASP 13 HA ASP 13 -4.477 5.030 -9.425 97 HB2 ASP 13 HB2 ASP 13 -5.456 5.753 -11.514 98 HB3 ASP 13 HB1 ASP 13 -6.109 4.146 -11.816 99 H GLN 14 HN GLN 14 -5.069 1.832 -10.774 100 HA GLN 14 HA GLN 14 -6.932 0.996 -8.795 101 HB2 GLN 14 HB2 GLN 14 -6.651 -0.092 -11.025 102 HB3 GLN 14 HB1 GLN 14 -5.098 -0.713 -10.488 103 HG2 GLN 14 HG2 GLN 14 -6.756 -2.437 -10.299 104 HG3 GLN 14 HG1 GLN 14 -6.238 -1.942 -8.688 105 HE21 GLN 14 HE21 GLN 14 -8.832 -1.920 -10.996 106 HE22 GLN 14 HE22 GLN 14 -10.069 -1.419 -9.899 107 H VAL 15 HN VAL 15 -3.423 0.659 -9.159 108 HA VAL 15 HA VAL 15 -2.958 -0.818 -6.811 109 HB VAL 15 HB VAL 15 -1.118 1.193 -8.137 110 HG11 VAL 15 HG11 VAL 15 -0.427 0.669 -5.858 111 HG12 VAL 15 HG12 VAL 15 0.688 -0.030 -7.031 112 HG13 VAL 15 HG13 VAL 15 -0.497 -1.055 -6.221 113 HG21 VAL 15 HG21 VAL 15 -0.130 -0.732 -9.263 114 HG22 VAL 15 HG22 VAL 15 -1.841 -0.576 -9.666 115 HG23 VAL 15 HG23 VAL 15 -1.315 -1.794 -8.502 116 H ALA 16 HN ALA 16 -3.095 2.667 -7.416 117 HA ALA 16 HA ALA 16 -2.492 3.475 -4.769 118 HB1 ALA 16 HB1 ALA 16 -3.317 5.662 -5.444 119 HB2 ALA 16 HB2 ALA 16 -4.053 4.956 -6.884 120 HB3 ALA 16 HB3 ALA 16 -2.298 4.970 -6.705 121 H ARG 17 HN ARG 17 -5.417 2.428 -6.330 122 HA ARG 17 HA ARG 17 -7.293 3.363 -4.429 123 HB2 ARG 17 HB2 ARG 17 -7.780 2.447 -6.740 124 HB3 ARG 17 HB1 ARG 17 -7.491 0.843 -6.089 125 HG2 ARG 17 HG2 ARG 17 -9.859 1.292 -6.204 126 HG3 ARG 17 HG1 ARG 17 -9.348 1.151 -4.519 127 HD2 ARG 17 HD2 ARG 17 -9.645 3.389 -4.098 128 HD3 ARG 17 HD1 ARG 17 -9.400 3.847 -5.784 129 HE ARG 17 HE ARG 17 -11.662 2.753 -6.144 130 HH11 ARG 17 HH11 ARG 17 -10.763 4.183 -3.084 131 HH12 ARG 17 HH12 ARG 17 -12.379 4.704 -2.707 132 HH21 ARG 17 HH21 ARG 17 -13.785 3.439 -5.667 133 HH22 ARG 17 HH22 ARG 17 -14.098 4.285 -4.173 134 H VAL 18 HN VAL 18 -5.743 0.195 -4.852 135 HA VAL 18 HA VAL 18 -6.541 -0.952 -2.414 136 HB VAL 18 HB VAL 18 -3.965 -1.473 -3.923 137 HG11 VAL 18 HG11 VAL 18 -4.062 -3.693 -2.887 138 HG12 VAL 18 HG12 VAL 18 -5.501 -3.209 -1.989 139 HG13 VAL 18 HG13 VAL 18 -3.957 -2.415 -1.675 140 HG21 VAL 18 HG21 VAL 18 -5.205 -3.309 -5.013 141 HG22 VAL 18 HG22 VAL 18 -5.851 -1.720 -5.421 142 HG23 VAL 18 HG23 VAL 18 -6.687 -2.737 -4.247 143 H GLY 19 HN GLY 19 -3.742 0.990 -3.325 144 HA2 GLY 19 HA2 GLY 19 -2.318 0.924 -0.929 145 HA3 GLY 19 HA1 GLY 19 -2.267 2.233 -2.099 146 H LYS 20 HN LYS 20 -4.965 3.076 -1.907 147 HA LYS 20 HA LYS 20 -4.859 4.727 0.381 148 HB2 LYS 20 HB2 LYS 20 -7.111 4.074 -1.516 149 HB3 LYS 20 HB1 LYS 20 -7.288 5.213 -0.188 150 HG2 LYS 20 HG2 LYS 20 -5.541 6.615 -1.133 151 HG3 LYS 20 HG1 LYS 20 -5.305 5.456 -2.442 152 HD2 LYS 20 HD2 LYS 20 -7.564 5.846 -3.235 153 HD3 LYS 20 HD1 LYS 20 -7.875 6.935 -1.881 154 HE2 LYS 20 HE2 LYS 20 -7.383 8.170 -3.938 155 HE3 LYS 20 HE1 LYS 20 -6.167 8.464 -2.696 156 HZ1 LYS 20 HZ1 LYS 20 -5.144 8.121 -4.846 157 HZ2 LYS 20 HZ2 LYS 20 -5.889 6.604 -5.001 158 HZ3 LYS 20 HZ3 LYS 20 -4.721 6.859 -3.796 159 H ALA 21 HN ALA 21 -6.414 1.645 -0.267 160 HA ALA 21 HA ALA 21 -7.840 1.575 2.214 161 HB1 ALA 21 HB1 ALA 21 -8.306 -0.732 1.677 162 HB2 ALA 21 HB2 ALA 21 -7.082 -0.712 0.408 163 HB3 ALA 21 HB3 ALA 21 -8.532 0.277 0.249 164 H LEU 22 HN LEU 22 -4.596 0.932 1.272 165 HA LEU 22 HA LEU 22 -3.980 -0.545 3.697 166 HB2 LEU 22 HB2 LEU 22 -2.187 0.512 1.510 167 HB3 LEU 22 HB1 LEU 22 -1.656 -0.484 2.851 168 HG LEU 22 HG LEU 22 -3.620 -1.346 0.728 169 HD11 LEU 22 HD11 LEU 22 -1.814 -2.771 -0.078 170 HD12 LEU 22 HD12 LEU 22 -0.725 -2.082 1.128 171 HD13 LEU 22 HD13 LEU 22 -1.367 -1.067 -0.164 172 HD21 LEU 22 HD21 LEU 22 -3.349 -3.568 1.691 173 HD22 LEU 22 HD22 LEU 22 -3.991 -2.441 2.885 174 HD23 LEU 22 HD23 LEU 22 -2.292 -2.911 2.939 175 H ALA 23 HN ALA 23 -3.760 2.686 2.419 176 HA ALA 23 HA ALA 23 -2.026 3.710 4.448 177 HB1 ALA 23 HB1 ALA 23 -2.171 4.751 2.240 178 HB2 ALA 23 HB2 ALA 23 -2.556 5.902 3.519 179 HB3 ALA 23 HB3 ALA 23 -3.848 5.191 2.552 180 H ASN 24 HN ASN 24 -3.253 2.727 6.214 181 HA ASN 24 HA ASN 24 -5.155 4.672 7.297 182 HB2 ASN 24 HB2 ASN 24 -5.580 1.680 7.158 183 HB3 ASN 24 HB1 ASN 24 -6.456 2.716 8.279 184 HD21 ASN 24 HD21 ASN 24 -6.058 1.764 4.975 185 HD22 ASN 24 HD22 ASN 24 -7.450 2.585 4.362 186 H GLY 25 HN GLY 25 -5.631 3.364 9.716 187 HA2 GLY 25 HA2 GLY 25 -2.897 3.170 10.808 188 HA3 GLY 25 HA1 GLY 25 -4.255 3.852 11.691 189 H ARG 26 HN ARG 26 -5.137 2.571 13.159 190 HA ARG 26 HA ARG 26 -4.299 -0.130 13.405 191 HB2 ARG 26 HB2 ARG 26 -6.023 -0.198 15.281 192 HB3 ARG 26 HB1 ARG 26 -4.686 0.928 15.439 193 HG2 ARG 26 HG2 ARG 26 -6.185 2.735 14.634 194 HG3 ARG 26 HG1 ARG 26 -7.520 1.576 14.661 195 HD2 ARG 26 HD2 ARG 26 -7.313 1.274 17.016 196 HD3 ARG 26 HD1 ARG 26 -5.790 2.160 17.057 197 HE ARG 26 HE ARG 26 -8.250 3.558 16.258 198 HH11 ARG 26 HH11 ARG 26 -5.649 3.069 18.552 199 HH12 ARG 26 HH12 ARG 26 -5.958 4.539 19.422 200 HH21 ARG 26 HH21 ARG 26 -8.665 5.495 17.392 201 HH22 ARG 26 HH22 ARG 26 -7.676 5.925 18.760 202 H ARG 27 HN ARG 27 -6.620 1.186 11.435 203 HA ARG 27 HA ARG 27 -8.585 -0.771 11.230 204 HB2 ARG 27 HB2 ARG 27 -7.251 1.052 9.277 205 HB3 ARG 27 HB1 ARG 27 -8.245 -0.246 8.644 206 HG2 ARG 27 HG2 ARG 27 -10.163 0.607 9.893 207 HG3 ARG 27 HG1 ARG 27 -9.162 1.917 10.526 208 HD2 ARG 27 HD2 ARG 27 -8.874 2.865 8.381 209 HD3 ARG 27 HD1 ARG 27 -9.495 1.427 7.582 210 HE ARG 27 HE ARG 27 -11.519 2.496 9.211 211 HH11 ARG 27 HH11 ARG 27 -9.703 3.332 6.336 212 HH12 ARG 27 HH12 ARG 27 -11.027 4.160 5.572 213 HH21 ARG 27 HH21 ARG 27 -13.274 3.615 8.220 214 HH22 ARG 27 HH22 ARG 27 -13.046 4.344 6.655 215 H LEU 28 HN LEU 28 -5.224 -0.816 10.275 216 HA LEU 28 HA LEU 28 -5.387 -3.026 8.496 217 HB2 LEU 28 HB2 LEU 28 -2.983 -1.934 9.956 218 HB3 LEU 28 HB1 LEU 28 -2.953 -2.977 8.545 219 HG LEU 28 HG LEU 28 -4.063 -0.166 8.596 220 HD11 LEU 28 HD11 LEU 28 -1.658 -0.150 8.871 221 HD12 LEU 28 HD12 LEU 28 -2.088 0.396 7.251 222 HD13 LEU 28 HD13 LEU 28 -1.472 -1.237 7.495 223 HD21 LEU 28 HD21 LEU 28 -4.127 -0.396 6.161 224 HD22 LEU 28 HD22 LEU 28 -5.165 -1.585 6.950 225 HD23 LEU 28 HD23 LEU 28 -3.599 -2.073 6.305 226 H GLN 29 HN GLN 29 -5.343 -2.791 11.893 227 HA GLN 29 HA GLN 29 -4.130 -5.237 12.595 228 HB2 GLN 29 HB2 GLN 29 -4.678 -3.424 14.201 229 HB3 GLN 29 HB1 GLN 29 -6.387 -3.776 13.993 230 HG2 GLN 29 HG2 GLN 29 -6.025 -6.023 14.912 231 HG3 GLN 29 HG1 GLN 29 -4.319 -5.642 15.147 232 HE21 GLN 29 HE21 GLN 29 -4.919 -2.873 15.932 233 HE22 GLN 29 HE22 GLN 29 -5.526 -2.967 17.546 234 H ILE 30 HN ILE 30 -7.297 -4.377 11.429 235 HA ILE 30 HA ILE 30 -8.592 -6.843 11.978 236 HB ILE 30 HB ILE 30 -9.277 -4.802 9.855 237 HG12 ILE 30 HG12 ILE 30 -10.300 -5.028 12.698 238 HG13 ILE 30 HG11 ILE 30 -9.142 -3.826 12.135 239 HG21 ILE 30 HG21 ILE 30 -10.371 -6.950 9.519 240 HG22 ILE 30 HG22 ILE 30 -11.537 -5.725 10.021 241 HG23 ILE 30 HG23 ILE 30 -10.964 -6.922 11.181 242 HD11 ILE 30 HD11 ILE 30 -10.818 -2.893 10.641 243 HD12 ILE 30 HD12 ILE 30 -11.397 -2.909 12.308 244 HD13 ILE 30 HD13 ILE 30 -11.976 -4.118 11.159 245 H LEU 31 HN LEU 31 -6.813 -5.557 9.214 246 HA LEU 31 HA LEU 31 -7.446 -7.546 7.350 247 HB2 LEU 31 HB2 LEU 31 -5.036 -5.764 7.634 248 HB3 LEU 31 HB1 LEU 31 -5.228 -6.878 6.293 249 HG LEU 31 HG LEU 31 -7.100 -4.602 6.959 250 HD11 LEU 31 HD11 LEU 31 -4.954 -3.822 6.114 251 HD12 LEU 31 HD12 LEU 31 -6.222 -3.595 4.909 252 HD13 LEU 31 HD13 LEU 31 -5.079 -4.930 4.746 253 HD21 LEU 31 HD21 LEU 31 -7.057 -6.506 4.619 254 HD22 LEU 31 HD22 LEU 31 -8.145 -5.131 4.819 255 HD23 LEU 31 HD23 LEU 31 -8.243 -6.502 5.925 256 H ASP 32 HN ASP 32 -4.705 -7.304 9.596 257 HA ASP 32 HA ASP 32 -3.516 -9.755 8.852 258 HB2 ASP 32 HB2 ASP 32 -2.298 -8.045 10.123 259 HB3 ASP 32 HB1 ASP 32 -3.362 -8.306 11.503 260 H LEU 33 HN LEU 33 -6.026 -8.928 11.160 261 HA LEU 33 HA LEU 33 -6.201 -11.441 12.438 262 HB2 LEU 33 HB2 LEU 33 -7.208 -9.395 13.343 263 HB3 LEU 33 HB1 LEU 33 -8.330 -9.344 11.998 264 HG LEU 33 HG LEU 33 -9.305 -11.496 12.776 265 HD11 LEU 33 HD11 LEU 33 -7.516 -11.064 15.164 266 HD12 LEU 33 HD12 LEU 33 -7.362 -12.358 13.974 267 HD13 LEU 33 HD13 LEU 33 -8.779 -12.287 15.024 268 HD21 LEU 33 HD21 LEU 33 -9.290 -9.267 14.807 269 HD22 LEU 33 HD22 LEU 33 -10.494 -10.547 14.686 270 HD23 LEU 33 HD23 LEU 33 -10.330 -9.368 13.386 271 H LEU 34 HN LEU 34 -7.697 -10.122 9.529 272 HA LEU 34 HA LEU 34 -9.413 -12.391 9.136 273 HB2 LEU 34 HB2 LEU 34 -8.683 -10.110 7.304 274 HB3 LEU 34 HB1 LEU 34 -9.904 -11.317 6.947 275 HG LEU 34 HG LEU 34 -9.989 -9.334 9.223 276 HD11 LEU 34 HD11 LEU 34 -11.864 -8.362 7.989 277 HD12 LEU 34 HD12 LEU 34 -11.581 -9.495 6.668 278 HD13 LEU 34 HD13 LEU 34 -10.363 -8.284 7.068 279 HD21 LEU 34 HD21 LEU 34 -11.044 -11.434 9.834 280 HD22 LEU 34 HD22 LEU 34 -11.993 -11.406 8.349 281 HD23 LEU 34 HD23 LEU 34 -12.258 -10.178 9.586 282 H ALA 35 HN ALA 35 -6.144 -11.728 8.466 283 HA ALA 35 HA ALA 35 -5.798 -13.321 6.147 284 HB1 ALA 35 HB1 ALA 35 -3.811 -12.659 8.315 285 HB2 ALA 35 HB2 ALA 35 -4.121 -11.703 6.865 286 HB3 ALA 35 HB3 ALA 35 -3.424 -13.317 6.727 287 H GLN 36 HN GLN 36 -6.095 -14.074 9.533 288 HA GLN 36 HA GLN 36 -5.134 -16.769 9.306 289 HB2 GLN 36 HB2 GLN 36 -6.569 -15.233 11.449 290 HB3 GLN 36 HB1 GLN 36 -6.409 -16.978 11.571 291 HG2 GLN 36 HG2 GLN 36 -4.656 -15.996 12.830 292 HG3 GLN 36 HG1 GLN 36 -3.942 -16.695 11.380 293 HE21 GLN 36 HE21 GLN 36 -4.726 -13.774 13.073 294 HE22 GLN 36 HE22 GLN 36 -3.790 -12.704 12.080 295 H GLY 37 HN GLY 37 -8.139 -15.154 8.785 296 HA2 GLY 37 HA2 GLY 37 -9.422 -17.051 7.345 297 HA3 GLY 37 HA1 GLY 37 -9.766 -17.531 9.003 298 H GLU 38 HN GLU 38 -11.965 -17.028 7.775 299 HA GLU 38 HA GLU 38 -12.666 -14.259 7.627 300 HB2 GLU 38 HB2 GLU 38 -14.974 -15.106 7.277 301 HB3 GLU 38 HB1 GLU 38 -13.797 -15.802 6.172 302 HG2 GLU 38 HG2 GLU 38 -13.700 -17.812 7.626 303 HG3 GLU 38 HG1 GLU 38 -14.998 -17.118 8.599 304 H ARG 39 HN ARG 39 -13.957 -13.066 8.993 305 HA ARG 39 HA ARG 39 -14.667 -14.239 11.587 306 HB2 ARG 39 HB2 ARG 39 -12.351 -13.105 11.611 307 HB3 ARG 39 HB1 ARG 39 -13.226 -11.595 11.418 308 HG2 ARG 39 HG2 ARG 39 -12.867 -11.744 13.703 309 HG3 ARG 39 HG1 ARG 39 -14.528 -12.304 13.507 310 HD2 ARG 39 HD2 ARG 39 -13.235 -13.716 15.055 311 HD3 ARG 39 HD1 ARG 39 -13.806 -14.610 13.645 312 HE ARG 39 HE ARG 39 -11.494 -14.288 12.736 313 HH11 ARG 39 HH11 ARG 39 -12.043 -14.211 16.214 314 HH12 ARG 39 HH12 ARG 39 -10.422 -14.719 16.592 315 HH21 ARG 39 HH21 ARG 39 -9.409 -14.973 13.238 316 HH22 ARG 39 HH22 ARG 39 -8.921 -15.166 14.901 317 H ALA 40 HN ALA 40 -16.447 -13.228 12.553 318 HA ALA 40 HA ALA 40 -18.081 -11.642 10.782 319 HB1 ALA 40 HB1 ALA 40 -19.797 -11.843 12.508 320 HB2 ALA 40 HB2 ALA 40 -18.616 -12.552 13.612 321 HB3 ALA 40 HB3 ALA 40 -19.081 -13.417 12.147 322 H VAL 41 HN VAL 41 -18.893 -9.571 11.227 323 HA VAL 41 HA VAL 41 -17.081 -7.666 12.094 324 HB VAL 41 HB VAL 41 -20.094 -7.409 12.028 325 HG11 VAL 41 HG11 VAL 41 -19.073 -5.610 13.310 326 HG12 VAL 41 HG12 VAL 41 -19.690 -5.007 11.773 327 HG13 VAL 41 HG13 VAL 41 -17.959 -5.278 11.984 328 HG21 VAL 41 HG21 VAL 41 -18.030 -6.793 9.919 329 HG22 VAL 41 HG22 VAL 41 -19.759 -6.468 9.795 330 HG23 VAL 41 HG23 VAL 41 -19.178 -8.130 9.889 331 H GLU 42 HN GLU 42 -19.738 -9.156 13.887 332 HA GLU 42 HA GLU 42 -19.627 -7.652 16.225 333 HB2 GLU 42 HB2 GLU 42 -21.280 -9.502 15.408 334 HB3 GLU 42 HB1 GLU 42 -20.203 -10.601 16.249 335 HG2 GLU 42 HG2 GLU 42 -21.439 -8.228 17.603 336 HG3 GLU 42 HG1 GLU 42 -22.260 -9.781 17.494 337 H ALA 43 HN ALA 43 -17.880 -10.596 15.330 338 HA ALA 43 HA ALA 43 -16.466 -10.821 17.785 339 HB1 ALA 43 HB1 ALA 43 -16.886 -12.740 16.324 340 HB2 ALA 43 HB2 ALA 43 -15.168 -12.538 16.660 341 HB3 ALA 43 HB3 ALA 43 -15.826 -12.037 15.102 342 H ILE 44 HN ILE 44 -15.664 -9.501 14.591 343 HA ILE 44 HA ILE 44 -12.966 -8.916 15.037 344 HB ILE 44 HB ILE 44 -14.958 -7.435 13.314 345 HG12 ILE 44 HG12 ILE 44 -12.892 -9.533 12.610 346 HG13 ILE 44 HG11 ILE 44 -14.628 -9.807 12.720 347 HG21 ILE 44 HG21 ILE 44 -13.021 -6.508 12.138 348 HG22 ILE 44 HG22 ILE 44 -11.945 -7.280 13.303 349 HG23 ILE 44 HG23 ILE 44 -13.050 -6.010 13.829 350 HD11 ILE 44 HD11 ILE 44 -13.257 -7.977 10.765 351 HD12 ILE 44 HD12 ILE 44 -14.993 -8.264 10.873 352 HD13 ILE 44 HD13 ILE 44 -13.910 -9.577 10.415 353 H ALA 45 HN ALA 45 -15.831 -6.870 15.485 354 HA ALA 45 HA ALA 45 -14.545 -4.551 16.327 355 HB1 ALA 45 HB1 ALA 45 -16.692 -3.903 17.282 356 HB2 ALA 45 HB2 ALA 45 -17.258 -5.569 17.156 357 HB3 ALA 45 HB3 ALA 45 -16.904 -4.644 15.696 358 H THR 46 HN THR 46 -15.937 -7.157 18.311 359 HA THR 46 HA THR 46 -15.227 -6.097 20.797 360 HB THR 46 HB THR 46 -15.454 -9.037 20.140 361 HG1 THR 46 HG1 THR 46 -17.402 -8.415 19.499 362 HG21 THR 46 HG21 THR 46 -14.632 -8.540 22.392 363 HG22 THR 46 HG22 THR 46 -16.266 -9.202 22.454 364 HG23 THR 46 HG23 THR 46 -16.008 -7.470 22.665 365 H ALA 47 HN ALA 47 -13.522 -8.468 18.756 366 HA ALA 47 HA ALA 47 -11.428 -9.013 20.534 367 HB1 ALA 47 HB1 ALA 47 -11.403 -9.157 17.522 368 HB2 ALA 47 HB2 ALA 47 -11.934 -10.429 18.624 369 HB3 ALA 47 HB3 ALA 47 -10.245 -9.926 18.606 370 H THR 48 HN THR 48 -11.733 -6.512 18.051 371 HA THR 48 HA THR 48 -9.003 -5.644 18.444 372 HB THR 48 HB THR 48 -9.655 -3.797 16.850 373 HG1 THR 48 HG1 THR 48 -12.013 -5.346 16.447 374 HG21 THR 48 HG21 THR 48 -9.739 -5.275 14.892 375 HG22 THR 48 HG22 THR 48 -10.110 -6.641 15.945 376 HG23 THR 48 HG23 THR 48 -8.550 -5.828 16.072 377 H GLY 49 HN GLY 49 -12.062 -4.955 19.827 378 HA2 GLY 49 HA2 GLY 49 -12.426 -3.636 21.723 379 HA3 GLY 49 HA1 GLY 49 -10.848 -2.900 21.488 380 H MET 50 HN MET 50 -13.301 -3.149 18.992 381 HA MET 50 HA MET 50 -13.758 -0.245 19.214 382 HB2 MET 50 HB2 MET 50 -13.370 -1.871 16.696 383 HB3 MET 50 HB1 MET 50 -14.001 -0.231 16.706 384 HG2 MET 50 HG2 MET 50 -11.903 0.538 17.743 385 HG3 MET 50 HG1 MET 50 -11.274 -1.105 17.636 386 HE1 MET 50 HE1 MET 50 -12.421 -2.080 14.839 387 HE2 MET 50 HE2 MET 50 -10.766 -2.351 15.387 388 HE3 MET 50 HE3 MET 50 -11.065 -1.676 13.785 389 H ASN 51 HN ASN 51 -15.810 0.397 17.967 390 HA ASN 51 HA ASN 51 -17.934 -1.300 18.921 391 HB2 ASN 51 HB2 ASN 51 -17.853 1.394 17.606 392 HB3 ASN 51 HB1 ASN 51 -19.378 0.528 17.787 393 HD21 ASN 51 HD21 ASN 51 -20.182 0.127 19.847 394 HD22 ASN 51 HD22 ASN 51 -19.649 1.030 21.228 395 H LEU 52 HN LEU 52 -19.778 -1.891 17.605 396 HA LEU 52 HA LEU 52 -18.995 -3.590 15.520 397 HB2 LEU 52 HB2 LEU 52 -21.756 -2.556 16.173 398 HB3 LEU 52 HB1 LEU 52 -21.403 -3.947 15.165 399 HG LEU 52 HG LEU 52 -20.757 -3.726 18.108 400 HD11 LEU 52 HD11 LEU 52 -22.917 -5.275 16.684 401 HD12 LEU 52 HD12 LEU 52 -23.159 -3.855 17.702 402 HD13 LEU 52 HD13 LEU 52 -22.550 -5.353 18.409 403 HD21 LEU 52 HD21 LEU 52 -19.202 -5.151 16.858 404 HD22 LEU 52 HD22 LEU 52 -20.567 -6.064 16.215 405 HD23 LEU 52 HD23 LEU 52 -20.226 -6.092 17.945 406 H THR 53 HN THR 53 -20.871 -0.576 15.397 407 HA THR 53 HA THR 53 -21.212 -0.412 12.647 408 HB THR 53 HB THR 53 -20.824 1.978 14.454 409 HG1 THR 53 HG1 THR 53 -23.400 1.151 14.196 410 HG21 THR 53 HG21 THR 53 -22.513 2.988 12.989 411 HG22 THR 53 HG22 THR 53 -22.586 1.499 12.045 412 HG23 THR 53 HG23 THR 53 -21.106 2.458 12.068 413 H THR 54 HN THR 54 -18.563 0.738 14.681 414 HA THR 54 HA THR 54 -17.098 2.094 12.710 415 HB THR 54 HB THR 54 -15.895 0.642 15.066 416 HG1 THR 54 HG1 THR 54 -17.061 3.259 15.058 417 HG21 THR 54 HG21 THR 54 -14.305 2.508 15.029 418 HG22 THR 54 HG22 THR 54 -15.154 3.207 13.648 419 HG23 THR 54 HG23 THR 54 -14.324 1.659 13.482 420 H ALA 55 HN ALA 55 -16.889 -1.240 13.917 421 HA ALA 55 HA ALA 55 -14.697 -2.047 12.362 422 HB1 ALA 55 HB1 ALA 55 -15.373 -4.324 12.892 423 HB2 ALA 55 HB2 ALA 55 -16.953 -3.748 13.424 424 HB3 ALA 55 HB3 ALA 55 -15.501 -3.291 14.314 425 H SER 56 HN SER 56 -18.194 -2.327 11.759 426 HA SER 56 HA SER 56 -17.946 -3.703 9.318 427 HB2 SER 56 HB2 SER 56 -20.304 -2.787 8.910 428 HB3 SER 56 HB1 SER 56 -20.064 -3.783 10.344 429 HG SER 56 HG SER 56 -19.851 -0.967 10.476 430 H ALA 57 HN ALA 57 -17.944 -0.266 10.079 431 HA ALA 57 HA ALA 57 -18.118 0.632 7.389 432 HB1 ALA 57 HB1 ALA 57 -18.680 2.077 9.262 433 HB2 ALA 57 HB2 ALA 57 -17.404 2.795 8.280 434 HB3 ALA 57 HB3 ALA 57 -17.008 2.028 9.817 435 H ASN 58 HN ASN 58 -15.421 0.013 9.591 436 HA ASN 58 HA ASN 58 -13.334 0.821 7.897 437 HB2 ASN 58 HB2 ASN 58 -13.388 -1.308 10.049 438 HB3 ASN 58 HB1 ASN 58 -11.918 -0.771 9.245 439 HD21 ASN 58 HD21 ASN 58 -12.534 -0.639 12.045 440 HD22 ASN 58 HD22 ASN 58 -12.492 1.030 12.489 441 H LEU 59 HN LEU 59 -14.989 -2.265 8.273 442 HA LEU 59 HA LEU 59 -13.378 -3.750 6.508 443 HB2 LEU 59 HB2 LEU 59 -16.214 -4.129 7.443 444 HB3 LEU 59 HB1 LEU 59 -15.364 -5.301 6.451 445 HG LEU 59 HG LEU 59 -14.365 -4.387 9.143 446 HD11 LEU 59 HD11 LEU 59 -15.983 -6.835 8.462 447 HD12 LEU 59 HD12 LEU 59 -16.519 -5.465 9.436 448 HD13 LEU 59 HD13 LEU 59 -15.218 -6.505 10.015 449 HD21 LEU 59 HD21 LEU 59 -12.670 -5.302 7.645 450 HD22 LEU 59 HD22 LEU 59 -13.653 -6.748 7.406 451 HD23 LEU 59 HD23 LEU 59 -12.981 -6.389 8.996 452 H GLN 60 HN GLN 60 -16.326 -1.860 5.981 453 HA GLN 60 HA GLN 60 -16.672 -2.641 3.277 454 HB2 GLN 60 HB2 GLN 60 -17.640 -0.227 4.805 455 HB3 GLN 60 HB1 GLN 60 -18.067 -0.532 3.126 456 HG2 GLN 60 HG2 GLN 60 -19.042 -2.692 3.805 457 HG3 GLN 60 HG1 GLN 60 -18.684 -2.296 5.483 458 HE21 GLN 60 HE21 GLN 60 -19.755 0.056 3.117 459 HE22 GLN 60 HE22 GLN 60 -21.309 0.332 3.832 460 H ALA 61 HN ALA 61 -14.767 -0.146 4.832 461 HA ALA 61 HA ALA 61 -13.999 1.215 2.467 462 HB1 ALA 61 HB1 ALA 61 -12.484 0.950 5.068 463 HB2 ALA 61 HB2 ALA 61 -13.697 2.179 4.710 464 HB3 ALA 61 HB3 ALA 61 -12.183 2.145 3.805 465 H LEU 62 HN LEU 62 -12.534 -1.397 4.346 466 HA LEU 62 HA LEU 62 -10.286 -1.812 2.710 467 HB2 LEU 62 HB2 LEU 62 -11.774 -3.805 4.425 468 HB3 LEU 62 HB1 LEU 62 -10.151 -4.013 3.795 469 HG LEU 62 HG LEU 62 -10.960 -1.844 5.734 470 HD11 LEU 62 HD11 LEU 62 -11.141 -4.018 6.784 471 HD12 LEU 62 HD12 LEU 62 -9.732 -3.155 7.402 472 HD13 LEU 62 HD13 LEU 62 -9.527 -4.450 6.220 473 HD21 LEU 62 HD21 LEU 62 -8.263 -2.749 4.740 474 HD22 LEU 62 HD22 LEU 62 -8.538 -1.560 6.012 475 HD23 LEU 62 HD23 LEU 62 -9.062 -1.223 4.362 476 H LYS 63 HN LYS 63 -13.569 -3.093 2.581 477 HA LYS 63 HA LYS 63 -13.137 -4.994 0.544 478 HB2 LYS 63 HB2 LYS 63 -15.157 -4.994 1.944 479 HB3 LYS 63 HB1 LYS 63 -15.664 -3.472 1.224 480 HG2 LYS 63 HG2 LYS 63 -15.772 -4.583 -0.971 481 HG3 LYS 63 HG1 LYS 63 -15.357 -6.109 -0.193 482 HD2 LYS 63 HD2 LYS 63 -17.385 -6.005 1.144 483 HD3 LYS 63 HD1 LYS 63 -17.792 -4.438 0.433 484 HE2 LYS 63 HE2 LYS 63 -17.835 -5.530 -1.798 485 HE3 LYS 63 HE1 LYS 63 -17.566 -7.078 -1.003 486 HZ1 LYS 63 HZ1 LYS 63 -19.879 -5.334 -0.369 487 HZ2 LYS 63 HZ2 LYS 63 -19.655 -6.961 0.045 488 HZ3 LYS 63 HZ3 LYS 63 -19.930 -6.530 -1.567 489 H SER 64 HN SER 64 -14.053 -1.584 0.452 490 HA SER 64 HA SER 64 -14.445 -1.456 -2.356 491 HB2 SER 64 HB2 SER 64 -13.736 0.800 -0.462 492 HB3 SER 64 HB1 SER 64 -14.489 0.954 -2.050 493 HG SER 64 HG SER 64 -15.575 -0.047 0.359 494 H GLY 65 HN GLY 65 -11.649 -1.443 -0.347 495 HA2 GLY 65 HA2 GLY 65 -9.920 -0.347 -2.411 496 HA3 GLY 65 HA1 GLY 65 -9.423 -0.929 -0.828 497 H GLY 66 HN GLY 66 -11.301 -3.336 -1.798 498 HA2 GLY 66 HA2 GLY 66 -11.034 -5.211 -3.177 499 HA3 GLY 66 HA1 GLY 66 -9.480 -4.582 -3.701 500 H LEU 67 HN LEU 67 -9.862 -4.496 -0.342 501 HA LEU 67 HA LEU 67 -7.802 -6.465 0.008 502 HB2 LEU 67 HB2 LEU 67 -9.311 -4.630 1.825 503 HB3 LEU 67 HB1 LEU 67 -8.403 -5.959 2.514 504 HG LEU 67 HG LEU 67 -7.167 -3.823 2.545 505 HD11 LEU 67 HD11 LEU 67 -5.072 -4.685 1.613 506 HD12 LEU 67 HD12 LEU 67 -5.974 -5.951 0.781 507 HD13 LEU 67 HD13 LEU 67 -5.938 -5.907 2.543 508 HD21 LEU 67 HD21 LEU 67 -6.275 -2.896 0.470 509 HD22 LEU 67 HD22 LEU 67 -8.037 -2.838 0.493 510 HD23 LEU 67 HD23 LEU 67 -7.209 -4.070 -0.459 511 H VAL 68 HN VAL 68 -11.217 -6.218 0.989 512 HA VAL 68 HA VAL 68 -11.233 -9.132 1.363 513 HB VAL 68 HB VAL 68 -12.642 -8.870 3.383 514 HG11 VAL 68 HG11 VAL 68 -10.838 -8.184 4.918 515 HG12 VAL 68 HG12 VAL 68 -9.926 -7.571 3.538 516 HG13 VAL 68 HG13 VAL 68 -10.280 -9.293 3.667 517 HG21 VAL 68 HG21 VAL 68 -12.718 -6.697 4.531 518 HG22 VAL 68 HG22 VAL 68 -13.527 -6.647 2.965 519 HG23 VAL 68 HG23 VAL 68 -11.918 -5.950 3.148 520 H GLU 69 HN GLU 69 -13.407 -10.069 1.365 521 HA GLU 69 HA GLU 69 -15.400 -8.357 0.034 522 HB2 GLU 69 HB2 GLU 69 -14.766 -11.266 -0.423 523 HB3 GLU 69 HB1 GLU 69 -16.330 -10.590 -0.857 524 HG2 GLU 69 HG2 GLU 69 -15.105 -8.902 -2.249 525 HG3 GLU 69 HG1 GLU 69 -13.634 -9.823 -1.943 526 H ALA 70 HN ALA 70 -17.675 -9.023 0.455 527 HA ALA 70 HA ALA 70 -17.875 -9.438 3.352 528 HB1 ALA 70 HB1 ALA 70 -19.834 -8.184 1.435 529 HB2 ALA 70 HB2 ALA 70 -18.720 -7.319 2.497 530 HB3 ALA 70 HB3 ALA 70 -20.022 -8.289 3.186 531 H ARG 71 HN ARG 71 -18.446 -11.369 3.999 532 HA ARG 71 HA ARG 71 -20.254 -13.002 2.370 533 HB2 ARG 71 HB2 ARG 71 -18.256 -14.155 3.060 534 HB3 ARG 71 HB1 ARG 71 -18.465 -13.629 4.723 535 HG2 ARG 71 HG2 ARG 71 -20.417 -15.044 4.956 536 HG3 ARG 71 HG1 ARG 71 -20.284 -15.535 3.264 537 HD2 ARG 71 HD2 ARG 71 -18.164 -16.583 3.676 538 HD3 ARG 71 HD1 ARG 71 -18.127 -15.956 5.323 539 HE ARG 71 HE ARG 71 -19.699 -17.559 5.965 540 HH11 ARG 71 HH11 ARG 71 -18.979 -17.763 2.546 541 HH12 ARG 71 HH12 ARG 71 -19.663 -19.347 2.356 542 HH21 ARG 71 HH21 ARG 71 -20.586 -19.659 5.730 543 HH22 ARG 71 HH22 ARG 71 -20.560 -20.432 4.179 544 H ARG 72 HN ARG 72 -22.329 -12.461 2.784 545 HA ARG 72 HA ARG 72 -23.072 -11.871 5.565 546 HB2 ARG 72 HB2 ARG 72 -24.862 -11.502 3.173 547 HB3 ARG 72 HB1 ARG 72 -24.984 -10.743 4.753 548 HG2 ARG 72 HG2 ARG 72 -22.711 -9.666 4.138 549 HG3 ARG 72 HG1 ARG 72 -23.139 -10.109 2.485 550 HD2 ARG 72 HD2 ARG 72 -24.383 -8.115 4.314 551 HD3 ARG 72 HD1 ARG 72 -24.015 -7.993 2.595 552 HE ARG 72 HE ARG 72 -26.124 -9.857 3.308 553 HH11 ARG 72 HH11 ARG 72 -25.298 -6.669 2.112 554 HH12 ARG 72 HH12 ARG 72 -26.925 -6.292 1.624 555 HH21 ARG 72 HH21 ARG 72 -28.233 -9.390 2.656 556 HH22 ARG 72 HH22 ARG 72 -28.600 -7.851 1.931 557 H GLU 73 HN GLU 73 -23.668 -13.625 6.648 558 HA GLU 73 HA GLU 73 -25.388 -15.562 5.260 559 HB2 GLU 73 HB2 GLU 73 -23.078 -16.424 5.533 560 HB3 GLU 73 HB1 GLU 73 -23.230 -16.216 7.272 561 HG2 GLU 73 HG2 GLU 73 -24.698 -17.960 7.495 562 HG3 GLU 73 HG1 GLU 73 -25.217 -17.886 5.811 563 H GLY 74 HN GLY 74 -27.319 -15.307 6.087 564 HA2 GLY 74 HA2 GLY 74 -29.014 -15.306 7.647 565 HA3 GLY 74 HA1 GLY 74 -27.819 -15.700 8.879 566 H THR 75 HN THR 75 -27.718 -14.235 10.414 567 HA THR 75 HA THR 75 -28.306 -11.440 9.730 568 HB THR 75 HB THR 75 -29.676 -12.499 11.532 569 HG1 THR 75 HG1 THR 75 -29.736 -10.627 12.579 570 HG21 THR 75 HG21 THR 75 -27.981 -13.961 12.502 571 HG22 THR 75 HG22 THR 75 -28.648 -12.885 13.732 572 HG23 THR 75 HG23 THR 75 -27.058 -12.557 13.040 573 H ARG 76 HN ARG 76 -25.748 -13.463 10.071 574 HA ARG 76 HA ARG 76 -24.024 -11.494 11.397 575 HB2 ARG 76 HB2 ARG 76 -23.556 -14.403 10.744 576 HB3 ARG 76 HB1 ARG 76 -22.368 -13.346 11.492 577 HG2 ARG 76 HG2 ARG 76 -25.062 -13.818 12.717 578 HG3 ARG 76 HG1 ARG 76 -23.695 -14.891 13.010 579 HD2 ARG 76 HD2 ARG 76 -23.791 -13.315 14.802 580 HD3 ARG 76 HD1 ARG 76 -22.397 -12.920 13.803 581 HE ARG 76 HE ARG 76 -23.499 -10.982 13.050 582 HH11 ARG 76 HH11 ARG 76 -25.448 -12.813 15.325 583 HH12 ARG 76 HH12 ARG 76 -26.450 -11.454 15.744 584 HH21 ARG 76 HH21 ARG 76 -24.836 -9.193 13.617 585 HH22 ARG 76 HH22 ARG 76 -26.110 -9.418 14.781 586 H GLN 77 HN GLN 77 -22.360 -10.543 10.377 587 HA GLN 77 HA GLN 77 -22.015 -11.182 7.526 588 HB2 GLN 77 HB2 GLN 77 -21.684 -8.553 8.979 589 HB3 GLN 77 HB1 GLN 77 -21.162 -8.823 7.319 590 HG2 GLN 77 HG2 GLN 77 -23.441 -9.310 6.655 591 HG3 GLN 77 HG1 GLN 77 -23.985 -9.121 8.319 592 HE21 GLN 77 HE21 GLN 77 -21.562 -7.060 6.895 593 HE22 GLN 77 HE22 GLN 77 -22.533 -5.629 6.826 594 H TYR 78 HN TYR 78 -20.271 -12.267 7.157 595 HA TYR 78 HA TYR 78 -17.940 -11.960 8.908 596 HB2 TYR 78 HB2 TYR 78 -18.726 -14.131 6.947 597 HB3 TYR 78 HB1 TYR 78 -17.175 -14.084 7.779 598 HD1 TYR 78 HD2 TYR 78 -20.850 -14.316 8.361 599 HD2 TYR 78 HD1 TYR 78 -16.946 -14.949 9.947 600 HE1 TYR 78 HE2 TYR 78 -21.822 -15.505 10.281 601 HE2 TYR 78 HE1 TYR 78 -17.915 -16.143 11.865 602 HH TYR 78 HH TYR 78 -21.143 -17.177 11.950 603 H TYR 79 HN TYR 79 -15.913 -11.469 8.044 604 HA TYR 79 HA TYR 79 -15.923 -10.767 5.189 605 HB2 TYR 79 HB2 TYR 79 -14.853 -9.258 7.527 606 HB3 TYR 79 HB1 TYR 79 -13.993 -9.147 5.993 607 HD1 TYR 79 HD1 TYR 79 -17.194 -8.454 7.693 608 HD2 TYR 79 HD2 TYR 79 -14.907 -7.944 4.143 609 HE1 TYR 79 HE1 TYR 79 -18.803 -6.771 6.901 610 HE2 TYR 79 HE2 TYR 79 -16.509 -6.261 3.340 611 HH TYR 79 HH TYR 79 -18.843 -4.851 5.326 612 H ARG 80 HN ARG 80 -14.280 -11.386 3.955 613 HA ARG 80 HA ARG 80 -12.060 -12.872 5.181 614 HB2 ARG 80 HB2 ARG 80 -13.856 -14.449 4.441 615 HB3 ARG 80 HB1 ARG 80 -13.706 -13.808 2.812 616 HG2 ARG 80 HG2 ARG 80 -12.531 -15.870 2.900 617 HG3 ARG 80 HG1 ARG 80 -11.331 -14.580 2.813 618 HD2 ARG 80 HD2 ARG 80 -10.862 -14.759 5.146 619 HD3 ARG 80 HD1 ARG 80 -12.223 -15.851 5.393 620 HE ARG 80 HE ARG 80 -9.649 -16.510 4.158 621 HH11 ARG 80 HH11 ARG 80 -12.858 -17.528 5.122 622 HH12 ARG 80 HH12 ARG 80 -12.463 -19.217 5.128 623 HH21 ARG 80 HH21 ARG 80 -9.119 -18.727 4.152 624 HH22 ARG 80 HH22 ARG 80 -10.330 -19.899 4.585 625 H ILE 81 HN ILE 81 -10.141 -12.778 3.947 626 HA ILE 81 HA ILE 81 -9.646 -10.546 2.374 627 HB ILE 81 HB ILE 81 -8.191 -13.192 2.186 628 HG12 ILE 81 HG12 ILE 81 -8.324 -12.424 4.519 629 HG13 ILE 81 HG11 ILE 81 -6.679 -12.318 3.908 630 HG21 ILE 81 HG21 ILE 81 -7.294 -10.384 1.557 631 HG22 ILE 81 HG22 ILE 81 -7.620 -11.668 0.390 632 HG23 ILE 81 HG23 ILE 81 -6.271 -11.818 1.514 633 HD11 ILE 81 HD11 ILE 81 -6.965 -9.917 3.570 634 HD12 ILE 81 HD12 ILE 81 -7.239 -10.384 5.250 635 HD13 ILE 81 HD13 ILE 81 -8.611 -10.030 4.199 636 H ALA 82 HN ALA 82 -10.026 -10.048 0.301 637 HA ALA 82 HA ALA 82 -11.985 -11.358 -1.149 638 HB1 ALA 82 HB1 ALA 82 -11.412 -9.884 -2.994 639 HB2 ALA 82 HB2 ALA 82 -9.866 -9.508 -2.235 640 HB3 ALA 82 HB3 ALA 82 -11.372 -9.006 -1.466 641 H GLY 83 HN GLY 83 -8.488 -11.355 -1.801 642 HA2 GLY 83 HA2 GLY 83 -8.808 -14.012 -2.997 643 HA3 GLY 83 HA1 GLY 83 -8.007 -12.753 -3.930 644 H GLU 84 HN GLU 84 -6.817 -15.213 -3.148 645 HA GLU 84 HA GLU 84 -5.175 -14.818 -0.851 646 HB2 GLU 84 HB2 GLU 84 -5.772 -17.037 -1.965 647 HB3 GLU 84 HB1 GLU 84 -4.552 -16.643 -3.169 648 HG2 GLU 84 HG2 GLU 84 -2.812 -16.720 -1.575 649 HG3 GLU 84 HG1 GLU 84 -3.951 -16.742 -0.228 650 H ASP 85 HN ASP 85 -5.108 -13.707 -4.067 651 HA ASP 85 HA ASP 85 -2.462 -12.944 -4.469 652 HB2 ASP 85 HB2 ASP 85 -4.818 -11.131 -5.025 653 HB3 ASP 85 HB1 ASP 85 -3.308 -11.236 -5.916 654 H VAL 86 HN VAL 86 -5.081 -11.298 -2.773 655 HA VAL 86 HA VAL 86 -3.514 -9.084 -1.897 656 HB VAL 86 HB VAL 86 -6.174 -10.041 -0.821 657 HG11 VAL 86 HG11 VAL 86 -6.482 -7.692 -0.176 658 HG12 VAL 86 HG12 VAL 86 -4.853 -7.332 -0.749 659 HG13 VAL 86 HG13 VAL 86 -5.087 -8.420 0.619 660 HG21 VAL 86 HG21 VAL 86 -7.195 -8.464 -2.403 661 HG22 VAL 86 HG22 VAL 86 -6.307 -9.744 -3.231 662 HG23 VAL 86 HG23 VAL 86 -5.605 -8.131 -3.088 663 H ALA 87 HN ALA 87 -4.487 -12.163 -0.529 664 HA ALA 87 HA ALA 87 -3.699 -11.759 2.124 665 HB1 ALA 87 HB1 ALA 87 -3.533 -14.197 2.281 666 HB2 ALA 87 HB2 ALA 87 -3.620 -14.315 0.523 667 HB3 ALA 87 HB3 ALA 87 -4.999 -13.703 1.436 668 H ARG 88 HN ARG 88 -1.865 -12.960 -0.670 669 HA ARG 88 HA ARG 88 0.597 -13.279 0.687 670 HB2 ARG 88 HB2 ARG 88 0.010 -12.760 -2.232 671 HB3 ARG 88 HB1 ARG 88 1.596 -13.174 -1.603 672 HG2 ARG 88 HG2 ARG 88 -0.852 -14.912 -1.396 673 HG3 ARG 88 HG1 ARG 88 0.430 -15.091 -2.595 674 HD2 ARG 88 HD2 ARG 88 0.699 -15.362 0.398 675 HD3 ARG 88 HD1 ARG 88 0.777 -16.662 -0.791 676 HE ARG 88 HE ARG 88 2.736 -14.516 -1.036 677 HH11 ARG 88 HH11 ARG 88 2.034 -17.817 -0.111 678 HH12 ARG 88 HH12 ARG 88 3.710 -18.255 0.078 679 HH21 ARG 88 HH21 ARG 88 4.931 -15.080 -0.804 680 HH22 ARG 88 HH22 ARG 88 5.358 -16.691 -0.304 681 H LEU 89 HN LEU 89 -0.951 -10.585 -0.903 682 HA LEU 89 HA LEU 89 1.235 -8.854 -1.138 683 HB2 LEU 89 HB2 LEU 89 -1.117 -8.689 -2.146 684 HB3 LEU 89 HB1 LEU 89 -1.597 -7.975 -0.623 685 HG LEU 89 HG LEU 89 0.607 -6.795 -2.305 686 HD11 LEU 89 HD11 LEU 89 -1.050 -5.267 -3.226 687 HD12 LEU 89 HD12 LEU 89 -2.333 -6.133 -2.383 688 HD13 LEU 89 HD13 LEU 89 -1.422 -6.934 -3.663 689 HD21 LEU 89 HD21 LEU 89 -1.207 -5.620 -0.197 690 HD22 LEU 89 HD22 LEU 89 0.050 -4.756 -1.083 691 HD23 LEU 89 HD23 LEU 89 0.489 -6.055 0.028 692 H PHE 90 HN PHE 90 -1.350 -8.739 1.350 693 HA PHE 90 HA PHE 90 -0.044 -6.764 2.891 694 HB2 PHE 90 HB2 PHE 90 -2.479 -7.221 3.005 695 HB3 PHE 90 HB1 PHE 90 -2.142 -8.749 3.807 696 HD1 PHE 90 HD1 PHE 90 -1.845 -5.079 4.151 697 HD2 PHE 90 HD2 PHE 90 -1.781 -8.842 6.135 698 HE1 PHE 90 HE1 PHE 90 -1.873 -3.928 6.324 699 HE2 PHE 90 HE2 PHE 90 -1.810 -7.700 8.312 700 HZ PHE 90 HZ PHE 90 -1.857 -5.239 8.409 701 H ALA 91 HN ALA 91 -0.032 -10.296 3.074 702 HA ALA 91 HA ALA 91 1.340 -10.570 5.503 703 HB1 ALA 91 HB1 ALA 91 0.277 -12.456 4.356 704 HB2 ALA 91 HB2 ALA 91 1.970 -12.796 4.718 705 HB3 ALA 91 HB3 ALA 91 1.487 -12.362 3.078 706 H LEU 92 HN LEU 92 2.577 -10.366 2.173 707 HA LEU 92 HA LEU 92 5.305 -10.534 2.780 708 HB2 LEU 92 HB2 LEU 92 4.429 -10.720 0.504 709 HB3 LEU 92 HB1 LEU 92 3.946 -9.036 0.534 710 HG LEU 92 HG LEU 92 6.340 -8.394 0.748 711 HD11 LEU 92 HD11 LEU 92 6.831 -11.330 0.245 712 HD12 LEU 92 HD12 LEU 92 7.164 -10.469 1.749 713 HD13 LEU 92 HD13 LEU 92 8.058 -10.061 0.284 714 HD21 LEU 92 HD21 LEU 92 5.640 -10.097 -1.639 715 HD22 LEU 92 HD22 LEU 92 6.920 -8.884 -1.578 716 HD23 LEU 92 HD23 LEU 92 5.232 -8.396 -1.418 717 H VAL 93 HN VAL 93 3.215 -7.699 2.389 718 HA VAL 93 HA VAL 93 5.084 -5.696 2.814 719 HB VAL 93 HB VAL 93 2.155 -5.744 3.578 720 HG11 VAL 93 HG11 VAL 93 2.254 -3.316 3.517 721 HG12 VAL 93 HG12 VAL 93 3.987 -3.383 3.200 722 HG13 VAL 93 HG13 VAL 93 3.350 -3.953 4.742 723 HG21 VAL 93 HG21 VAL 93 3.548 -4.717 1.112 724 HG22 VAL 93 HG22 VAL 93 1.823 -4.577 1.455 725 HG23 VAL 93 HG23 VAL 93 2.549 -6.167 1.216 726 H GLN 94 HN GLN 94 3.140 -7.489 5.185 727 HA GLN 94 HA GLN 94 4.075 -6.017 7.427 728 HB2 GLN 94 HB2 GLN 94 1.948 -7.243 7.451 729 HB3 GLN 94 HB1 GLN 94 2.815 -8.766 7.322 730 HG2 GLN 94 HG2 GLN 94 3.804 -8.445 9.491 731 HG3 GLN 94 HG1 GLN 94 3.108 -6.832 9.611 732 HE21 GLN 94 HE21 GLN 94 1.349 -9.500 8.265 733 HE22 GLN 94 HE22 GLN 94 0.217 -9.683 9.565 734 H VAL 95 HN VAL 95 5.069 -9.091 5.962 735 HA VAL 95 HA VAL 95 6.961 -9.766 7.955 736 HB VAL 95 HB VAL 95 6.837 -10.596 5.052 737 HG11 VAL 95 HG11 VAL 95 8.522 -11.700 7.300 738 HG12 VAL 95 HG12 VAL 95 9.108 -10.863 5.860 739 HG13 VAL 95 HG13 VAL 95 8.335 -12.441 5.711 740 HG21 VAL 95 HG21 VAL 95 5.971 -11.986 7.584 741 HG22 VAL 95 HG22 VAL 95 5.943 -12.696 5.971 742 HG23 VAL 95 HG23 VAL 95 4.914 -11.313 6.344 743 H VAL 96 HN VAL 96 7.321 -8.141 4.807 744 HA VAL 96 HA VAL 96 10.084 -7.700 4.921 745 HB VAL 96 HB VAL 96 7.928 -6.041 3.594 746 HG11 VAL 96 HG11 VAL 96 10.912 -5.946 3.154 747 HG12 VAL 96 HG12 VAL 96 9.937 -4.691 3.920 748 HG13 VAL 96 HG13 VAL 96 9.697 -5.077 2.217 749 HG21 VAL 96 HG21 VAL 96 8.619 -7.198 1.559 750 HG22 VAL 96 HG22 VAL 96 8.076 -8.342 2.788 751 HG23 VAL 96 HG23 VAL 96 9.799 -8.126 2.483 752 H ALA 97 HN ALA 97 7.384 -5.828 6.195 753 HA ALA 97 HA ALA 97 8.823 -3.607 7.120 754 HB1 ALA 97 HB1 ALA 97 6.376 -3.674 6.952 755 HB2 ALA 97 HB2 ALA 97 6.910 -3.194 8.564 756 HB3 ALA 97 HB3 ALA 97 6.325 -4.834 8.282 757 H ASP 98 HN ASP 98 8.001 -6.681 8.681 758 HA ASP 98 HA ASP 98 9.007 -6.091 11.236 759 HB2 ASP 98 HB2 ASP 98 7.521 -7.991 10.797 760 HB3 ASP 98 HB1 ASP 98 8.780 -8.771 9.853 761 H GLU 99 HN GLU 99 10.536 -7.839 8.536 762 HA GLU 99 HA GLU 99 12.892 -8.414 10.011 763 HB2 GLU 99 HB2 GLU 99 13.810 -9.158 7.829 764 HB3 GLU 99 HB1 GLU 99 12.254 -9.871 8.223 765 HG2 GLU 99 HG2 GLU 99 11.143 -8.319 6.718 766 HG3 GLU 99 HG1 GLU 99 12.690 -7.559 6.343 767 H HIS 100 HN HIS 100 11.917 -5.608 8.277 768 HA HIS 100 HA HIS 100 14.715 -4.728 8.195 769 HB2 HIS 100 HB2 HIS 100 12.331 -3.700 6.652 770 HB3 HIS 100 HB1 HIS 100 13.927 -2.949 6.624 771 HD1 HIS 100 HD1 HIS 100 15.847 -5.127 6.207 772 HD2 HIS 100 HD2 HIS 100 12.089 -5.222 4.427 773 HE1 HIS 100 HE1 HIS 100 16.051 -6.723 4.273 774 HE2 HIS 100 HE2 HIS 100 13.713 -6.936 3.366 775 H LEU 101 HN LEU 101 11.783 -4.269 9.855 776 HA LEU 101 HA LEU 101 12.569 -1.789 11.095 777 HB2 LEU 101 HB2 LEU 101 10.214 -2.459 11.076 778 HB3 LEU 101 HB1 LEU 101 10.604 -3.926 11.952 779 HG LEU 101 HG LEU 101 11.277 -2.568 13.902 780 HD11 LEU 101 HD11 LEU 101 10.716 -0.188 13.963 781 HD12 LEU 101 HD12 LEU 101 10.276 -0.251 12.255 782 HD13 LEU 101 HD13 LEU 101 11.946 -0.537 12.747 783 HD21 LEU 101 HD21 LEU 101 9.025 -1.878 14.545 784 HD22 LEU 101 HD22 LEU 101 9.012 -3.448 13.743 785 HD23 LEU 101 HD23 LEU 101 8.504 -2.004 12.866 786 H GLU 102 HN GLU 102 12.854 -5.221 11.667 787 HA GLU 102 HA GLU 102 14.242 -5.154 14.109 788 HB2 GLU 102 HB2 GLU 102 13.298 -7.221 13.208 789 HB3 GLU 102 HB1 GLU 102 14.381 -7.137 11.825 790 HG2 GLU 102 HG2 GLU 102 15.181 -8.770 13.395 791 HG3 GLU 102 HG1 GLU 102 16.297 -7.407 13.337 792 H HIS 103 HN HIS 103 16.257 -4.547 14.577 793 HA HIS 103 HA HIS 103 18.145 -4.219 12.339 794 HB2 HIS 103 HB2 HIS 103 17.851 -2.458 14.787 795 HB3 HIS 103 HB1 HIS 103 19.140 -2.315 13.595 796 HD1 HIS 103 HD1 HIS 103 16.520 -0.379 14.400 797 HD2 HIS 103 HD2 HIS 103 17.357 -2.390 10.859 798 HE1 HIS 103 HE1 HIS 103 15.232 0.832 12.612 799 HE2 HIS 103 HE2 HIS 103 15.589 -0.530 10.523 800 H HIS 104 HN HIS 104 20.445 -4.301 13.051 801 HA HIS 104 HA HIS 104 20.883 -6.814 14.215 802 HB2 HIS 104 HB2 HIS 104 22.764 -4.554 13.545 803 HB3 HIS 104 HB1 HIS 104 23.328 -6.088 14.195 804 HD1 HIS 104 HD1 HIS 104 21.900 -4.531 11.105 805 HD2 HIS 104 HD2 HIS 104 23.294 -8.229 12.398 806 HE1 HIS 104 HE1 HIS 104 22.151 -5.928 9.025 807 HE2 HIS 104 HE2 HIS 104 23.210 -8.076 9.818 808 H HIS 105 HN HIS 105 20.330 -7.162 16.298 809 HA HIS 105 HA HIS 105 21.819 -5.570 18.264 810 HB2 HIS 105 HB2 HIS 105 20.022 -5.733 19.881 811 HB3 HIS 105 HB1 HIS 105 19.436 -4.974 18.414 812 HD1 HIS 105 HD1 HIS 105 17.921 -6.603 16.841 813 HD2 HIS 105 HD2 HIS 105 18.544 -7.821 20.764 814 HE1 HIS 105 HE1 HIS 105 16.139 -8.311 17.312 815 HE2 HIS 105 HE2 HIS 105 16.380 -8.821 19.766 816 H HIS 106 HN HIS 106 23.269 -7.390 17.535 817 HA HIS 106 HA HIS 106 23.002 -9.580 19.472 818 HB2 HIS 106 HB2 HIS 106 22.404 -10.522 17.314 819 HB3 HIS 106 HB1 HIS 106 23.844 -9.832 16.575 820 HD1 HIS 106 HD1 HIS 106 25.726 -11.401 16.336 821 HD2 HIS 106 HD2 HIS 106 23.165 -12.512 19.424 822 HE1 HIS 106 HE1 HIS 106 26.618 -13.587 17.207 823 HE2 HIS 106 HE2 HIS 106 25.125 -14.180 19.150 824 H HIS 107 HN HIS 107 25.176 -7.927 17.216 825 HA HIS 107 HA HIS 107 27.552 -8.623 18.619 826 HB2 HIS 107 HB2 HIS 107 27.694 -8.110 16.271 827 HB3 HIS 107 HB1 HIS 107 26.959 -6.532 16.514 828 HD1 HIS 107 HD1 HIS 107 30.193 -8.387 17.177 829 HD2 HIS 107 HD2 HIS 107 28.703 -4.506 17.104 830 HE1 HIS 107 HE1 HIS 107 32.202 -6.881 17.379 831 HE2 HIS 107 HE2 HIS 107 31.282 -4.536 17.227 832 H HIS 108 HN HIS 108 28.569 -7.612 20.260 833 HA HIS 108 HA HIS 108 27.412 -5.059 21.196 834 HB2 HIS 108 HB2 HIS 108 28.951 -7.133 22.779 835 HB3 HIS 108 HB1 HIS 108 28.337 -5.615 23.417 836 HD1 HIS 108 HD1 HIS 108 27.583 -8.735 24.131 837 HD2 HIS 108 HD2 HIS 108 25.274 -5.865 22.199 838 HE1 HIS 108 HE1 HIS 108 25.193 -9.464 24.439 839 HE2 HIS 108 HE2 HIS 108 23.843 -7.843 23.057 840 H1 MET 1 HT1 MET 1 -1.577 1.323 24.916 841 H2 MET 1 HT2 MET 1 -1.142 2.850 24.324 842 H3 MET 1 HT3 MET 1 -0.645 2.373 25.873 843 HA MET 1 HA MET 1 1.211 2.191 24.432 844 HB2 MET 1 HB2 MET 1 0.917 0.406 26.107 845 HB3 MET 1 HB1 MET 1 -0.005 -0.535 24.942 846 HG2 MET 1 HG2 MET 1 1.998 -0.604 23.487 847 HG3 MET 1 HG1 MET 1 2.900 0.225 24.751 848 HE1 MET 1 HE1 MET 1 1.622 -1.139 27.380 849 HE2 MET 1 HE2 MET 1 3.342 -0.812 27.167 850 HE3 MET 1 HE3 MET 1 2.804 -2.420 27.656 851 H ALA 2 HN ALA 2 1.777 2.339 22.369 852 HA ALA 2 HA ALA 2 -0.022 1.206 20.343 853 HB1 ALA 2 HB1 ALA 2 0.355 3.608 20.198 854 HB2 ALA 2 HB2 ALA 2 1.034 2.785 18.794 855 HB3 ALA 2 HB3 ALA 2 2.094 3.342 20.088 856 H GLY 3 HN GLY 3 3.423 1.469 21.194 857 HA2 GLY 3 HA2 GLY 3 3.911 -1.133 20.011 858 HA3 GLY 3 HA1 GLY 3 4.686 0.206 19.176 859 H GLN 4 HN GLN 4 4.176 -0.316 22.652 860 HA GLN 4 HA GLN 4 7.023 0.085 23.126 861 HB2 GLN 4 HB2 GLN 4 5.271 1.157 24.579 862 HB3 GLN 4 HB1 GLN 4 4.827 -0.449 25.141 863 HG2 GLN 4 HG2 GLN 4 7.213 -0.719 25.903 864 HG3 GLN 4 HG1 GLN 4 7.427 0.998 25.564 865 HE21 GLN 4 HE21 GLN 4 5.967 -1.357 27.635 866 HE22 GLN 4 HE22 GLN 4 5.481 -0.262 28.882 867 H SER 5 HN SER 5 4.743 -2.422 22.808 868 HA SER 5 HA SER 5 6.799 -4.417 23.208 869 HB2 SER 5 HB2 SER 5 4.152 -4.518 24.688 870 HB3 SER 5 HB1 SER 5 5.335 -5.825 24.628 871 HG SER 5 HG SER 5 6.590 -3.600 25.382 872 H ASP 6 HN ASP 6 6.086 -6.524 22.334 873 HA ASP 6 HA ASP 6 5.206 -7.839 20.712 874 HB2 ASP 6 HB2 ASP 6 2.990 -7.328 21.545 875 HB3 ASP 6 HB1 ASP 6 2.973 -5.801 20.670 876 H ARG 7 HN ARG 7 5.865 -8.067 18.680 877 HA ARG 7 HA ARG 7 7.195 -5.857 17.464 878 HB2 ARG 7 HB2 ARG 7 6.744 -8.685 16.504 879 HB3 ARG 7 HB1 ARG 7 7.717 -7.501 15.640 880 HG2 ARG 7 HG2 ARG 7 9.236 -7.344 17.530 881 HG3 ARG 7 HG1 ARG 7 8.244 -8.489 18.435 882 HD2 ARG 7 HD2 ARG 7 10.159 -9.622 17.490 883 HD3 ARG 7 HD1 ARG 7 8.682 -10.195 16.720 884 HE ARG 7 HE ARG 7 9.271 -8.945 14.756 885 HH11 ARG 7 HH11 ARG 7 11.755 -9.010 17.223 886 HH12 ARG 7 HH12 ARG 7 13.064 -8.741 16.108 887 HH21 ARG 7 HH21 ARG 7 10.975 -8.627 13.277 888 HH22 ARG 7 HH22 ARG 7 12.608 -8.525 13.862 889 H LYS 8 HN LYS 8 4.346 -7.797 16.551 890 HA LYS 8 HA LYS 8 4.073 -6.581 14.020 891 HB2 LYS 8 HB2 LYS 8 2.001 -7.744 13.813 892 HB3 LYS 8 HB1 LYS 8 3.134 -8.799 14.637 893 HG2 LYS 8 HG2 LYS 8 1.478 -9.152 16.076 894 HG3 LYS 8 HG1 LYS 8 1.886 -7.564 16.724 895 HD2 LYS 8 HD2 LYS 8 -0.377 -7.333 16.369 896 HD3 LYS 8 HD1 LYS 8 0.271 -6.708 14.853 897 HE2 LYS 8 HE2 LYS 8 -0.825 -9.475 15.345 898 HE3 LYS 8 HE1 LYS 8 -1.590 -8.192 14.412 899 HZ1 LYS 8 HZ1 LYS 8 0.912 -9.645 13.727 900 HZ2 LYS 8 HZ2 LYS 8 0.322 -8.313 12.863 901 HZ3 LYS 8 HZ3 LYS 8 -0.582 -9.745 12.928 902 H ALA 9 HN ALA 9 2.975 -5.614 17.166 903 HA ALA 9 HA ALA 9 1.035 -3.728 16.497 904 HB1 ALA 9 HB1 ALA 9 1.606 -4.328 18.804 905 HB2 ALA 9 HB2 ALA 9 1.650 -2.581 18.563 906 HB3 ALA 9 HB3 ALA 9 3.155 -3.500 18.635 907 H ALA 10 HN ALA 10 4.550 -3.523 16.386 908 HA ALA 10 HA ALA 10 4.521 -0.780 15.470 909 HB1 ALA 10 HB1 ALA 10 6.351 -1.639 16.879 910 HB2 ALA 10 HB2 ALA 10 6.933 -0.998 15.341 911 HB3 ALA 10 HB3 ALA 10 6.811 -2.742 15.581 912 H LEU 11 HN LEU 11 4.444 -3.948 14.107 913 HA LEU 11 HA LEU 11 5.455 -3.371 11.526 914 HB2 LEU 11 HB2 LEU 11 3.806 -5.529 12.731 915 HB3 LEU 11 HB1 LEU 11 3.750 -5.363 10.989 916 HG LEU 11 HG LEU 11 6.093 -5.816 10.788 917 HD11 LEU 11 HD11 LEU 11 6.207 -5.826 13.800 918 HD12 LEU 11 HD12 LEU 11 6.896 -4.593 12.743 919 HD13 LEU 11 HD13 LEU 11 7.532 -6.239 12.712 920 HD21 LEU 11 HD21 LEU 11 4.802 -7.791 10.908 921 HD22 LEU 11 HD22 LEU 11 4.642 -7.670 12.657 922 HD23 LEU 11 HD23 LEU 11 6.201 -8.064 11.945 923 H LEU 12 HN LEU 12 2.261 -3.153 12.976 924 HA LEU 12 HA LEU 12 0.849 -2.558 10.599 925 HB2 LEU 12 HB2 LEU 12 0.206 -1.856 13.463 926 HB3 LEU 12 HB1 LEU 12 -0.911 -1.699 12.121 927 HG LEU 12 HG LEU 12 0.280 -4.294 13.108 928 HD11 LEU 12 HD11 LEU 12 -2.506 -3.172 13.365 929 HD12 LEU 12 HD12 LEU 12 -1.333 -3.347 14.671 930 HD13 LEU 12 HD13 LEU 12 -1.987 -4.779 13.873 931 HD21 LEU 12 HD21 LEU 12 -1.283 -5.357 11.563 932 HD22 LEU 12 HD22 LEU 12 -0.166 -4.304 10.693 933 HD23 LEU 12 HD23 LEU 12 -1.820 -3.774 11.001 934 H ASP 13 HN ASP 13 2.819 -0.641 12.715 935 HA ASP 13 HA ASP 13 1.943 1.903 11.698 936 HB2 ASP 13 HB2 ASP 13 3.050 1.594 13.937 937 HB3 ASP 13 HB1 ASP 13 4.552 1.239 13.092 938 H GLN 14 HN GLN 14 4.499 -0.391 11.023 939 HA GLN 14 HA GLN 14 5.939 1.133 9.128 940 HB2 GLN 14 HB2 GLN 14 5.664 -1.872 9.357 941 HB3 GLN 14 HB1 GLN 14 6.907 -1.022 8.451 942 HG2 GLN 14 HG2 GLN 14 6.530 -0.765 11.423 943 HG3 GLN 14 HG1 GLN 14 7.637 -1.907 10.661 944 HE21 GLN 14 HE21 GLN 14 9.480 -1.155 9.667 945 HE22 GLN 14 HE22 GLN 14 10.090 0.443 9.932 946 H VAL 15 HN VAL 15 3.429 -1.374 8.747 947 HA VAL 15 HA VAL 15 3.390 -1.233 5.919 948 HB VAL 15 HB VAL 15 1.340 -2.549 6.009 949 HG11 VAL 15 HG11 VAL 15 3.448 -3.712 6.296 950 HG12 VAL 15 HG12 VAL 15 2.194 -4.476 7.272 951 HG13 VAL 15 HG13 VAL 15 3.390 -3.427 8.035 952 HG21 VAL 15 HG21 VAL 15 0.325 -3.178 8.142 953 HG22 VAL 15 HG22 VAL 15 0.227 -1.438 7.870 954 HG23 VAL 15 HG23 VAL 15 1.425 -2.091 8.988 955 H ALA 16 HN ALA 16 1.685 0.521 8.420 956 HA ALA 16 HA ALA 16 -0.235 1.785 6.779 957 HB1 ALA 16 HB1 ALA 16 1.050 2.813 9.311 958 HB2 ALA 16 HB2 ALA 16 -0.359 1.755 9.235 959 HB3 ALA 16 HB3 ALA 16 -0.451 3.395 8.592 960 H ARG 17 HN ARG 17 3.103 2.481 7.573 961 HA ARG 17 HA ARG 17 3.153 5.094 6.450 962 HB2 ARG 17 HB2 ARG 17 4.748 4.592 8.134 963 HB3 ARG 17 HB1 ARG 17 5.297 3.152 7.292 964 HG2 ARG 17 HG2 ARG 17 6.482 4.393 5.706 965 HG3 ARG 17 HG1 ARG 17 5.631 5.885 6.113 966 HD2 ARG 17 HD2 ARG 17 7.966 5.781 6.971 967 HD3 ARG 17 HD1 ARG 17 6.745 6.033 8.214 968 HE ARG 17 HE ARG 17 7.003 3.646 8.766 969 HH11 ARG 17 HH11 ARG 17 9.559 5.183 6.924 970 HH12 ARG 17 HH12 ARG 17 10.814 4.167 7.574 971 HH21 ARG 17 HH21 ARG 17 8.663 2.338 9.662 972 HH22 ARG 17 HH22 ARG 17 10.306 2.572 9.145 973 H VAL 18 HN VAL 18 4.261 1.915 5.259 974 HA VAL 18 HA VAL 18 5.267 2.957 2.821 975 HB VAL 18 HB VAL 18 5.348 0.629 2.019 976 HG11 VAL 18 HG11 VAL 18 6.327 0.954 4.853 977 HG12 VAL 18 HG12 VAL 18 7.153 1.533 3.408 978 HG13 VAL 18 HG13 VAL 18 6.937 -0.199 3.667 979 HG21 VAL 18 HG21 VAL 18 4.012 -0.051 4.639 980 HG22 VAL 18 HG22 VAL 18 4.677 -1.208 3.485 981 HG23 VAL 18 HG23 VAL 18 3.294 -0.211 3.033 982 H GLY 19 HN GLY 19 2.136 1.648 3.768 983 HA2 GLY 19 HA2 GLY 19 1.033 1.670 1.135 984 HA3 GLY 19 HA1 GLY 19 0.126 1.573 2.640 985 H LYS 20 HN LYS 20 1.336 4.009 3.693 986 HA LYS 20 HA LYS 20 -0.553 5.896 2.778 987 HB2 LYS 20 HB2 LYS 20 0.539 5.749 5.054 988 HB3 LYS 20 HB1 LYS 20 1.973 6.458 4.336 989 HG2 LYS 20 HG2 LYS 20 0.858 8.502 3.916 990 HG3 LYS 20 HG1 LYS 20 -0.716 7.799 4.300 991 HD2 LYS 20 HD2 LYS 20 1.564 8.085 6.263 992 HD3 LYS 20 HD1 LYS 20 0.205 9.206 6.131 993 HE2 LYS 20 HE2 LYS 20 -1.348 7.544 6.802 994 HE3 LYS 20 HE1 LYS 20 -0.157 6.258 6.626 995 HZ1 LYS 20 HZ1 LYS 20 1.015 7.036 8.522 996 HZ2 LYS 20 HZ2 LYS 20 -0.619 6.941 8.957 997 HZ3 LYS 20 HZ3 LYS 20 0.080 8.448 8.622 998 H ALA 21 HN ALA 21 2.814 5.292 2.003 999 HA ALA 21 HA ALA 21 3.108 7.653 0.387 1000 HB1 ALA 21 HB1 ALA 21 5.263 6.711 -0.232 1001 HB2 ALA 21 HB2 ALA 21 4.816 5.169 0.500 1002 HB3 ALA 21 HB3 ALA 21 5.020 6.600 1.511 1003 H LEU 22 HN LEU 22 2.299 4.286 -0.158 1004 HA LEU 22 HA LEU 22 2.598 4.414 -3.014 1005 HB2 LEU 22 HB2 LEU 22 3.075 2.382 -1.726 1006 HB3 LEU 22 HB1 LEU 22 1.400 2.294 -1.224 1007 HG LEU 22 HG LEU 22 1.858 2.286 -4.147 1008 HD11 LEU 22 HD11 LEU 22 3.711 0.893 -3.442 1009 HD12 LEU 22 HD12 LEU 22 2.438 -0.106 -4.142 1010 HD13 LEU 22 HD13 LEU 22 2.642 -0.037 -2.392 1011 HD21 LEU 22 HD21 LEU 22 0.174 0.592 -2.298 1012 HD22 LEU 22 HD22 LEU 22 0.099 0.602 -4.061 1013 HD23 LEU 22 HD23 LEU 22 -0.371 2.038 -3.152 1014 H ALA 23 HN ALA 23 0.160 5.338 -0.880 1015 HA ALA 23 HA ALA 23 -2.147 4.565 -2.351 1016 HB1 ALA 23 HB1 ALA 23 -1.860 6.742 -0.291 1017 HB2 ALA 23 HB2 ALA 23 -2.180 5.042 0.052 1018 HB3 ALA 23 HB3 ALA 23 -3.368 6.003 -0.831 1019 H ASN 24 HN ASN 24 0.098 6.477 -3.528 1020 HA ASN 24 HA ASN 24 -1.790 8.451 -4.635 1021 HB2 ASN 24 HB2 ASN 24 1.092 8.852 -3.830 1022 HB3 ASN 24 HB1 ASN 24 0.200 9.993 -4.830 1023 HD21 ASN 24 HD21 ASN 24 0.459 8.552 -1.663 1024 HD22 ASN 24 HD22 ASN 24 -0.470 9.749 -0.835 1025 H GLY 25 HN GLY 25 -2.033 8.322 -6.754 1026 HA2 GLY 25 HA2 GLY 25 -0.635 6.456 -8.340 1027 HA3 GLY 25 HA1 GLY 25 -1.724 7.698 -8.940 1028 H ARG 26 HN ARG 26 -0.307 9.980 -8.035 1029 HA ARG 26 HA ARG 26 1.593 10.201 -10.141 1030 HB2 ARG 26 HB2 ARG 26 2.098 12.453 -9.138 1031 HB3 ARG 26 HB1 ARG 26 0.418 12.177 -9.572 1032 HG2 ARG 26 HG2 ARG 26 -0.181 11.831 -7.280 1033 HG3 ARG 26 HG1 ARG 26 1.511 11.892 -6.785 1034 HD2 ARG 26 HD2 ARG 26 0.110 13.992 -6.424 1035 HD3 ARG 26 HD1 ARG 26 1.675 14.188 -7.207 1036 HE ARG 26 HE ARG 26 0.608 14.756 -9.181 1037 HH11 ARG 26 HH11 ARG 26 -1.742 13.717 -6.805 1038 HH12 ARG 26 HH12 ARG 26 -3.102 14.348 -7.680 1039 HH21 ARG 26 HH21 ARG 26 -1.175 15.634 -10.330 1040 HH22 ARG 26 HH22 ARG 26 -2.779 15.454 -9.680 1041 H ARG 27 HN ARG 27 1.873 9.002 -6.982 1042 HA ARG 27 HA ARG 27 4.751 9.477 -6.906 1043 HB2 ARG 27 HB2 ARG 27 2.893 8.157 -4.920 1044 HB3 ARG 27 HB1 ARG 27 4.632 8.315 -4.693 1045 HG2 ARG 27 HG2 ARG 27 4.410 10.755 -4.821 1046 HG3 ARG 27 HG1 ARG 27 2.667 10.572 -4.995 1047 HD2 ARG 27 HD2 ARG 27 2.535 9.547 -2.794 1048 HD3 ARG 27 HD1 ARG 27 4.288 9.658 -2.620 1049 HE ARG 27 HE ARG 27 3.593 12.216 -3.092 1050 HH11 ARG 27 HH11 ARG 27 2.365 9.868 -0.799 1051 HH12 ARG 27 HH12 ARG 27 1.901 11.065 0.370 1052 HH21 ARG 27 HH21 ARG 27 3.040 13.774 -1.550 1053 HH22 ARG 27 HH22 ARG 27 2.317 13.298 -0.043 1054 H LEU 28 HN LEU 28 2.422 7.018 -7.612 1055 HA LEU 28 HA LEU 28 4.249 4.829 -7.652 1056 HB2 LEU 28 HB2 LEU 28 1.579 5.194 -9.013 1057 HB3 LEU 28 HB1 LEU 28 2.462 3.681 -8.936 1058 HG LEU 28 HG LEU 28 1.356 5.195 -6.571 1059 HD11 LEU 28 HD11 LEU 28 -0.184 3.302 -6.385 1060 HD12 LEU 28 HD12 LEU 28 0.467 2.632 -7.882 1061 HD13 LEU 28 HD13 LEU 28 -0.392 4.174 -7.906 1062 HD21 LEU 28 HD21 LEU 28 3.407 4.004 -6.013 1063 HD22 LEU 28 HD22 LEU 28 2.750 2.525 -6.715 1064 HD23 LEU 28 HD23 LEU 28 2.005 3.226 -5.278 1065 H GLN 29 HN GLN 29 3.196 7.248 -9.958 1066 HA GLN 29 HA GLN 29 4.319 6.195 -12.293 1067 HB2 GLN 29 HB2 GLN 29 4.059 9.083 -11.433 1068 HB3 GLN 29 HB1 GLN 29 4.496 8.567 -13.056 1069 HG2 GLN 29 HG2 GLN 29 2.321 7.388 -13.207 1070 HG3 GLN 29 HG1 GLN 29 1.889 8.072 -11.638 1071 HE21 GLN 29 HE21 GLN 29 1.481 10.278 -11.482 1072 HE22 GLN 29 HE22 GLN 29 1.188 11.276 -12.864 1073 H ILE 30 HN ILE 30 5.755 7.856 -9.578 1074 HA ILE 30 HA ILE 30 8.306 8.324 -10.705 1075 HB ILE 30 HB ILE 30 7.570 7.910 -7.800 1076 HG12 ILE 30 HG12 ILE 30 7.842 10.457 -9.416 1077 HG13 ILE 30 HG11 ILE 30 6.324 9.751 -8.872 1078 HG21 ILE 30 HG21 ILE 30 10.014 9.171 -9.042 1079 HG22 ILE 30 HG22 ILE 30 9.958 7.635 -8.176 1080 HG23 ILE 30 HG23 ILE 30 9.637 9.142 -7.319 1081 HD11 ILE 30 HD11 ILE 30 7.000 10.096 -6.553 1082 HD12 ILE 30 HD12 ILE 30 6.984 11.608 -7.463 1083 HD13 ILE 30 HD13 ILE 30 8.516 10.810 -7.102 1084 H LEU 31 HN LEU 31 7.010 5.697 -8.696 1085 HA LEU 31 HA LEU 31 9.361 4.168 -8.559 1086 HB2 LEU 31 HB2 LEU 31 6.481 3.261 -8.461 1087 HB3 LEU 31 HB1 LEU 31 7.858 2.289 -7.982 1088 HG LEU 31 HG LEU 31 7.026 4.870 -6.652 1089 HD11 LEU 31 HD11 LEU 31 5.394 3.108 -6.271 1090 HD12 LEU 31 HD12 LEU 31 6.310 3.445 -4.802 1091 HD13 LEU 31 HD13 LEU 31 6.677 2.014 -5.764 1092 HD21 LEU 31 HD21 LEU 31 9.110 2.818 -5.920 1093 HD22 LEU 31 HD22 LEU 31 8.629 4.190 -4.919 1094 HD23 LEU 31 HD23 LEU 31 9.411 4.463 -6.478 1095 H ASP 32 HN ASP 32 6.673 4.141 -10.848 1096 HA ASP 32 HA ASP 32 7.523 1.972 -12.432 1097 HB2 ASP 32 HB2 ASP 32 5.258 2.835 -12.581 1098 HB3 ASP 32 HB1 ASP 32 5.852 4.395 -13.134 1099 H LEU 33 HN LEU 33 8.278 5.407 -12.534 1100 HA LEU 33 HA LEU 33 9.747 5.302 -14.971 1101 HB2 LEU 33 HB2 LEU 33 8.752 7.372 -14.110 1102 HB3 LEU 33 HB1 LEU 33 9.830 7.320 -12.730 1103 HG LEU 33 HG LEU 33 11.761 7.552 -14.290 1104 HD11 LEU 33 HD11 LEU 33 11.353 8.275 -16.574 1105 HD12 LEU 33 HD12 LEU 33 9.617 8.076 -16.342 1106 HD13 LEU 33 HD13 LEU 33 10.678 6.668 -16.298 1107 HD21 LEU 33 HD21 LEU 33 9.698 9.746 -14.444 1108 HD22 LEU 33 HD22 LEU 33 11.434 9.925 -14.699 1109 HD23 LEU 33 HD23 LEU 33 10.818 9.478 -13.109 1110 H LEU 34 HN LEU 34 10.607 5.072 -11.553 1111 HA LEU 34 HA LEU 34 13.421 5.115 -11.989 1112 HB2 LEU 34 HB2 LEU 34 11.848 4.097 -9.625 1113 HB3 LEU 34 HB1 LEU 34 13.583 4.342 -9.649 1114 HG LEU 34 HG LEU 34 11.466 6.480 -9.886 1115 HD11 LEU 34 HD11 LEU 34 13.487 5.881 -7.733 1116 HD12 LEU 34 HD12 LEU 34 11.745 5.625 -7.628 1117 HD13 LEU 34 HD13 LEU 34 12.393 7.262 -7.759 1118 HD21 LEU 34 HD21 LEU 34 14.470 6.738 -9.944 1119 HD22 LEU 34 HD22 LEU 34 13.318 8.074 -9.894 1120 HD23 LEU 34 HD23 LEU 34 13.378 7.014 -11.301 1121 H ALA 35 HN ALA 35 11.006 2.609 -12.007 1122 HA ALA 35 HA ALA 35 12.790 0.397 -11.924 1123 HB1 ALA 35 HB1 ALA 35 10.923 -0.902 -12.806 1124 HB2 ALA 35 HB2 ALA 35 10.054 0.584 -13.184 1125 HB3 ALA 35 HB3 ALA 35 10.384 0.160 -11.506 1126 H GLN 36 HN GLN 36 11.862 2.667 -14.325 1127 HA GLN 36 HA GLN 36 13.022 1.116 -16.505 1128 HB2 GLN 36 HB2 GLN 36 11.606 3.788 -16.441 1129 HB3 GLN 36 HB1 GLN 36 12.261 3.058 -17.900 1130 HG2 GLN 36 HG2 GLN 36 10.738 1.208 -17.727 1131 HG3 GLN 36 HG1 GLN 36 10.163 1.781 -16.161 1132 HE21 GLN 36 HE21 GLN 36 8.754 3.482 -16.063 1133 HE22 GLN 36 HE22 GLN 36 7.945 4.123 -17.454 1134 H GLY 37 HN GLY 37 14.403 2.577 -14.125 1135 HA2 GLY 37 HA2 GLY 37 16.876 2.795 -14.638 1136 HA3 GLY 37 HA1 GLY 37 16.365 4.036 -15.772 1137 H GLU 38 HN GLU 38 18.164 4.304 -13.531 1138 HA GLU 38 HA GLU 38 16.838 5.672 -11.403 1139 HB2 GLU 38 HB2 GLU 38 19.161 6.416 -10.820 1140 HB3 GLU 38 HB1 GLU 38 18.980 4.672 -10.978 1141 HG2 GLU 38 HG2 GLU 38 19.807 4.996 -13.378 1142 HG3 GLU 38 HG1 GLU 38 20.314 6.596 -12.846 1143 H ARG 39 HN ARG 39 16.284 7.782 -11.232 1144 HA ARG 39 HA ARG 39 16.982 9.525 -13.506 1145 HB2 ARG 39 HB2 ARG 39 14.254 9.344 -12.208 1146 HB3 ARG 39 HB1 ARG 39 14.698 10.355 -13.575 1147 HG2 ARG 39 HG2 ARG 39 14.659 7.342 -13.560 1148 HG3 ARG 39 HG1 ARG 39 13.435 8.394 -14.272 1149 HD2 ARG 39 HD2 ARG 39 14.985 9.224 -15.885 1150 HD3 ARG 39 HD1 ARG 39 16.332 8.414 -15.086 1151 HE ARG 39 HE ARG 39 14.740 6.352 -15.711 1152 HH11 ARG 39 HH11 ARG 39 15.846 9.069 -17.625 1153 HH12 ARG 39 HH12 ARG 39 15.886 8.163 -19.110 1154 HH21 ARG 39 HH21 ARG 39 14.810 5.158 -17.670 1155 HH22 ARG 39 HH22 ARG 39 15.271 5.965 -19.143 1156 H ALA 40 HN ALA 40 17.069 11.743 -13.077 1157 HA ALA 40 HA ALA 40 17.653 12.423 -10.323 1158 HB1 ALA 40 HB1 ALA 40 19.123 13.216 -12.127 1159 HB2 ALA 40 HB2 ALA 40 18.427 14.556 -11.217 1160 HB3 ALA 40 HB3 ALA 40 17.783 14.140 -12.805 1161 H VAL 41 HN VAL 41 16.831 14.628 -9.556 1162 HA VAL 41 HA VAL 41 14.119 14.508 -9.072 1163 HB VAL 41 HB VAL 41 15.780 17.033 -9.080 1164 HG11 VAL 41 HG11 VAL 41 13.408 17.488 -8.897 1165 HG12 VAL 41 HG12 VAL 41 14.203 17.784 -7.351 1166 HG13 VAL 41 HG13 VAL 41 13.259 16.312 -7.590 1167 HG21 VAL 41 HG21 VAL 41 16.184 16.527 -6.701 1168 HG22 VAL 41 HG22 VAL 41 16.880 15.312 -7.775 1169 HG23 VAL 41 HG23 VAL 41 15.377 14.973 -6.916 1170 H GLU 42 HN GLU 42 15.732 16.751 -11.353 1171 HA GLU 42 HA GLU 42 13.396 17.899 -12.372 1172 HB2 GLU 42 HB2 GLU 42 15.875 17.456 -14.034 1173 HB3 GLU 42 HB1 GLU 42 14.698 18.753 -14.175 1174 HG2 GLU 42 HG2 GLU 42 16.396 19.859 -13.144 1175 HG3 GLU 42 HG1 GLU 42 15.499 19.299 -11.730 1176 H ALA 43 HN ALA 43 15.135 15.008 -13.367 1177 HA ALA 43 HA ALA 43 13.760 14.513 -15.764 1178 HB1 ALA 43 HB1 ALA 43 14.605 12.245 -15.588 1179 HB2 ALA 43 HB2 ALA 43 15.001 12.504 -13.890 1180 HB3 ALA 43 HB3 ALA 43 15.859 13.403 -15.141 1181 H ILE 44 HN ILE 44 13.200 13.290 -12.475 1182 HA ILE 44 HA ILE 44 10.931 11.744 -13.096 1183 HB ILE 44 HB ILE 44 11.651 13.068 -10.473 1184 HG12 ILE 44 HG12 ILE 44 12.178 10.250 -11.442 1185 HG13 ILE 44 HG11 ILE 44 13.381 11.535 -11.397 1186 HG21 ILE 44 HG21 ILE 44 9.312 12.423 -10.513 1187 HG22 ILE 44 HG22 ILE 44 10.221 11.339 -9.458 1188 HG23 ILE 44 HG23 ILE 44 9.745 10.806 -11.069 1189 HD11 ILE 44 HD11 ILE 44 13.196 11.644 -8.981 1190 HD12 ILE 44 HD12 ILE 44 13.595 10.011 -9.511 1191 HD13 ILE 44 HD13 ILE 44 11.948 10.397 -9.010 1192 H ALA 45 HN ALA 45 11.262 15.075 -11.918 1193 HA ALA 45 HA ALA 45 8.531 15.636 -11.610 1194 HB1 ALA 45 HB1 ALA 45 10.757 17.550 -12.298 1195 HB2 ALA 45 HB2 ALA 45 10.300 17.042 -10.672 1196 HB3 ALA 45 HB3 ALA 45 9.177 17.988 -11.649 1197 H THR 46 HN THR 46 10.665 16.007 -14.406 1198 HA THR 46 HA THR 46 8.770 17.341 -16.037 1199 HB THR 46 HB THR 46 11.140 15.680 -16.927 1200 HG1 THR 46 HG1 THR 46 11.927 17.272 -15.600 1201 HG21 THR 46 HG21 THR 46 9.555 16.233 -18.734 1202 HG22 THR 46 HG22 THR 46 11.092 17.076 -18.925 1203 HG23 THR 46 HG23 THR 46 9.683 17.940 -18.308 1204 H ALA 47 HN ALA 47 9.701 13.920 -15.755 1205 HA ALA 47 HA ALA 47 8.108 13.011 -17.905 1206 HB1 ALA 47 HB1 ALA 47 9.078 11.451 -15.515 1207 HB2 ALA 47 HB2 ALA 47 10.006 11.753 -16.985 1208 HB3 ALA 47 HB3 ALA 47 8.532 10.786 -17.056 1209 H THR 48 HN THR 48 7.405 13.572 -14.519 1210 HA THR 48 HA THR 48 4.845 12.210 -14.708 1211 HB THR 48 HB THR 48 4.595 12.989 -12.306 1212 HG1 THR 48 HG1 THR 48 7.379 13.502 -12.410 1213 HG21 THR 48 HG21 THR 48 6.983 11.291 -13.035 1214 HG22 THR 48 HG22 THR 48 5.325 10.732 -12.820 1215 HG23 THR 48 HG23 THR 48 6.233 11.353 -11.441 1216 H GLY 49 HN GLY 49 6.059 15.292 -15.324 1217 HA2 GLY 49 HA2 GLY 49 4.979 17.200 -16.024 1218 HA3 GLY 49 HA1 GLY 49 3.460 16.331 -15.889 1219 H MET 50 HN MET 50 5.801 16.836 -13.300 1220 HA MET 50 HA MET 50 3.853 18.608 -11.972 1221 HB2 MET 50 HB2 MET 50 5.466 16.376 -10.721 1222 HB3 MET 50 HB1 MET 50 4.574 17.578 -9.802 1223 HG2 MET 50 HG2 MET 50 2.492 16.810 -10.840 1224 HG3 MET 50 HG1 MET 50 3.397 15.588 -11.731 1225 HE1 MET 50 HE1 MET 50 4.651 13.534 -10.567 1226 HE2 MET 50 HE2 MET 50 4.742 13.324 -8.818 1227 HE3 MET 50 HE3 MET 50 5.548 14.693 -9.586 1228 H ASN 51 HN ASN 51 4.937 19.784 -10.074 1229 HA ASN 51 HA ASN 51 7.251 21.144 -11.105 1230 HB2 ASN 51 HB2 ASN 51 5.513 21.493 -8.682 1231 HB3 ASN 51 HB1 ASN 51 7.062 22.329 -8.785 1232 HD21 ASN 51 HD21 ASN 51 7.378 23.876 -10.382 1233 HD22 ASN 51 HD22 ASN 51 6.052 24.633 -11.202 1234 H LEU 52 HN LEU 52 9.210 21.509 -9.844 1235 HA LEU 52 HA LEU 52 10.456 19.125 -9.049 1236 HB2 LEU 52 HB2 LEU 52 11.199 21.998 -8.496 1237 HB3 LEU 52 HB1 LEU 52 12.229 20.638 -8.095 1238 HG LEU 52 HG LEU 52 11.345 21.383 -10.887 1239 HD11 LEU 52 HD11 LEU 52 12.902 23.001 -9.928 1240 HD12 LEU 52 HD12 LEU 52 13.652 22.064 -11.222 1241 HD13 LEU 52 HD13 LEU 52 14.018 21.693 -9.536 1242 HD21 LEU 52 HD21 LEU 52 11.702 18.993 -10.645 1243 HD22 LEU 52 HD22 LEU 52 13.276 19.287 -9.907 1244 HD23 LEU 52 HD23 LEU 52 12.998 19.721 -11.594 1245 H THR 53 HN THR 53 9.035 21.738 -7.142 1246 HA THR 53 HA THR 53 9.653 20.769 -4.596 1247 HB THR 53 HB THR 53 7.128 22.255 -5.320 1248 HG1 THR 53 HG1 THR 53 8.684 24.105 -4.737 1249 HG21 THR 53 HG21 THR 53 7.392 23.230 -3.087 1250 HG22 THR 53 HG22 THR 53 8.844 22.260 -2.835 1251 HG23 THR 53 HG23 THR 53 7.275 21.472 -3.005 1252 H THR 54 HN THR 54 6.766 20.280 -6.602 1253 HA THR 54 HA THR 54 5.331 18.633 -4.865 1254 HB THR 54 HB THR 54 5.309 18.437 -7.881 1255 HG1 THR 54 HG1 THR 54 3.653 20.189 -6.384 1256 HG21 THR 54 HG21 THR 54 3.976 16.742 -6.754 1257 HG22 THR 54 HG22 THR 54 2.915 17.923 -7.524 1258 HG23 THR 54 HG23 THR 54 3.183 17.981 -5.782 1259 H ALA 55 HN ALA 55 7.587 17.798 -7.485 1260 HA ALA 55 HA ALA 55 7.461 15.016 -7.224 1261 HB1 ALA 55 HB1 ALA 55 9.583 14.966 -8.421 1262 HB2 ALA 55 HB2 ALA 55 9.805 16.689 -8.118 1263 HB3 ALA 55 HB3 ALA 55 8.481 16.137 -9.144 1264 H SER 56 HN SER 56 9.598 17.379 -5.659 1265 HA SER 56 HA SER 56 11.195 15.493 -4.306 1266 HB2 SER 56 HB2 SER 56 10.624 18.386 -3.625 1267 HB3 SER 56 HB1 SER 56 11.921 17.413 -2.927 1268 HG SER 56 HG SER 56 11.611 18.324 -5.587 1269 H ALA 57 HN ALA 57 8.207 17.155 -3.384 1270 HA ALA 57 HA ALA 57 8.098 16.219 -0.722 1271 HB1 ALA 57 HB1 ALA 57 6.674 18.030 -1.517 1272 HB2 ALA 57 HB2 ALA 57 5.698 16.723 -0.846 1273 HB3 ALA 57 HB3 ALA 57 5.833 16.916 -2.594 1274 H ASN 58 HN ASN 58 6.959 14.879 -3.779 1275 HA ASN 58 HA ASN 58 5.730 12.569 -2.683 1276 HB2 ASN 58 HB2 ASN 58 6.811 13.141 -5.448 1277 HB3 ASN 58 HB1 ASN 58 5.917 11.683 -5.030 1278 HD21 ASN 58 HD21 ASN 58 5.290 13.838 -6.910 1279 HD22 ASN 58 HD22 ASN 58 3.747 14.445 -6.428 1280 H LEU 59 HN LEU 59 8.932 13.189 -4.044 1281 HA LEU 59 HA LEU 59 10.004 10.620 -3.775 1282 HB2 LEU 59 HB2 LEU 59 11.336 13.325 -3.612 1283 HB3 LEU 59 HB1 LEU 59 12.213 11.809 -3.690 1284 HG LEU 59 HG LEU 59 10.300 12.745 -5.829 1285 HD11 LEU 59 HD11 LEU 59 12.166 14.298 -5.672 1286 HD12 LEU 59 HD12 LEU 59 12.303 13.310 -7.127 1287 HD13 LEU 59 HD13 LEU 59 13.308 12.953 -5.724 1288 HD21 LEU 59 HD21 LEU 59 11.384 11.023 -7.176 1289 HD22 LEU 59 HD22 LEU 59 10.649 10.326 -5.732 1290 HD23 LEU 59 HD23 LEU 59 12.393 10.573 -5.803 1291 H GLN 60 HN GLN 60 9.958 13.347 -1.516 1292 HA GLN 60 HA GLN 60 11.388 12.163 0.576 1293 HB2 GLN 60 HB2 GLN 60 10.870 14.550 0.523 1294 HB3 GLN 60 HB1 GLN 60 9.155 14.204 0.682 1295 HG2 GLN 60 HG2 GLN 60 10.106 14.963 2.785 1296 HG3 GLN 60 HG1 GLN 60 9.526 13.305 2.908 1297 HE21 GLN 60 HE21 GLN 60 10.973 11.649 3.230 1298 HE22 GLN 60 HE22 GLN 60 12.627 11.924 3.661 1299 H ALA 61 HN ALA 61 7.890 12.182 -0.096 1300 HA ALA 61 HA ALA 61 7.081 10.744 2.162 1301 HB1 ALA 61 HB1 ALA 61 5.529 11.937 0.701 1302 HB2 ALA 61 HB2 ALA 61 5.039 10.258 0.932 1303 HB3 ALA 61 HB3 ALA 61 5.814 10.752 -0.574 1304 H LEU 62 HN LEU 62 8.019 9.592 -1.060 1305 HA LEU 62 HA LEU 62 7.584 6.844 -0.513 1306 HB2 LEU 62 HB2 LEU 62 9.385 8.166 -2.541 1307 HB3 LEU 62 HB1 LEU 62 8.989 6.459 -2.518 1308 HG LEU 62 HG LEU 62 7.010 8.702 -2.935 1309 HD11 LEU 62 HD11 LEU 62 8.488 8.484 -4.832 1310 HD12 LEU 62 HD12 LEU 62 6.897 7.839 -5.236 1311 HD13 LEU 62 HD13 LEU 62 8.227 6.739 -4.871 1312 HD21 LEU 62 HD21 LEU 62 6.010 6.762 -1.842 1313 HD22 LEU 62 HD22 LEU 62 6.665 5.707 -3.093 1314 HD23 LEU 62 HD23 LEU 62 5.442 6.911 -3.505 1315 H LYS 63 HN LYS 63 10.287 9.008 -0.041 1316 HA LYS 63 HA LYS 63 12.168 6.931 0.545 1317 HB2 LYS 63 HB2 LYS 63 12.856 9.130 -0.349 1318 HB3 LYS 63 HB1 LYS 63 12.326 9.889 1.146 1319 HG2 LYS 63 HG2 LYS 63 14.027 8.858 2.395 1320 HG3 LYS 63 HG1 LYS 63 14.407 7.732 1.090 1321 HD2 LYS 63 HD2 LYS 63 15.155 9.645 -0.288 1322 HD3 LYS 63 HD1 LYS 63 14.861 10.713 1.088 1323 HE2 LYS 63 HE2 LYS 63 17.238 9.971 0.790 1324 HE3 LYS 63 HE1 LYS 63 16.543 9.656 2.381 1325 HZ1 LYS 63 HZ1 LYS 63 16.255 7.372 1.840 1326 HZ2 LYS 63 HZ2 LYS 63 17.847 7.776 1.410 1327 HZ3 LYS 63 HZ3 LYS 63 16.657 7.631 0.218 1328 H SER 64 HN SER 64 10.073 9.051 2.441 1329 HA SER 64 HA SER 64 11.000 8.228 4.986 1330 HB2 SER 64 HB2 SER 64 8.236 9.198 4.212 1331 HB3 SER 64 HB1 SER 64 8.909 9.161 5.843 1332 HG SER 64 HG SER 64 8.996 11.204 4.458 1333 H GLY 65 HN GLY 65 8.775 6.863 2.669 1334 HA2 GLY 65 HA2 GLY 65 7.758 4.818 4.393 1335 HA3 GLY 65 HA1 GLY 65 7.673 4.836 2.636 1336 H GLY 66 HN GLY 66 10.632 5.242 2.517 1337 HA2 GLY 66 HA2 GLY 66 12.598 3.981 2.783 1338 HA3 GLY 66 HA1 GLY 66 11.643 2.677 3.475 1339 H LEU 67 HN LEU 67 10.592 4.188 0.545 1340 HA LEU 67 HA LEU 67 10.910 1.631 -0.807 1341 HB2 LEU 67 HB2 LEU 67 9.170 3.996 -1.128 1342 HB3 LEU 67 HB1 LEU 67 9.599 3.152 -2.603 1343 HG LEU 67 HG LEU 67 8.612 1.104 -1.794 1344 HD11 LEU 67 HD11 LEU 67 9.186 1.264 0.559 1345 HD12 LEU 67 HD12 LEU 67 7.455 0.991 0.365 1346 HD13 LEU 67 HD13 LEU 67 8.055 2.601 0.765 1347 HD21 LEU 67 HD21 LEU 67 6.775 3.438 -1.286 1348 HD22 LEU 67 HD22 LEU 67 6.283 1.782 -1.646 1349 HD23 LEU 67 HD23 LEU 67 7.134 2.733 -2.863 1350 H VAL 68 HN VAL 68 12.141 4.912 -1.011 1351 HA VAL 68 HA VAL 68 13.869 4.033 -3.218 1352 HB VAL 68 HB VAL 68 13.661 6.232 -4.317 1353 HG11 VAL 68 HG11 VAL 68 11.438 5.868 -5.294 1354 HG12 VAL 68 HG12 VAL 68 11.065 4.737 -3.993 1355 HG13 VAL 68 HG13 VAL 68 12.352 4.369 -5.141 1356 HG21 VAL 68 HG21 VAL 68 11.421 6.694 -2.351 1357 HG22 VAL 68 HG22 VAL 68 11.805 7.724 -3.732 1358 HG23 VAL 68 HG23 VAL 68 12.955 7.563 -2.403 1359 H GLU 69 HN GLU 69 15.862 5.085 -3.414 1360 HA GLU 69 HA GLU 69 16.603 6.910 -1.234 1361 HB2 GLU 69 HB2 GLU 69 18.236 4.561 -2.217 1362 HB3 GLU 69 HB1 GLU 69 18.834 5.804 -1.124 1363 HG2 GLU 69 HG2 GLU 69 17.025 5.175 0.466 1364 HG3 GLU 69 HG1 GLU 69 16.624 3.834 -0.604 1365 H ALA 70 HN ALA 70 18.687 8.099 -1.770 1366 HA ALA 70 HA ALA 70 18.912 8.559 -4.663 1367 HB1 ALA 70 HB1 ALA 70 17.296 10.176 -3.869 1368 HB2 ALA 70 HB2 ALA 70 18.798 10.990 -4.302 1369 HB3 ALA 70 HB3 ALA 70 18.406 10.705 -2.606 1370 H ARG 71 HN ARG 71 20.763 9.880 -5.250 1371 HA ARG 71 HA ARG 71 22.904 9.942 -3.229 1372 HB2 ARG 71 HB2 ARG 71 24.526 9.265 -4.878 1373 HB3 ARG 71 HB1 ARG 71 23.231 8.077 -4.872 1374 HG2 ARG 71 HG2 ARG 71 22.270 9.118 -6.867 1375 HG3 ARG 71 HG1 ARG 71 23.576 10.303 -6.876 1376 HD2 ARG 71 HD2 ARG 71 24.079 8.575 -8.464 1377 HD3 ARG 71 HD1 ARG 71 25.196 8.445 -7.107 1378 HE ARG 71 HE ARG 71 23.837 6.565 -6.307 1379 HH11 ARG 71 HH11 ARG 71 23.477 7.579 -9.631 1380 HH12 ARG 71 HH12 ARG 71 22.863 6.047 -10.184 1381 HH21 ARG 71 HH21 ARG 71 23.063 4.541 -7.003 1382 HH22 ARG 71 HH22 ARG 71 22.622 4.296 -8.670 1383 H ARG 72 HN ARG 72 24.407 11.679 -3.465 1384 HA ARG 72 HA ARG 72 23.296 13.948 -4.951 1385 HB2 ARG 72 HB2 ARG 72 25.450 13.834 -2.834 1386 HB3 ARG 72 HB1 ARG 72 24.954 15.302 -3.662 1387 HG2 ARG 72 HG2 ARG 72 22.634 14.883 -2.765 1388 HG3 ARG 72 HG1 ARG 72 23.350 13.620 -1.759 1389 HD2 ARG 72 HD2 ARG 72 24.881 15.281 -0.788 1390 HD3 ARG 72 HD1 ARG 72 24.124 16.537 -1.767 1391 HE ARG 72 HE ARG 72 22.705 15.016 0.334 1392 HH11 ARG 72 HH11 ARG 72 23.316 17.984 -1.429 1393 HH12 ARG 72 HH12 ARG 72 22.205 18.929 -0.484 1394 HH21 ARG 72 HH21 ARG 72 21.281 16.236 1.595 1395 HH22 ARG 72 HH22 ARG 72 21.053 17.936 1.268 1396 H GLU 73 HN GLU 73 24.046 14.314 -6.916 1397 HA GLU 73 HA GLU 73 26.932 13.997 -7.365 1398 HB2 GLU 73 HB2 GLU 73 24.731 13.352 -9.332 1399 HB3 GLU 73 HB1 GLU 73 26.446 13.383 -9.720 1400 HG2 GLU 73 HG2 GLU 73 26.717 11.640 -7.879 1401 HG3 GLU 73 HG1 GLU 73 24.965 11.472 -7.951 1402 H GLY 74 HN GLY 74 27.521 16.069 -7.170 1403 HA2 GLY 74 HA2 GLY 74 27.793 18.272 -7.787 1404 HA3 GLY 74 HA1 GLY 74 26.792 17.951 -9.200 1405 H THR 75 HN THR 75 25.151 19.318 -9.231 1406 HA THR 75 HA THR 75 23.883 20.168 -6.760 1407 HB THR 75 HB THR 75 22.459 21.534 -8.373 1408 HG1 THR 75 HG1 THR 75 22.669 20.901 -10.384 1409 HG21 THR 75 HG21 THR 75 24.333 22.522 -7.165 1410 HG22 THR 75 HG22 THR 75 24.251 23.167 -8.804 1411 HG23 THR 75 HG23 THR 75 25.453 21.943 -8.397 1412 H ARG 76 HN ARG 76 23.558 17.706 -9.036 1413 HA ARG 76 HA ARG 76 20.661 17.541 -8.829 1414 HB2 ARG 76 HB2 ARG 76 22.713 16.428 -10.657 1415 HB3 ARG 76 HB1 ARG 76 21.246 15.483 -10.416 1416 HG2 ARG 76 HG2 ARG 76 19.885 17.171 -11.255 1417 HG3 ARG 76 HG1 ARG 76 21.141 18.393 -11.091 1418 HD2 ARG 76 HD2 ARG 76 20.825 17.805 -13.407 1419 HD3 ARG 76 HD1 ARG 76 22.418 17.312 -12.855 1420 HE ARG 76 HE ARG 76 21.735 15.055 -12.989 1421 HH11 ARG 76 HH11 ARG 76 19.162 17.237 -13.901 1422 HH12 ARG 76 HH12 ARG 76 18.449 16.133 -15.045 1423 HH21 ARG 76 HH21 ARG 76 20.801 13.580 -14.473 1424 HH22 ARG 76 HH22 ARG 76 19.366 14.029 -15.353 1425 H GLN 77 HN GLN 77 19.627 15.567 -8.414 1426 HA GLN 77 HA GLN 77 21.120 13.667 -6.753 1427 HB2 GLN 77 HB2 GLN 77 18.464 14.951 -6.092 1428 HB3 GLN 77 HB1 GLN 77 19.066 13.507 -5.290 1429 HG2 GLN 77 HG2 GLN 77 20.993 14.740 -4.480 1430 HG3 GLN 77 HG1 GLN 77 20.433 16.185 -5.316 1431 HE21 GLN 77 HE21 GLN 77 18.243 13.992 -3.720 1432 HE22 GLN 77 HE22 GLN 77 17.817 15.051 -2.424 1433 H TYR 78 HN TYR 78 20.789 11.638 -7.324 1434 HA TYR 78 HA TYR 78 18.669 11.101 -9.289 1435 HB2 TYR 78 HB2 TYR 78 21.301 9.695 -8.784 1436 HB3 TYR 78 HB1 TYR 78 20.080 9.116 -9.913 1437 HD1 TYR 78 HD2 TYR 78 22.349 11.967 -9.193 1438 HD2 TYR 78 HD1 TYR 78 19.955 9.987 -12.100 1439 HE1 TYR 78 HE2 TYR 78 23.288 13.416 -10.944 1440 HE2 TYR 78 HE1 TYR 78 20.890 11.432 -13.860 1441 HH TYR 78 HH TYR 78 23.632 13.356 -13.399 1442 H TYR 79 HN TYR 79 17.069 9.765 -8.799 1443 HA TYR 79 HA TYR 79 17.215 8.375 -6.210 1444 HB2 TYR 79 HB2 TYR 79 14.862 9.475 -7.755 1445 HB3 TYR 79 HB1 TYR 79 14.687 8.418 -6.361 1446 HD1 TYR 79 HD1 TYR 79 16.092 11.693 -7.422 1447 HD2 TYR 79 HD2 TYR 79 14.695 9.295 -4.198 1448 HE1 TYR 79 HE1 TYR 79 16.189 13.646 -5.933 1449 HE2 TYR 79 HE2 TYR 79 14.788 11.241 -2.697 1450 HH TYR 79 HH TYR 79 15.070 14.396 -3.792 1451 H ARG 80 HN ARG 80 16.423 6.282 -6.017 1452 HA ARG 80 HA ARG 80 15.139 4.938 -8.195 1453 HB2 ARG 80 HB2 ARG 80 17.514 4.737 -8.897 1454 HB3 ARG 80 HB1 ARG 80 17.888 3.968 -7.360 1455 HG2 ARG 80 HG2 ARG 80 16.472 2.098 -7.902 1456 HG3 ARG 80 HG1 ARG 80 15.949 2.883 -9.391 1457 HD2 ARG 80 HD2 ARG 80 18.165 2.713 -10.314 1458 HD3 ARG 80 HD1 ARG 80 18.795 2.097 -8.782 1459 HE ARG 80 HE ARG 80 17.574 0.073 -9.137 1460 HH11 ARG 80 HH11 ARG 80 17.730 2.201 -11.917 1461 HH12 ARG 80 HH12 ARG 80 17.175 0.986 -13.026 1462 HH21 ARG 80 HH21 ARG 80 16.848 -1.518 -10.611 1463 HH22 ARG 80 HH22 ARG 80 16.689 -1.106 -12.299 1464 H ILE 81 HN ILE 81 14.500 2.709 -7.531 1465 HA ILE 81 HA ILE 81 13.389 2.600 -4.992 1466 HB ILE 81 HB ILE 81 14.158 0.238 -6.723 1467 HG12 ILE 81 HG12 ILE 81 11.583 1.831 -6.647 1468 HG13 ILE 81 HG11 ILE 81 12.796 1.928 -7.919 1469 HG21 ILE 81 HG21 ILE 81 12.301 -0.904 -5.581 1470 HG22 ILE 81 HG22 ILE 81 12.094 0.503 -4.538 1471 HG23 ILE 81 HG23 ILE 81 13.583 -0.439 -4.464 1472 HD11 ILE 81 HD11 ILE 81 11.169 -0.498 -7.203 1473 HD12 ILE 81 HD12 ILE 81 12.394 -0.416 -8.470 1474 HD13 ILE 81 HD13 ILE 81 10.925 0.552 -8.600 1475 H ALA 82 HN ALA 82 14.048 1.869 -3.039 1476 HA ALA 82 HA ALA 82 16.798 1.960 -2.451 1477 HB1 ALA 82 HB1 ALA 82 16.132 1.361 -0.169 1478 HB2 ALA 82 HB2 ALA 82 14.521 0.943 -0.755 1479 HB3 ALA 82 HB3 ALA 82 15.087 2.612 -0.848 1480 H GLY 83 HN GLY 83 14.612 -0.811 -1.929 1481 HA2 GLY 83 HA2 GLY 83 16.942 -2.568 -2.370 1482 HA3 GLY 83 HA1 GLY 83 15.633 -2.936 -1.253 1483 H GLU 84 HN GLU 84 16.665 -4.484 -3.534 1484 HA GLU 84 HA GLU 84 14.798 -4.305 -5.662 1485 HB2 GLU 84 HB2 GLU 84 15.732 -6.406 -6.441 1486 HB3 GLU 84 HB1 GLU 84 17.021 -5.326 -5.936 1487 HG2 GLU 84 HG2 GLU 84 17.801 -7.148 -4.888 1488 HG3 GLU 84 HG1 GLU 84 16.618 -6.711 -3.655 1489 H ASP 85 HN ASP 85 14.802 -5.916 -2.583 1490 HA ASP 85 HA ASP 85 12.593 -7.641 -3.104 1491 HB2 ASP 85 HB2 ASP 85 14.250 -7.914 -1.228 1492 HB3 ASP 85 HB1 ASP 85 13.487 -6.545 -0.429 1493 H VAL 86 HN VAL 86 12.952 -4.336 -2.016 1494 HA VAL 86 HA VAL 86 10.239 -3.800 -1.401 1495 HB VAL 86 HB VAL 86 12.309 -1.885 -2.508 1496 HG11 VAL 86 HG11 VAL 86 10.051 -0.998 -2.650 1497 HG12 VAL 86 HG12 VAL 86 10.965 -0.152 -1.400 1498 HG13 VAL 86 HG13 VAL 86 9.778 -1.377 -0.948 1499 HG21 VAL 86 HG21 VAL 86 11.660 -2.577 0.356 1500 HG22 VAL 86 HG22 VAL 86 12.752 -1.293 -0.167 1501 HG23 VAL 86 HG23 VAL 86 13.145 -2.978 -0.508 1502 H ALA 87 HN ALA 87 12.151 -3.685 -4.357 1503 HA ALA 87 HA ALA 87 10.131 -2.684 -6.064 1504 HB1 ALA 87 HB1 ALA 87 12.507 -2.641 -6.656 1505 HB2 ALA 87 HB2 ALA 87 11.547 -3.455 -7.891 1506 HB3 ALA 87 HB3 ALA 87 12.512 -4.403 -6.759 1507 H ARG 88 HN ARG 88 10.914 -5.892 -4.908 1508 HA ARG 88 HA ARG 88 9.289 -7.370 -6.683 1509 HB2 ARG 88 HB2 ARG 88 10.069 -7.983 -3.826 1510 HB3 ARG 88 HB1 ARG 88 9.336 -9.130 -4.938 1511 HG2 ARG 88 HG2 ARG 88 11.272 -8.992 -6.390 1512 HG3 ARG 88 HG1 ARG 88 11.999 -7.786 -5.325 1513 HD2 ARG 88 HD2 ARG 88 12.025 -9.422 -3.503 1514 HD3 ARG 88 HD1 ARG 88 11.329 -10.634 -4.586 1515 HE ARG 88 HE ARG 88 14.032 -9.475 -4.754 1516 HH11 ARG 88 HH11 ARG 88 11.710 -11.939 -5.697 1517 HH12 ARG 88 HH12 ARG 88 12.897 -12.900 -6.536 1518 HH21 ARG 88 HH21 ARG 88 15.566 -10.711 -5.840 1519 HH22 ARG 88 HH22 ARG 88 15.102 -12.212 -6.600 1520 H LEU 89 HN LEU 89 8.661 -5.774 -3.613 1521 HA LEU 89 HA LEU 89 6.024 -6.683 -3.242 1522 HB2 LEU 89 HB2 LEU 89 7.556 -5.544 -1.571 1523 HB3 LEU 89 HB1 LEU 89 7.159 -4.029 -2.354 1524 HG LEU 89 HG LEU 89 5.008 -5.783 -1.190 1525 HD11 LEU 89 HD11 LEU 89 6.627 -3.675 0.235 1526 HD12 LEU 89 HD12 LEU 89 6.629 -5.405 0.578 1527 HD13 LEU 89 HD13 LEU 89 5.173 -4.451 0.863 1528 HD21 LEU 89 HD21 LEU 89 5.194 -2.804 -1.647 1529 HD22 LEU 89 HD22 LEU 89 3.797 -3.681 -1.021 1530 HD23 LEU 89 HD23 LEU 89 4.333 -3.944 -2.680 1531 H PHE 90 HN PHE 90 7.299 -3.717 -4.748 1532 HA PHE 90 HA PHE 90 4.813 -2.634 -5.505 1533 HB2 PHE 90 HB2 PHE 90 6.824 -1.264 -5.477 1534 HB3 PHE 90 HB1 PHE 90 7.551 -2.248 -6.741 1535 HD1 PHE 90 HD2 PHE 90 4.478 -0.206 -6.132 1536 HD2 PHE 90 HD1 PHE 90 7.448 -1.485 -8.900 1537 HE1 PHE 90 HE2 PHE 90 3.518 1.278 -7.843 1538 HE2 PHE 90 HE1 PHE 90 6.493 -0.005 -10.616 1539 HZ PHE 90 HZ PHE 90 4.527 1.381 -10.087 1540 H ALA 91 HN ALA 91 7.013 -4.840 -7.162 1541 HA ALA 91 HA ALA 91 5.630 -4.941 -9.616 1542 HB1 ALA 91 HB1 ALA 91 7.322 -7.083 -8.323 1543 HB2 ALA 91 HB2 ALA 91 7.919 -5.773 -9.342 1544 HB3 ALA 91 HB3 ALA 91 6.861 -7.009 -10.024 1545 H LEU 92 HN LEU 92 5.351 -6.819 -6.639 1546 HA LEU 92 HA LEU 92 3.580 -8.780 -7.570 1547 HB2 LEU 92 HB2 LEU 92 4.890 -8.877 -5.461 1548 HB3 LEU 92 HB1 LEU 92 3.821 -7.674 -4.768 1549 HG LEU 92 HG LEU 92 2.671 -10.246 -5.790 1550 HD11 LEU 92 HD11 LEU 92 3.005 -11.226 -3.555 1551 HD12 LEU 92 HD12 LEU 92 4.021 -9.850 -3.122 1552 HD13 LEU 92 HD13 LEU 92 4.527 -10.952 -4.403 1553 HD21 LEU 92 HD21 LEU 92 1.046 -9.849 -4.012 1554 HD22 LEU 92 HD22 LEU 92 1.158 -8.451 -5.080 1555 HD23 LEU 92 HD23 LEU 92 1.940 -8.416 -3.500 1556 H VAL 93 HN VAL 93 2.876 -5.742 -5.810 1557 HA VAL 93 HA VAL 93 0.081 -6.094 -5.823 1558 HB VAL 93 HB VAL 93 1.180 -4.524 -4.297 1559 HG11 VAL 93 HG11 VAL 93 1.679 -2.850 -6.748 1560 HG12 VAL 93 HG12 VAL 93 2.894 -3.612 -5.722 1561 HG13 VAL 93 HG13 VAL 93 1.896 -2.303 -5.085 1562 HG21 VAL 93 HG21 VAL 93 -1.185 -4.238 -4.721 1563 HG22 VAL 93 HG22 VAL 93 -0.835 -3.213 -6.114 1564 HG23 VAL 93 HG23 VAL 93 -0.416 -2.668 -4.489 1565 H GLN 94 HN GLN 94 2.269 -4.707 -8.184 1566 HA GLN 94 HA GLN 94 0.269 -3.512 -9.805 1567 HB2 GLN 94 HB2 GLN 94 2.662 -2.892 -9.916 1568 HB3 GLN 94 HB1 GLN 94 3.025 -4.474 -10.595 1569 HG2 GLN 94 HG2 GLN 94 1.656 -3.969 -12.543 1570 HG3 GLN 94 HG1 GLN 94 1.247 -2.398 -11.857 1571 HE21 GLN 94 HE21 GLN 94 4.420 -3.815 -11.585 1572 HE22 GLN 94 HE22 GLN 94 5.220 -2.702 -12.635 1573 H VAL 95 HN VAL 95 1.869 -6.680 -9.829 1574 HA VAL 95 HA VAL 95 0.647 -7.663 -12.176 1575 HB VAL 95 HB VAL 95 1.659 -9.175 -9.757 1576 HG11 VAL 95 HG11 VAL 95 1.695 -11.155 -11.186 1577 HG12 VAL 95 HG12 VAL 95 0.964 -10.231 -12.498 1578 HG13 VAL 95 HG13 VAL 95 0.054 -10.530 -11.018 1579 HG21 VAL 95 HG21 VAL 95 3.379 -7.881 -10.906 1580 HG22 VAL 95 HG22 VAL 95 2.928 -8.625 -12.440 1581 HG23 VAL 95 HG23 VAL 95 3.624 -9.610 -11.151 1582 H VAL 96 HN VAL 96 -0.293 -7.862 -8.760 1583 HA VAL 96 HA VAL 96 -2.620 -9.386 -9.061 1584 HB VAL 96 HB VAL 96 -2.038 -7.200 -7.050 1585 HG11 VAL 96 HG11 VAL 96 -4.143 -9.360 -6.953 1586 HG12 VAL 96 HG12 VAL 96 -4.440 -7.640 -7.195 1587 HG13 VAL 96 HG13 VAL 96 -3.774 -8.213 -5.665 1588 HG21 VAL 96 HG21 VAL 96 -0.427 -9.034 -7.001 1589 HG22 VAL 96 HG22 VAL 96 -1.745 -10.195 -6.854 1590 HG23 VAL 96 HG23 VAL 96 -1.439 -9.041 -5.558 1591 H ALA 97 HN ALA 97 -2.159 -5.872 -9.165 1592 HA ALA 97 HA ALA 97 -4.860 -5.201 -9.602 1593 HB1 ALA 97 HB1 ALA 97 -3.164 -3.594 -8.849 1594 HB2 ALA 97 HB2 ALA 97 -4.036 -3.023 -10.272 1595 HB3 ALA 97 HB3 ALA 97 -2.404 -3.669 -10.439 1596 H ASP 98 HN ASP 98 -2.184 -5.768 -11.858 1597 HA ASP 98 HA ASP 98 -3.564 -5.045 -14.202 1598 HB2 ASP 98 HB2 ASP 98 -1.116 -5.204 -14.079 1599 HB3 ASP 98 HB1 ASP 98 -1.233 -6.946 -13.862 1600 H GLU 99 HN GLU 99 -2.998 -8.232 -12.736 1601 HA GLU 99 HA GLU 99 -4.265 -9.751 -14.743 1602 HB2 GLU 99 HB2 GLU 99 -2.734 -10.733 -13.126 1603 HB3 GLU 99 HB1 GLU 99 -3.828 -10.346 -11.810 1604 HG2 GLU 99 HG2 GLU 99 -3.929 -12.700 -12.377 1605 HG3 GLU 99 HG1 GLU 99 -5.469 -11.908 -12.696 1606 H HIS 100 HN HIS 100 -5.516 -8.214 -11.824 1607 HA HIS 100 HA HIS 100 -8.123 -9.461 -12.259 1608 HB2 HIS 100 HB2 HIS 100 -7.041 -7.822 -9.960 1609 HB3 HIS 100 HB1 HIS 100 -8.705 -8.389 -10.054 1610 HD1 HIS 100 HD1 HIS 100 -9.158 -10.683 -9.168 1611 HD2 HIS 100 HD2 HIS 100 -5.109 -10.032 -9.867 1612 HE1 HIS 100 HE1 HIS 100 -7.976 -12.705 -8.254 1613 HE2 HIS 100 HE2 HIS 100 -5.518 -12.202 -8.509 1614 H LEU 101 HN LEU 101 -6.589 -6.783 -13.350 1615 HA LEU 101 HA LEU 101 -8.459 -4.714 -12.938 1616 HB2 LEU 101 HB2 LEU 101 -6.099 -4.411 -13.670 1617 HB3 LEU 101 HB1 LEU 101 -6.535 -5.049 -15.240 1618 HG LEU 101 HG LEU 101 -8.040 -3.143 -15.608 1619 HD11 LEU 101 HD11 LEU 101 -7.024 -2.184 -12.937 1620 HD12 LEU 101 HD12 LEU 101 -8.673 -2.698 -13.302 1621 HD13 LEU 101 HD13 LEU 101 -8.011 -1.247 -14.059 1622 HD21 LEU 101 HD21 LEU 101 -5.243 -2.375 -14.780 1623 HD22 LEU 101 HD22 LEU 101 -6.310 -1.411 -15.800 1624 HD23 LEU 101 HD23 LEU 101 -5.737 -2.982 -16.362 1625 H GLU 102 HN GLU 102 -7.965 -6.896 -15.706 1626 HA GLU 102 HA GLU 102 -10.325 -5.918 -17.026 1627 HB2 GLU 102 HB2 GLU 102 -8.462 -8.210 -17.626 1628 HB3 GLU 102 HB1 GLU 102 -9.876 -7.845 -18.606 1629 HG2 GLU 102 HG2 GLU 102 -8.943 -5.548 -18.940 1630 HG3 GLU 102 HG1 GLU 102 -7.470 -6.104 -18.148 1631 H HIS 103 HN HIS 103 -9.798 -8.015 -14.514 1632 HA HIS 103 HA HIS 103 -11.158 -9.324 -13.269 1633 HB2 HIS 103 HB2 HIS 103 -13.333 -8.526 -15.216 1634 HB3 HIS 103 HB1 HIS 103 -13.585 -9.341 -13.678 1635 HD1 HIS 103 HD1 HIS 103 -13.402 -6.039 -15.175 1636 HD2 HIS 103 HD2 HIS 103 -12.761 -7.666 -11.400 1637 HE1 HIS 103 HE1 HIS 103 -13.493 -4.104 -13.578 1638 HE2 HIS 103 HE2 HIS 103 -13.291 -5.133 -11.285 1639 H HIS 104 HN HIS 104 -12.321 -9.816 -16.603 1640 HA HIS 104 HA HIS 104 -11.355 -12.571 -16.512 1641 HB2 HIS 104 HB2 HIS 104 -14.231 -11.772 -16.970 1642 HB3 HIS 104 HB1 HIS 104 -13.581 -13.312 -17.523 1643 HD1 HIS 104 HD1 HIS 104 -15.272 -11.844 -14.725 1644 HD2 HIS 104 HD2 HIS 104 -12.414 -14.826 -15.215 1645 HE1 HIS 104 HE1 HIS 104 -15.334 -13.201 -12.603 1646 HE2 HIS 104 HE2 HIS 104 -13.495 -14.908 -12.869 1647 H HIS 105 HN HIS 105 -11.741 -13.608 -18.746 1648 HA HIS 105 HA HIS 105 -10.671 -11.859 -20.724 1649 HB2 HIS 105 HB2 HIS 105 -11.091 -13.847 -22.287 1650 HB3 HIS 105 HB1 HIS 105 -9.946 -14.068 -20.975 1651 HD1 HIS 105 HD1 HIS 105 -10.145 -16.524 -20.674 1652 HD2 HIS 105 HD2 HIS 105 -13.846 -14.628 -20.582 1653 HE1 HIS 105 HE1 HIS 105 -11.796 -18.290 -19.974 1654 HE2 HIS 105 HE2 HIS 105 -13.972 -17.056 -19.689 1655 H HIS 106 HN HIS 106 -11.580 -11.283 -22.728 1656 HA HIS 106 HA HIS 106 -14.237 -10.291 -22.372 1657 HB2 HIS 106 HB2 HIS 106 -13.855 -9.278 -24.666 1658 HB3 HIS 106 HB1 HIS 106 -12.743 -8.781 -23.399 1659 HD1 HIS 106 HD1 HIS 106 -10.272 -9.390 -23.682 1660 HD2 HIS 106 HD2 HIS 106 -12.711 -10.836 -26.727 1661 HE1 HIS 106 HE1 HIS 106 -8.710 -10.184 -25.485 1662 HE2 HIS 106 HE2 HIS 106 -10.217 -10.812 -27.407 1663 H HIS 107 HN HIS 107 -15.912 -11.550 -22.619 1664 HA HIS 107 HA HIS 107 -16.085 -13.197 -25.051 1665 HB2 HIS 107 HB2 HIS 107 -15.592 -14.569 -22.976 1666 HB3 HIS 107 HB1 HIS 107 -17.159 -14.061 -22.361 1667 HD1 HIS 107 HD1 HIS 107 -19.275 -14.792 -23.977 1668 HD2 HIS 107 HD2 HIS 107 -15.661 -16.789 -24.522 1669 HE1 HIS 107 HE1 HIS 107 -19.843 -16.903 -25.214 1670 HE2 HIS 107 HE2 HIS 107 -17.655 -18.132 -25.477 1671 H HIS 108 HN HIS 108 -17.884 -12.839 -26.185 1672 HA HIS 108 HA HIS 108 -20.070 -11.390 -24.868 1673 HB2 HIS 108 HB2 HIS 108 -20.852 -10.952 -27.244 1674 HB3 HIS 108 HB1 HIS 108 -19.344 -10.176 -26.780 1675 HD1 HIS 108 HD1 HIS 108 -17.163 -11.074 -27.879 1676 HD2 HIS 108 HD2 HIS 108 -20.662 -12.792 -29.322 1677 HE1 HIS 108 HE1 HIS 108 -16.506 -12.277 -29.992 1678 HE2 HIS 108 HE2 HIS 108 -18.605 -13.459 -30.738 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 -11.457 18.901 -20.804 2 H2 MET 1 HT2 MET 1 -13.135 19.043 -20.667 3 H3 MET 1 HT3 MET 1 -12.386 19.284 -22.170 4 HA MET 1 HA MET 1 -12.528 16.737 -20.666 5 HB2 MET 1 HB2 MET 1 -13.826 17.669 -23.233 6 HB3 MET 1 HB1 MET 1 -13.812 15.998 -22.695 7 HG2 MET 1 HG2 MET 1 -15.047 16.641 -20.684 8 HG3 MET 1 HG1 MET 1 -15.069 18.311 -21.240 9 HE1 MET 1 HE1 MET 1 -16.410 19.167 -23.334 10 HE2 MET 1 HE2 MET 1 -17.328 18.120 -24.417 11 HE3 MET 1 HE3 MET 1 -15.567 18.009 -24.366 12 H ALA 2 HN ALA 2 -11.354 15.038 -21.480 13 HA ALA 2 HA ALA 2 -9.763 15.434 -23.895 14 HB1 ALA 2 HB1 ALA 2 -8.494 14.827 -21.223 15 HB2 ALA 2 HB2 ALA 2 -8.345 16.338 -22.123 16 HB3 ALA 2 HB3 ALA 2 -7.665 14.850 -22.781 17 H GLY 3 HN GLY 3 -8.846 13.449 -24.701 18 HA2 GLY 3 HA2 GLY 3 -10.469 11.150 -24.103 19 HA3 GLY 3 HA1 GLY 3 -9.169 11.234 -25.284 20 H GLN 4 HN GLN 4 -6.962 11.681 -24.088 21 HA GLN 4 HA GLN 4 -5.271 10.822 -22.869 22 HB2 GLN 4 HB2 GLN 4 -7.445 10.509 -20.807 23 HB3 GLN 4 HB1 GLN 4 -5.750 10.182 -20.486 24 HG2 GLN 4 HG2 GLN 4 -5.345 12.585 -21.287 25 HG3 GLN 4 HG1 GLN 4 -7.082 12.795 -21.069 26 HE21 GLN 4 HE21 GLN 4 -5.080 10.705 -19.106 27 HE22 GLN 4 HE22 GLN 4 -5.230 11.618 -17.638 28 H SER 5 HN SER 5 -4.577 9.070 -23.922 29 HA SER 5 HA SER 5 -5.963 6.526 -23.520 30 HB2 SER 5 HB2 SER 5 -3.634 7.223 -25.324 31 HB3 SER 5 HB1 SER 5 -4.511 5.691 -25.308 32 HG SER 5 HG SER 5 -5.669 8.228 -25.854 33 H ASP 6 HN ASP 6 -3.980 8.167 -21.694 34 HA ASP 6 HA ASP 6 -2.022 6.125 -21.102 35 HB2 ASP 6 HB2 ASP 6 -1.410 7.619 -19.184 36 HB3 ASP 6 HB1 ASP 6 -1.310 8.404 -20.754 37 H ARG 7 HN ARG 7 -3.945 4.656 -20.999 38 HA ARG 7 HA ARG 7 -5.794 4.704 -18.888 39 HB2 ARG 7 HB2 ARG 7 -4.738 2.374 -20.497 40 HB3 ARG 7 HB1 ARG 7 -6.159 2.318 -19.460 41 HG2 ARG 7 HG2 ARG 7 -7.351 3.814 -20.850 42 HG3 ARG 7 HG1 ARG 7 -5.899 4.232 -21.763 43 HD2 ARG 7 HD2 ARG 7 -7.347 2.713 -23.018 44 HD3 ARG 7 HD1 ARG 7 -5.792 1.968 -22.657 45 HE ARG 7 HE ARG 7 -7.845 1.360 -20.734 46 HH11 ARG 7 HH11 ARG 7 -6.413 0.450 -23.796 47 HH12 ARG 7 HH12 ARG 7 -6.936 -1.209 -23.692 48 HH21 ARG 7 HH21 ARG 7 -8.578 -0.805 -20.616 49 HH22 ARG 7 HH22 ARG 7 -8.170 -1.926 -21.883 50 H LYS 8 HN LYS 8 -2.510 3.599 -19.080 51 HA LYS 8 HA LYS 8 -2.467 1.866 -16.869 52 HB2 LYS 8 HB2 LYS 8 -0.667 1.871 -18.462 53 HB3 LYS 8 HB1 LYS 8 -0.303 3.554 -18.124 54 HG2 LYS 8 HG2 LYS 8 0.685 3.062 -16.080 55 HG3 LYS 8 HG1 LYS 8 -0.099 1.484 -15.972 56 HD2 LYS 8 HD2 LYS 8 1.304 0.578 -17.662 57 HD3 LYS 8 HD1 LYS 8 1.925 2.170 -18.094 58 HE2 LYS 8 HE2 LYS 8 2.312 1.049 -15.341 59 HE3 LYS 8 HE1 LYS 8 3.399 0.619 -16.662 60 HZ1 LYS 8 HZ1 LYS 8 2.838 3.384 -15.727 61 HZ2 LYS 8 HZ2 LYS 8 3.898 2.953 -16.975 62 HZ3 LYS 8 HZ3 LYS 8 4.237 2.487 -15.379 63 H ALA 9 HN ALA 9 -2.402 5.345 -17.087 64 HA ALA 9 HA ALA 9 -1.418 5.880 -14.483 65 HB1 ALA 9 HB1 ALA 9 -1.434 7.587 -16.217 66 HB2 ALA 9 HB2 ALA 9 -2.338 8.128 -14.802 67 HB3 ALA 9 HB3 ALA 9 -3.198 7.570 -16.237 68 H ALA 10 HN ALA 10 -4.563 5.052 -15.740 69 HA ALA 10 HA ALA 10 -6.062 5.802 -13.434 70 HB1 ALA 10 HB1 ALA 10 -6.757 3.813 -15.593 71 HB2 ALA 10 HB2 ALA 10 -7.101 5.543 -15.640 72 HB3 ALA 10 HB3 ALA 10 -7.878 4.519 -14.430 73 H LEU 11 HN LEU 11 -4.213 3.008 -14.366 74 HA LEU 11 HA LEU 11 -5.244 1.228 -12.399 75 HB2 LEU 11 HB2 LEU 11 -2.750 1.284 -14.063 76 HB3 LEU 11 HB1 LEU 11 -2.889 0.144 -12.741 77 HG LEU 11 HG LEU 11 -4.947 -0.778 -13.803 78 HD11 LEU 11 HD11 LEU 11 -4.170 1.012 -16.100 79 HD12 LEU 11 HD12 LEU 11 -5.617 1.164 -15.100 80 HD13 LEU 11 HD13 LEU 11 -5.408 -0.246 -16.140 81 HD21 LEU 11 HD21 LEU 11 -2.806 -1.865 -14.122 82 HD22 LEU 11 HD22 LEU 11 -2.444 -0.800 -15.481 83 HD23 LEU 11 HD23 LEU 11 -3.766 -1.959 -15.600 84 H LEU 12 HN LEU 12 -2.817 3.721 -12.449 85 HA LEU 12 HA LEU 12 -1.618 3.123 -9.948 86 HB2 LEU 12 HB2 LEU 12 -1.831 5.758 -11.408 87 HB3 LEU 12 HB1 LEU 12 -0.773 5.440 -10.046 88 HG LEU 12 HG LEU 12 -0.600 4.099 -12.748 89 HD11 LEU 12 HD11 LEU 12 1.464 5.358 -13.009 90 HD12 LEU 12 HD12 LEU 12 1.186 6.154 -11.458 91 HD13 LEU 12 HD13 LEU 12 0.086 6.440 -12.808 92 HD21 LEU 12 HD21 LEU 12 0.109 2.629 -10.930 93 HD22 LEU 12 HD22 LEU 12 1.195 3.885 -10.335 94 HD23 LEU 12 HD23 LEU 12 1.482 3.145 -11.910 95 H ASP 13 HN ASP 13 -4.434 4.988 -10.926 96 HA ASP 13 HA ASP 13 -5.021 6.113 -8.405 97 HB2 ASP 13 HB2 ASP 13 -6.775 5.409 -10.757 98 HB3 ASP 13 HB1 ASP 13 -7.424 6.129 -9.288 99 H GLN 14 HN GLN 14 -5.800 3.019 -9.882 100 HA GLN 14 HA GLN 14 -7.470 2.104 -7.769 101 HB2 GLN 14 HB2 GLN 14 -7.226 1.202 -10.191 102 HB3 GLN 14 HB1 GLN 14 -5.875 0.281 -9.546 103 HG2 GLN 14 HG2 GLN 14 -7.920 -1.039 -9.593 104 HG3 GLN 14 HG1 GLN 14 -7.343 -0.798 -7.944 105 HE21 GLN 14 HE21 GLN 14 -9.766 0.102 -10.295 106 HE22 GLN 14 HE22 GLN 14 -10.904 0.754 -9.160 107 H VAL 15 HN VAL 15 -4.030 1.708 -8.531 108 HA VAL 15 HA VAL 15 -3.246 0.135 -6.365 109 HB VAL 15 HB VAL 15 -1.748 2.328 -7.819 110 HG11 VAL 15 HG11 VAL 15 0.305 1.440 -6.849 111 HG12 VAL 15 HG12 VAL 15 -0.630 0.299 -5.882 112 HG13 VAL 15 HG13 VAL 15 -0.781 2.032 -5.592 113 HG21 VAL 15 HG21 VAL 15 -1.617 -0.680 -8.030 114 HG22 VAL 15 HG22 VAL 15 -0.609 0.460 -8.921 115 HG23 VAL 15 HG23 VAL 15 -2.349 0.420 -9.198 116 H ALA 16 HN ALA 16 -3.658 3.629 -6.626 117 HA ALA 16 HA ALA 16 -2.758 4.361 -4.086 118 HB1 ALA 16 HB1 ALA 16 -4.030 6.419 -4.414 119 HB2 ALA 16 HB2 ALA 16 -4.885 5.677 -5.767 120 HB3 ALA 16 HB3 ALA 16 -3.150 5.969 -5.875 121 H ARG 17 HN ARG 17 -5.919 3.206 -5.161 122 HA ARG 17 HA ARG 17 -7.281 3.767 -2.735 123 HB2 ARG 17 HB2 ARG 17 -7.905 1.847 -4.978 124 HB3 ARG 17 HB1 ARG 17 -8.990 2.155 -3.628 125 HG2 ARG 17 HG2 ARG 17 -9.148 4.490 -4.244 126 HG3 ARG 17 HG1 ARG 17 -7.990 4.242 -5.549 127 HD2 ARG 17 HD2 ARG 17 -9.556 2.683 -6.623 128 HD3 ARG 17 HD1 ARG 17 -10.720 2.978 -5.327 129 HE ARG 17 HE ARG 17 -10.903 5.259 -6.085 130 HH11 ARG 17 HH11 ARG 17 -9.344 3.019 -8.273 131 HH12 ARG 17 HH12 ARG 17 -9.501 4.055 -9.662 132 HH21 ARG 17 HH21 ARG 17 -11.108 6.637 -7.906 133 HH22 ARG 17 HH22 ARG 17 -10.461 6.132 -9.439 134 H VAL 18 HN VAL 18 -5.418 1.022 -3.872 135 HA VAL 18 HA VAL 18 -6.063 -0.732 -1.739 136 HB VAL 18 HB VAL 18 -3.502 -0.612 -3.352 137 HG11 VAL 18 HG11 VAL 18 -4.701 -2.845 -1.719 138 HG12 VAL 18 HG12 VAL 18 -3.243 -1.932 -1.332 139 HG13 VAL 18 HG13 VAL 18 -3.276 -2.985 -2.747 140 HG21 VAL 18 HG21 VAL 18 -5.447 -0.840 -4.804 141 HG22 VAL 18 HG22 VAL 18 -6.020 -2.204 -3.843 142 HG23 VAL 18 HG23 VAL 18 -4.520 -2.339 -4.760 143 H GLY 19 HN GLY 19 -3.327 1.485 -2.277 144 HA2 GLY 19 HA2 GLY 19 -2.095 1.103 0.229 145 HA3 GLY 19 HA1 GLY 19 -1.887 2.507 -0.806 146 H LYS 20 HN LYS 20 -4.592 3.342 -0.824 147 HA LYS 20 HA LYS 20 -4.706 4.947 1.469 148 HB2 LYS 20 HB2 LYS 20 -5.809 5.312 -0.804 149 HB3 LYS 20 HB1 LYS 20 -7.066 4.211 -0.267 150 HG2 LYS 20 HG2 LYS 20 -6.366 6.648 1.325 151 HG3 LYS 20 HG1 LYS 20 -7.457 6.736 -0.055 152 HD2 LYS 20 HD2 LYS 20 -8.854 4.973 1.033 153 HD3 LYS 20 HD1 LYS 20 -7.813 5.101 2.453 154 HE2 LYS 20 HE2 LYS 20 -9.821 6.439 2.746 155 HE3 LYS 20 HE1 LYS 20 -8.394 7.475 2.656 156 HZ1 LYS 20 HZ1 LYS 20 -10.267 6.926 0.411 157 HZ2 LYS 20 HZ2 LYS 20 -8.918 7.957 0.354 158 HZ3 LYS 20 HZ3 LYS 20 -10.240 8.344 1.340 159 H ALA 21 HN ALA 21 -6.306 1.890 0.661 160 HA ALA 21 HA ALA 21 -7.944 1.789 2.977 161 HB1 ALA 21 HB1 ALA 21 -8.281 -0.570 2.400 162 HB2 ALA 21 HB2 ALA 21 -6.982 -0.462 1.211 163 HB3 ALA 21 HB3 ALA 21 -8.461 0.474 0.990 164 H LEU 22 HN LEU 22 -4.641 0.930 2.322 165 HA LEU 22 HA LEU 22 -4.357 -0.584 4.792 166 HB2 LEU 22 HB2 LEU 22 -2.272 0.203 2.755 167 HB3 LEU 22 HB1 LEU 22 -2.065 -0.958 4.052 168 HG LEU 22 HG LEU 22 -3.934 -1.277 1.702 169 HD11 LEU 22 HD11 LEU 22 -1.618 -1.437 1.016 170 HD12 LEU 22 HD12 LEU 22 -2.363 -3.037 1.006 171 HD13 LEU 22 HD13 LEU 22 -1.284 -2.572 2.323 172 HD21 LEU 22 HD21 LEU 22 -3.210 -3.199 3.908 173 HD22 LEU 22 HD22 LEU 22 -4.229 -3.555 2.513 174 HD23 LEU 22 HD23 LEU 22 -4.760 -2.380 3.718 175 H ALA 23 HN ALA 23 -4.582 2.591 4.248 176 HA ALA 23 HA ALA 23 -2.127 3.523 5.439 177 HB1 ALA 23 HB1 ALA 23 -4.596 5.052 4.641 178 HB2 ALA 23 HB2 ALA 23 -3.171 4.776 3.638 179 HB3 ALA 23 HB3 ALA 23 -3.045 5.756 5.099 180 H ASN 24 HN ASN 24 -4.389 1.976 6.971 181 HA ASN 24 HA ASN 24 -4.145 3.653 9.363 182 HB2 ASN 24 HB2 ASN 24 -6.386 4.093 8.492 183 HB3 ASN 24 HB1 ASN 24 -6.727 2.367 8.448 184 HD21 ASN 24 HD21 ASN 24 -6.292 5.158 10.482 185 HD22 ASN 24 HD22 ASN 24 -6.959 4.465 11.922 186 H GLY 25 HN GLY 25 -3.375 2.549 11.031 187 HA2 GLY 25 HA2 GLY 25 -2.590 -0.146 10.746 188 HA3 GLY 25 HA1 GLY 25 -2.507 0.797 12.224 189 H ARG 26 HN ARG 26 -5.293 1.295 12.519 190 HA ARG 26 HA ARG 26 -6.051 -1.071 13.872 191 HB2 ARG 26 HB2 ARG 26 -7.540 1.462 13.213 192 HB3 ARG 26 HB1 ARG 26 -8.305 0.131 14.069 193 HG2 ARG 26 HG2 ARG 26 -6.627 0.300 15.836 194 HG3 ARG 26 HG1 ARG 26 -5.865 1.640 14.979 195 HD2 ARG 26 HD2 ARG 26 -7.795 3.013 15.263 196 HD3 ARG 26 HD1 ARG 26 -8.736 1.655 15.880 197 HE ARG 26 HE ARG 26 -6.557 1.937 17.568 198 HH11 ARG 26 HH11 ARG 26 -9.264 3.908 16.549 199 HH12 ARG 26 HH12 ARG 26 -9.418 4.724 18.075 200 HH21 ARG 26 HH21 ARG 26 -6.781 2.965 19.604 201 HH22 ARG 26 HH22 ARG 26 -8.027 4.163 19.830 202 H ARG 27 HN ARG 27 -6.595 0.087 10.672 203 HA ARG 27 HA ARG 27 -8.763 -1.725 10.112 204 HB2 ARG 27 HB2 ARG 27 -8.488 0.460 8.950 205 HB3 ARG 27 HB1 ARG 27 -7.026 -0.157 8.196 206 HG2 ARG 27 HG2 ARG 27 -8.246 -1.765 6.949 207 HG3 ARG 27 HG1 ARG 27 -9.724 -1.438 7.859 208 HD2 ARG 27 HD2 ARG 27 -8.291 0.472 6.019 209 HD3 ARG 27 HD1 ARG 27 -9.808 -0.365 5.682 210 HE ARG 27 HE ARG 27 -10.331 0.984 7.978 211 HH11 ARG 27 HH11 ARG 27 -9.077 1.946 4.854 212 HH12 ARG 27 HH12 ARG 27 -9.759 3.542 4.927 213 HH21 ARG 27 HH21 ARG 27 -11.175 3.101 8.106 214 HH22 ARG 27 HH22 ARG 27 -10.896 4.219 6.802 215 H LEU 28 HN LEU 28 -5.295 -1.702 9.885 216 HA LEU 28 HA LEU 28 -5.081 -4.027 8.231 217 HB2 LEU 28 HB2 LEU 28 -3.054 -2.745 10.068 218 HB3 LEU 28 HB1 LEU 28 -2.702 -3.997 8.891 219 HG LEU 28 HG LEU 28 -3.669 -1.204 8.272 220 HD11 LEU 28 HD11 LEU 28 -1.462 -0.910 7.284 221 HD12 LEU 28 HD12 LEU 28 -1.006 -2.534 7.803 222 HD13 LEU 28 HD13 LEU 28 -1.346 -1.286 9.003 223 HD21 LEU 28 HD21 LEU 28 -3.292 -1.830 5.927 224 HD22 LEU 28 HD22 LEU 28 -4.557 -2.806 6.676 225 HD23 LEU 28 HD23 LEU 28 -2.947 -3.483 6.434 226 H GLN 29 HN GLN 29 -5.555 -3.423 11.590 227 HA GLN 29 HA GLN 29 -4.757 -5.884 12.679 228 HB2 GLN 29 HB2 GLN 29 -6.998 -4.033 13.516 229 HB3 GLN 29 HB1 GLN 29 -6.422 -5.391 14.474 230 HG2 GLN 29 HG2 GLN 29 -4.224 -4.354 14.638 231 HG3 GLN 29 HG1 GLN 29 -4.787 -2.997 13.662 232 HE21 GLN 29 HE21 GLN 29 -3.739 -3.057 16.395 233 HE22 GLN 29 HE22 GLN 29 -4.962 -2.345 17.388 234 H ILE 30 HN ILE 30 -7.595 -4.906 10.912 235 HA ILE 30 HA ILE 30 -9.213 -7.161 11.398 236 HB ILE 30 HB ILE 30 -9.121 -5.484 8.883 237 HG12 ILE 30 HG12 ILE 30 -9.429 -4.059 10.850 238 HG13 ILE 30 HG11 ILE 30 -10.917 -4.148 9.913 239 HG21 ILE 30 HG21 ILE 30 -11.303 -7.212 10.038 240 HG22 ILE 30 HG22 ILE 30 -10.350 -7.548 8.593 241 HG23 ILE 30 HG23 ILE 30 -11.460 -6.177 8.617 242 HD11 ILE 30 HD11 ILE 30 -11.390 -4.252 12.272 243 HD12 ILE 30 HD12 ILE 30 -10.317 -5.639 12.452 244 HD13 ILE 30 HD13 ILE 30 -11.798 -5.789 11.505 245 H LEU 31 HN LEU 31 -6.830 -6.428 8.881 246 HA LEU 31 HA LEU 31 -7.125 -8.831 7.430 247 HB2 LEU 31 HB2 LEU 31 -4.781 -6.939 7.641 248 HB3 LEU 31 HB1 LEU 31 -4.886 -8.255 6.486 249 HG LEU 31 HG LEU 31 -6.787 -5.912 6.610 250 HD11 LEU 31 HD11 LEU 31 -5.692 -5.198 4.534 251 HD12 LEU 31 HD12 LEU 31 -4.523 -6.509 4.710 252 HD13 LEU 31 HD13 LEU 31 -4.577 -5.207 5.900 253 HD21 LEU 31 HD21 LEU 31 -6.503 -8.134 4.589 254 HD22 LEU 31 HD22 LEU 31 -7.592 -6.753 4.464 255 HD23 LEU 31 HD23 LEU 31 -7.826 -7.944 5.742 256 H ASP 32 HN ASP 32 -5.038 -7.898 10.120 257 HA ASP 32 HA ASP 32 -3.442 -10.216 10.176 258 HB2 ASP 32 HB2 ASP 32 -2.808 -8.237 11.440 259 HB3 ASP 32 HB1 ASP 32 -4.256 -8.373 12.433 260 H LEU 33 HN LEU 33 -6.552 -9.451 11.648 261 HA LEU 33 HA LEU 33 -6.747 -11.866 13.140 262 HB2 LEU 33 HB2 LEU 33 -7.979 -9.766 13.664 263 HB3 LEU 33 HB1 LEU 33 -8.956 -10.017 12.233 264 HG LEU 33 HG LEU 33 -8.891 -12.135 14.354 265 HD11 LEU 33 HD11 LEU 33 -9.300 -10.055 15.552 266 HD12 LEU 33 HD12 LEU 33 -10.764 -11.036 15.476 267 HD13 LEU 33 HD13 LEU 33 -10.581 -9.640 14.414 268 HD21 LEU 33 HD21 LEU 33 -11.179 -12.509 13.574 269 HD22 LEU 33 HD22 LEU 33 -10.021 -12.618 12.247 270 HD23 LEU 33 HD23 LEU 33 -11.012 -11.171 12.437 271 H LEU 34 HN LEU 34 -7.933 -10.829 9.968 272 HA LEU 34 HA LEU 34 -9.401 -13.207 9.457 273 HB2 LEU 34 HB2 LEU 34 -8.269 -11.165 7.546 274 HB3 LEU 34 HB1 LEU 34 -9.372 -12.452 7.092 275 HG LEU 34 HG LEU 34 -9.978 -10.156 8.961 276 HD11 LEU 34 HD11 LEU 34 -10.990 -10.834 6.206 277 HD12 LEU 34 HD12 LEU 34 -9.928 -9.491 6.633 278 HD13 LEU 34 HD13 LEU 34 -11.591 -9.524 7.221 279 HD21 LEU 34 HD21 LEU 34 -11.729 -12.447 8.077 280 HD22 LEU 34 HD22 LEU 34 -12.256 -11.049 9.014 281 HD23 LEU 34 HD23 LEU 34 -11.099 -12.187 9.705 282 H ALA 35 HN ALA 35 -6.056 -12.391 9.223 283 HA ALA 35 HA ALA 35 -5.307 -14.576 7.534 284 HB1 ALA 35 HB1 ALA 35 -3.027 -14.062 8.198 285 HB2 ALA 35 HB2 ALA 35 -3.618 -13.006 9.481 286 HB3 ALA 35 HB3 ALA 35 -3.896 -12.582 7.792 287 H GLN 36 HN GLN 36 -6.291 -14.297 10.755 288 HA GLN 36 HA GLN 36 -5.070 -16.816 11.589 289 HB2 GLN 36 HB2 GLN 36 -7.061 -15.115 13.107 290 HB3 GLN 36 HB1 GLN 36 -6.018 -16.371 13.756 291 HG2 GLN 36 HG2 GLN 36 -4.065 -15.004 13.362 292 HG3 GLN 36 HG1 GLN 36 -5.059 -13.768 12.592 293 HE21 GLN 36 HE21 GLN 36 -4.457 -12.180 14.064 294 HE22 GLN 36 HE22 GLN 36 -5.013 -12.184 15.703 295 H GLY 37 HN GLY 37 -7.599 -15.812 9.777 296 HA2 GLY 37 HA2 GLY 37 -8.939 -17.820 8.961 297 HA3 GLY 37 HA1 GLY 37 -9.425 -17.949 10.649 298 H GLU 38 HN GLU 38 -11.162 -17.546 8.404 299 HA GLU 38 HA GLU 38 -11.964 -14.803 8.291 300 HB2 GLU 38 HB2 GLU 38 -13.957 -15.702 7.107 301 HB3 GLU 38 HB1 GLU 38 -12.435 -16.250 6.419 302 HG2 GLU 38 HG2 GLU 38 -12.720 -18.353 7.774 303 HG3 GLU 38 HG1 GLU 38 -14.359 -17.801 8.123 304 H ARG 39 HN ARG 39 -13.903 -13.881 9.217 305 HA ARG 39 HA ARG 39 -15.029 -15.305 11.490 306 HB2 ARG 39 HB2 ARG 39 -12.702 -14.140 11.981 307 HB3 ARG 39 HB1 ARG 39 -13.699 -12.701 12.104 308 HG2 ARG 39 HG2 ARG 39 -13.285 -13.699 14.280 309 HG3 ARG 39 HG1 ARG 39 -15.001 -13.726 13.877 310 HD2 ARG 39 HD2 ARG 39 -13.966 -15.835 14.920 311 HD3 ARG 39 HD1 ARG 39 -15.006 -16.027 13.509 312 HE ARG 39 HE ARG 39 -12.889 -16.165 12.193 313 HH11 ARG 39 HH11 ARG 39 -12.891 -16.986 15.604 314 HH12 ARG 39 HH12 ARG 39 -11.583 -18.119 15.450 315 HH21 ARG 39 HH21 ARG 39 -11.207 -17.663 11.987 316 HH22 ARG 39 HH22 ARG 39 -10.611 -18.503 13.386 317 H ALA 40 HN ALA 40 -16.844 -14.270 12.413 318 HA ALA 40 HA ALA 40 -18.344 -12.597 10.660 319 HB1 ALA 40 HB1 ALA 40 -20.045 -12.635 12.414 320 HB2 ALA 40 HB2 ALA 40 -18.887 -13.363 13.528 321 HB3 ALA 40 HB3 ALA 40 -19.414 -14.252 12.099 322 H VAL 41 HN VAL 41 -19.218 -10.521 11.149 323 HA VAL 41 HA VAL 41 -17.364 -8.556 11.646 324 HB VAL 41 HB VAL 41 -20.340 -8.313 12.101 325 HG11 VAL 41 HG11 VAL 41 -20.006 -5.944 11.540 326 HG12 VAL 41 HG12 VAL 41 -18.263 -6.217 11.478 327 HG13 VAL 41 HG13 VAL 41 -19.132 -6.411 13.001 328 HG21 VAL 41 HG21 VAL 41 -18.729 -7.894 9.587 329 HG22 VAL 41 HG22 VAL 41 -20.457 -7.594 9.771 330 HG23 VAL 41 HG23 VAL 41 -19.828 -9.236 9.899 331 H GLU 42 HN GLU 42 -19.880 -9.616 13.969 332 HA GLU 42 HA GLU 42 -19.080 -7.887 16.032 333 HB2 GLU 42 HB2 GLU 42 -20.519 -10.533 16.255 334 HB3 GLU 42 HB1 GLU 42 -20.420 -9.318 17.519 335 HG2 GLU 42 HG2 GLU 42 -21.605 -7.739 16.027 336 HG3 GLU 42 HG1 GLU 42 -21.792 -9.044 14.858 337 H ALA 43 HN ALA 43 -18.063 -11.134 15.182 338 HA ALA 43 HA ALA 43 -16.628 -11.677 17.559 339 HB1 ALA 43 HB1 ALA 43 -17.339 -13.462 16.075 340 HB2 ALA 43 HB2 ALA 43 -15.587 -13.493 16.273 341 HB3 ALA 43 HB3 ALA 43 -16.296 -12.839 14.798 342 H ILE 44 HN ILE 44 -15.659 -10.386 14.396 343 HA ILE 44 HA ILE 44 -12.911 -10.110 14.924 344 HB ILE 44 HB ILE 44 -14.656 -8.399 13.138 345 HG12 ILE 44 HG12 ILE 44 -12.943 -10.800 12.463 346 HG13 ILE 44 HG11 ILE 44 -14.698 -10.824 12.605 347 HG21 ILE 44 HG21 ILE 44 -12.571 -7.846 11.967 348 HG22 ILE 44 HG22 ILE 44 -11.660 -8.750 13.175 349 HG23 ILE 44 HG23 ILE 44 -12.547 -7.300 13.643 350 HD11 ILE 44 HD11 ILE 44 -14.037 -10.729 10.288 351 HD12 ILE 44 HD12 ILE 44 -13.094 -9.269 10.591 352 HD13 ILE 44 HD13 ILE 44 -14.851 -9.233 10.747 353 H ALA 45 HN ALA 45 -15.612 -7.859 15.346 354 HA ALA 45 HA ALA 45 -14.171 -5.659 16.288 355 HB1 ALA 45 HB1 ALA 45 -16.292 -4.868 17.200 356 HB2 ALA 45 HB2 ALA 45 -16.992 -6.474 16.993 357 HB3 ALA 45 HB3 ALA 45 -16.511 -5.533 15.580 358 H THR 46 HN THR 46 -15.832 -8.215 18.128 359 HA THR 46 HA THR 46 -15.191 -7.281 20.683 360 HB THR 46 HB THR 46 -15.592 -10.168 19.865 361 HG1 THR 46 HG1 THR 46 -17.359 -8.924 19.182 362 HG21 THR 46 HG21 THR 46 -14.734 -9.936 22.135 363 HG22 THR 46 HG22 THR 46 -16.428 -10.431 22.171 364 HG23 THR 46 HG23 THR 46 -15.990 -8.756 22.507 365 H ALA 47 HN ALA 47 -13.492 -9.601 18.601 366 HA ALA 47 HA ALA 47 -11.537 -10.388 20.445 367 HB1 ALA 47 HB1 ALA 47 -11.346 -10.307 17.438 368 HB2 ALA 47 HB2 ALA 47 -12.000 -11.630 18.403 369 HB3 ALA 47 HB3 ALA 47 -10.290 -11.217 18.518 370 H THR 48 HN THR 48 -11.539 -7.750 18.076 371 HA THR 48 HA THR 48 -8.837 -6.986 18.712 372 HB THR 48 HB THR 48 -9.432 -4.930 17.316 373 HG1 THR 48 HG1 THR 48 -11.667 -6.471 16.484 374 HG21 THR 48 HG21 THR 48 -8.187 -6.774 16.368 375 HG22 THR 48 HG22 THR 48 -9.378 -6.212 15.196 376 HG23 THR 48 HG23 THR 48 -9.674 -7.688 16.113 377 H GLY 49 HN GLY 49 -11.939 -6.328 19.997 378 HA2 GLY 49 HA2 GLY 49 -12.344 -5.206 22.014 379 HA3 GLY 49 HA1 GLY 49 -10.768 -4.437 21.880 380 H MET 50 HN MET 50 -12.665 -4.365 19.042 381 HA MET 50 HA MET 50 -13.204 -1.515 19.528 382 HB2 MET 50 HB2 MET 50 -12.894 -3.027 16.928 383 HB3 MET 50 HB1 MET 50 -13.363 -1.335 17.039 384 HG2 MET 50 HG2 MET 50 -11.220 -0.893 18.223 385 HG3 MET 50 HG1 MET 50 -10.752 -2.558 17.891 386 HE1 MET 50 HE1 MET 50 -10.301 -3.515 15.449 387 HE2 MET 50 HE2 MET 50 -10.540 -2.577 13.974 388 HE3 MET 50 HE3 MET 50 -11.927 -3.030 14.968 389 H ASN 51 HN ASN 51 -15.156 -0.675 18.313 390 HA ASN 51 HA ASN 51 -17.425 -2.308 19.061 391 HB2 ASN 51 HB2 ASN 51 -17.248 0.482 17.908 392 HB3 ASN 51 HB1 ASN 51 -18.751 -0.302 18.379 393 HD21 ASN 51 HD21 ASN 51 -17.531 -1.610 20.702 394 HD22 ASN 51 HD22 ASN 51 -17.335 -0.359 21.883 395 H LEU 52 HN LEU 52 -19.326 -2.369 17.519 396 HA LEU 52 HA LEU 52 -18.576 -3.809 15.207 397 HB2 LEU 52 HB2 LEU 52 -21.189 -2.729 16.214 398 HB3 LEU 52 HB1 LEU 52 -21.082 -3.452 14.624 399 HG LEU 52 HG LEU 52 -20.281 -5.558 15.681 400 HD11 LEU 52 HD11 LEU 52 -20.555 -5.879 18.076 401 HD12 LEU 52 HD12 LEU 52 -20.979 -4.176 18.264 402 HD13 LEU 52 HD13 LEU 52 -19.357 -4.627 17.737 403 HD21 LEU 52 HD21 LEU 52 -22.607 -5.296 15.078 404 HD22 LEU 52 HD22 LEU 52 -22.943 -4.503 16.615 405 HD23 LEU 52 HD23 LEU 52 -22.473 -6.201 16.585 406 H THR 53 HN THR 53 -19.639 -0.507 15.750 407 HA THR 53 HA THR 53 -20.018 0.305 13.099 408 HB THR 53 HB THR 53 -19.435 2.616 14.059 409 HG1 THR 53 HG1 THR 53 -19.209 2.689 16.313 410 HG21 THR 53 HG21 THR 53 -21.736 1.797 13.868 411 HG22 THR 53 HG22 THR 53 -21.523 2.715 15.359 412 HG23 THR 53 HG23 THR 53 -21.571 0.952 15.406 413 H THR 54 HN THR 54 -17.141 0.478 15.163 414 HA THR 54 HA THR 54 -15.411 1.633 13.275 415 HB THR 54 HB THR 54 -14.562 -0.257 15.472 416 HG1 THR 54 HG1 THR 54 -14.771 1.448 16.905 417 HG21 THR 54 HG21 THR 54 -12.615 1.250 15.593 418 HG22 THR 54 HG22 THR 54 -13.271 2.189 14.251 419 HG23 THR 54 HG23 THR 54 -12.781 0.515 13.999 420 H ALA 55 HN ALA 55 -16.020 -1.749 14.159 421 HA ALA 55 HA ALA 55 -14.060 -2.912 12.519 422 HB1 ALA 55 HB1 ALA 55 -16.665 -4.108 13.451 423 HB2 ALA 55 HB2 ALA 55 -15.149 -4.106 14.353 424 HB3 ALA 55 HB3 ALA 55 -15.273 -4.998 12.835 425 H SER 56 HN SER 56 -17.544 -2.426 11.918 426 HA SER 56 HA SER 56 -17.556 -3.713 9.424 427 HB2 SER 56 HB2 SER 56 -19.735 -2.462 9.082 428 HB3 SER 56 HB1 SER 56 -19.638 -3.455 10.533 429 HG SER 56 HG SER 56 -19.260 -1.599 11.747 430 H ALA 57 HN ALA 57 -16.982 -0.341 10.285 431 HA ALA 57 HA ALA 57 -17.052 0.742 7.695 432 HB1 ALA 57 HB1 ALA 57 -15.358 1.646 10.022 433 HB2 ALA 57 HB2 ALA 57 -17.034 2.108 9.738 434 HB3 ALA 57 HB3 ALA 57 -15.781 2.602 8.600 435 H ASN 58 HN ASN 58 -14.363 -0.589 9.585 436 HA ASN 58 HA ASN 58 -12.373 -0.210 7.620 437 HB2 ASN 58 HB2 ASN 58 -12.585 -2.117 9.949 438 HB3 ASN 58 HB1 ASN 58 -11.173 -2.066 8.897 439 HD21 ASN 58 HD21 ASN 58 -11.506 -1.440 11.761 440 HD22 ASN 58 HD22 ASN 58 -10.907 0.170 11.952 441 H LEU 59 HN LEU 59 -14.640 -2.816 8.243 442 HA LEU 59 HA LEU 59 -13.585 -4.712 6.456 443 HB2 LEU 59 HB2 LEU 59 -16.421 -4.272 7.391 444 HB3 LEU 59 HB1 LEU 59 -15.883 -5.684 6.502 445 HG LEU 59 HG LEU 59 -14.803 -4.877 9.201 446 HD11 LEU 59 HD11 LEU 59 -16.140 -6.733 10.076 447 HD12 LEU 59 HD12 LEU 59 -16.865 -6.956 8.483 448 HD13 LEU 59 HD13 LEU 59 -17.154 -5.467 9.382 449 HD21 LEU 59 HD21 LEU 59 -13.855 -7.112 9.218 450 HD22 LEU 59 HD22 LEU 59 -13.271 -6.205 7.822 451 HD23 LEU 59 HD23 LEU 59 -14.527 -7.427 7.618 452 H GLN 60 HN GLN 60 -16.159 -2.288 6.010 453 HA GLN 60 HA GLN 60 -16.669 -2.914 3.307 454 HB2 GLN 60 HB2 GLN 60 -17.131 -0.372 4.866 455 HB3 GLN 60 HB1 GLN 60 -17.697 -0.618 3.220 456 HG2 GLN 60 HG2 GLN 60 -19.011 -2.555 3.996 457 HG3 GLN 60 HG1 GLN 60 -18.495 -2.210 5.646 458 HE21 GLN 60 HE21 GLN 60 -20.449 -1.162 2.970 459 HE22 GLN 60 HE22 GLN 60 -21.401 -0.017 3.854 460 H ALA 61 HN ALA 61 -14.382 -0.730 4.836 461 HA ALA 61 HA ALA 61 -13.529 0.603 2.497 462 HB1 ALA 61 HB1 ALA 61 -11.988 0.090 5.039 463 HB2 ALA 61 HB2 ALA 61 -13.080 1.443 4.753 464 HB3 ALA 61 HB3 ALA 61 -11.597 1.293 3.811 465 H LEU 62 HN LEU 62 -12.227 -2.250 4.193 466 HA LEU 62 HA LEU 62 -10.111 -2.697 2.353 467 HB2 LEU 62 HB2 LEU 62 -11.486 -4.566 4.282 468 HB3 LEU 62 HB1 LEU 62 -10.053 -4.987 3.365 469 HG LEU 62 HG LEU 62 -10.206 -2.748 5.385 470 HD11 LEU 62 HD11 LEU 62 -8.844 -4.211 6.793 471 HD12 LEU 62 HD12 LEU 62 -8.990 -5.498 5.596 472 HD13 LEU 62 HD13 LEU 62 -10.421 -4.920 6.451 473 HD21 LEU 62 HD21 LEU 62 -7.854 -3.948 3.924 474 HD22 LEU 62 HD22 LEU 62 -7.780 -2.686 5.156 475 HD23 LEU 62 HD23 LEU 62 -8.565 -2.365 3.611 476 H LYS 63 HN LYS 63 -13.452 -3.739 2.505 477 HA LYS 63 HA LYS 63 -13.316 -5.653 0.426 478 HB2 LYS 63 HB2 LYS 63 -15.183 -5.621 1.984 479 HB3 LYS 63 HB1 LYS 63 -15.645 -4.014 1.446 480 HG2 LYS 63 HG2 LYS 63 -16.310 -4.844 -0.690 481 HG3 LYS 63 HG1 LYS 63 -15.645 -6.441 -0.333 482 HD2 LYS 63 HD2 LYS 63 -17.286 -6.807 1.378 483 HD3 LYS 63 HD1 LYS 63 -17.868 -5.148 1.242 484 HE2 LYS 63 HE2 LYS 63 -19.362 -6.737 0.129 485 HE3 LYS 63 HE1 LYS 63 -18.666 -5.581 -1.006 486 HZ1 LYS 63 HZ1 LYS 63 -17.956 -8.433 -0.637 487 HZ2 LYS 63 HZ2 LYS 63 -16.967 -7.358 -1.497 488 HZ3 LYS 63 HZ3 LYS 63 -18.540 -7.672 -2.035 489 H SER 64 HN SER 64 -14.029 -2.180 0.468 490 HA SER 64 HA SER 64 -14.563 -1.982 -2.318 491 HB2 SER 64 HB2 SER 64 -13.660 0.177 -0.393 492 HB3 SER 64 HB1 SER 64 -14.379 0.439 -1.982 493 HG SER 64 HG SER 64 -15.569 -0.521 0.389 494 H GLY 65 HN GLY 65 -11.638 -1.774 -0.371 495 HA2 GLY 65 HA2 GLY 65 -9.906 -0.893 -2.438 496 HA3 GLY 65 HA1 GLY 65 -9.423 -1.743 -0.976 497 H GLY 66 HN GLY 66 -11.374 -3.942 -1.751 498 HA2 GLY 66 HA2 GLY 66 -11.504 -5.688 -3.333 499 HA3 GLY 66 HA1 GLY 66 -10.053 -5.064 -4.103 500 H LEU 67 HN LEU 67 -10.218 -5.512 -0.655 501 HA LEU 67 HA LEU 67 -8.123 -7.541 -0.923 502 HB2 LEU 67 HB2 LEU 67 -8.810 -5.535 1.176 503 HB3 LEU 67 HB1 LEU 67 -7.937 -6.981 1.639 504 HG LEU 67 HG LEU 67 -6.151 -6.404 0.032 505 HD11 LEU 67 HD11 LEU 67 -7.453 -5.119 -1.567 506 HD12 LEU 67 HD12 LEU 67 -6.086 -4.179 -0.966 507 HD13 LEU 67 HD13 LEU 67 -7.712 -3.856 -0.362 508 HD21 LEU 67 HD21 LEU 67 -6.807 -4.229 2.011 509 HD22 LEU 67 HD22 LEU 67 -5.223 -4.541 1.303 510 HD23 LEU 67 HD23 LEU 67 -5.966 -5.739 2.364 511 H VAL 68 HN VAL 68 -11.127 -6.922 0.889 512 HA VAL 68 HA VAL 68 -11.143 -9.786 1.572 513 HB VAL 68 HB VAL 68 -12.396 -9.278 3.590 514 HG11 VAL 68 HG11 VAL 68 -9.908 -7.593 3.357 515 HG12 VAL 68 HG12 VAL 68 -9.968 -9.316 3.730 516 HG13 VAL 68 HG13 VAL 68 -10.645 -8.145 4.863 517 HG21 VAL 68 HG21 VAL 68 -12.083 -6.373 2.839 518 HG22 VAL 68 HG22 VAL 68 -12.767 -6.989 4.342 519 HG23 VAL 68 HG23 VAL 68 -13.590 -7.288 2.811 520 H GLU 69 HN GLU 69 -13.109 -10.874 1.614 521 HA GLU 69 HA GLU 69 -15.358 -9.535 0.267 522 HB2 GLU 69 HB2 GLU 69 -15.941 -11.785 -0.668 523 HB3 GLU 69 HB1 GLU 69 -14.443 -11.118 -1.298 524 HG2 GLU 69 HG2 GLU 69 -13.135 -12.571 0.065 525 HG3 GLU 69 HG1 GLU 69 -14.561 -13.124 0.936 526 H ALA 70 HN ALA 70 -17.495 -10.629 0.826 527 HA ALA 70 HA ALA 70 -17.377 -11.496 3.637 528 HB1 ALA 70 HB1 ALA 70 -18.216 -9.211 3.428 529 HB2 ALA 70 HB2 ALA 70 -19.458 -10.308 4.032 530 HB3 ALA 70 HB3 ALA 70 -19.492 -9.781 2.351 531 H ARG 71 HN ARG 71 -18.605 -13.148 4.283 532 HA ARG 71 HA ARG 71 -20.251 -14.546 2.295 533 HB2 ARG 71 HB2 ARG 71 -19.181 -15.395 4.991 534 HB3 ARG 71 HB1 ARG 71 -20.307 -16.356 4.049 535 HG2 ARG 71 HG2 ARG 71 -18.638 -16.448 2.228 536 HG3 ARG 71 HG1 ARG 71 -17.502 -15.599 3.283 537 HD2 ARG 71 HD2 ARG 71 -17.201 -18.060 3.294 538 HD3 ARG 71 HD1 ARG 71 -17.566 -17.391 4.885 539 HE ARG 71 HE ARG 71 -19.904 -18.151 4.501 540 HH11 ARG 71 HH11 ARG 71 -17.224 -19.694 2.844 541 HH12 ARG 71 HH12 ARG 71 -18.114 -21.146 2.496 542 HH21 ARG 71 HH21 ARG 71 -21.061 -20.065 4.059 543 HH22 ARG 71 HH22 ARG 71 -20.290 -21.363 3.196 544 H ARG 72 HN ARG 72 -22.436 -14.903 2.663 545 HA ARG 72 HA ARG 72 -23.543 -13.547 5.026 546 HB2 ARG 72 HB2 ARG 72 -24.714 -13.642 2.241 547 HB3 ARG 72 HB1 ARG 72 -25.540 -12.998 3.653 548 HG2 ARG 72 HG2 ARG 72 -23.783 -11.298 3.885 549 HG3 ARG 72 HG1 ARG 72 -22.998 -11.929 2.436 550 HD2 ARG 72 HD2 ARG 72 -24.312 -10.000 1.843 551 HD3 ARG 72 HD1 ARG 72 -25.060 -11.441 1.159 552 HE ARG 72 HE ARG 72 -26.076 -9.846 3.402 553 HH11 ARG 72 HH11 ARG 72 -26.503 -12.458 1.115 554 HH12 ARG 72 HH12 ARG 72 -28.198 -12.642 1.444 555 HH21 ARG 72 HH21 ARG 72 -28.314 -10.037 3.796 556 HH22 ARG 72 HH22 ARG 72 -29.233 -11.251 2.956 557 H GLU 73 HN GLU 73 -23.803 -15.312 6.273 558 HA GLU 73 HA GLU 73 -25.488 -17.481 5.246 559 HB2 GLU 73 HB2 GLU 73 -23.510 -17.301 7.485 560 HB3 GLU 73 HB1 GLU 73 -24.820 -18.462 7.608 561 HG2 GLU 73 HG2 GLU 73 -22.955 -19.612 6.737 562 HG3 GLU 73 HG1 GLU 73 -24.088 -19.398 5.408 563 H GLY 74 HN GLY 74 -27.558 -16.911 5.459 564 HA2 GLY 74 HA2 GLY 74 -29.550 -16.408 6.487 565 HA3 GLY 74 HA1 GLY 74 -28.736 -16.648 8.026 566 H THR 75 HN THR 75 -28.366 -14.921 9.271 567 HA THR 75 HA THR 75 -28.705 -12.266 8.030 568 HB THR 75 HB THR 75 -30.426 -12.750 9.714 569 HG1 THR 75 HG1 THR 75 -28.508 -10.744 10.134 570 HG21 THR 75 HG21 THR 75 -29.849 -13.034 12.068 571 HG22 THR 75 HG22 THR 75 -28.133 -13.005 11.662 572 HG23 THR 75 HG23 THR 75 -29.151 -14.329 11.094 573 H ARG 76 HN ARG 76 -26.367 -14.299 8.954 574 HA ARG 76 HA ARG 76 -24.738 -12.308 10.346 575 HB2 ARG 76 HB2 ARG 76 -24.376 -15.265 9.899 576 HB3 ARG 76 HB1 ARG 76 -23.128 -14.238 10.592 577 HG2 ARG 76 HG2 ARG 76 -24.641 -13.647 12.423 578 HG3 ARG 76 HG1 ARG 76 -25.869 -14.718 11.736 579 HD2 ARG 76 HD2 ARG 76 -24.422 -16.623 12.020 580 HD3 ARG 76 HD1 ARG 76 -23.109 -15.584 12.573 581 HE ARG 76 HE ARG 76 -24.431 -15.115 14.560 582 HH11 ARG 76 HH11 ARG 76 -25.519 -17.787 12.569 583 HH12 ARG 76 HH12 ARG 76 -26.252 -18.637 13.892 584 HH21 ARG 76 HH21 ARG 76 -25.407 -16.222 16.294 585 HH22 ARG 76 HH22 ARG 76 -26.207 -17.739 16.014 586 H GLN 77 HN GLN 77 -22.929 -11.445 9.523 587 HA GLN 77 HA GLN 77 -22.150 -12.287 6.820 588 HB2 GLN 77 HB2 GLN 77 -22.099 -9.523 8.036 589 HB3 GLN 77 HB1 GLN 77 -21.285 -9.934 6.531 590 HG2 GLN 77 HG2 GLN 77 -23.489 -10.662 5.626 591 HG3 GLN 77 HG1 GLN 77 -24.239 -10.034 7.090 592 HE21 GLN 77 HE21 GLN 77 -22.370 -7.766 7.240 593 HE22 GLN 77 HE22 GLN 77 -22.885 -6.662 6.018 594 H TYR 78 HN TYR 78 -20.331 -13.284 6.775 595 HA TYR 78 HA TYR 78 -18.283 -12.776 8.819 596 HB2 TYR 78 HB2 TYR 78 -18.460 -15.022 6.790 597 HB3 TYR 78 HB1 TYR 78 -17.285 -14.888 8.091 598 HD1 TYR 78 HD2 TYR 78 -20.801 -15.594 7.275 599 HD2 TYR 78 HD1 TYR 78 -17.848 -15.510 10.332 600 HE1 TYR 78 HE2 TYR 78 -22.284 -16.901 8.736 601 HE2 TYR 78 HE1 TYR 78 -19.320 -16.822 11.800 602 HH TYR 78 HH TYR 78 -21.998 -18.479 10.698 603 H TYR 79 HN TYR 79 -16.169 -12.195 8.165 604 HA TYR 79 HA TYR 79 -15.991 -11.472 5.324 605 HB2 TYR 79 HB2 TYR 79 -14.979 -10.047 7.756 606 HB3 TYR 79 HB1 TYR 79 -14.171 -9.825 6.203 607 HD1 TYR 79 HD1 TYR 79 -17.469 -9.541 7.895 608 HD2 TYR 79 HD2 TYR 79 -15.087 -8.401 4.558 609 HE1 TYR 79 HE1 TYR 79 -19.205 -7.940 7.207 610 HE2 TYR 79 HE2 TYR 79 -16.814 -6.793 3.864 611 HH TYR 79 HH TYR 79 -19.388 -5.881 5.867 612 H ARG 80 HN ARG 80 -14.132 -11.847 4.209 613 HA ARG 80 HA ARG 80 -12.228 -13.747 5.380 614 HB2 ARG 80 HB2 ARG 80 -14.272 -14.910 4.411 615 HB3 ARG 80 HB1 ARG 80 -13.790 -14.279 2.847 616 HG2 ARG 80 HG2 ARG 80 -11.602 -15.497 3.173 617 HG3 ARG 80 HG1 ARG 80 -12.370 -16.299 4.548 618 HD2 ARG 80 HD2 ARG 80 -14.276 -16.777 2.830 619 HD3 ARG 80 HD1 ARG 80 -13.012 -16.486 1.637 620 HE ARG 80 HE ARG 80 -12.647 -18.497 3.756 621 HH11 ARG 80 HH11 ARG 80 -12.712 -17.594 0.363 622 HH12 ARG 80 HH12 ARG 80 -12.341 -19.200 -0.202 623 HH21 ARG 80 HH21 ARG 80 -12.130 -20.599 3.009 624 HH22 ARG 80 HH22 ARG 80 -11.985 -20.900 1.301 625 H ILE 81 HN ILE 81 -10.244 -13.817 4.230 626 HA ILE 81 HA ILE 81 -9.601 -11.639 2.529 627 HB ILE 81 HB ILE 81 -8.095 -14.251 2.838 628 HG12 ILE 81 HG12 ILE 81 -7.747 -11.647 4.349 629 HG13 ILE 81 HG11 ILE 81 -8.476 -13.108 5.013 630 HG21 ILE 81 HG21 ILE 81 -7.389 -12.977 0.900 631 HG22 ILE 81 HG22 ILE 81 -6.148 -12.918 2.150 632 HG23 ILE 81 HG23 ILE 81 -7.204 -11.529 1.891 633 HD11 ILE 81 HD11 ILE 81 -6.335 -14.282 4.666 634 HD12 ILE 81 HD12 ILE 81 -6.203 -12.908 5.766 635 HD13 ILE 81 HD13 ILE 81 -5.630 -12.766 4.104 636 H ALA 82 HN ALA 82 -9.720 -11.476 0.335 637 HA ALA 82 HA ALA 82 -11.492 -13.368 -0.914 638 HB1 ALA 82 HB1 ALA 82 -10.261 -10.831 -1.971 639 HB2 ALA 82 HB2 ALA 82 -11.859 -11.017 -1.241 640 HB3 ALA 82 HB3 ALA 82 -11.503 -11.780 -2.790 641 H GLY 83 HN GLY 83 -8.327 -13.633 -0.478 642 HA2 GLY 83 HA2 GLY 83 -7.875 -15.736 -2.131 643 HA3 GLY 83 HA1 GLY 83 -7.477 -14.344 -3.130 644 H GLU 84 HN GLU 84 -5.625 -16.355 -2.345 645 HA GLU 84 HA GLU 84 -4.077 -15.482 -0.134 646 HB2 GLU 84 HB2 GLU 84 -2.368 -17.018 -0.922 647 HB3 GLU 84 HB1 GLU 84 -3.951 -17.779 -0.999 648 HG2 GLU 84 HG2 GLU 84 -4.042 -17.320 -3.403 649 HG3 GLU 84 HG1 GLU 84 -2.434 -16.601 -3.313 650 H ASP 85 HN ASP 85 -4.432 -14.327 -3.308 651 HA ASP 85 HA ASP 85 -1.950 -13.088 -3.731 652 HB2 ASP 85 HB2 ASP 85 -3.346 -11.461 -5.130 653 HB3 ASP 85 HB1 ASP 85 -3.428 -13.160 -5.577 654 H VAL 86 HN VAL 86 -4.910 -11.873 -2.181 655 HA VAL 86 HA VAL 86 -3.826 -9.416 -1.301 656 HB VAL 86 HB VAL 86 -6.084 -11.035 -0.097 657 HG11 VAL 86 HG11 VAL 86 -5.223 -9.390 1.482 658 HG12 VAL 86 HG12 VAL 86 -6.818 -8.918 0.893 659 HG13 VAL 86 HG13 VAL 86 -5.374 -8.124 0.262 660 HG21 VAL 86 HG21 VAL 86 -6.513 -10.488 -2.421 661 HG22 VAL 86 HG22 VAL 86 -6.111 -8.796 -2.121 662 HG23 VAL 86 HG23 VAL 86 -7.541 -9.510 -1.373 663 H ALA 87 HN ALA 87 -4.044 -12.619 0.171 664 HA ALA 87 HA ALA 87 -3.142 -11.977 2.739 665 HB1 ALA 87 HB1 ALA 87 -4.177 -14.119 2.163 666 HB2 ALA 87 HB2 ALA 87 -2.630 -14.348 2.976 667 HB3 ALA 87 HB3 ALA 87 -2.751 -14.562 1.229 668 H ARG 88 HN ARG 88 -1.304 -13.056 -0.127 669 HA ARG 88 HA ARG 88 1.226 -13.027 1.137 670 HB2 ARG 88 HB2 ARG 88 0.535 -12.737 -1.790 671 HB3 ARG 88 HB1 ARG 88 2.159 -12.976 -1.167 672 HG2 ARG 88 HG2 ARG 88 1.437 -15.140 -0.222 673 HG3 ARG 88 HG1 ARG 88 -0.146 -14.901 -0.970 674 HD2 ARG 88 HD2 ARG 88 1.012 -14.702 -3.172 675 HD3 ARG 88 HD1 ARG 88 2.517 -15.147 -2.368 676 HE ARG 88 HE ARG 88 0.230 -16.968 -2.185 677 HH11 ARG 88 HH11 ARG 88 3.433 -16.269 -3.418 678 HH12 ARG 88 HH12 ARG 88 3.710 -17.888 -3.981 679 HH21 ARG 88 HH21 ARG 88 0.589 -19.094 -2.908 680 HH22 ARG 88 HH22 ARG 88 2.093 -19.503 -3.682 681 H LEU 89 HN LEU 89 -0.642 -10.566 -0.524 682 HA LEU 89 HA LEU 89 1.367 -8.629 -0.822 683 HB2 LEU 89 HB2 LEU 89 -1.003 -8.674 -1.790 684 HB3 LEU 89 HB1 LEU 89 -1.541 -8.052 -0.244 685 HG LEU 89 HG LEU 89 0.500 -6.604 -1.930 686 HD11 LEU 89 HD11 LEU 89 -1.350 -5.216 -2.738 687 HD12 LEU 89 HD12 LEU 89 -2.498 -6.287 -1.937 688 HD13 LEU 89 HD13 LEU 89 -1.512 -6.890 -3.269 689 HD21 LEU 89 HD21 LEU 89 0.361 -5.943 0.427 690 HD22 LEU 89 HD22 LEU 89 -1.374 -5.674 0.248 691 HD23 LEU 89 HD23 LEU 89 -0.229 -4.665 -0.637 692 H PHE 90 HN PHE 90 -1.009 -9.121 1.787 693 HA PHE 90 HA PHE 90 -0.087 -7.024 3.429 694 HB2 PHE 90 HB2 PHE 90 -2.299 -8.071 3.695 695 HB3 PHE 90 HB1 PHE 90 -1.531 -9.568 4.207 696 HD1 PHE 90 HD1 PHE 90 -1.755 -5.964 5.119 697 HD2 PHE 90 HD2 PHE 90 -1.213 -9.967 6.463 698 HE1 PHE 90 HE1 PHE 90 -1.829 -5.187 7.452 699 HE2 PHE 90 HE2 PHE 90 -1.285 -9.194 8.799 700 HZ PHE 90 HZ PHE 90 -1.594 -6.802 9.295 701 H ALA 91 HN ALA 91 0.718 -10.462 3.299 702 HA ALA 91 HA ALA 91 2.423 -10.498 5.543 703 HB1 ALA 91 HB1 ALA 91 2.448 -12.271 3.103 704 HB2 ALA 91 HB2 ALA 91 1.508 -12.533 4.570 705 HB3 ALA 91 HB3 ALA 91 3.268 -12.605 4.629 706 H LEU 92 HN LEU 92 3.018 -9.900 2.115 707 HA LEU 92 HA LEU 92 5.830 -9.858 2.236 708 HB2 LEU 92 HB2 LEU 92 4.401 -10.064 0.176 709 HB3 LEU 92 HB1 LEU 92 4.061 -8.352 0.303 710 HG LEU 92 HG LEU 92 6.903 -9.294 0.093 711 HD11 LEU 92 HD11 LEU 92 5.721 -10.392 -1.733 712 HD12 LEU 92 HD12 LEU 92 6.740 -9.088 -2.341 713 HD13 LEU 92 HD13 LEU 92 4.997 -8.855 -2.203 714 HD21 LEU 92 HD21 LEU 92 6.493 -6.949 0.624 715 HD22 LEU 92 HD22 LEU 92 5.467 -6.796 -0.804 716 HD23 LEU 92 HD23 LEU 92 7.191 -7.119 -0.988 717 H VAL 93 HN VAL 93 3.477 -7.165 2.248 718 HA VAL 93 HA VAL 93 5.448 -5.163 2.533 719 HB VAL 93 HB VAL 93 3.169 -4.702 1.700 720 HG11 VAL 93 HG11 VAL 93 1.885 -6.076 3.245 721 HG12 VAL 93 HG12 VAL 93 1.314 -4.408 3.261 722 HG13 VAL 93 HG13 VAL 93 2.324 -5.008 4.578 723 HG21 VAL 93 HG21 VAL 93 2.873 -2.552 2.858 724 HG22 VAL 93 HG22 VAL 93 4.558 -2.867 2.443 725 HG23 VAL 93 HG23 VAL 93 4.003 -3.084 4.102 726 H GLN 94 HN GLN 94 3.713 -7.122 4.873 727 HA GLN 94 HA GLN 94 4.457 -5.686 7.185 728 HB2 GLN 94 HB2 GLN 94 2.711 -7.442 7.171 729 HB3 GLN 94 HB1 GLN 94 3.956 -8.657 6.911 730 HG2 GLN 94 HG2 GLN 94 4.943 -8.165 9.055 731 HG3 GLN 94 HG1 GLN 94 3.801 -6.847 9.311 732 HE21 GLN 94 HE21 GLN 94 4.238 -10.292 9.206 733 HE22 GLN 94 HE22 GLN 94 2.747 -10.698 9.986 734 H VAL 95 HN VAL 95 6.037 -8.293 5.376 735 HA VAL 95 HA VAL 95 8.284 -8.601 7.049 736 HB VAL 95 HB VAL 95 7.998 -9.031 4.067 737 HG11 VAL 95 HG11 VAL 95 10.251 -9.909 5.869 738 HG12 VAL 95 HG12 VAL 95 10.352 -8.644 4.646 739 HG13 VAL 95 HG13 VAL 95 10.061 -10.316 4.165 740 HG21 VAL 95 HG21 VAL 95 6.601 -10.483 5.424 741 HG22 VAL 95 HG22 VAL 95 7.998 -10.947 6.397 742 HG23 VAL 95 HG23 VAL 95 7.917 -11.405 4.696 743 H VAL 96 HN VAL 96 7.639 -6.455 4.322 744 HA VAL 96 HA VAL 96 10.170 -5.268 4.111 745 HB VAL 96 HB VAL 96 7.475 -4.046 3.480 746 HG11 VAL 96 HG11 VAL 96 9.201 -2.340 3.587 747 HG12 VAL 96 HG12 VAL 96 8.719 -2.617 1.914 748 HG13 VAL 96 HG13 VAL 96 10.233 -3.291 2.519 749 HG21 VAL 96 HG21 VAL 96 7.841 -6.163 2.322 750 HG22 VAL 96 HG22 VAL 96 9.389 -5.573 1.717 751 HG23 VAL 96 HG23 VAL 96 7.887 -4.808 1.196 752 H ALA 97 HN ALA 97 7.583 -4.734 6.379 753 HA ALA 97 HA ALA 97 8.857 -2.336 7.443 754 HB1 ALA 97 HB1 ALA 97 6.421 -3.831 8.402 755 HB2 ALA 97 HB2 ALA 97 6.417 -2.427 7.336 756 HB3 ALA 97 HB3 ALA 97 6.979 -2.270 9.000 757 H ASP 98 HN ASP 98 8.155 -5.647 8.451 758 HA ASP 98 HA ASP 98 9.086 -5.374 11.104 759 HB2 ASP 98 HB2 ASP 98 7.474 -7.054 10.613 760 HB3 ASP 98 HB1 ASP 98 8.494 -7.765 9.369 761 H GLU 99 HN GLU 99 10.668 -6.746 8.207 762 HA GLU 99 HA GLU 99 12.682 -8.118 9.583 763 HB2 GLU 99 HB2 GLU 99 11.944 -8.287 7.121 764 HB3 GLU 99 HB1 GLU 99 13.072 -6.973 6.831 765 HG2 GLU 99 HG2 GLU 99 13.821 -9.616 8.061 766 HG3 GLU 99 HG1 GLU 99 13.979 -9.233 6.350 767 H HIS 100 HN HIS 100 13.083 -5.035 7.787 768 HA HIS 100 HA HIS 100 15.695 -4.748 8.968 769 HB2 HIS 100 HB2 HIS 100 16.001 -2.794 7.585 770 HB3 HIS 100 HB1 HIS 100 15.323 -4.094 6.619 771 HD1 HIS 100 HD1 HIS 100 14.604 -0.671 7.894 772 HD2 HIS 100 HD2 HIS 100 12.706 -3.652 5.697 773 HE1 HIS 100 HE1 HIS 100 12.590 0.426 6.856 774 HE2 HIS 100 HE2 HIS 100 11.353 -1.453 5.717 775 H LEU 101 HN LEU 101 12.737 -4.133 10.181 776 HA LEU 101 HA LEU 101 12.820 -1.571 11.255 777 HB2 LEU 101 HB2 LEU 101 10.884 -3.088 11.383 778 HB3 LEU 101 HB1 LEU 101 11.743 -4.075 12.547 779 HG LEU 101 HG LEU 101 11.774 -2.136 14.107 780 HD11 LEU 101 HD11 LEU 101 11.592 -0.343 12.472 781 HD12 LEU 101 HD12 LEU 101 10.287 -0.245 13.654 782 HD13 LEU 101 HD13 LEU 101 9.970 -0.885 12.040 783 HD21 LEU 101 HD21 LEU 101 10.076 -3.864 14.303 784 HD22 LEU 101 HD22 LEU 101 9.058 -3.017 13.141 785 HD23 LEU 101 HD23 LEU 101 9.405 -2.285 14.707 786 H GLU 102 HN GLU 102 14.242 -4.575 12.501 787 HA GLU 102 HA GLU 102 15.506 -3.076 14.669 788 HB2 GLU 102 HB2 GLU 102 14.335 -5.252 15.124 789 HB3 GLU 102 HB1 GLU 102 15.577 -6.058 14.177 790 HG2 GLU 102 HG2 GLU 102 15.927 -6.161 16.633 791 HG3 GLU 102 HG1 GLU 102 17.270 -5.457 15.735 792 H HIS 103 HN HIS 103 16.291 -2.723 11.895 793 HA HIS 103 HA HIS 103 19.138 -3.460 12.150 794 HB2 HIS 103 HB2 HIS 103 17.535 -2.609 9.725 795 HB3 HIS 103 HB1 HIS 103 19.289 -2.723 9.732 796 HD1 HIS 103 HD1 HIS 103 19.902 -4.736 8.455 797 HD2 HIS 103 HD2 HIS 103 16.594 -5.407 10.885 798 HE1 HIS 103 HE1 HIS 103 19.263 -7.139 8.088 799 HE2 HIS 103 HE2 HIS 103 17.109 -7.434 9.359 800 H HIS 104 HN HIS 104 17.737 -1.474 13.656 801 HA HIS 104 HA HIS 104 18.058 1.117 12.513 802 HB2 HIS 104 HB2 HIS 104 16.329 0.502 14.205 803 HB3 HIS 104 HB1 HIS 104 17.607 0.353 15.404 804 HD1 HIS 104 HD1 HIS 104 17.523 2.300 16.897 805 HD2 HIS 104 HD2 HIS 104 16.700 3.349 12.961 806 HE1 HIS 104 HE1 HIS 104 17.147 4.787 16.925 807 HE2 HIS 104 HE2 HIS 104 16.463 5.365 14.571 808 H HIS 105 HN HIS 105 20.227 -1.033 13.840 809 HA HIS 105 HA HIS 105 22.460 -0.916 14.207 810 HB2 HIS 105 HB2 HIS 105 22.036 1.879 13.184 811 HB3 HIS 105 HB1 HIS 105 23.602 1.365 13.797 812 HD1 HIS 105 HD1 HIS 105 21.089 0.166 11.173 813 HD2 HIS 105 HD2 HIS 105 25.181 0.317 11.892 814 HE1 HIS 105 HE1 HIS 105 22.178 -0.704 9.082 815 HE2 HIS 105 HE2 HIS 105 24.652 -0.395 9.466 816 H HIS 106 HN HIS 106 24.113 0.753 15.470 817 HA HIS 106 HA HIS 106 23.013 0.683 18.138 818 HB2 HIS 106 HB2 HIS 106 25.333 1.101 18.888 819 HB3 HIS 106 HB1 HIS 106 25.204 -0.290 17.824 820 HD1 HIS 106 HD1 HIS 106 27.395 2.352 18.452 821 HD2 HIS 106 HD2 HIS 106 25.838 0.719 14.958 822 HE1 HIS 106 HE1 HIS 106 28.962 3.057 16.613 823 HE2 HIS 106 HE2 HIS 106 27.928 2.171 14.489 824 H HIS 107 HN HIS 107 21.524 2.499 17.430 825 HA HIS 107 HA HIS 107 22.340 4.794 18.882 826 HB2 HIS 107 HB2 HIS 107 22.384 6.490 17.234 827 HB3 HIS 107 HB1 HIS 107 23.399 5.211 16.581 828 HD1 HIS 107 HD1 HIS 107 20.560 7.341 15.760 829 HD2 HIS 107 HD2 HIS 107 22.023 3.653 14.502 830 HE1 HIS 107 HE1 HIS 107 19.440 6.881 13.559 831 HE2 HIS 107 HE2 HIS 107 20.333 4.647 12.807 832 H HIS 108 HN HIS 108 20.576 6.431 18.962 833 HA HIS 108 HA HIS 108 17.994 5.295 18.130 834 HB2 HIS 108 HB2 HIS 108 17.007 6.505 20.146 835 HB3 HIS 108 HB1 HIS 108 17.936 5.053 20.474 836 HD1 HIS 108 HD1 HIS 108 20.000 5.275 21.923 837 HD2 HIS 108 HD2 HIS 108 18.245 8.933 20.998 838 HE1 HIS 108 HE1 HIS 108 21.132 6.968 23.401 839 HE2 HIS 108 HE2 HIS 108 20.208 9.194 22.667 840 H1 MET 1 HT1 MET 1 0.972 6.262 33.833 841 H2 MET 1 HT2 MET 1 2.504 6.051 34.521 842 H3 MET 1 HT3 MET 1 1.387 4.778 34.539 843 HA MET 1 HA MET 1 2.619 5.977 32.123 844 HB2 MET 1 HB2 MET 1 4.148 4.590 33.549 845 HB3 MET 1 HB1 MET 1 3.049 3.235 33.333 846 HG2 MET 1 HG2 MET 1 4.918 3.039 31.827 847 HG3 MET 1 HG1 MET 1 3.434 3.320 30.915 848 HE1 MET 1 HE1 MET 1 6.471 3.688 29.781 849 HE2 MET 1 HE2 MET 1 6.234 5.142 28.808 850 HE3 MET 1 HE3 MET 1 5.014 3.870 28.808 851 H ALA 2 HN ALA 2 0.974 6.067 30.714 852 HA ALA 2 HA ALA 2 -0.969 3.869 30.635 853 HB1 ALA 2 HB1 ALA 2 -1.876 6.129 30.760 854 HB2 ALA 2 HB2 ALA 2 -2.311 5.361 29.234 855 HB3 ALA 2 HB3 ALA 2 -1.023 6.564 29.280 856 H GLY 3 HN GLY 3 1.734 5.144 28.969 857 HA2 GLY 3 HA2 GLY 3 1.098 3.859 26.449 858 HA3 GLY 3 HA1 GLY 3 2.571 4.740 26.833 859 H GLN 4 HN GLN 4 1.466 1.811 26.029 860 HA GLN 4 HA GLN 4 3.658 0.456 27.472 861 HB2 GLN 4 HB2 GLN 4 1.056 -0.734 26.484 862 HB3 GLN 4 HB1 GLN 4 2.373 -1.645 27.208 863 HG2 GLN 4 HG2 GLN 4 0.761 0.504 28.567 864 HG3 GLN 4 HG1 GLN 4 0.580 -1.234 28.802 865 HE21 GLN 4 HE21 GLN 4 1.229 0.868 30.717 866 HE22 GLN 4 HE22 GLN 4 2.750 0.428 31.427 867 H SER 5 HN SER 5 2.740 1.720 24.640 868 HA SER 5 HA SER 5 3.471 1.628 22.512 869 HB2 SER 5 HB2 SER 5 5.541 -0.323 23.559 870 HB3 SER 5 HB1 SER 5 5.606 0.536 22.020 871 HG SER 5 HG SER 5 6.663 1.969 23.164 872 H ASP 6 HN ASP 6 1.631 0.736 21.667 873 HA ASP 6 HA ASP 6 0.948 -1.994 21.731 874 HB2 ASP 6 HB2 ASP 6 0.155 0.212 19.830 875 HB3 ASP 6 HB1 ASP 6 -0.501 -1.419 19.729 876 H ARG 7 HN ARG 7 1.967 -3.621 20.864 877 HA ARG 7 HA ARG 7 4.366 -3.110 19.456 878 HB2 ARG 7 HB2 ARG 7 3.557 -5.046 21.134 879 HB3 ARG 7 HB1 ARG 7 3.368 -5.888 19.601 880 HG2 ARG 7 HG2 ARG 7 5.564 -6.232 20.705 881 HG3 ARG 7 HG1 ARG 7 5.668 -5.586 19.066 882 HD2 ARG 7 HD2 ARG 7 7.203 -4.503 20.731 883 HD3 ARG 7 HD1 ARG 7 6.136 -3.398 19.870 884 HE ARG 7 HE ARG 7 4.759 -3.322 21.901 885 HH11 ARG 7 HH11 ARG 7 8.028 -4.523 22.180 886 HH12 ARG 7 HH12 ARG 7 8.172 -4.111 23.865 887 HH21 ARG 7 HH21 ARG 7 4.952 -2.747 24.114 888 HH22 ARG 7 HH22 ARG 7 6.433 -3.098 24.952 889 H LYS 8 HN LYS 8 1.377 -4.807 18.490 890 HA LYS 8 HA LYS 8 2.406 -5.222 15.832 891 HB2 LYS 8 HB2 LYS 8 0.901 -6.879 16.818 892 HB3 LYS 8 HB1 LYS 8 -0.366 -5.668 16.962 893 HG2 LYS 8 HG2 LYS 8 -0.667 -5.555 14.630 894 HG3 LYS 8 HG1 LYS 8 0.835 -6.428 14.321 895 HD2 LYS 8 HD2 LYS 8 -1.590 -7.599 15.687 896 HD3 LYS 8 HD1 LYS 8 -1.188 -7.819 13.982 897 HE2 LYS 8 HE2 LYS 8 0.979 -8.811 14.686 898 HE3 LYS 8 HE1 LYS 8 0.441 -8.705 16.361 899 HZ1 LYS 8 HZ1 LYS 8 -1.412 -10.164 15.812 900 HZ2 LYS 8 HZ2 LYS 8 0.075 -10.904 15.465 901 HZ3 LYS 8 HZ3 LYS 8 -0.872 -10.272 14.205 902 H ALA 9 HN ALA 9 0.134 -3.048 17.416 903 HA ALA 9 HA ALA 9 -0.948 -1.822 15.154 904 HB1 ALA 9 HB1 ALA 9 -0.394 -0.584 17.844 905 HB2 ALA 9 HB2 ALA 9 -1.840 -1.487 17.394 906 HB3 ALA 9 HB3 ALA 9 -1.488 0.057 16.617 907 H ALA 10 HN ALA 10 2.050 -1.113 16.906 908 HA ALA 10 HA ALA 10 2.729 1.197 15.417 909 HB1 ALA 10 HB1 ALA 10 4.925 0.989 16.390 910 HB2 ALA 10 HB2 ALA 10 4.605 -0.686 16.840 911 HB3 ALA 10 HB3 ALA 10 3.710 0.621 17.615 912 H LEU 11 HN LEU 11 3.262 -2.233 14.912 913 HA LEU 11 HA LEU 11 5.142 -1.932 12.786 914 HB2 LEU 11 HB2 LEU 11 4.928 -4.008 14.111 915 HB3 LEU 11 HB1 LEU 11 3.322 -4.254 13.452 916 HG LEU 11 HG LEU 11 4.313 -4.472 11.186 917 HD11 LEU 11 HD11 LEU 11 6.719 -4.773 10.956 918 HD12 LEU 11 HD12 LEU 11 6.939 -4.388 12.663 919 HD13 LEU 11 HD13 LEU 11 6.336 -3.158 11.552 920 HD21 LEU 11 HD21 LEU 11 5.298 -6.692 11.557 921 HD22 LEU 11 HD22 LEU 11 3.822 -6.456 12.494 922 HD23 LEU 11 HD23 LEU 11 5.395 -6.350 13.284 923 H LEU 12 HN LEU 12 1.661 -2.429 12.993 924 HA LEU 12 HA LEU 12 1.186 -2.457 10.196 925 HB2 LEU 12 HB2 LEU 12 -0.678 -1.726 12.455 926 HB3 LEU 12 HB1 LEU 12 -1.165 -2.103 10.814 927 HG LEU 12 HG LEU 12 0.153 -4.022 12.741 928 HD11 LEU 12 HD11 LEU 12 -2.684 -3.842 11.742 929 HD12 LEU 12 HD12 LEU 12 -2.123 -3.527 13.384 930 HD13 LEU 12 HD13 LEU 12 -2.023 -5.155 12.717 931 HD21 LEU 12 HD21 LEU 12 0.779 -4.507 10.449 932 HD22 LEU 12 HD22 LEU 12 -0.912 -4.448 9.952 933 HD23 LEU 12 HD23 LEU 12 -0.357 -5.720 11.042 934 H ASP 13 HN ASP 13 1.388 0.074 12.616 935 HA ASP 13 HA ASP 13 0.384 2.208 11.087 936 HB2 ASP 13 HB2 ASP 13 1.755 1.874 13.604 937 HB3 ASP 13 HB1 ASP 13 2.407 3.260 12.735 938 H GLN 14 HN GLN 14 3.554 0.716 11.239 939 HA GLN 14 HA GLN 14 4.896 2.622 9.615 940 HB2 GLN 14 HB2 GLN 14 6.069 0.986 11.060 941 HB3 GLN 14 HB1 GLN 14 5.512 -0.314 10.016 942 HG2 GLN 14 HG2 GLN 14 7.760 0.144 9.441 943 HG3 GLN 14 HG1 GLN 14 6.752 0.767 8.140 944 HE21 GLN 14 HE21 GLN 14 9.468 1.474 8.938 945 HE22 GLN 14 HE22 GLN 14 9.459 3.175 9.249 946 H VAL 15 HN VAL 15 3.275 -0.461 8.934 947 HA VAL 15 HA VAL 15 3.630 -0.500 6.150 948 HB VAL 15 HB VAL 15 1.289 -1.553 7.758 949 HG11 VAL 15 HG11 VAL 15 0.735 -1.376 5.397 950 HG12 VAL 15 HG12 VAL 15 0.913 -3.066 5.872 951 HG13 VAL 15 HG13 VAL 15 2.201 -2.264 4.973 952 HG21 VAL 15 HG21 VAL 15 3.811 -2.933 6.845 953 HG22 VAL 15 HG22 VAL 15 2.460 -3.699 7.682 954 HG23 VAL 15 HG23 VAL 15 3.422 -2.469 8.502 955 H ALA 16 HN ALA 16 1.161 0.958 8.183 956 HA ALA 16 HA ALA 16 -0.557 1.948 6.226 957 HB1 ALA 16 HB1 ALA 16 -1.089 1.905 8.620 958 HB2 ALA 16 HB2 ALA 16 -1.333 3.507 7.925 959 HB3 ALA 16 HB3 ALA 16 0.098 3.177 8.901 960 H ARG 17 HN ARG 17 2.421 3.275 7.552 961 HA ARG 17 HA ARG 17 2.313 5.813 6.350 962 HB2 ARG 17 HB2 ARG 17 3.893 5.444 8.092 963 HB3 ARG 17 HB1 ARG 17 4.615 4.083 7.249 964 HG2 ARG 17 HG2 ARG 17 5.594 5.535 5.615 965 HG3 ARG 17 HG1 ARG 17 4.733 6.927 6.274 966 HD2 ARG 17 HD2 ARG 17 6.732 5.283 7.817 967 HD3 ARG 17 HD1 ARG 17 7.126 6.777 6.967 968 HE ARG 17 HE ARG 17 5.039 7.476 8.570 969 HH11 ARG 17 HH11 ARG 17 8.099 5.889 9.182 970 HH12 ARG 17 HH12 ARG 17 8.302 6.601 10.748 971 HH21 ARG 17 HH21 ARG 17 5.284 8.384 10.642 972 HH22 ARG 17 HH22 ARG 17 6.697 8.017 11.592 973 H VAL 18 HN VAL 18 3.642 2.737 5.221 974 HA VAL 18 HA VAL 18 4.724 3.670 2.795 975 HB VAL 18 HB VAL 18 3.594 0.918 3.361 976 HG11 VAL 18 HG11 VAL 18 5.589 1.841 1.294 977 HG12 VAL 18 HG12 VAL 18 3.933 1.322 0.982 978 HG13 VAL 18 HG13 VAL 18 5.119 0.167 1.593 979 HG21 VAL 18 HG21 VAL 18 5.277 1.559 5.013 980 HG22 VAL 18 HG22 VAL 18 6.402 1.970 3.718 981 HG23 VAL 18 HG23 VAL 18 5.891 0.298 3.944 982 H GLY 19 HN GLY 19 1.558 2.222 3.523 983 HA2 GLY 19 HA2 GLY 19 0.514 2.446 0.900 984 HA3 GLY 19 HA1 GLY 19 -0.433 2.260 2.370 985 H LYS 20 HN LYS 20 0.685 4.681 3.565 986 HA LYS 20 HA LYS 20 -1.253 6.530 2.693 987 HB2 LYS 20 HB2 LYS 20 -0.217 6.360 4.987 988 HB3 LYS 20 HB1 LYS 20 1.222 7.116 4.321 989 HG2 LYS 20 HG2 LYS 20 -0.032 9.115 3.797 990 HG3 LYS 20 HG1 LYS 20 -1.520 8.358 4.375 991 HD2 LYS 20 HD2 LYS 20 -0.448 8.115 6.611 992 HD3 LYS 20 HD1 LYS 20 0.934 9.029 6.000 993 HE2 LYS 20 HE2 LYS 20 -0.615 10.447 7.261 994 HE3 LYS 20 HE1 LYS 20 -0.493 10.945 5.575 995 HZ1 LYS 20 HZ1 LYS 20 -2.793 10.857 6.554 996 HZ2 LYS 20 HZ2 LYS 20 -2.651 9.164 6.554 997 HZ3 LYS 20 HZ3 LYS 20 -2.579 10.025 5.093 998 H ALA 21 HN ALA 21 2.168 6.129 1.961 999 HA ALA 21 HA ALA 21 2.231 8.563 0.371 1000 HB1 ALA 21 HB1 ALA 21 4.204 7.946 1.650 1001 HB2 ALA 21 HB2 ALA 21 4.562 7.957 -0.076 1002 HB3 ALA 21 HB3 ALA 21 4.321 6.425 0.766 1003 H LEU 22 HN LEU 22 1.475 5.270 -0.054 1004 HA LEU 22 HA LEU 22 2.137 5.045 -2.834 1005 HB2 LEU 22 HB2 LEU 22 1.956 3.127 -1.235 1006 HB3 LEU 22 HB1 LEU 22 0.225 3.387 -1.185 1007 HG LEU 22 HG LEU 22 0.156 2.928 -3.651 1008 HD11 LEU 22 HD11 LEU 22 2.063 1.808 -4.666 1009 HD12 LEU 22 HD12 LEU 22 3.003 2.050 -3.194 1010 HD13 LEU 22 HD13 LEU 22 2.490 3.439 -4.152 1011 HD21 LEU 22 HD21 LEU 22 1.252 0.728 -1.901 1012 HD22 LEU 22 HD22 LEU 22 0.360 0.508 -3.408 1013 HD23 LEU 22 HD23 LEU 22 -0.438 1.223 -2.008 1014 H ALA 23 HN ALA 23 -0.240 6.702 -1.204 1015 HA ALA 23 HA ALA 23 -2.342 6.403 -3.128 1016 HB1 ALA 23 HB1 ALA 23 -3.508 8.093 -1.801 1017 HB2 ALA 23 HB2 ALA 23 -2.055 8.349 -0.834 1018 HB3 ALA 23 HB3 ALA 23 -2.894 6.796 -0.774 1019 H ASN 24 HN ASN 24 -2.965 7.888 -4.561 1020 HA ASN 24 HA ASN 24 -2.945 9.647 -6.011 1021 HB2 ASN 24 HB2 ASN 24 -0.707 10.672 -4.270 1022 HB3 ASN 24 HB1 ASN 24 -1.148 11.460 -5.779 1023 HD21 ASN 24 HD21 ASN 24 -3.431 9.939 -3.599 1024 HD22 ASN 24 HD22 ASN 24 -4.221 11.394 -3.108 1025 H GLY 25 HN GLY 25 -2.484 9.042 -7.958 1026 HA2 GLY 25 HA2 GLY 25 -0.318 7.296 -8.533 1027 HA3 GLY 25 HA1 GLY 25 -1.445 7.972 -9.697 1028 H ARG 26 HN ARG 26 -0.583 10.739 -8.656 1029 HA ARG 26 HA ARG 26 1.143 11.422 -10.703 1030 HB2 ARG 26 HB2 ARG 26 0.526 12.707 -8.071 1031 HB3 ARG 26 HB1 ARG 26 1.758 13.398 -9.118 1032 HG2 ARG 26 HG2 ARG 26 0.119 13.614 -10.913 1033 HG3 ARG 26 HG1 ARG 26 -1.121 12.925 -9.864 1034 HD2 ARG 26 HD2 ARG 26 -1.042 14.782 -8.400 1035 HD3 ARG 26 HD1 ARG 26 0.438 15.390 -9.133 1036 HE ARG 26 HE ARG 26 -1.486 15.330 -11.131 1037 HH11 ARG 26 HH11 ARG 26 -1.028 16.953 -8.049 1038 HH12 ARG 26 HH12 ARG 26 -1.855 18.400 -8.555 1039 HH21 ARG 26 HH21 ARG 26 -2.529 17.259 -11.801 1040 HH22 ARG 26 HH22 ARG 26 -2.668 18.583 -10.681 1041 H ARG 27 HN ARG 27 1.996 10.477 -7.392 1042 HA ARG 27 HA ARG 27 4.821 10.778 -8.036 1043 HB2 ARG 27 HB2 ARG 27 5.123 10.062 -5.611 1044 HB3 ARG 27 HB1 ARG 27 4.344 11.612 -5.897 1045 HG2 ARG 27 HG2 ARG 27 2.147 10.495 -5.592 1046 HG3 ARG 27 HG1 ARG 27 3.015 9.022 -5.145 1047 HD2 ARG 27 HD2 ARG 27 3.901 9.994 -3.210 1048 HD3 ARG 27 HD1 ARG 27 3.529 11.630 -3.758 1049 HE ARG 27 HE ARG 27 1.471 9.670 -2.941 1050 HH11 ARG 27 HH11 ARG 27 2.739 12.936 -3.095 1051 HH12 ARG 27 HH12 ARG 27 1.426 13.633 -2.196 1052 HH21 ARG 27 HH21 ARG 27 -0.284 10.582 -1.803 1053 HH22 ARG 27 HH22 ARG 27 -0.333 12.293 -1.497 1054 H LEU 28 HN LEU 28 2.480 8.383 -8.229 1055 HA LEU 28 HA LEU 28 4.170 6.134 -7.690 1056 HB2 LEU 28 HB2 LEU 28 1.580 6.299 -9.235 1057 HB3 LEU 28 HB1 LEU 28 2.377 4.812 -8.757 1058 HG LEU 28 HG LEU 28 1.126 6.865 -6.934 1059 HD11 LEU 28 HD11 LEU 28 0.458 3.985 -7.514 1060 HD12 LEU 28 HD12 LEU 28 -0.469 5.398 -8.020 1061 HD13 LEU 28 HD13 LEU 28 -0.332 4.999 -6.309 1062 HD21 LEU 28 HD21 LEU 28 2.643 4.358 -6.222 1063 HD22 LEU 28 HD22 LEU 28 1.760 5.391 -5.094 1064 HD23 LEU 28 HD23 LEU 28 3.180 6.013 -5.936 1065 H GLN 29 HN GLN 29 3.469 8.178 -10.399 1066 HA GLN 29 HA GLN 29 4.564 6.647 -12.479 1067 HB2 GLN 29 HB2 GLN 29 4.581 9.645 -12.076 1068 HB3 GLN 29 HB1 GLN 29 5.025 8.841 -13.575 1069 HG2 GLN 29 HG2 GLN 29 2.749 7.890 -13.696 1070 HG3 GLN 29 HG1 GLN 29 2.326 8.804 -12.249 1071 HE21 GLN 29 HE21 GLN 29 3.148 8.985 -15.621 1072 HE22 GLN 29 HE22 GLN 29 2.596 10.608 -15.871 1073 H ILE 30 HN ILE 30 6.018 8.468 -9.908 1074 HA ILE 30 HA ILE 30 8.658 8.565 -10.943 1075 HB ILE 30 HB ILE 30 7.739 8.666 -8.064 1076 HG12 ILE 30 HG12 ILE 30 8.386 10.906 -9.995 1077 HG13 ILE 30 HG11 ILE 30 6.762 10.430 -9.512 1078 HG21 ILE 30 HG21 ILE 30 10.094 8.115 -8.224 1079 HG22 ILE 30 HG22 ILE 30 9.897 9.770 -7.649 1080 HG23 ILE 30 HG23 ILE 30 10.358 9.468 -9.324 1081 HD11 ILE 30 HD11 ILE 30 7.258 11.065 -7.213 1082 HD12 ILE 30 HD12 ILE 30 7.517 12.412 -8.321 1083 HD13 ILE 30 HD13 ILE 30 8.897 11.516 -7.686 1084 H LEU 31 HN LEU 31 7.068 6.395 -8.603 1085 HA LEU 31 HA LEU 31 9.218 4.647 -8.199 1086 HB2 LEU 31 HB2 LEU 31 6.244 4.115 -8.141 1087 HB3 LEU 31 HB1 LEU 31 7.452 2.966 -7.601 1088 HG LEU 31 HG LEU 31 7.058 5.704 -6.387 1089 HD11 LEU 31 HD11 LEU 31 5.998 4.542 -4.530 1090 HD12 LEU 31 HD12 LEU 31 6.148 3.008 -5.385 1091 HD13 LEU 31 HD13 LEU 31 5.100 4.276 -6.024 1092 HD21 LEU 31 HD21 LEU 31 9.315 4.813 -6.122 1093 HD22 LEU 31 HD22 LEU 31 8.653 3.307 -5.483 1094 HD23 LEU 31 HD23 LEU 31 8.451 4.809 -4.584 1095 H ASP 32 HN ASP 32 6.726 4.753 -10.661 1096 HA ASP 32 HA ASP 32 7.320 2.320 -11.951 1097 HB2 ASP 32 HB2 ASP 32 5.225 3.487 -12.335 1098 HB3 ASP 32 HB1 ASP 32 6.079 4.866 -13.013 1099 H LEU 33 HN LEU 33 8.547 5.603 -12.414 1100 HA LEU 33 HA LEU 33 10.126 4.968 -14.699 1101 HB2 LEU 33 HB2 LEU 33 9.375 7.256 -14.190 1102 HB3 LEU 33 HB1 LEU 33 10.379 7.265 -12.753 1103 HG LEU 33 HG LEU 33 12.391 7.033 -14.200 1104 HD11 LEU 33 HD11 LEU 33 12.180 7.431 -16.597 1105 HD12 LEU 33 HD12 LEU 33 10.423 7.447 -16.447 1106 HD13 LEU 33 HD13 LEU 33 11.322 5.965 -16.119 1107 HD21 LEU 33 HD21 LEU 33 12.366 9.332 -15.028 1108 HD22 LEU 33 HD22 LEU 33 11.671 9.223 -13.410 1109 HD23 LEU 33 HD23 LEU 33 10.616 9.394 -14.813 1110 H LEU 34 HN LEU 34 10.739 5.111 -11.229 1111 HA LEU 34 HA LEU 34 13.561 4.709 -11.489 1112 HB2 LEU 34 HB2 LEU 34 11.793 4.366 -9.067 1113 HB3 LEU 34 HB1 LEU 34 13.544 4.451 -9.057 1114 HG LEU 34 HG LEU 34 11.621 6.667 -9.747 1115 HD11 LEU 34 HD11 LEU 34 11.878 6.259 -7.367 1116 HD12 LEU 34 HD12 LEU 34 12.642 7.782 -7.824 1117 HD13 LEU 34 HD13 LEU 34 13.632 6.354 -7.523 1118 HD21 LEU 34 HD21 LEU 34 14.633 6.705 -9.851 1119 HD22 LEU 34 HD22 LEU 34 13.558 8.078 -10.118 1120 HD23 LEU 34 HD23 LEU 34 13.556 6.723 -11.246 1121 H ALA 35 HN ALA 35 10.873 2.652 -11.642 1122 HA ALA 35 HA ALA 35 12.206 0.250 -10.797 1123 HB1 ALA 35 HB1 ALA 35 9.716 0.604 -12.465 1124 HB2 ALA 35 HB2 ALA 35 9.765 0.435 -10.711 1125 HB3 ALA 35 HB3 ALA 35 10.266 -0.907 -11.739 1126 H GLN 36 HN GLN 36 12.268 2.217 -13.532 1127 HA GLN 36 HA GLN 36 13.196 0.079 -15.303 1128 HB2 GLN 36 HB2 GLN 36 12.535 2.985 -15.830 1129 HB3 GLN 36 HB1 GLN 36 13.081 1.848 -17.056 1130 HG2 GLN 36 HG2 GLN 36 11.096 0.577 -16.893 1131 HG3 GLN 36 HG1 GLN 36 10.603 1.405 -15.419 1132 HE21 GLN 36 HE21 GLN 36 9.672 3.412 -15.543 1133 HE22 GLN 36 HE22 GLN 36 9.137 4.110 -17.035 1134 H GLY 37 HN GLY 37 14.508 1.869 -12.992 1135 HA2 GLY 37 HA2 GLY 37 17.030 1.571 -12.995 1136 HA3 GLY 37 HA1 GLY 37 16.967 2.508 -14.484 1137 H GLU 38 HN GLU 38 18.532 3.524 -12.597 1138 HA GLU 38 HA GLU 38 17.030 5.359 -10.931 1139 HB2 GLU 38 HB2 GLU 38 19.282 6.117 -10.166 1140 HB3 GLU 38 HB1 GLU 38 18.983 4.401 -9.923 1141 HG2 GLU 38 HG2 GLU 38 20.267 3.941 -11.992 1142 HG3 GLU 38 HG1 GLU 38 20.657 5.660 -12.078 1143 H ARG 39 HN ARG 39 16.855 7.519 -11.201 1144 HA ARG 39 HA ARG 39 18.074 8.725 -13.589 1145 HB2 ARG 39 HB2 ARG 39 15.157 8.877 -12.806 1146 HB3 ARG 39 HB1 ARG 39 15.905 9.922 -14.003 1147 HG2 ARG 39 HG2 ARG 39 15.808 6.923 -14.203 1148 HG3 ARG 39 HG1 ARG 39 14.642 8.013 -14.952 1149 HD2 ARG 39 HD2 ARG 39 16.397 9.033 -16.276 1150 HD3 ARG 39 HD1 ARG 39 17.611 8.038 -15.469 1151 HE ARG 39 HE ARG 39 15.892 6.216 -16.511 1152 HH11 ARG 39 HH11 ARG 39 17.619 8.933 -17.898 1153 HH12 ARG 39 HH12 ARG 39 17.804 8.189 -19.456 1154 HH21 ARG 39 HH21 ARG 39 16.167 5.216 -18.542 1155 HH22 ARG 39 HH22 ARG 39 16.989 6.062 -19.821 1156 H ALA 40 HN ALA 40 18.212 11.045 -13.506 1157 HA ALA 40 HA ALA 40 18.655 12.104 -10.882 1158 HB1 ALA 40 HB1 ALA 40 20.010 12.800 -12.801 1159 HB2 ALA 40 HB2 ALA 40 19.217 14.178 -12.040 1160 HB3 ALA 40 HB3 ALA 40 18.583 13.518 -13.548 1161 H VAL 41 HN VAL 41 17.558 13.918 -9.958 1162 HA VAL 41 HA VAL 41 14.804 13.607 -9.782 1163 HB VAL 41 HB VAL 41 16.407 16.081 -9.105 1164 HG11 VAL 41 HG11 VAL 41 14.583 16.539 -7.512 1165 HG12 VAL 41 HG12 VAL 41 13.681 15.181 -8.185 1166 HG13 VAL 41 HG13 VAL 41 14.045 16.584 -9.190 1167 HG21 VAL 41 HG21 VAL 41 17.282 14.118 -7.988 1168 HG22 VAL 41 HG22 VAL 41 15.666 13.687 -7.428 1169 HG23 VAL 41 HG23 VAL 41 16.448 15.153 -6.829 1170 H GLU 42 HN GLU 42 16.664 15.977 -11.668 1171 HA GLU 42 HA GLU 42 14.465 17.460 -12.602 1172 HB2 GLU 42 HB2 GLU 42 17.035 17.009 -14.120 1173 HB3 GLU 42 HB1 GLU 42 15.944 18.378 -14.258 1174 HG2 GLU 42 HG2 GLU 42 17.504 19.343 -12.951 1175 HG3 GLU 42 HG1 GLU 42 16.546 18.595 -11.672 1176 H ALA 43 HN ALA 43 16.024 14.559 -13.839 1177 HA ALA 43 HA ALA 43 14.599 14.436 -16.287 1178 HB1 ALA 43 HB1 ALA 43 15.856 12.174 -14.728 1179 HB2 ALA 43 HB2 ALA 43 16.690 13.200 -15.896 1180 HB3 ALA 43 HB3 ALA 43 15.385 12.139 -16.429 1181 H ILE 44 HN ILE 44 14.064 13.071 -13.079 1182 HA ILE 44 HA ILE 44 11.772 11.554 -13.662 1183 HB ILE 44 HB ILE 44 12.478 12.952 -11.073 1184 HG12 ILE 44 HG12 ILE 44 13.033 10.108 -11.943 1185 HG13 ILE 44 HG11 ILE 44 14.229 11.400 -11.919 1186 HG21 ILE 44 HG21 ILE 44 10.142 12.285 -11.124 1187 HG22 ILE 44 HG22 ILE 44 11.050 11.261 -10.011 1188 HG23 ILE 44 HG23 ILE 44 10.602 10.651 -11.605 1189 HD11 ILE 44 HD11 ILE 44 14.448 9.973 -9.976 1190 HD12 ILE 44 HD12 ILE 44 12.771 10.287 -9.533 1191 HD13 ILE 44 HD13 ILE 44 13.953 11.595 -9.498 1192 H ALA 45 HN ALA 45 12.113 14.890 -12.479 1193 HA ALA 45 HA ALA 45 9.385 15.513 -12.316 1194 HB1 ALA 45 HB1 ALA 45 11.122 16.882 -11.290 1195 HB2 ALA 45 HB2 ALA 45 10.098 17.853 -12.348 1196 HB3 ALA 45 HB3 ALA 45 11.705 17.358 -12.886 1197 H THR 46 HN THR 46 11.626 15.631 -15.021 1198 HA THR 46 HA THR 46 9.858 17.022 -16.771 1199 HB THR 46 HB THR 46 12.220 15.271 -17.495 1200 HG1 THR 46 HG1 THR 46 12.946 16.924 -16.164 1201 HG21 THR 46 HG21 THR 46 10.741 15.770 -19.390 1202 HG22 THR 46 HG22 THR 46 12.287 16.603 -19.547 1203 HG23 THR 46 HG23 THR 46 10.856 17.492 -19.026 1204 H ALA 47 HN ALA 47 10.764 13.596 -16.408 1205 HA ALA 47 HA ALA 47 9.202 12.618 -18.530 1206 HB1 ALA 47 HB1 ALA 47 11.039 11.363 -17.501 1207 HB2 ALA 47 HB2 ALA 47 9.548 10.424 -17.558 1208 HB3 ALA 47 HB3 ALA 47 10.070 11.157 -16.040 1209 H THR 48 HN THR 48 8.368 13.399 -15.228 1210 HA THR 48 HA THR 48 5.810 12.044 -15.413 1211 HB THR 48 HB THR 48 5.440 13.087 -13.122 1212 HG1 THR 48 HG1 THR 48 8.233 13.560 -13.145 1213 HG21 THR 48 HG21 THR 48 6.180 10.774 -13.395 1214 HG22 THR 48 HG22 THR 48 6.959 11.520 -12.000 1215 HG23 THR 48 HG23 THR 48 7.856 11.314 -13.505 1216 H GLY 49 HN GLY 49 7.101 15.200 -15.972 1217 HA2 GLY 49 HA2 GLY 49 6.030 17.032 -16.913 1218 HA3 GLY 49 HA1 GLY 49 4.505 16.164 -16.795 1219 H MET 50 HN MET 50 6.736 16.762 -14.135 1220 HA MET 50 HA MET 50 4.768 18.627 -12.990 1221 HB2 MET 50 HB2 MET 50 6.209 16.380 -11.584 1222 HB3 MET 50 HB1 MET 50 5.385 17.680 -10.736 1223 HG2 MET 50 HG2 MET 50 3.289 17.019 -11.909 1224 HG3 MET 50 HG1 MET 50 4.154 15.627 -12.557 1225 HE1 MET 50 HE1 MET 50 5.030 13.632 -9.302 1226 HE2 MET 50 HE2 MET 50 6.036 14.832 -10.115 1227 HE3 MET 50 HE3 MET 50 5.120 13.660 -11.062 1228 H ASN 51 HN ASN 51 5.632 20.054 -11.345 1229 HA ASN 51 HA ASN 51 7.980 21.366 -12.150 1230 HB2 ASN 51 HB2 ASN 51 6.196 22.536 -10.972 1231 HB3 ASN 51 HB1 ASN 51 6.449 21.540 -9.542 1232 HD21 ASN 51 HD21 ASN 51 7.643 24.179 -11.453 1233 HD22 ASN 51 HD22 ASN 51 8.818 24.738 -10.306 1234 H LEU 52 HN LEU 52 10.044 21.370 -11.389 1235 HA LEU 52 HA LEU 52 11.198 19.041 -10.467 1236 HB2 LEU 52 HB2 LEU 52 12.448 20.790 -11.589 1237 HB3 LEU 52 HB1 LEU 52 12.197 21.877 -10.237 1238 HG LEU 52 HG LEU 52 13.519 20.321 -8.809 1239 HD11 LEU 52 HD11 LEU 52 14.058 18.961 -11.440 1240 HD12 LEU 52 HD12 LEU 52 13.224 18.275 -10.045 1241 HD13 LEU 52 HD13 LEU 52 14.942 18.663 -9.943 1242 HD21 LEU 52 HD21 LEU 52 14.547 22.299 -9.780 1243 HD22 LEU 52 HD22 LEU 52 14.922 21.397 -11.248 1244 HD23 LEU 52 HD23 LEU 52 15.695 20.962 -9.724 1245 H THR 53 HN THR 53 10.503 21.971 -8.551 1246 HA THR 53 HA THR 53 11.540 20.963 -6.134 1247 HB THR 53 HB THR 53 9.394 23.070 -6.421 1248 HG1 THR 53 HG1 THR 53 12.125 23.707 -6.266 1249 HG21 THR 53 HG21 THR 53 10.422 23.982 -4.376 1250 HG22 THR 53 HG22 THR 53 11.531 22.612 -4.334 1251 HG23 THR 53 HG23 THR 53 9.798 22.351 -4.125 1252 H THR 54 HN THR 54 8.277 20.968 -7.503 1253 HA THR 54 HA THR 54 6.968 19.885 -5.245 1254 HB THR 54 HB THR 54 6.134 19.589 -8.138 1255 HG1 THR 54 HG1 THR 54 6.368 21.803 -6.529 1256 HG21 THR 54 HG21 THR 54 4.547 19.656 -5.566 1257 HG22 THR 54 HG22 THR 54 4.838 18.233 -6.569 1258 HG23 THR 54 HG23 THR 54 3.863 19.568 -7.189 1259 H ALA 55 HN ALA 55 8.450 18.406 -8.107 1260 HA ALA 55 HA ALA 55 7.783 15.730 -7.500 1261 HB1 ALA 55 HB1 ALA 55 9.558 15.113 -9.047 1262 HB2 ALA 55 HB2 ALA 55 10.189 16.761 -9.003 1263 HB3 ALA 55 HB3 ALA 55 8.601 16.443 -9.703 1264 H SER 56 HN SER 56 10.511 17.780 -6.589 1265 HA SER 56 HA SER 56 12.081 15.857 -5.306 1266 HB2 SER 56 HB2 SER 56 11.798 18.790 -4.609 1267 HB3 SER 56 HB1 SER 56 13.143 17.743 -4.157 1268 HG SER 56 HG SER 56 12.362 18.398 -6.816 1269 H ALA 57 HN ALA 57 9.418 17.852 -4.082 1270 HA ALA 57 HA ALA 57 9.599 17.060 -1.383 1271 HB1 ALA 57 HB1 ALA 57 7.294 17.889 -1.183 1272 HB2 ALA 57 HB2 ALA 57 7.190 18.000 -2.941 1273 HB3 ALA 57 HB3 ALA 57 8.329 19.018 -2.057 1274 H ASN 58 HN ASN 58 7.827 15.720 -4.130 1275 HA ASN 58 HA ASN 58 6.483 13.706 -2.657 1276 HB2 ASN 58 HB2 ASN 58 7.083 14.075 -5.575 1277 HB3 ASN 58 HB1 ASN 58 6.390 12.564 -4.992 1278 HD21 ASN 58 HD21 ASN 58 5.836 15.936 -5.571 1279 HD22 ASN 58 HD22 ASN 58 4.125 15.899 -5.308 1280 H LEU 59 HN LEU 59 9.627 13.859 -4.209 1281 HA LEU 59 HA LEU 59 10.307 11.139 -4.013 1282 HB2 LEU 59 HB2 LEU 59 12.014 13.625 -3.984 1283 HB3 LEU 59 HB1 LEU 59 12.682 12.003 -4.014 1284 HG LEU 59 HG LEU 59 10.869 13.149 -6.139 1285 HD11 LEU 59 HD11 LEU 59 13.021 14.287 -6.108 1286 HD12 LEU 59 HD12 LEU 59 12.891 13.233 -7.516 1287 HD13 LEU 59 HD13 LEU 59 13.857 12.734 -6.127 1288 HD21 LEU 59 HD21 LEU 59 11.504 11.179 -7.415 1289 HD22 LEU 59 HD22 LEU 59 10.749 10.703 -5.893 1290 HD23 LEU 59 HD23 LEU 59 12.501 10.612 -6.077 1291 H GLN 60 HN GLN 60 10.465 13.763 -1.688 1292 HA GLN 60 HA GLN 60 11.917 12.321 0.286 1293 HB2 GLN 60 HB2 GLN 60 10.036 14.662 0.621 1294 HB3 GLN 60 HB1 GLN 60 11.180 14.081 1.826 1295 HG2 GLN 60 HG2 GLN 60 13.027 14.594 0.297 1296 HG3 GLN 60 HG1 GLN 60 11.864 15.225 -0.870 1297 HE21 GLN 60 HE21 GLN 60 13.465 15.750 2.161 1298 HE22 GLN 60 HE22 GLN 60 13.029 17.416 2.328 1299 H ALA 61 HN ALA 61 8.492 12.766 -0.415 1300 HA ALA 61 HA ALA 61 7.503 11.328 1.819 1301 HB1 ALA 61 HB1 ALA 61 5.410 11.184 0.564 1302 HB2 ALA 61 HB2 ALA 61 6.241 11.729 -0.893 1303 HB3 ALA 61 HB3 ALA 61 6.081 12.813 0.489 1304 H LEU 62 HN LEU 62 8.415 10.408 -1.469 1305 HA LEU 62 HA LEU 62 7.795 7.636 -1.097 1306 HB2 LEU 62 HB2 LEU 62 9.551 8.920 -3.178 1307 HB3 LEU 62 HB1 LEU 62 8.988 7.257 -3.183 1308 HG LEU 62 HG LEU 62 7.217 9.699 -3.402 1309 HD11 LEU 62 HD11 LEU 62 8.069 7.680 -5.469 1310 HD12 LEU 62 HD12 LEU 62 8.577 9.366 -5.392 1311 HD13 LEU 62 HD13 LEU 62 6.889 8.966 -5.712 1312 HD21 LEU 62 HD21 LEU 62 6.092 7.838 -2.300 1313 HD22 LEU 62 HD22 LEU 62 6.583 6.756 -3.604 1314 HD23 LEU 62 HD23 LEU 62 5.454 8.071 -3.928 1315 H LYS 63 HN LYS 63 10.325 9.568 0.014 1316 HA LYS 63 HA LYS 63 12.152 7.355 0.217 1317 HB2 LYS 63 HB2 LYS 63 12.934 9.714 0.219 1318 HB3 LYS 63 HB1 LYS 63 12.128 9.957 1.761 1319 HG2 LYS 63 HG2 LYS 63 13.602 8.444 2.857 1320 HG3 LYS 63 HG1 LYS 63 14.299 7.927 1.319 1321 HD2 LYS 63 HD2 LYS 63 14.458 10.733 2.422 1322 HD3 LYS 63 HD1 LYS 63 15.740 9.527 2.554 1323 HE2 LYS 63 HE2 LYS 63 15.882 9.409 0.114 1324 HE3 LYS 63 HE1 LYS 63 14.588 10.598 -0.022 1325 HZ1 LYS 63 HZ1 LYS 63 17.210 11.091 1.290 1326 HZ2 LYS 63 HZ2 LYS 63 15.986 12.238 1.028 1327 HZ3 LYS 63 HZ3 LYS 63 16.813 11.566 -0.288 1328 H SER 64 HN SER 64 10.424 9.246 2.707 1329 HA SER 64 HA SER 64 10.929 7.439 4.772 1330 HB2 SER 64 HB2 SER 64 9.012 8.686 5.921 1331 HB3 SER 64 HB1 SER 64 10.386 9.649 5.380 1332 HG SER 64 HG SER 64 8.470 10.649 4.753 1333 H GLY 65 HN GLY 65 8.247 7.566 2.489 1334 HA2 GLY 65 HA2 GLY 65 7.370 4.972 3.570 1335 HA3 GLY 65 HA1 GLY 65 6.188 6.247 3.323 1336 H GLY 66 HN GLY 66 8.832 5.950 1.090 1337 HA2 GLY 66 HA2 GLY 66 6.917 4.768 -0.849 1338 HA3 GLY 66 HA1 GLY 66 8.017 6.069 -1.287 1339 H LEU 67 HN LEU 67 10.102 4.860 0.430 1340 HA LEU 67 HA LEU 67 11.556 3.140 0.667 1341 HB2 LEU 67 HB2 LEU 67 10.008 1.522 -1.320 1342 HB3 LEU 67 HB1 LEU 67 11.027 0.958 -0.012 1343 HG LEU 67 HG LEU 67 8.244 2.080 0.136 1344 HD11 LEU 67 HD11 LEU 67 7.789 0.017 1.343 1345 HD12 LEU 67 HD12 LEU 67 9.474 -0.468 1.152 1346 HD13 LEU 67 HD13 LEU 67 8.439 -0.294 -0.266 1347 HD21 LEU 67 HD21 LEU 67 10.195 1.756 2.405 1348 HD22 LEU 67 HD22 LEU 67 8.457 1.981 2.603 1349 HD23 LEU 67 HD23 LEU 67 9.428 3.249 1.845 1350 H VAL 68 HN VAL 68 12.016 5.215 -1.140 1351 HA VAL 68 HA VAL 68 13.736 3.796 -3.066 1352 HB VAL 68 HB VAL 68 13.793 5.888 -4.404 1353 HG11 VAL 68 HG11 VAL 68 11.036 4.755 -3.970 1354 HG12 VAL 68 HG12 VAL 68 12.286 4.069 -5.008 1355 HG13 VAL 68 HG13 VAL 68 11.579 5.639 -5.394 1356 HG21 VAL 68 HG21 VAL 68 13.220 7.473 -2.653 1357 HG22 VAL 68 HG22 VAL 68 11.605 6.773 -2.531 1358 HG23 VAL 68 HG23 VAL 68 12.097 7.608 -4.008 1359 H GLU 69 HN GLU 69 15.796 4.927 -3.544 1360 HA GLU 69 HA GLU 69 16.853 6.194 -1.096 1361 HB2 GLU 69 HB2 GLU 69 18.309 4.484 -3.120 1362 HB3 GLU 69 HB1 GLU 69 19.044 5.242 -1.715 1363 HG2 GLU 69 HG2 GLU 69 17.649 3.875 -0.250 1364 HG3 GLU 69 HG1 GLU 69 16.918 3.117 -1.662 1365 H ALA 70 HN ALA 70 18.760 7.589 -1.467 1366 HA ALA 70 HA ALA 70 18.558 9.062 -4.017 1367 HB1 ALA 70 HB1 ALA 70 18.999 11.122 -2.783 1368 HB2 ALA 70 HB2 ALA 70 19.042 10.218 -1.269 1369 HB3 ALA 70 HB3 ALA 70 17.539 10.333 -2.188 1370 H ARG 71 HN ARG 71 20.438 9.496 -5.033 1371 HA ARG 71 HA ARG 71 22.943 8.926 -3.585 1372 HB2 ARG 71 HB2 ARG 71 22.202 7.146 -5.250 1373 HB3 ARG 71 HB1 ARG 71 22.484 8.344 -6.507 1374 HG2 ARG 71 HG2 ARG 71 24.827 8.495 -5.846 1375 HG3 ARG 71 HG1 ARG 71 24.546 7.297 -4.578 1376 HD2 ARG 71 HD2 ARG 71 23.767 5.730 -6.390 1377 HD3 ARG 71 HD1 ARG 71 24.359 6.911 -7.559 1378 HE ARG 71 HE ARG 71 26.150 5.741 -5.528 1379 HH11 ARG 71 HH11 ARG 71 25.335 6.361 -8.882 1380 HH12 ARG 71 HH12 ARG 71 26.875 5.832 -9.483 1381 HH21 ARG 71 HH21 ARG 71 28.165 5.023 -6.325 1382 HH22 ARG 71 HH22 ARG 71 28.473 5.058 -8.035 1383 H ARG 72 HN ARG 72 24.257 10.616 -3.521 1384 HA ARG 72 HA ARG 72 23.834 12.815 -5.413 1385 HB2 ARG 72 HB2 ARG 72 25.426 12.677 -2.850 1386 HB3 ARG 72 HB1 ARG 72 25.379 14.082 -3.902 1387 HG2 ARG 72 HG2 ARG 72 22.893 14.124 -3.549 1388 HG3 ARG 72 HG1 ARG 72 23.135 12.897 -2.301 1389 HD2 ARG 72 HD2 ARG 72 24.672 14.403 -1.130 1390 HD3 ARG 72 HD1 ARG 72 24.415 15.627 -2.369 1391 HE ARG 72 HE ARG 72 22.283 14.648 -0.576 1392 HH11 ARG 72 HH11 ARG 72 23.886 17.207 -2.346 1393 HH12 ARG 72 HH12 ARG 72 22.804 18.448 -1.795 1394 HH21 ARG 72 HH21 ARG 72 20.855 16.267 0.163 1395 HH22 ARG 72 HH22 ARG 72 21.078 17.918 -0.360 1396 H GLU 73 HN GLU 73 24.973 12.549 -7.238 1397 HA GLU 73 HA GLU 73 27.834 11.894 -6.955 1398 HB2 GLU 73 HB2 GLU 73 26.013 11.635 -9.356 1399 HB3 GLU 73 HB1 GLU 73 27.751 11.390 -9.408 1400 HG2 GLU 73 HG2 GLU 73 25.856 9.790 -7.705 1401 HG3 GLU 73 HG1 GLU 73 26.454 9.290 -9.286 1402 H GLY 74 HN GLY 74 28.433 13.999 -6.392 1403 HA2 GLY 74 HA2 GLY 74 29.198 16.122 -6.855 1404 HA3 GLY 74 HA1 GLY 74 28.845 15.819 -8.554 1405 H THR 75 HN THR 75 27.324 17.039 -9.416 1406 HA THR 75 HA THR 75 25.407 18.376 -7.650 1407 HB THR 75 HB THR 75 24.919 19.694 -9.820 1408 HG1 THR 75 HG1 THR 75 25.967 18.547 -11.380 1409 HG21 THR 75 HG21 THR 75 27.633 19.933 -8.510 1410 HG22 THR 75 HG22 THR 75 26.129 20.610 -7.886 1411 HG23 THR 75 HG23 THR 75 26.797 21.201 -9.407 1412 H ARG 76 HN ARG 76 25.420 15.533 -8.853 1413 HA ARG 76 HA ARG 76 22.778 15.644 -10.128 1414 HB2 ARG 76 HB2 ARG 76 24.981 13.600 -10.259 1415 HB3 ARG 76 HB1 ARG 76 23.340 13.234 -10.774 1416 HG2 ARG 76 HG2 ARG 76 25.068 15.424 -11.890 1417 HG3 ARG 76 HG1 ARG 76 24.777 13.856 -12.641 1418 HD2 ARG 76 HD2 ARG 76 22.364 14.376 -12.696 1419 HD3 ARG 76 HD1 ARG 76 22.721 15.977 -12.048 1420 HE ARG 76 HE ARG 76 24.096 15.231 -14.505 1421 HH11 ARG 76 HH11 ARG 76 21.403 16.917 -13.025 1422 HH12 ARG 76 HH12 ARG 76 21.132 17.943 -14.399 1423 HH21 ARG 76 HH21 ARG 76 23.733 16.556 -16.305 1424 HH22 ARG 76 HH22 ARG 76 22.470 17.753 -16.266 1425 H GLN 77 HN GLN 77 21.096 14.971 -9.095 1426 HA GLN 77 HA GLN 77 21.426 13.244 -6.736 1427 HB2 GLN 77 HB2 GLN 77 19.347 15.270 -7.518 1428 HB3 GLN 77 HB1 GLN 77 18.970 14.011 -6.353 1429 HG2 GLN 77 HG2 GLN 77 21.360 15.767 -5.983 1430 HG3 GLN 77 HG1 GLN 77 19.752 16.312 -5.511 1431 HE21 GLN 77 HE21 GLN 77 20.777 12.967 -5.301 1432 HE22 GLN 77 HE22 GLN 77 20.804 12.892 -3.577 1433 H TYR 78 HN TYR 78 21.289 11.192 -7.430 1434 HA TYR 78 HA TYR 78 19.247 10.488 -9.408 1435 HB2 TYR 78 HB2 TYR 78 21.471 8.801 -8.227 1436 HB3 TYR 78 HB1 TYR 78 20.368 8.293 -9.499 1437 HD1 TYR 78 HD1 TYR 78 20.379 9.779 -11.664 1438 HD2 TYR 78 HD2 TYR 78 23.515 9.706 -8.788 1439 HE1 TYR 78 HE1 TYR 78 21.943 10.646 -13.353 1440 HE2 TYR 78 HE2 TYR 78 25.082 10.575 -10.469 1441 HH TYR 78 HH TYR 78 25.323 10.654 -12.887 1442 H TYR 79 HN TYR 79 17.525 9.226 -8.943 1443 HA TYR 79 HA TYR 79 17.336 8.135 -6.214 1444 HB2 TYR 79 HB2 TYR 79 15.353 9.684 -7.813 1445 HB3 TYR 79 HB1 TYR 79 14.743 8.372 -6.808 1446 HD1 TYR 79 HD1 TYR 79 16.679 11.540 -6.711 1447 HD2 TYR 79 HD2 TYR 79 14.517 8.633 -4.479 1448 HE1 TYR 79 HE1 TYR 79 16.745 13.013 -4.741 1449 HE2 TYR 79 HE2 TYR 79 14.575 10.095 -2.503 1450 HH TYR 79 HH TYR 79 15.480 13.359 -2.649 1451 H ARG 80 HN ARG 80 16.421 6.106 -5.986 1452 HA ARG 80 HA ARG 80 15.278 4.714 -8.235 1453 HB2 ARG 80 HB2 ARG 80 17.810 4.487 -8.526 1454 HB3 ARG 80 HB1 ARG 80 17.801 3.546 -7.041 1455 HG2 ARG 80 HG2 ARG 80 15.867 2.292 -8.463 1456 HG3 ARG 80 HG1 ARG 80 16.956 2.807 -9.750 1457 HD2 ARG 80 HD2 ARG 80 17.724 1.213 -7.308 1458 HD3 ARG 80 HD1 ARG 80 17.506 0.565 -8.931 1459 HE ARG 80 HE ARG 80 19.404 2.574 -9.124 1460 HH11 ARG 80 HH11 ARG 80 19.053 -0.493 -7.484 1461 HH12 ARG 80 HH12 ARG 80 20.753 -0.841 -7.480 1462 HH21 ARG 80 HH21 ARG 80 21.628 2.139 -9.151 1463 HH22 ARG 80 HH22 ARG 80 22.223 0.654 -8.455 1464 H ILE 81 HN ILE 81 14.478 2.569 -7.579 1465 HA ILE 81 HA ILE 81 13.258 2.487 -5.078 1466 HB ILE 81 HB ILE 81 13.967 0.144 -6.857 1467 HG12 ILE 81 HG12 ILE 81 11.476 1.864 -6.765 1468 HG13 ILE 81 HG11 ILE 81 12.691 1.886 -8.039 1469 HG21 ILE 81 HG21 ILE 81 12.080 -0.978 -5.776 1470 HG22 ILE 81 HG22 ILE 81 11.863 0.414 -4.715 1471 HG23 ILE 81 HG23 ILE 81 13.334 -0.552 -4.613 1472 HD11 ILE 81 HD11 ILE 81 10.729 0.631 -8.709 1473 HD12 ILE 81 HD12 ILE 81 10.925 -0.442 -7.324 1474 HD13 ILE 81 HD13 ILE 81 12.139 -0.422 -8.603 1475 H ALA 82 HN ALA 82 13.790 1.565 -3.120 1476 HA ALA 82 HA ALA 82 16.508 1.595 -2.423 1477 HB1 ALA 82 HB1 ALA 82 14.227 0.429 -0.842 1478 HB2 ALA 82 HB2 ALA 82 14.682 2.133 -0.874 1479 HB3 ALA 82 HB3 ALA 82 15.794 0.936 -0.212 1480 H GLY 83 HN GLY 83 14.409 -1.077 -3.287 1481 HA2 GLY 83 HA2 GLY 83 16.636 -2.770 -3.766 1482 HA3 GLY 83 HA1 GLY 83 15.850 -3.209 -2.256 1483 H GLU 84 HN GLU 84 15.864 -5.140 -3.990 1484 HA GLU 84 HA GLU 84 13.785 -5.103 -5.930 1485 HB2 GLU 84 HB2 GLU 84 14.160 -7.513 -6.099 1486 HB3 GLU 84 HB1 GLU 84 15.687 -6.640 -6.087 1487 HG2 GLU 84 HG2 GLU 84 15.941 -7.187 -3.697 1488 HG3 GLU 84 HG1 GLU 84 14.458 -8.137 -3.786 1489 H ASP 85 HN ASP 85 13.902 -5.655 -2.540 1490 HA ASP 85 HA ASP 85 11.585 -7.092 -2.028 1491 HB2 ASP 85 HB2 ASP 85 12.422 -4.661 -0.437 1492 HB3 ASP 85 HB1 ASP 85 11.605 -6.104 0.150 1493 H VAL 86 HN VAL 86 12.032 -3.637 -2.583 1494 HA VAL 86 HA VAL 86 9.252 -2.999 -2.303 1495 HB VAL 86 HB VAL 86 11.414 -1.303 -3.554 1496 HG11 VAL 86 HG11 VAL 86 8.801 -0.581 -2.235 1497 HG12 VAL 86 HG12 VAL 86 9.178 -0.472 -3.954 1498 HG13 VAL 86 HG13 VAL 86 10.010 0.571 -2.801 1499 HG21 VAL 86 HG21 VAL 86 12.170 -2.035 -1.371 1500 HG22 VAL 86 HG22 VAL 86 10.644 -1.529 -0.648 1501 HG23 VAL 86 HG23 VAL 86 11.742 -0.325 -1.326 1502 H ALA 87 HN ALA 87 11.481 -3.602 -4.953 1503 HA ALA 87 HA ALA 87 9.896 -2.747 -7.094 1504 HB1 ALA 87 HB1 ALA 87 12.243 -3.287 -7.369 1505 HB2 ALA 87 HB2 ALA 87 11.266 -4.255 -8.475 1506 HB3 ALA 87 HB3 ALA 87 11.918 -4.981 -7.006 1507 H ARG 88 HN ARG 88 10.161 -5.949 -5.583 1508 HA ARG 88 HA ARG 88 8.203 -7.203 -7.193 1509 HB2 ARG 88 HB2 ARG 88 9.058 -7.911 -4.374 1510 HB3 ARG 88 HB1 ARG 88 8.194 -8.965 -5.487 1511 HG2 ARG 88 HG2 ARG 88 10.114 -8.958 -6.994 1512 HG3 ARG 88 HG1 ARG 88 10.981 -7.887 -5.892 1513 HD2 ARG 88 HD2 ARG 88 10.732 -9.650 -4.126 1514 HD3 ARG 88 HD1 ARG 88 10.083 -10.715 -5.372 1515 HE ARG 88 HE ARG 88 12.797 -9.562 -5.527 1516 HH11 ARG 88 HH11 ARG 88 10.601 -12.276 -5.788 1517 HH12 ARG 88 HH12 ARG 88 11.828 -13.374 -6.330 1518 HH21 ARG 88 HH21 ARG 88 14.416 -11.009 -6.192 1519 HH22 ARG 88 HH22 ARG 88 13.987 -12.657 -6.575 1520 H LEU 89 HN LEU 89 8.064 -5.414 -4.172 1521 HA LEU 89 HA LEU 89 5.425 -5.961 -3.427 1522 HB2 LEU 89 HB2 LEU 89 7.230 -4.788 -2.096 1523 HB3 LEU 89 HB1 LEU 89 6.886 -3.347 -3.028 1524 HG LEU 89 HG LEU 89 4.745 -4.707 -1.403 1525 HD11 LEU 89 HD11 LEU 89 6.666 -2.571 -0.480 1526 HD12 LEU 89 HD12 LEU 89 6.615 -4.236 0.096 1527 HD13 LEU 89 HD13 LEU 89 5.260 -3.153 0.411 1528 HD21 LEU 89 HD21 LEU 89 4.036 -3.031 -3.061 1529 HD22 LEU 89 HD22 LEU 89 5.108 -1.849 -2.309 1530 HD23 LEU 89 HD23 LEU 89 3.735 -2.493 -1.409 1531 H PHE 90 HN PHE 90 6.642 -3.076 -5.161 1532 HA PHE 90 HA PHE 90 4.077 -2.018 -5.664 1533 HB2 PHE 90 HB2 PHE 90 6.157 -0.681 -5.713 1534 HB3 PHE 90 HB1 PHE 90 6.639 -1.506 -7.190 1535 HD1 PHE 90 HD2 PHE 90 4.006 0.680 -5.753 1536 HD2 PHE 90 HD1 PHE 90 5.956 -0.703 -9.276 1537 HE1 PHE 90 HE2 PHE 90 2.804 2.369 -7.079 1538 HE2 PHE 90 HE1 PHE 90 4.756 0.985 -10.605 1539 HZ PHE 90 HZ PHE 90 3.177 2.523 -9.508 1540 H ALA 91 HN ALA 91 6.149 -4.171 -7.542 1541 HA ALA 91 HA ALA 91 4.652 -4.165 -9.926 1542 HB1 ALA 91 HB1 ALA 91 6.314 -6.392 -8.746 1543 HB2 ALA 91 HB2 ALA 91 6.901 -5.105 -9.799 1544 HB3 ALA 91 HB3 ALA 91 5.756 -6.297 -10.416 1545 H LEU 92 HN LEU 92 4.528 -6.334 -7.110 1546 HA LEU 92 HA LEU 92 2.442 -7.979 -7.999 1547 HB2 LEU 92 HB2 LEU 92 3.963 -8.443 -6.089 1548 HB3 LEU 92 HB1 LEU 92 3.137 -7.212 -5.160 1549 HG LEU 92 HG LEU 92 1.570 -9.522 -6.247 1550 HD11 LEU 92 HD11 LEU 92 3.508 -10.541 -5.169 1551 HD12 LEU 92 HD12 LEU 92 2.055 -10.778 -4.197 1552 HD13 LEU 92 HD13 LEU 92 3.237 -9.554 -3.731 1553 HD21 LEU 92 HD21 LEU 92 0.248 -9.134 -4.224 1554 HD22 LEU 92 HD22 LEU 92 0.381 -7.663 -5.190 1555 HD23 LEU 92 HD23 LEU 92 1.365 -7.857 -3.737 1556 H VAL 93 HN VAL 93 2.387 -5.005 -6.079 1557 HA VAL 93 HA VAL 93 -0.365 -4.879 -5.612 1558 HB VAL 93 HB VAL 93 1.675 -2.662 -5.860 1559 HG11 VAL 93 HG11 VAL 93 -1.113 -2.530 -4.729 1560 HG12 VAL 93 HG12 VAL 93 -0.575 -1.792 -6.239 1561 HG13 VAL 93 HG13 VAL 93 0.089 -1.237 -4.702 1562 HG21 VAL 93 HG21 VAL 93 1.604 -2.681 -3.412 1563 HG22 VAL 93 HG22 VAL 93 2.105 -4.244 -4.058 1564 HG23 VAL 93 HG23 VAL 93 0.461 -4.024 -3.460 1565 H GLN 94 HN GLN 94 1.582 -3.689 -8.321 1566 HA GLN 94 HA GLN 94 -0.548 -2.400 -9.668 1567 HB2 GLN 94 HB2 GLN 94 1.808 -1.909 -10.165 1568 HB3 GLN 94 HB1 GLN 94 2.012 -3.533 -10.811 1569 HG2 GLN 94 HG2 GLN 94 0.478 -3.068 -12.604 1570 HG3 GLN 94 HG1 GLN 94 0.097 -1.492 -11.915 1571 HE21 GLN 94 HE21 GLN 94 3.335 -2.797 -11.982 1572 HE22 GLN 94 HE22 GLN 94 3.969 -1.677 -13.142 1573 H VAL 95 HN VAL 95 0.754 -5.684 -9.796 1574 HA VAL 95 HA VAL 95 -0.701 -6.661 -11.970 1575 HB VAL 95 HB VAL 95 0.108 -8.140 -9.454 1576 HG11 VAL 95 HG11 VAL 95 -0.781 -9.209 -12.132 1577 HG12 VAL 95 HG12 VAL 95 -1.638 -9.366 -10.600 1578 HG13 VAL 95 HG13 VAL 95 -0.092 -10.179 -10.831 1579 HG21 VAL 95 HG21 VAL 95 2.002 -7.174 -10.630 1580 HG22 VAL 95 HG22 VAL 95 1.456 -7.902 -12.141 1581 HG23 VAL 95 HG23 VAL 95 1.994 -8.929 -10.813 1582 H VAL 96 HN VAL 96 -1.610 -6.384 -8.563 1583 HA VAL 96 HA VAL 96 -4.099 -7.660 -8.707 1584 HB VAL 96 HB VAL 96 -3.301 -5.364 -6.907 1585 HG11 VAL 96 HG11 VAL 96 -5.043 -6.253 -5.398 1586 HG12 VAL 96 HG12 VAL 96 -5.518 -7.394 -6.657 1587 HG13 VAL 96 HG13 VAL 96 -5.701 -5.660 -6.923 1588 HG21 VAL 96 HG21 VAL 96 -1.767 -7.249 -6.723 1589 HG22 VAL 96 HG22 VAL 96 -3.127 -8.342 -6.464 1590 HG23 VAL 96 HG23 VAL 96 -2.755 -7.099 -5.269 1591 H ALA 97 HN ALA 97 -3.291 -4.208 -8.981 1592 HA ALA 97 HA ALA 97 -5.949 -3.347 -9.469 1593 HB1 ALA 97 HB1 ALA 97 -4.224 -1.857 -8.597 1594 HB2 ALA 97 HB2 ALA 97 -4.931 -1.212 -10.078 1595 HB3 ALA 97 HB3 ALA 97 -3.343 -1.976 -10.121 1596 H ASP 98 HN ASP 98 -3.442 -4.588 -11.499 1597 HA ASP 98 HA ASP 98 -4.489 -3.622 -13.982 1598 HB2 ASP 98 HB2 ASP 98 -2.118 -4.172 -13.743 1599 HB3 ASP 98 HB1 ASP 98 -2.523 -5.843 -13.379 1600 H GLU 99 HN GLU 99 -4.306 -6.903 -12.591 1601 HA GLU 99 HA GLU 99 -5.838 -8.058 -14.674 1602 HB2 GLU 99 HB2 GLU 99 -4.168 -9.265 -13.273 1603 HB3 GLU 99 HB1 GLU 99 -5.296 -9.188 -11.925 1604 HG2 GLU 99 HG2 GLU 99 -6.773 -10.256 -14.019 1605 HG3 GLU 99 HG1 GLU 99 -5.192 -11.021 -14.147 1606 H HIS 100 HN HIS 100 -6.713 -6.775 -11.505 1607 HA HIS 100 HA HIS 100 -9.273 -7.992 -11.392 1608 HB2 HIS 100 HB2 HIS 100 -8.067 -5.636 -9.975 1609 HB3 HIS 100 HB1 HIS 100 -9.763 -6.054 -9.759 1610 HD1 HIS 100 HD1 HIS 100 -9.638 -6.848 -7.363 1611 HD2 HIS 100 HD2 HIS 100 -6.906 -8.762 -9.853 1612 HE1 HIS 100 HE1 HIS 100 -8.650 -8.716 -5.992 1613 HE2 HIS 100 HE2 HIS 100 -7.178 -9.987 -7.594 1614 H LEU 101 HN LEU 101 -8.101 -5.054 -12.871 1615 HA LEU 101 HA LEU 101 -10.809 -4.253 -13.590 1616 HB2 LEU 101 HB2 LEU 101 -8.121 -2.962 -13.839 1617 HB3 LEU 101 HB1 LEU 101 -9.444 -2.412 -14.848 1618 HG LEU 101 HG LEU 101 -9.229 -0.994 -12.888 1619 HD11 LEU 101 HD11 LEU 101 -11.457 -1.362 -13.808 1620 HD12 LEU 101 HD12 LEU 101 -11.517 -1.119 -12.061 1621 HD13 LEU 101 HD13 LEU 101 -11.680 -2.741 -12.731 1622 HD21 LEU 101 HD21 LEU 101 -9.664 -1.870 -10.636 1623 HD22 LEU 101 HD22 LEU 101 -8.205 -2.562 -11.347 1624 HD23 LEU 101 HD23 LEU 101 -9.693 -3.507 -11.288 1625 H GLU 102 HN GLU 102 -8.604 -6.380 -14.688 1626 HA GLU 102 HA GLU 102 -8.953 -5.997 -17.522 1627 HB2 GLU 102 HB2 GLU 102 -6.944 -7.063 -16.337 1628 HB3 GLU 102 HB1 GLU 102 -7.959 -8.475 -16.107 1629 HG2 GLU 102 HG2 GLU 102 -7.446 -7.329 -18.826 1630 HG3 GLU 102 HG1 GLU 102 -6.338 -8.467 -18.068 1631 H HIS 103 HN HIS 103 -10.385 -7.854 -14.922 1632 HA HIS 103 HA HIS 103 -12.087 -9.456 -16.579 1633 HB2 HIS 103 HB2 HIS 103 -12.598 -8.709 -13.689 1634 HB3 HIS 103 HB1 HIS 103 -13.222 -10.103 -14.560 1635 HD1 HIS 103 HD1 HIS 103 -10.895 -11.567 -15.588 1636 HD2 HIS 103 HD2 HIS 103 -10.720 -9.528 -11.965 1637 HE1 HIS 103 HE1 HIS 103 -9.017 -12.629 -14.300 1638 HE2 HIS 103 HE2 HIS 103 -8.781 -11.225 -12.218 1639 H HIS 104 HN HIS 104 -13.697 -8.640 -17.782 1640 HA HIS 104 HA HIS 104 -14.919 -6.110 -16.875 1641 HB2 HIS 104 HB2 HIS 104 -14.411 -7.176 -19.650 1642 HB3 HIS 104 HB1 HIS 104 -15.509 -5.836 -19.341 1643 HD1 HIS 104 HD1 HIS 104 -12.132 -6.438 -20.279 1644 HD2 HIS 104 HD2 HIS 104 -14.033 -3.694 -17.796 1645 HE1 HIS 104 HE1 HIS 104 -10.527 -4.516 -20.031 1646 HE2 HIS 104 HE2 HIS 104 -11.766 -2.803 -18.652 1647 H HIS 105 HN HIS 105 -15.552 -9.393 -17.461 1648 HA HIS 105 HA HIS 105 -18.265 -9.052 -18.370 1649 HB2 HIS 105 HB2 HIS 105 -16.566 -11.046 -18.742 1650 HB3 HIS 105 HB1 HIS 105 -17.281 -11.643 -17.250 1651 HD1 HIS 105 HD1 HIS 105 -17.677 -11.851 -20.781 1652 HD2 HIS 105 HD2 HIS 105 -20.291 -11.742 -17.551 1653 HE1 HIS 105 HE1 HIS 105 -19.846 -12.785 -21.634 1654 HE2 HIS 105 HE2 HIS 105 -21.301 -12.970 -19.590 1655 H HIS 106 HN HIS 106 -16.819 -8.731 -15.391 1656 HA HIS 106 HA HIS 106 -19.228 -9.603 -13.944 1657 HB2 HIS 106 HB2 HIS 106 -16.368 -9.294 -13.110 1658 HB3 HIS 106 HB1 HIS 106 -17.646 -9.209 -11.904 1659 HD1 HIS 106 HD1 HIS 106 -15.735 -11.463 -11.562 1660 HD2 HIS 106 HD2 HIS 106 -19.106 -11.763 -13.984 1661 HE1 HIS 106 HE1 HIS 106 -16.225 -13.927 -11.753 1662 HE2 HIS 106 HE2 HIS 106 -18.390 -14.064 -13.044 1663 H HIS 107 HN HIS 107 -18.447 -6.922 -15.405 1664 HA HIS 107 HA HIS 107 -19.806 -5.313 -13.413 1665 HB2 HIS 107 HB2 HIS 107 -16.974 -5.030 -13.928 1666 HB3 HIS 107 HB1 HIS 107 -17.839 -3.547 -14.319 1667 HD1 HIS 107 HD1 HIS 107 -19.278 -2.488 -12.334 1668 HD2 HIS 107 HD2 HIS 107 -16.614 -5.493 -11.243 1669 HE1 HIS 107 HE1 HIS 107 -19.029 -2.303 -9.840 1670 HE2 HIS 107 HE2 HIS 107 -17.598 -4.268 -9.184 1671 H HIS 108 HN HIS 108 -21.348 -4.220 -14.343 1672 HA HIS 108 HA HIS 108 -20.880 -2.893 -16.887 1673 HB2 HIS 108 HB2 HIS 108 -21.939 -5.198 -17.322 1674 HB3 HIS 108 HB1 HIS 108 -23.377 -4.557 -16.535 1675 HD1 HIS 108 HD1 HIS 108 -22.374 -5.233 -19.746 1676 HD2 HIS 108 HD2 HIS 108 -23.814 -1.755 -17.971 1677 HE1 HIS 108 HE1 HIS 108 -23.262 -3.821 -21.630 1678 HE2 HIS 108 HE2 HIS 108 -23.970 -1.655 -20.556 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 -5.778 18.849 -22.092 2 H2 MET 1 HT2 MET 1 -5.853 17.455 -21.129 3 H3 MET 1 HT3 MET 1 -7.167 17.871 -22.115 4 HA MET 1 HA MET 1 -5.812 17.534 -24.089 5 HB2 MET 1 HB2 MET 1 -3.771 16.574 -22.070 6 HB3 MET 1 HB1 MET 1 -3.643 16.350 -23.809 7 HG2 MET 1 HG2 MET 1 -3.538 18.753 -24.128 8 HG3 MET 1 HG1 MET 1 -3.715 19.003 -22.391 9 HE1 MET 1 HE1 MET 1 -1.550 20.521 -22.360 10 HE2 MET 1 HE2 MET 1 -1.367 20.290 -24.100 11 HE3 MET 1 HE3 MET 1 0.006 20.020 -23.026 12 H ALA 2 HN ALA 2 -5.412 15.303 -24.969 13 HA ALA 2 HA ALA 2 -6.971 13.332 -23.429 14 HB1 ALA 2 HB1 ALA 2 -6.578 13.500 -26.420 15 HB2 ALA 2 HB2 ALA 2 -8.024 13.997 -25.542 16 HB3 ALA 2 HB3 ALA 2 -7.547 12.299 -25.566 17 H GLY 3 HN GLY 3 -5.626 11.975 -22.432 18 HA2 GLY 3 HA2 GLY 3 -3.008 11.394 -23.549 19 HA3 GLY 3 HA1 GLY 3 -3.618 10.872 -21.985 20 H GLN 4 HN GLN 4 -2.891 9.928 -25.112 21 HA GLN 4 HA GLN 4 -4.747 7.680 -25.153 22 HB2 GLN 4 HB2 GLN 4 -2.656 8.522 -27.171 23 HB3 GLN 4 HB1 GLN 4 -3.847 7.249 -27.397 24 HG2 GLN 4 HG2 GLN 4 -5.643 8.888 -27.250 25 HG3 GLN 4 HG1 GLN 4 -4.458 10.170 -26.996 26 HE21 GLN 4 HE21 GLN 4 -3.158 10.823 -28.717 27 HE22 GLN 4 HE22 GLN 4 -3.563 10.451 -30.355 28 H SER 5 HN SER 5 -1.351 8.378 -24.694 29 HA SER 5 HA SER 5 -0.656 5.555 -24.563 30 HB2 SER 5 HB2 SER 5 1.058 8.003 -24.060 31 HB3 SER 5 HB1 SER 5 1.636 6.348 -24.245 32 HG SER 5 HG SER 5 0.337 7.945 -26.207 33 H ASP 6 HN ASP 6 -2.258 7.453 -22.593 34 HA ASP 6 HA ASP 6 -0.779 6.807 -20.141 35 HB2 ASP 6 HB2 ASP 6 -3.015 8.806 -20.558 36 HB3 ASP 6 HB1 ASP 6 -2.069 8.594 -19.088 37 H ARG 7 HN ARG 7 -2.481 4.925 -21.637 38 HA ARG 7 HA ARG 7 -5.001 4.663 -20.394 39 HB2 ARG 7 HB2 ARG 7 -3.347 2.462 -21.646 40 HB3 ARG 7 HB1 ARG 7 -5.081 2.437 -21.359 41 HG2 ARG 7 HG2 ARG 7 -5.254 4.409 -22.910 42 HG3 ARG 7 HG1 ARG 7 -3.563 4.128 -23.324 43 HD2 ARG 7 HD2 ARG 7 -5.869 2.228 -23.701 44 HD3 ARG 7 HD1 ARG 7 -4.974 3.068 -24.963 45 HE ARG 7 HE ARG 7 -3.602 1.136 -23.217 46 HH11 ARG 7 HH11 ARG 7 -4.616 2.189 -26.395 47 HH12 ARG 7 HH12 ARG 7 -3.769 0.922 -27.234 48 HH21 ARG 7 HH21 ARG 7 -2.501 -0.553 -24.296 49 HH22 ARG 7 HH22 ARG 7 -2.548 -0.636 -26.039 50 H LYS 8 HN LYS 8 -1.805 3.490 -19.559 51 HA LYS 8 HA LYS 8 -2.671 1.638 -17.583 52 HB2 LYS 8 HB2 LYS 8 -0.348 1.502 -16.920 53 HB3 LYS 8 HB1 LYS 8 -0.481 1.467 -18.670 54 HG2 LYS 8 HG2 LYS 8 0.254 3.742 -18.830 55 HG3 LYS 8 HG1 LYS 8 0.230 3.918 -17.074 56 HD2 LYS 8 HD2 LYS 8 1.969 2.183 -16.898 57 HD3 LYS 8 HD1 LYS 8 2.003 2.063 -18.659 58 HE2 LYS 8 HE2 LYS 8 2.740 4.362 -18.835 59 HE3 LYS 8 HE1 LYS 8 2.622 4.564 -17.086 60 HZ1 LYS 8 HZ1 LYS 8 4.382 2.985 -16.773 61 HZ2 LYS 8 HZ2 LYS 8 4.904 4.163 -17.874 62 HZ3 LYS 8 HZ3 LYS 8 4.435 2.634 -18.435 63 H ALA 9 HN ALA 9 -2.491 5.014 -17.601 64 HA ALA 9 HA ALA 9 -1.881 5.541 -14.895 65 HB1 ALA 9 HB1 ALA 9 -1.860 7.293 -16.597 66 HB2 ALA 9 HB2 ALA 9 -2.916 7.722 -15.249 67 HB3 ALA 9 HB3 ALA 9 -3.611 7.155 -16.768 68 H ALA 10 HN ALA 10 -4.819 4.535 -16.501 69 HA ALA 10 HA ALA 10 -6.574 5.002 -14.306 70 HB1 ALA 10 HB1 ALA 10 -7.426 4.733 -16.572 71 HB2 ALA 10 HB2 ALA 10 -8.124 3.521 -15.497 72 HB3 ALA 10 HB3 ALA 10 -6.835 3.071 -16.613 73 H LEU 11 HN LEU 11 -4.453 2.393 -15.263 74 HA LEU 11 HA LEU 11 -5.393 0.491 -13.368 75 HB2 LEU 11 HB2 LEU 11 -2.713 0.708 -14.748 76 HB3 LEU 11 HB1 LEU 11 -3.276 -0.690 -13.850 77 HG LEU 11 HG LEU 11 -4.578 0.385 -16.354 78 HD11 LEU 11 HD11 LEU 11 -3.652 -1.609 -17.435 79 HD12 LEU 11 HD12 LEU 11 -2.773 -1.995 -15.955 80 HD13 LEU 11 HD13 LEU 11 -2.390 -0.527 -16.853 81 HD21 LEU 11 HD21 LEU 11 -5.830 -1.714 -16.310 82 HD22 LEU 11 HD22 LEU 11 -6.138 -0.754 -14.863 83 HD23 LEU 11 HD23 LEU 11 -5.058 -2.148 -14.785 84 H LEU 12 HN LEU 12 -2.917 2.997 -13.379 85 HA LEU 12 HA LEU 12 -1.813 2.437 -10.840 86 HB2 LEU 12 HB2 LEU 12 -2.037 5.057 -12.329 87 HB3 LEU 12 HB1 LEU 12 -1.080 4.823 -10.880 88 HG LEU 12 HG LEU 12 -0.621 3.467 -13.537 89 HD11 LEU 12 HD11 LEU 12 -0.024 5.813 -13.576 90 HD12 LEU 12 HD12 LEU 12 1.424 4.808 -13.592 91 HD13 LEU 12 HD13 LEU 12 0.927 5.615 -12.105 92 HD21 LEU 12 HD21 LEU 12 0.961 3.312 -10.973 93 HD22 LEU 12 HD22 LEU 12 1.417 2.589 -12.515 94 HD23 LEU 12 HD23 LEU 12 -0.018 2.017 -11.664 95 H ASP 13 HN ASP 13 -4.621 4.277 -11.882 96 HA ASP 13 HA ASP 13 -5.311 5.421 -9.408 97 HB2 ASP 13 HB2 ASP 13 -6.402 6.157 -11.446 98 HB3 ASP 13 HB1 ASP 13 -7.071 4.551 -11.710 99 H GLN 14 HN GLN 14 -6.008 2.268 -10.824 100 HA GLN 14 HA GLN 14 -7.666 1.351 -8.716 101 HB2 GLN 14 HB2 GLN 14 -7.644 0.294 -10.933 102 HB3 GLN 14 HB1 GLN 14 -5.990 -0.237 -10.668 103 HG2 GLN 14 HG2 GLN 14 -7.601 -2.038 -10.329 104 HG3 GLN 14 HG1 GLN 14 -6.705 -1.674 -8.857 105 HE21 GLN 14 HE21 GLN 14 -8.278 -2.575 -7.544 106 HE22 GLN 14 HE22 GLN 14 -9.806 -1.820 -7.270 107 H VAL 15 HN VAL 15 -4.182 1.265 -9.273 108 HA VAL 15 HA VAL 15 -3.491 -0.282 -7.010 109 HB VAL 15 HB VAL 15 -1.865 1.932 -8.287 110 HG11 VAL 15 HG11 VAL 15 -0.989 -0.390 -6.570 111 HG12 VAL 15 HG12 VAL 15 -1.076 1.295 -6.056 112 HG13 VAL 15 HG13 VAL 15 0.066 0.815 -7.310 113 HG21 VAL 15 HG21 VAL 15 -2.451 0.271 -9.943 114 HG22 VAL 15 HG22 VAL 15 -1.922 -1.025 -8.870 115 HG23 VAL 15 HG23 VAL 15 -0.745 0.117 -9.520 116 H ALA 16 HN ALA 16 -3.939 3.190 -7.499 117 HA ALA 16 HA ALA 16 -3.338 4.073 -4.924 118 HB1 ALA 16 HB1 ALA 16 -4.688 6.026 -5.440 119 HB2 ALA 16 HB2 ALA 16 -5.426 5.178 -6.798 120 HB3 ALA 16 HB3 ALA 16 -3.708 5.569 -6.832 121 H ARG 17 HN ARG 17 -6.327 2.778 -6.267 122 HA ARG 17 HA ARG 17 -8.009 3.264 -4.084 123 HB2 ARG 17 HB2 ARG 17 -8.780 2.574 -6.334 124 HB3 ARG 17 HB1 ARG 17 -8.133 0.964 -6.039 125 HG2 ARG 17 HG2 ARG 17 -9.678 0.716 -4.142 126 HG3 ARG 17 HG1 ARG 17 -10.347 2.308 -4.505 127 HD2 ARG 17 HD2 ARG 17 -10.389 -0.114 -6.305 128 HD3 ARG 17 HD1 ARG 17 -11.759 0.563 -5.424 129 HE ARG 17 HE ARG 17 -10.528 1.620 -7.845 130 HH11 ARG 17 HH11 ARG 17 -12.754 2.167 -5.195 131 HH12 ARG 17 HH12 ARG 17 -13.712 3.326 -6.070 132 HH21 ARG 17 HH21 ARG 17 -11.767 3.155 -8.996 133 HH22 ARG 17 HH22 ARG 17 -13.160 3.875 -8.238 134 H VAL 18 HN VAL 18 -6.155 0.315 -4.899 135 HA VAL 18 HA VAL 18 -6.905 -1.019 -2.502 136 HB VAL 18 HB VAL 18 -5.190 -2.679 -3.033 137 HG11 VAL 18 HG11 VAL 18 -7.352 -2.826 -4.142 138 HG12 VAL 18 HG12 VAL 18 -6.062 -3.409 -5.194 139 HG13 VAL 18 HG13 VAL 18 -6.759 -1.809 -5.456 140 HG21 VAL 18 HG21 VAL 18 -4.393 -0.801 -5.252 141 HG22 VAL 18 HG22 VAL 18 -3.827 -2.462 -5.072 142 HG23 VAL 18 HG23 VAL 18 -3.418 -1.255 -3.852 143 H GLY 19 HN GLY 19 -4.303 1.140 -3.372 144 HA2 GLY 19 HA2 GLY 19 -2.675 0.734 -1.089 145 HA3 GLY 19 HA1 GLY 19 -2.693 2.171 -2.102 146 H LYS 20 HN LYS 20 -5.439 2.840 -1.712 147 HA LYS 20 HA LYS 20 -5.349 4.288 0.702 148 HB2 LYS 20 HB2 LYS 20 -7.671 3.542 -1.076 149 HB3 LYS 20 HB1 LYS 20 -7.823 4.609 0.310 150 HG2 LYS 20 HG2 LYS 20 -6.340 6.211 -0.695 151 HG3 LYS 20 HG1 LYS 20 -6.012 5.116 -2.039 152 HD2 LYS 20 HD2 LYS 20 -7.626 6.855 -2.660 153 HD3 LYS 20 HD1 LYS 20 -8.344 5.247 -2.735 154 HE2 LYS 20 HE2 LYS 20 -9.371 5.610 -0.540 155 HE3 LYS 20 HE1 LYS 20 -8.659 7.219 -0.476 156 HZ1 LYS 20 HZ1 LYS 20 -10.583 6.307 -2.551 157 HZ2 LYS 20 HZ2 LYS 20 -9.962 7.876 -2.369 158 HZ3 LYS 20 HZ3 LYS 20 -10.994 7.228 -1.191 159 H ALA 21 HN ALA 21 -6.854 1.211 -0.161 160 HA ALA 21 HA ALA 21 -8.052 0.782 2.398 161 HB1 ALA 21 HB1 ALA 21 -7.356 -1.244 0.272 162 HB2 ALA 21 HB2 ALA 21 -8.853 -0.316 0.343 163 HB3 ALA 21 HB3 ALA 21 -8.473 -1.476 1.617 164 H LEU 22 HN LEU 22 -5.015 -0.135 0.889 165 HA LEU 22 HA LEU 22 -4.151 -1.625 3.225 166 HB2 LEU 22 HB2 LEU 22 -2.947 -1.093 0.526 167 HB3 LEU 22 HB1 LEU 22 -2.005 -1.812 1.817 168 HG LEU 22 HG LEU 22 -4.552 -2.984 0.693 169 HD11 LEU 22 HD11 LEU 22 -1.673 -3.757 0.225 170 HD12 LEU 22 HD12 LEU 22 -2.757 -3.019 -0.956 171 HD13 LEU 22 HD13 LEU 22 -3.087 -4.642 -0.350 172 HD21 LEU 22 HD21 LEU 22 -3.916 -4.967 1.964 173 HD22 LEU 22 HD22 LEU 22 -4.121 -3.579 3.032 174 HD23 LEU 22 HD23 LEU 22 -2.502 -4.122 2.593 175 H ALA 23 HN ALA 23 -4.581 1.355 3.305 176 HA ALA 23 HA ALA 23 -1.992 2.517 3.652 177 HB1 ALA 23 HB1 ALA 23 -3.979 3.875 3.147 178 HB2 ALA 23 HB2 ALA 23 -3.158 4.416 4.611 179 HB3 ALA 23 HB3 ALA 23 -4.644 3.470 4.729 180 H ASN 24 HN ASN 24 -3.433 0.155 5.305 181 HA ASN 24 HA ASN 24 -3.007 -0.923 7.221 182 HB2 ASN 24 HB2 ASN 24 -0.651 0.947 7.476 183 HB3 ASN 24 HB1 ASN 24 -0.837 -0.634 8.230 184 HD21 ASN 24 HD21 ASN 24 -0.927 -2.502 6.782 185 HD22 ASN 24 HD22 ASN 24 -0.075 -2.441 5.283 186 H GLY 25 HN GLY 25 -1.704 0.188 9.585 187 HA2 GLY 25 HA2 GLY 25 -2.215 1.819 11.270 188 HA3 GLY 25 HA1 GLY 25 -3.785 2.051 10.508 189 H ARG 26 HN ARG 26 -4.662 1.715 12.663 190 HA ARG 26 HA ARG 26 -4.333 -0.759 14.019 191 HB2 ARG 26 HB2 ARG 26 -6.483 1.347 14.255 192 HB3 ARG 26 HB1 ARG 26 -6.305 -0.016 15.352 193 HG2 ARG 26 HG2 ARG 26 -4.091 0.781 15.992 194 HG3 ARG 26 HG1 ARG 26 -4.263 2.147 14.890 195 HD2 ARG 26 HD2 ARG 26 -6.036 1.563 17.258 196 HD3 ARG 26 HD1 ARG 26 -4.751 2.770 17.213 197 HE ARG 26 HE ARG 26 -7.326 2.899 15.814 198 HH11 ARG 26 HH11 ARG 26 -4.245 4.380 16.593 199 HH12 ARG 26 HH12 ARG 26 -4.757 5.985 16.173 200 HH21 ARG 26 HH21 ARG 26 -8.009 5.019 15.236 201 HH22 ARG 26 HH22 ARG 26 -6.902 6.355 15.428 202 H ARG 27 HN ARG 27 -6.088 0.050 11.249 203 HA ARG 27 HA ARG 27 -8.291 -1.735 11.600 204 HB2 ARG 27 HB2 ARG 27 -8.979 -1.091 9.487 205 HB3 ARG 27 HB1 ARG 27 -8.033 0.303 9.988 206 HG2 ARG 27 HG2 ARG 27 -6.094 -0.693 8.737 207 HG3 ARG 27 HG1 ARG 27 -7.227 -1.883 8.090 208 HD2 ARG 27 HD2 ARG 27 -7.340 -0.314 6.432 209 HD3 ARG 27 HD1 ARG 27 -8.617 0.285 7.492 210 HE ARG 27 HE ARG 27 -5.873 1.351 7.677 211 HH11 ARG 27 HH11 ARG 27 -9.325 1.871 7.318 212 HH12 ARG 27 HH12 ARG 27 -9.174 3.595 7.213 213 HH21 ARG 27 HH21 ARG 27 -5.683 3.605 7.555 214 HH22 ARG 27 HH22 ARG 27 -7.098 4.594 7.343 215 H LEU 28 HN LEU 28 -5.027 -2.240 11.033 216 HA LEU 28 HA LEU 28 -5.198 -4.466 9.252 217 HB2 LEU 28 HB2 LEU 28 -2.989 -3.568 11.091 218 HB3 LEU 28 HB1 LEU 28 -2.842 -4.882 9.938 219 HG LEU 28 HG LEU 28 -3.320 -1.977 9.294 220 HD11 LEU 28 HD11 LEU 28 -1.045 -2.439 9.955 221 HD12 LEU 28 HD12 LEU 28 -1.128 -2.148 8.213 222 HD13 LEU 28 HD13 LEU 28 -0.966 -3.796 8.829 223 HD21 LEU 28 HD21 LEU 28 -3.163 -2.652 6.951 224 HD22 LEU 28 HD22 LEU 28 -4.539 -3.419 7.745 225 HD23 LEU 28 HD23 LEU 28 -3.070 -4.344 7.442 226 H GLN 29 HN GLN 29 -5.710 -4.052 12.598 227 HA GLN 29 HA GLN 29 -5.183 -6.631 13.556 228 HB2 GLN 29 HB2 GLN 29 -7.353 -4.683 14.355 229 HB3 GLN 29 HB1 GLN 29 -6.922 -6.123 15.266 230 HG2 GLN 29 HG2 GLN 29 -4.746 -5.243 15.743 231 HG3 GLN 29 HG1 GLN 29 -5.019 -3.868 14.674 232 HE21 GLN 29 HE21 GLN 29 -4.671 -2.387 16.313 233 HE22 GLN 29 HE22 GLN 29 -5.811 -2.117 17.582 234 H ILE 30 HN ILE 30 -7.807 -5.293 11.698 235 HA ILE 30 HA ILE 30 -9.560 -7.515 11.839 236 HB ILE 30 HB ILE 30 -9.311 -5.434 9.659 237 HG12 ILE 30 HG12 ILE 30 -11.120 -5.513 12.089 238 HG13 ILE 30 HG11 ILE 30 -9.722 -4.461 11.894 239 HG21 ILE 30 HG21 ILE 30 -11.608 -6.040 9.099 240 HG22 ILE 30 HG22 ILE 30 -11.592 -7.283 10.351 241 HG23 ILE 30 HG23 ILE 30 -10.530 -7.429 8.950 242 HD11 ILE 30 HD11 ILE 30 -11.802 -3.273 11.483 243 HD12 ILE 30 HD12 ILE 30 -12.211 -4.410 10.200 244 HD13 ILE 30 HD13 ILE 30 -10.815 -3.346 10.024 245 H LEU 31 HN LEU 31 -7.190 -6.470 9.384 246 HA LEU 31 HA LEU 31 -7.558 -8.652 7.661 247 HB2 LEU 31 HB2 LEU 31 -5.218 -6.802 8.067 248 HB3 LEU 31 HB1 LEU 31 -5.226 -8.051 6.838 249 HG LEU 31 HG LEU 31 -7.148 -5.727 7.014 250 HD11 LEU 31 HD11 LEU 31 -4.935 -6.330 5.059 251 HD12 LEU 31 HD12 LEU 31 -4.915 -5.073 6.295 252 HD13 LEU 31 HD13 LEU 31 -6.063 -4.977 4.958 253 HD21 LEU 31 HD21 LEU 31 -8.234 -7.714 6.118 254 HD22 LEU 31 HD22 LEU 31 -6.918 -7.925 4.963 255 HD23 LEU 31 HD23 LEU 31 -7.974 -6.514 4.850 256 H ASP 32 HN ASP 32 -5.349 -8.193 10.377 257 HA ASP 32 HA ASP 32 -3.910 -10.595 10.135 258 HB2 ASP 32 HB2 ASP 32 -3.249 -8.771 11.655 259 HB3 ASP 32 HB1 ASP 32 -4.670 -9.080 12.646 260 H LEU 33 HN LEU 33 -6.931 -9.808 11.757 261 HA LEU 33 HA LEU 33 -7.361 -12.358 12.918 262 HB2 LEU 33 HB2 LEU 33 -8.410 -10.228 13.667 263 HB3 LEU 33 HB1 LEU 33 -9.380 -10.230 12.208 264 HG LEU 33 HG LEU 33 -10.428 -12.359 12.948 265 HD11 LEU 33 HD11 LEU 33 -10.122 -13.087 15.254 266 HD12 LEU 33 HD12 LEU 33 -8.896 -11.843 15.492 267 HD13 LEU 33 HD13 LEU 33 -8.604 -13.164 14.361 268 HD21 LEU 33 HD21 LEU 33 -11.497 -10.209 13.388 269 HD22 LEU 33 HD22 LEU 33 -10.616 -10.075 14.908 270 HD23 LEU 33 HD23 LEU 33 -11.809 -11.355 14.690 271 H LEU 34 HN LEU 34 -8.069 -10.977 9.785 272 HA LEU 34 HA LEU 34 -9.780 -13.210 9.046 273 HB2 LEU 34 HB2 LEU 34 -8.802 -10.909 7.355 274 HB3 LEU 34 HB1 LEU 34 -10.050 -12.060 6.915 275 HG LEU 34 HG LEU 34 -10.200 -9.963 9.079 276 HD11 LEU 34 HD11 LEU 34 -12.031 -9.085 7.710 277 HD12 LEU 34 HD12 LEU 34 -11.714 -10.330 6.501 278 HD13 LEU 34 HD13 LEU 34 -10.500 -9.098 6.837 279 HD21 LEU 34 HD21 LEU 34 -11.306 -11.987 9.844 280 HD22 LEU 34 HD22 LEU 34 -12.210 -12.084 8.333 281 HD23 LEU 34 HD23 LEU 34 -12.493 -10.746 9.445 282 H ALA 35 HN ALA 35 -6.508 -12.628 9.157 283 HA ALA 35 HA ALA 35 -5.790 -14.157 6.811 284 HB1 ALA 35 HB1 ALA 35 -3.494 -13.880 7.575 285 HB2 ALA 35 HB2 ALA 35 -4.071 -13.200 9.095 286 HB3 ALA 35 HB3 ALA 35 -4.347 -12.335 7.583 287 H GLN 36 HN GLN 36 -6.434 -14.716 10.154 288 HA GLN 36 HA GLN 36 -5.142 -17.307 10.205 289 HB2 GLN 36 HB2 GLN 36 -5.910 -17.452 12.491 290 HB3 GLN 36 HB1 GLN 36 -5.242 -15.847 12.223 291 HG2 GLN 36 HG2 GLN 36 -7.559 -15.010 11.889 292 HG3 GLN 36 HG1 GLN 36 -8.148 -16.607 12.343 293 HE21 GLN 36 HE21 GLN 36 -5.375 -15.042 13.795 294 HE22 GLN 36 HE22 GLN 36 -6.087 -14.812 15.352 295 H GLY 37 HN GLY 37 -8.159 -16.008 9.303 296 HA2 GLY 37 HA2 GLY 37 -9.218 -18.238 8.143 297 HA3 GLY 37 HA1 GLY 37 -9.754 -18.338 9.815 298 H GLU 38 HN GLU 38 -11.911 -18.173 8.871 299 HA GLU 38 HA GLU 38 -12.630 -15.490 7.922 300 HB2 GLU 38 HB2 GLU 38 -13.457 -17.420 6.634 301 HB3 GLU 38 HB1 GLU 38 -14.249 -18.046 8.072 302 HG2 GLU 38 HG2 GLU 38 -15.721 -16.110 8.118 303 HG3 GLU 38 HG1 GLU 38 -14.914 -15.454 6.693 304 H ARG 39 HN ARG 39 -13.857 -14.103 9.155 305 HA ARG 39 HA ARG 39 -14.713 -15.090 11.790 306 HB2 ARG 39 HB2 ARG 39 -12.408 -14.040 11.863 307 HB3 ARG 39 HB1 ARG 39 -13.172 -12.519 11.422 308 HG2 ARG 39 HG2 ARG 39 -12.868 -12.528 13.776 309 HG3 ARG 39 HG1 ARG 39 -14.594 -12.725 13.458 310 HD2 ARG 39 HD2 ARG 39 -14.062 -14.267 15.168 311 HD3 ARG 39 HD1 ARG 39 -14.227 -15.213 13.691 312 HE ARG 39 HE ARG 39 -11.523 -14.427 14.198 313 HH11 ARG 39 HH11 ARG 39 -13.983 -16.817 14.906 314 HH12 ARG 39 HH12 ARG 39 -12.843 -18.010 15.444 315 HH21 ARG 39 HH21 ARG 39 -10.015 -16.016 14.929 316 HH22 ARG 39 HH22 ARG 39 -10.615 -17.560 15.472 317 H ALA 40 HN ALA 40 -16.525 -14.143 12.617 318 HA ALA 40 HA ALA 40 -18.158 -12.596 10.833 319 HB1 ALA 40 HB1 ALA 40 -19.103 -14.308 12.325 320 HB2 ALA 40 HB2 ALA 40 -19.846 -12.729 12.575 321 HB3 ALA 40 HB3 ALA 40 -18.647 -13.329 13.720 322 H VAL 41 HN VAL 41 -19.131 -10.542 11.363 323 HA VAL 41 HA VAL 41 -17.255 -8.544 11.820 324 HB VAL 41 HB VAL 41 -20.239 -8.261 12.188 325 HG11 VAL 41 HG11 VAL 41 -18.133 -6.246 11.415 326 HG12 VAL 41 HG12 VAL 41 -18.959 -6.342 12.971 327 HG13 VAL 41 HG13 VAL 41 -19.867 -5.943 11.514 328 HG21 VAL 41 HG21 VAL 41 -18.592 -8.070 9.668 329 HG22 VAL 41 HG22 VAL 41 -20.301 -7.660 9.811 330 HG23 VAL 41 HG23 VAL 41 -19.772 -9.323 10.059 331 H GLU 42 HN GLU 42 -19.719 -9.832 14.040 332 HA GLU 42 HA GLU 42 -19.317 -8.013 16.119 333 HB2 GLU 42 HB2 GLU 42 -20.084 -10.916 16.457 334 HB3 GLU 42 HB1 GLU 42 -20.429 -9.593 17.562 335 HG2 GLU 42 HG2 GLU 42 -22.435 -9.688 16.544 336 HG3 GLU 42 HG1 GLU 42 -21.625 -8.629 15.390 337 H ALA 43 HN ALA 43 -17.685 -11.070 15.441 338 HA ALA 43 HA ALA 43 -16.087 -11.044 17.792 339 HB1 ALA 43 HB1 ALA 43 -15.578 -12.447 15.171 340 HB2 ALA 43 HB2 ALA 43 -16.521 -13.090 16.516 341 HB3 ALA 43 HB3 ALA 43 -14.795 -12.795 16.712 342 H ILE 44 HN ILE 44 -15.613 -9.918 14.476 343 HA ILE 44 HA ILE 44 -12.932 -9.119 14.668 344 HB ILE 44 HB ILE 44 -15.153 -7.928 12.996 345 HG12 ILE 44 HG12 ILE 44 -13.004 -9.930 12.277 346 HG13 ILE 44 HG11 ILE 44 -14.689 -10.330 12.588 347 HG21 ILE 44 HG21 ILE 44 -13.384 -7.000 11.594 348 HG22 ILE 44 HG22 ILE 44 -12.169 -7.606 12.718 349 HG23 ILE 44 HG23 ILE 44 -13.305 -6.357 13.233 350 HD11 ILE 44 HD11 ILE 44 -13.666 -8.587 10.360 351 HD12 ILE 44 HD12 ILE 44 -15.359 -8.973 10.672 352 HD13 ILE 44 HD13 ILE 44 -14.233 -10.250 10.212 353 H ALA 45 HN ALA 45 -15.914 -7.251 15.168 354 HA ALA 45 HA ALA 45 -14.713 -4.813 15.840 355 HB1 ALA 45 HB1 ALA 45 -16.869 -4.209 16.803 356 HB2 ALA 45 HB2 ALA 45 -17.366 -5.902 16.770 357 HB3 ALA 45 HB3 ALA 45 -17.079 -5.039 15.260 358 H THR 46 HN THR 46 -15.651 -7.554 17.859 359 HA THR 46 HA THR 46 -15.095 -6.326 20.334 360 HB THR 46 HB THR 46 -15.036 -9.278 19.674 361 HG1 THR 46 HG1 THR 46 -17.052 -8.430 19.131 362 HG21 THR 46 HG21 THR 46 -14.025 -8.746 21.840 363 HG22 THR 46 HG22 THR 46 -15.567 -9.576 22.050 364 HG23 THR 46 HG23 THR 46 -15.463 -7.832 22.292 365 H ALA 47 HN ALA 47 -13.133 -8.475 18.274 366 HA ALA 47 HA ALA 47 -10.922 -8.625 20.022 367 HB1 ALA 47 HB1 ALA 47 -9.716 -9.560 18.145 368 HB2 ALA 47 HB2 ALA 47 -10.945 -8.969 17.026 369 HB3 ALA 47 HB3 ALA 47 -11.351 -10.222 18.199 370 H THR 48 HN THR 48 -11.809 -6.310 17.540 371 HA THR 48 HA THR 48 -9.230 -5.004 17.621 372 HB THR 48 HB THR 48 -10.398 -3.288 16.163 373 HG1 THR 48 HG1 THR 48 -12.425 -5.251 15.896 374 HG21 THR 48 HG21 THR 48 -10.415 -6.162 15.233 375 HG22 THR 48 HG22 THR 48 -9.017 -5.085 15.233 376 HG23 THR 48 HG23 THR 48 -10.397 -4.738 14.192 377 H GLY 49 HN GLY 49 -12.208 -4.822 19.297 378 HA2 GLY 49 HA2 GLY 49 -12.716 -3.568 21.182 379 HA3 GLY 49 HA1 GLY 49 -11.216 -2.678 20.959 380 H MET 50 HN MET 50 -13.496 -3.026 18.356 381 HA MET 50 HA MET 50 -14.165 -0.167 18.645 382 HB2 MET 50 HB2 MET 50 -13.812 -1.746 16.088 383 HB3 MET 50 HB1 MET 50 -14.291 -0.059 16.185 384 HG2 MET 50 HG2 MET 50 -12.128 0.447 17.269 385 HG3 MET 50 HG1 MET 50 -11.654 -1.233 17.023 386 HE1 MET 50 HE1 MET 50 -13.023 -1.796 14.180 387 HE2 MET 50 HE2 MET 50 -11.392 -2.340 14.577 388 HE3 MET 50 HE3 MET 50 -11.688 -1.449 13.083 389 H ASN 51 HN ASN 51 -16.177 0.318 17.157 390 HA ASN 51 HA ASN 51 -18.300 -1.387 18.148 391 HB2 ASN 51 HB2 ASN 51 -18.381 1.172 16.533 392 HB3 ASN 51 HB1 ASN 51 -19.801 0.330 17.142 393 HD21 ASN 51 HD21 ASN 51 -20.217 0.323 19.360 394 HD22 ASN 51 HD22 ASN 51 -19.474 1.474 20.424 395 H LEU 52 HN LEU 52 -20.070 -2.075 16.684 396 HA LEU 52 HA LEU 52 -19.139 -3.706 14.621 397 HB2 LEU 52 HB2 LEU 52 -21.881 -2.708 15.337 398 HB3 LEU 52 HB1 LEU 52 -21.633 -3.687 13.906 399 HG LEU 52 HG LEU 52 -22.400 -5.109 15.657 400 HD11 LEU 52 HD11 LEU 52 -19.441 -5.479 15.249 401 HD12 LEU 52 HD12 LEU 52 -20.732 -6.072 14.204 402 HD13 LEU 52 HD13 LEU 52 -20.559 -6.709 15.839 403 HD21 LEU 52 HD21 LEU 52 -21.209 -5.386 17.775 404 HD22 LEU 52 HD22 LEU 52 -21.827 -3.744 17.584 405 HD23 LEU 52 HD23 LEU 52 -20.114 -4.076 17.328 406 H THR 53 HN THR 53 -20.932 -0.638 14.402 407 HA THR 53 HA THR 53 -20.965 -0.462 11.609 408 HB THR 53 HB THR 53 -20.845 1.967 13.381 409 HG1 THR 53 HG1 THR 53 -22.379 0.963 14.484 410 HG21 THR 53 HG21 THR 53 -22.550 2.786 11.799 411 HG22 THR 53 HG22 THR 53 -22.438 1.268 10.908 412 HG23 THR 53 HG23 THR 53 -21.048 2.351 10.983 413 H THR 54 HN THR 54 -18.549 0.554 13.955 414 HA THR 54 HA THR 54 -16.946 2.070 12.170 415 HB THR 54 HB THR 54 -16.018 0.655 14.675 416 HG1 THR 54 HG1 THR 54 -17.555 3.007 14.302 417 HG21 THR 54 HG21 THR 54 -14.243 1.642 13.298 418 HG22 THR 54 HG22 THR 54 -14.437 2.520 14.818 419 HG23 THR 54 HG23 THR 54 -15.086 3.191 13.319 420 H ALA 55 HN ALA 55 -16.909 -1.301 13.258 421 HA ALA 55 HA ALA 55 -14.595 -2.107 11.867 422 HB1 ALA 55 HB1 ALA 55 -15.493 -4.396 12.110 423 HB2 ALA 55 HB2 ALA 55 -17.017 -3.716 12.681 424 HB3 ALA 55 HB3 ALA 55 -15.540 -3.484 13.618 425 H SER 56 HN SER 56 -18.044 -2.291 10.991 426 HA SER 56 HA SER 56 -17.730 -3.421 8.461 427 HB2 SER 56 HB2 SER 56 -19.862 -1.473 9.368 428 HB3 SER 56 HB1 SER 56 -19.979 -2.574 7.995 429 HG SER 56 HG SER 56 -20.869 -3.791 9.492 430 H ALA 57 HN ALA 57 -17.392 -0.093 9.524 431 HA ALA 57 HA ALA 57 -17.412 1.159 7.005 432 HB1 ALA 57 HB1 ALA 57 -16.318 3.024 8.106 433 HB2 ALA 57 HB2 ALA 57 -15.900 1.999 9.477 434 HB3 ALA 57 HB3 ALA 57 -17.590 2.374 9.139 435 H ASN 58 HN ASN 58 -14.729 -0.126 8.959 436 HA ASN 58 HA ASN 58 -12.757 0.452 6.965 437 HB2 ASN 58 HB2 ASN 58 -12.740 -1.223 9.464 438 HB3 ASN 58 HB1 ASN 58 -11.370 -1.222 8.360 439 HD21 ASN 58 HD21 ASN 58 -13.195 0.605 10.668 440 HD22 ASN 58 HD22 ASN 58 -12.068 1.904 10.832 441 H LEU 59 HN LEU 59 -14.729 -2.327 7.786 442 HA LEU 59 HA LEU 59 -13.491 -4.219 6.116 443 HB2 LEU 59 HB2 LEU 59 -16.331 -3.968 7.092 444 HB3 LEU 59 HB1 LEU 59 -15.740 -5.358 6.200 445 HG LEU 59 HG LEU 59 -14.583 -4.443 8.833 446 HD11 LEU 59 HD11 LEU 59 -15.785 -6.350 9.807 447 HD12 LEU 59 HD12 LEU 59 -16.594 -6.616 8.263 448 HD13 LEU 59 HD13 LEU 59 -16.884 -5.130 9.169 449 HD21 LEU 59 HD21 LEU 59 -13.539 -6.642 8.837 450 HD22 LEU 59 HD22 LEU 59 -13.066 -5.732 7.404 451 HD23 LEU 59 HD23 LEU 59 -14.276 -7.008 7.279 452 H GLN 60 HN GLN 60 -16.144 -1.941 5.523 453 HA GLN 60 HA GLN 60 -16.696 -2.688 2.877 454 HB2 GLN 60 HB2 GLN 60 -18.124 -1.182 4.224 455 HB3 GLN 60 HB1 GLN 60 -16.893 0.068 4.108 456 HG2 GLN 60 HG2 GLN 60 -17.170 0.088 1.666 457 HG3 GLN 60 HG1 GLN 60 -18.433 -1.130 1.817 458 HE21 GLN 60 HE21 GLN 60 -20.393 -0.579 2.746 459 HE22 GLN 60 HE22 GLN 60 -20.906 1.070 2.890 460 H ALA 61 HN ALA 61 -14.385 -0.374 4.215 461 HA ALA 61 HA ALA 61 -13.394 0.670 1.817 462 HB1 ALA 61 HB1 ALA 61 -11.877 0.196 4.387 463 HB2 ALA 61 HB2 ALA 61 -12.878 1.605 4.034 464 HB3 ALA 61 HB3 ALA 61 -11.418 1.304 3.093 465 H LEU 62 HN LEU 62 -12.219 -2.064 3.758 466 HA LEU 62 HA LEU 62 -10.127 -2.832 2.062 467 HB2 LEU 62 HB2 LEU 62 -11.794 -4.565 3.885 468 HB3 LEU 62 HB1 LEU 62 -10.230 -4.992 3.219 469 HG LEU 62 HG LEU 62 -10.707 -2.684 5.109 470 HD11 LEU 62 HD11 LEU 62 -9.655 -4.076 6.804 471 HD12 LEU 62 HD12 LEU 62 -9.541 -5.412 5.657 472 HD13 LEU 62 HD13 LEU 62 -11.122 -4.839 6.190 473 HD21 LEU 62 HD21 LEU 62 -8.164 -3.943 4.080 474 HD22 LEU 62 HD22 LEU 62 -8.261 -2.688 5.314 475 HD23 LEU 62 HD23 LEU 62 -8.782 -2.344 3.666 476 H LYS 63 HN LYS 63 -13.547 -3.750 2.086 477 HA LYS 63 HA LYS 63 -13.217 -5.744 0.064 478 HB2 LYS 63 HB2 LYS 63 -15.042 -5.831 1.737 479 HB3 LYS 63 HB1 LYS 63 -15.766 -4.411 0.992 480 HG2 LYS 63 HG2 LYS 63 -16.305 -5.575 -0.968 481 HG3 LYS 63 HG1 LYS 63 -15.230 -6.915 -0.567 482 HD2 LYS 63 HD2 LYS 63 -17.465 -7.646 -0.184 483 HD3 LYS 63 HD1 LYS 63 -16.705 -7.405 1.390 484 HE2 LYS 63 HE2 LYS 63 -18.929 -6.516 1.465 485 HE3 LYS 63 HE1 LYS 63 -17.788 -5.174 1.507 486 HZ1 LYS 63 HZ1 LYS 63 -19.728 -4.865 0.001 487 HZ2 LYS 63 HZ2 LYS 63 -19.118 -6.108 -0.974 488 HZ3 LYS 63 HZ3 LYS 63 -18.222 -4.685 -0.757 489 H SER 64 HN SER 64 -14.161 -2.332 0.065 490 HA SER 64 HA SER 64 -14.939 -2.244 -2.654 491 HB2 SER 64 HB2 SER 64 -14.744 0.195 -2.461 492 HB3 SER 64 HB1 SER 64 -15.556 -0.470 -1.046 493 HG SER 64 HG SER 64 -13.115 -0.478 -0.315 494 H GLY 65 HN GLY 65 -11.865 -2.344 -1.103 495 HA2 GLY 65 HA2 GLY 65 -10.416 -1.509 -3.480 496 HA3 GLY 65 HA1 GLY 65 -9.712 -2.082 -1.973 497 H GLY 66 HN GLY 66 -11.824 -4.360 -2.282 498 HA2 GLY 66 HA2 GLY 66 -11.983 -6.390 -3.431 499 HA3 GLY 66 HA1 GLY 66 -10.628 -5.902 -4.437 500 H LEU 67 HN LEU 67 -10.524 -5.746 -0.943 501 HA LEU 67 HA LEU 67 -8.305 -7.633 -1.025 502 HB2 LEU 67 HB2 LEU 67 -9.244 -5.925 1.273 503 HB3 LEU 67 HB1 LEU 67 -7.767 -6.863 1.214 504 HG LEU 67 HG LEU 67 -8.420 -4.348 -0.300 505 HD11 LEU 67 HD11 LEU 67 -6.408 -3.531 0.775 506 HD12 LEU 67 HD12 LEU 67 -6.152 -5.106 1.524 507 HD13 LEU 67 HD13 LEU 67 -7.553 -4.133 1.976 508 HD21 LEU 67 HD21 LEU 67 -7.397 -5.904 -1.883 509 HD22 LEU 67 HD22 LEU 67 -6.082 -6.201 -0.747 510 HD23 LEU 67 HD23 LEU 67 -6.282 -4.604 -1.464 511 H VAL 68 HN VAL 68 -11.364 -7.174 0.738 512 HA VAL 68 HA VAL 68 -11.164 -9.989 1.579 513 HB VAL 68 HB VAL 68 -12.336 -9.443 3.649 514 HG11 VAL 68 HG11 VAL 68 -9.870 -7.767 3.202 515 HG12 VAL 68 HG12 VAL 68 -9.915 -9.464 3.682 516 HG13 VAL 68 HG13 VAL 68 -10.527 -8.222 4.774 517 HG21 VAL 68 HG21 VAL 68 -12.671 -7.111 4.335 518 HG22 VAL 68 HG22 VAL 68 -13.608 -7.504 2.894 519 HG23 VAL 68 HG23 VAL 68 -12.120 -6.566 2.752 520 H GLU 69 HN GLU 69 -13.186 -11.073 1.963 521 HA GLU 69 HA GLU 69 -15.351 -10.071 0.240 522 HB2 GLU 69 HB2 GLU 69 -14.855 -12.866 1.283 523 HB3 GLU 69 HB1 GLU 69 -16.152 -12.391 0.198 524 HG2 GLU 69 HG2 GLU 69 -14.520 -11.814 -1.510 525 HG3 GLU 69 HG1 GLU 69 -13.212 -12.273 -0.418 526 H ALA 70 HN ALA 70 -17.503 -10.189 0.961 527 HA ALA 70 HA ALA 70 -17.826 -10.503 3.876 528 HB1 ALA 70 HB1 ALA 70 -19.410 -8.762 1.987 529 HB2 ALA 70 HB2 ALA 70 -18.213 -8.201 3.157 530 HB3 ALA 70 HB3 ALA 70 -19.713 -8.947 3.716 531 H ARG 71 HN ARG 71 -18.693 -12.442 4.233 532 HA ARG 71 HA ARG 71 -20.803 -13.361 2.395 533 HB2 ARG 71 HB2 ARG 71 -19.141 -15.081 4.249 534 HB3 ARG 71 HB1 ARG 71 -20.258 -15.635 3.009 535 HG2 ARG 71 HG2 ARG 71 -18.710 -14.341 1.386 536 HG3 ARG 71 HG1 ARG 71 -17.540 -14.434 2.701 537 HD2 ARG 71 HD2 ARG 71 -18.931 -16.781 1.421 538 HD3 ARG 71 HD1 ARG 71 -17.284 -16.263 1.082 539 HE ARG 71 HE ARG 71 -17.381 -16.693 3.811 540 HH11 ARG 71 HH11 ARG 71 -17.947 -18.567 0.908 541 HH12 ARG 71 HH12 ARG 71 -17.427 -20.065 1.604 542 HH21 ARG 71 HH21 ARG 71 -16.720 -18.674 4.763 543 HH22 ARG 71 HH22 ARG 71 -16.756 -20.131 3.814 544 H ARG 72 HN ARG 72 -22.702 -12.785 3.254 545 HA ARG 72 HA ARG 72 -23.023 -12.628 6.114 546 HB2 ARG 72 HB2 ARG 72 -24.065 -10.937 4.669 547 HB3 ARG 72 HB1 ARG 72 -25.048 -12.184 3.915 548 HG2 ARG 72 HG2 ARG 72 -26.198 -12.604 5.987 549 HG3 ARG 72 HG1 ARG 72 -25.142 -11.486 6.843 550 HD2 ARG 72 HD2 ARG 72 -27.308 -10.470 6.377 551 HD3 ARG 72 HD1 ARG 72 -26.019 -9.635 5.513 552 HE ARG 72 HE ARG 72 -26.786 -10.640 3.481 553 HH11 ARG 72 HH11 ARG 72 -28.871 -11.226 6.235 554 HH12 ARG 72 HH12 ARG 72 -30.276 -11.549 5.269 555 HH21 ARG 72 HH21 ARG 72 -28.619 -11.074 2.200 556 HH22 ARG 72 HH22 ARG 72 -30.137 -11.457 2.964 557 H GLU 73 HN GLU 73 -23.949 -14.048 7.402 558 HA GLU 73 HA GLU 73 -25.395 -16.308 6.201 559 HB2 GLU 73 HB2 GLU 73 -23.111 -16.913 7.081 560 HB3 GLU 73 HB1 GLU 73 -23.668 -16.439 8.679 561 HG2 GLU 73 HG2 GLU 73 -25.376 -18.166 8.616 562 HG3 GLU 73 HG1 GLU 73 -24.866 -18.623 6.992 563 H GLY 74 HN GLY 74 -27.443 -15.785 6.606 564 HA2 GLY 74 HA2 GLY 74 -29.360 -15.475 7.838 565 HA3 GLY 74 HA1 GLY 74 -28.406 -15.732 9.294 566 H THR 75 HN THR 75 -27.837 -14.025 10.509 567 HA THR 75 HA THR 75 -28.719 -11.391 9.542 568 HB THR 75 HB THR 75 -28.251 -12.239 12.405 569 HG1 THR 75 HG1 THR 75 -30.279 -12.825 10.694 570 HG21 THR 75 HG21 THR 75 -29.599 -10.282 12.948 571 HG22 THR 75 HG22 THR 75 -29.788 -9.916 11.235 572 HG23 THR 75 HG23 THR 75 -28.199 -9.808 11.989 573 H ARG 76 HN ARG 76 -25.939 -13.213 10.495 574 HA ARG 76 HA ARG 76 -24.434 -10.720 10.931 575 HB2 ARG 76 HB2 ARG 76 -22.695 -12.150 11.977 576 HB3 ARG 76 HB1 ARG 76 -24.237 -12.183 12.817 577 HG2 ARG 76 HG2 ARG 76 -24.751 -14.340 11.826 578 HG3 ARG 76 HG1 ARG 76 -23.231 -14.302 10.928 579 HD2 ARG 76 HD2 ARG 76 -23.212 -15.661 13.051 580 HD3 ARG 76 HD1 ARG 76 -21.951 -14.437 12.908 581 HE ARG 76 HE ARG 76 -23.205 -13.046 14.436 582 HH11 ARG 76 HH11 ARG 76 -24.225 -16.401 14.212 583 HH12 ARG 76 HH12 ARG 76 -25.018 -16.390 15.765 584 HH21 ARG 76 HH21 ARG 76 -24.239 -13.043 16.457 585 HH22 ARG 76 HH22 ARG 76 -25.013 -14.485 17.042 586 H GLN 77 HN GLN 77 -22.253 -10.602 10.087 587 HA GLN 77 HA GLN 77 -22.083 -11.936 7.470 588 HB2 GLN 77 HB2 GLN 77 -20.937 -9.266 8.304 589 HB3 GLN 77 HB1 GLN 77 -20.801 -9.988 6.708 590 HG2 GLN 77 HG2 GLN 77 -23.232 -9.859 6.454 591 HG3 GLN 77 HG1 GLN 77 -23.344 -9.095 8.039 592 HE21 GLN 77 HE21 GLN 77 -20.869 -7.567 7.629 593 HE22 GLN 77 HE22 GLN 77 -21.267 -6.303 6.526 594 H TYR 78 HN TYR 78 -20.347 -13.149 7.053 595 HA TYR 78 HA TYR 78 -18.094 -13.080 8.926 596 HB2 TYR 78 HB2 TYR 78 -18.872 -15.046 6.762 597 HB3 TYR 78 HB1 TYR 78 -17.362 -15.136 7.658 598 HD1 TYR 78 HD1 TYR 78 -20.989 -15.615 7.814 599 HD2 TYR 78 HD2 TYR 78 -17.331 -15.847 9.973 600 HE1 TYR 78 HE1 TYR 78 -22.097 -16.976 9.534 601 HE2 TYR 78 HE2 TYR 78 -18.429 -17.207 11.701 602 HH TYR 78 HH TYR 78 -21.412 -18.679 11.243 603 H TYR 79 HN TYR 79 -16.198 -12.196 8.354 604 HA TYR 79 HA TYR 79 -15.861 -11.480 5.520 605 HB2 TYR 79 HB2 TYR 79 -14.927 -10.109 8.026 606 HB3 TYR 79 HB1 TYR 79 -14.132 -9.819 6.481 607 HD1 TYR 79 HD1 TYR 79 -17.415 -9.619 8.204 608 HD2 TYR 79 HD2 TYR 79 -15.042 -8.311 4.927 609 HE1 TYR 79 HE1 TYR 79 -19.117 -7.934 7.651 610 HE2 TYR 79 HE2 TYR 79 -16.736 -6.620 4.364 611 HH TYR 79 HH TYR 79 -19.171 -6.254 4.718 612 H ARG 80 HN ARG 80 -13.868 -11.788 4.551 613 HA ARG 80 HA ARG 80 -11.738 -13.144 5.960 614 HB2 ARG 80 HB2 ARG 80 -13.320 -14.992 5.454 615 HB3 ARG 80 HB1 ARG 80 -13.255 -14.563 3.750 616 HG2 ARG 80 HG2 ARG 80 -10.737 -14.971 3.938 617 HG3 ARG 80 HG1 ARG 80 -11.120 -15.779 5.460 618 HD2 ARG 80 HD2 ARG 80 -11.041 -17.436 3.736 619 HD3 ARG 80 HD1 ARG 80 -12.724 -17.218 4.214 620 HE ARG 80 HE ARG 80 -12.614 -15.575 2.142 621 HH11 ARG 80 HH11 ARG 80 -11.310 -18.806 2.482 622 HH12 ARG 80 HH12 ARG 80 -11.452 -19.175 0.787 623 HH21 ARG 80 HH21 ARG 80 -12.779 -16.042 -0.097 624 HH22 ARG 80 HH22 ARG 80 -12.255 -17.602 -0.679 625 H ILE 81 HN ILE 81 -9.784 -12.981 4.809 626 HA ILE 81 HA ILE 81 -9.545 -11.132 2.720 627 HB ILE 81 HB ILE 81 -7.673 -13.417 3.391 628 HG12 ILE 81 HG12 ILE 81 -7.657 -10.516 4.267 629 HG13 ILE 81 HG11 ILE 81 -8.065 -11.895 5.284 630 HG21 ILE 81 HG21 ILE 81 -5.963 -12.088 2.242 631 HG22 ILE 81 HG22 ILE 81 -7.190 -10.909 1.787 632 HG23 ILE 81 HG23 ILE 81 -7.271 -12.551 1.154 633 HD11 ILE 81 HD11 ILE 81 -5.382 -11.400 4.010 634 HD12 ILE 81 HD12 ILE 81 -5.801 -12.740 5.079 635 HD13 ILE 81 HD13 ILE 81 -5.801 -11.087 5.696 636 H ALA 82 HN ALA 82 -9.867 -11.281 0.587 637 HA ALA 82 HA ALA 82 -11.388 -13.471 -0.383 638 HB1 ALA 82 HB1 ALA 82 -11.723 -11.151 -1.127 639 HB2 ALA 82 HB2 ALA 82 -11.470 -12.258 -2.476 640 HB3 ALA 82 HB3 ALA 82 -10.160 -11.203 -1.944 641 H GLY 83 HN GLY 83 -8.534 -12.147 -2.017 642 HA2 GLY 83 HA2 GLY 83 -7.890 -14.881 -2.860 643 HA3 GLY 83 HA1 GLY 83 -7.372 -13.409 -3.670 644 H GLU 84 HN GLU 84 -5.706 -15.570 -2.948 645 HA GLU 84 HA GLU 84 -4.231 -14.928 -0.604 646 HB2 GLU 84 HB2 GLU 84 -2.504 -16.445 -1.561 647 HB3 GLU 84 HB1 GLU 84 -4.105 -17.166 -1.462 648 HG2 GLU 84 HG2 GLU 84 -4.449 -16.830 -3.820 649 HG3 GLU 84 HG1 GLU 84 -2.918 -15.964 -3.949 650 H ASP 85 HN ASP 85 -4.365 -13.606 -3.754 651 HA ASP 85 HA ASP 85 -1.826 -12.452 -3.983 652 HB2 ASP 85 HB2 ASP 85 -3.178 -10.549 -5.189 653 HB3 ASP 85 HB1 ASP 85 -3.069 -12.147 -5.911 654 H VAL 86 HN VAL 86 -4.751 -11.179 -2.429 655 HA VAL 86 HA VAL 86 -3.561 -8.881 -1.292 656 HB VAL 86 HB VAL 86 -5.919 -10.485 -0.287 657 HG11 VAL 86 HG11 VAL 86 -5.094 -7.640 0.280 658 HG12 VAL 86 HG12 VAL 86 -5.055 -8.985 1.420 659 HG13 VAL 86 HG13 VAL 86 -6.599 -8.393 0.806 660 HG21 VAL 86 HG21 VAL 86 -5.899 -8.043 -2.052 661 HG22 VAL 86 HG22 VAL 86 -7.302 -8.993 -1.556 662 HG23 VAL 86 HG23 VAL 86 -6.099 -9.695 -2.636 663 H ALA 87 HN ALA 87 -4.089 -12.157 -0.060 664 HA ALA 87 HA ALA 87 -3.210 -11.776 2.562 665 HB1 ALA 87 HB1 ALA 87 -3.015 -14.275 0.890 666 HB2 ALA 87 HB2 ALA 87 -4.421 -13.760 1.823 667 HB3 ALA 87 HB3 ALA 87 -2.924 -14.193 2.649 668 H ARG 88 HN ARG 88 -1.345 -12.840 -0.289 669 HA ARG 88 HA ARG 88 1.115 -13.119 1.080 670 HB2 ARG 88 HB2 ARG 88 0.603 -12.548 -1.847 671 HB3 ARG 88 HB1 ARG 88 2.155 -13.018 -1.173 672 HG2 ARG 88 HG2 ARG 88 1.133 -15.156 -0.438 673 HG3 ARG 88 HG1 ARG 88 -0.355 -14.680 -1.263 674 HD2 ARG 88 HD2 ARG 88 1.007 -14.432 -3.358 675 HD3 ARG 88 HD1 ARG 88 2.357 -15.157 -2.488 676 HE ARG 88 HE ARG 88 -0.200 -16.557 -2.967 677 HH11 ARG 88 HH11 ARG 88 3.302 -16.536 -2.776 678 HH12 ARG 88 HH12 ARG 88 3.455 -18.212 -3.220 679 HH21 ARG 88 HH21 ARG 88 -0.003 -18.719 -3.597 680 HH22 ARG 88 HH22 ARG 88 1.580 -19.444 -3.714 681 H LEU 89 HN LEU 89 -0.387 -10.418 -0.629 682 HA LEU 89 HA LEU 89 1.863 -8.722 -0.644 683 HB2 LEU 89 HB2 LEU 89 -0.134 -8.422 -2.065 684 HB3 LEU 89 HB1 LEU 89 -1.062 -7.978 -0.646 685 HG LEU 89 HG LEU 89 0.308 -5.977 -0.343 686 HD11 LEU 89 HD11 LEU 89 1.942 -5.323 -2.052 687 HD12 LEU 89 HD12 LEU 89 1.733 -6.887 -2.841 688 HD13 LEU 89 HD13 LEU 89 2.418 -6.801 -1.217 689 HD21 LEU 89 HD21 LEU 89 -0.435 -4.756 -2.324 690 HD22 LEU 89 HD22 LEU 89 -1.689 -5.846 -1.731 691 HD23 LEU 89 HD23 LEU 89 -0.741 -6.282 -3.153 692 H PHE 90 HN PHE 90 -0.833 -9.044 1.640 693 HA PHE 90 HA PHE 90 -0.165 -6.963 3.383 694 HB2 PHE 90 HB2 PHE 90 -2.301 -8.039 3.577 695 HB3 PHE 90 HB1 PHE 90 -1.552 -9.602 3.879 696 HD1 PHE 90 HD2 PHE 90 -1.912 -6.193 5.332 697 HD2 PHE 90 HD1 PHE 90 -1.200 -10.325 6.050 698 HE1 PHE 90 HE2 PHE 90 -2.054 -5.794 7.756 699 HE2 PHE 90 HE1 PHE 90 -1.342 -9.935 8.473 700 HZ PHE 90 HZ PHE 90 -1.771 -7.665 9.329 701 H ALA 91 HN ALA 91 0.790 -10.378 3.465 702 HA ALA 91 HA ALA 91 2.395 -10.135 5.794 703 HB1 ALA 91 HB1 ALA 91 1.459 -12.272 5.041 704 HB2 ALA 91 HB2 ALA 91 3.209 -12.357 5.237 705 HB3 ALA 91 HB3 ALA 91 2.507 -12.226 3.623 706 H LEU 92 HN LEU 92 3.067 -9.945 2.340 707 HA LEU 92 HA LEU 92 5.871 -9.985 2.488 708 HB2 LEU 92 HB2 LEU 92 4.344 -10.268 0.454 709 HB3 LEU 92 HB1 LEU 92 4.268 -8.519 0.399 710 HG LEU 92 HG LEU 92 6.917 -9.939 0.304 711 HD11 LEU 92 HD11 LEU 92 5.568 -10.940 -1.446 712 HD12 LEU 92 HD12 LEU 92 6.774 -9.860 -2.145 713 HD13 LEU 92 HD13 LEU 92 5.092 -9.342 -2.020 714 HD21 LEU 92 HD21 LEU 92 7.579 -7.927 -0.930 715 HD22 LEU 92 HD22 LEU 92 6.951 -7.530 0.670 716 HD23 LEU 92 HD23 LEU 92 5.945 -7.288 -0.758 717 H VAL 93 HN VAL 93 3.621 -7.207 2.274 718 HA VAL 93 HA VAL 93 5.650 -5.246 2.403 719 HB VAL 93 HB VAL 93 3.363 -4.760 1.594 720 HG11 VAL 93 HG11 VAL 93 2.561 -4.852 4.498 721 HG12 VAL 93 HG12 VAL 93 2.105 -6.028 3.265 722 HG13 VAL 93 HG13 VAL 93 1.542 -4.361 3.143 723 HG21 VAL 93 HG21 VAL 93 4.303 -3.046 3.889 724 HG22 VAL 93 HG22 VAL 93 3.135 -2.549 2.665 725 HG23 VAL 93 HG23 VAL 93 4.798 -2.916 2.202 726 H GLN 94 HN GLN 94 3.896 -7.009 4.858 727 HA GLN 94 HA GLN 94 4.701 -5.494 7.097 728 HB2 GLN 94 HB2 GLN 94 2.895 -7.200 7.100 729 HB3 GLN 94 HB1 GLN 94 4.112 -8.457 6.942 730 HG2 GLN 94 HG2 GLN 94 5.071 -7.762 9.099 731 HG3 GLN 94 HG1 GLN 94 3.790 -6.563 9.257 732 HE21 GLN 94 HE21 GLN 94 1.672 -7.263 9.629 733 HE22 GLN 94 HE22 GLN 94 1.314 -8.859 10.198 734 H VAL 95 HN VAL 95 6.136 -8.293 5.465 735 HA VAL 95 HA VAL 95 8.351 -8.595 7.187 736 HB VAL 95 HB VAL 95 8.058 -9.362 4.274 737 HG11 VAL 95 HG11 VAL 95 10.130 -10.208 6.296 738 HG12 VAL 95 HG12 VAL 95 10.408 -9.228 4.858 739 HG13 VAL 95 HG13 VAL 95 9.922 -10.915 4.696 740 HG21 VAL 95 HG21 VAL 95 7.654 -11.615 5.173 741 HG22 VAL 95 HG22 VAL 95 6.433 -10.454 5.698 742 HG23 VAL 95 HG23 VAL 95 7.709 -10.957 6.810 743 H VAL 96 HN VAL 96 7.898 -6.757 4.192 744 HA VAL 96 HA VAL 96 10.489 -5.823 3.834 745 HB VAL 96 HB VAL 96 7.881 -4.393 3.268 746 HG11 VAL 96 HG11 VAL 96 10.651 -3.774 2.250 747 HG12 VAL 96 HG12 VAL 96 9.707 -2.785 3.361 748 HG13 VAL 96 HG13 VAL 96 9.159 -3.011 1.700 749 HG21 VAL 96 HG21 VAL 96 9.694 -6.018 1.486 750 HG22 VAL 96 HG22 VAL 96 8.238 -5.164 0.972 751 HG23 VAL 96 HG23 VAL 96 8.117 -6.518 2.097 752 H ALA 97 HN ALA 97 7.840 -4.311 5.682 753 HA ALA 97 HA ALA 97 9.380 -2.147 6.645 754 HB1 ALA 97 HB1 ALA 97 6.956 -2.068 6.645 755 HB2 ALA 97 HB2 ALA 97 7.570 -1.841 8.285 756 HB3 ALA 97 HB3 ALA 97 6.892 -3.396 7.803 757 H ASP 98 HN ASP 98 8.925 -5.420 7.771 758 HA ASP 98 HA ASP 98 9.986 -5.029 10.380 759 HB2 ASP 98 HB2 ASP 98 8.568 -6.937 9.923 760 HB3 ASP 98 HB1 ASP 98 9.694 -7.534 8.708 761 H GLU 99 HN GLU 99 11.393 -6.307 7.369 762 HA GLU 99 HA GLU 99 13.940 -6.766 8.563 763 HB2 GLU 99 HB2 GLU 99 13.025 -6.741 5.696 764 HB3 GLU 99 HB1 GLU 99 14.692 -7.055 6.157 765 HG2 GLU 99 HG2 GLU 99 13.796 -8.913 7.622 766 HG3 GLU 99 HG1 GLU 99 12.255 -8.684 6.798 767 H HIS 100 HN HIS 100 12.575 -4.089 6.684 768 HA HIS 100 HA HIS 100 15.099 -2.728 6.505 769 HB2 HIS 100 HB2 HIS 100 12.264 -1.844 6.007 770 HB3 HIS 100 HB1 HIS 100 13.610 -0.713 5.942 771 HD1 HIS 100 HD1 HIS 100 14.983 -0.658 3.817 772 HD2 HIS 100 HD2 HIS 100 12.362 -3.891 3.984 773 HE1 HIS 100 HE1 HIS 100 15.029 -1.701 1.523 774 HE2 HIS 100 HE2 HIS 100 13.284 -3.529 1.597 775 H LEU 101 HN LEU 101 12.919 -3.272 8.965 776 HA LEU 101 HA LEU 101 13.606 -0.917 10.514 777 HB2 LEU 101 HB2 LEU 101 11.351 -2.070 10.590 778 HB3 LEU 101 HB1 LEU 101 12.141 -3.389 11.432 779 HG LEU 101 HG LEU 101 12.721 -1.886 13.277 780 HD11 LEU 101 HD11 LEU 101 11.208 0.186 11.691 781 HD12 LEU 101 HD12 LEU 101 12.935 0.199 12.054 782 HD13 LEU 101 HD13 LEU 101 11.761 0.372 13.357 783 HD21 LEU 101 HD21 LEU 101 10.452 -1.557 14.123 784 HD22 LEU 101 HD22 LEU 101 10.633 -3.127 13.336 785 HD23 LEU 101 HD23 LEU 101 9.813 -1.811 12.495 786 H GLU 102 HN GLU 102 15.059 -3.690 9.652 787 HA GLU 102 HA GLU 102 17.210 -4.301 10.072 788 HB2 GLU 102 HB2 GLU 102 17.444 -2.085 11.308 789 HB3 GLU 102 HB1 GLU 102 17.089 -2.986 12.775 790 HG2 GLU 102 HG2 GLU 102 19.464 -2.712 12.503 791 HG3 GLU 102 HG1 GLU 102 19.016 -4.412 12.368 792 H HIS 103 HN HIS 103 16.309 -4.333 13.471 793 HA HIS 103 HA HIS 103 15.682 -5.981 14.906 794 HB2 HIS 103 HB2 HIS 103 14.639 -7.132 12.337 795 HB3 HIS 103 HB1 HIS 103 14.552 -8.054 13.833 796 HD1 HIS 103 HD1 HIS 103 12.519 -5.998 11.850 797 HD2 HIS 103 HD2 HIS 103 13.240 -6.249 15.937 798 HE1 HIS 103 HE1 HIS 103 10.518 -4.954 12.958 799 HE2 HIS 103 HE2 HIS 103 10.890 -5.301 15.430 800 H HIS 104 HN HIS 104 18.414 -6.124 13.427 801 HA HIS 104 HA HIS 104 18.855 -8.987 13.521 802 HB2 HIS 104 HB2 HIS 104 21.055 -8.629 12.672 803 HB3 HIS 104 HB1 HIS 104 19.962 -7.603 11.762 804 HD1 HIS 104 HD1 HIS 104 20.835 -5.339 11.353 805 HD2 HIS 104 HD2 HIS 104 22.453 -7.001 14.808 806 HE1 HIS 104 HE1 HIS 104 22.545 -3.686 12.173 807 HE2 HIS 104 HE2 HIS 104 23.340 -4.611 14.379 808 H HIS 105 HN HIS 105 19.557 -10.113 15.160 809 HA HIS 105 HA HIS 105 20.243 -10.677 17.255 810 HB2 HIS 105 HB2 HIS 105 22.236 -8.529 16.548 811 HB3 HIS 105 HB1 HIS 105 22.339 -9.436 18.053 812 HD1 HIS 105 HD1 HIS 105 24.172 -9.420 15.257 813 HD2 HIS 105 HD2 HIS 105 21.834 -12.441 16.904 814 HE1 HIS 105 HE1 HIS 105 25.101 -11.573 14.343 815 HE2 HIS 105 HE2 HIS 105 23.759 -13.395 15.460 816 H HIS 106 HN HIS 106 18.067 -8.845 17.167 817 HA HIS 106 HA HIS 106 18.589 -7.114 19.493 818 HB2 HIS 106 HB2 HIS 106 17.863 -5.923 17.470 819 HB3 HIS 106 HB1 HIS 106 16.425 -6.929 17.379 820 HD1 HIS 106 HD1 HIS 106 14.395 -6.047 18.494 821 HD2 HIS 106 HD2 HIS 106 17.865 -4.228 19.899 822 HE1 HIS 106 HE1 HIS 106 13.626 -4.215 20.036 823 HE2 HIS 106 HE2 HIS 106 15.741 -3.263 21.021 824 H HIS 107 HN HIS 107 17.462 -10.072 18.851 825 HA HIS 107 HA HIS 107 16.066 -11.564 19.845 826 HB2 HIS 107 HB2 HIS 107 15.928 -9.418 21.985 827 HB3 HIS 107 HB1 HIS 107 15.196 -11.010 22.149 828 HD1 HIS 107 HD1 HIS 107 16.614 -12.692 23.275 829 HD2 HIS 107 HD2 HIS 107 18.880 -9.660 21.543 830 HE1 HIS 107 HE1 HIS 107 18.998 -13.186 23.895 831 HE2 HIS 107 HE2 HIS 107 20.362 -11.395 22.771 832 H HIS 108 HN HIS 108 13.618 -10.837 21.395 833 HA HIS 108 HA HIS 108 12.140 -9.282 19.429 834 HB2 HIS 108 HB2 HIS 108 10.436 -10.938 19.076 835 HB3 HIS 108 HB1 HIS 108 11.991 -11.669 18.709 836 HD1 HIS 108 HD1 HIS 108 12.870 -13.485 20.396 837 HD2 HIS 108 HD2 HIS 108 9.000 -12.133 21.109 838 HE1 HIS 108 HE1 HIS 108 11.834 -15.167 21.959 839 HE2 HIS 108 HE2 HIS 108 9.430 -14.437 22.194 840 H1 MET 1 HT1 MET 1 -3.640 -0.636 28.686 841 H2 MET 1 HT2 MET 1 -5.057 -0.061 27.955 842 H3 MET 1 HT3 MET 1 -3.636 0.863 27.890 843 HA MET 1 HA MET 1 -4.127 -1.753 26.594 844 HB2 MET 1 HB2 MET 1 -3.943 -0.573 24.503 845 HB3 MET 1 HB1 MET 1 -5.156 0.231 25.487 846 HG2 MET 1 HG2 MET 1 -3.581 1.981 26.056 847 HG3 MET 1 HG1 MET 1 -2.306 1.154 25.163 848 HE1 MET 1 HE1 MET 1 -3.983 0.101 22.622 849 HE2 MET 1 HE2 MET 1 -2.365 0.793 22.521 850 HE3 MET 1 HE3 MET 1 -3.650 1.400 21.476 851 H ALA 2 HN ALA 2 -2.403 -2.585 25.364 852 HA ALA 2 HA ALA 2 -0.266 -3.204 24.952 853 HB1 ALA 2 HB1 ALA 2 0.064 -0.915 24.160 854 HB2 ALA 2 HB2 ALA 2 1.515 -1.543 24.942 855 HB3 ALA 2 HB3 ALA 2 0.473 -0.407 25.799 856 H GLY 3 HN GLY 3 2.008 -3.308 26.072 857 HA2 GLY 3 HA2 GLY 3 2.942 -3.226 28.418 858 HA3 GLY 3 HA1 GLY 3 1.437 -4.014 28.876 859 H GLN 4 HN GLN 4 1.159 -5.806 26.771 860 HA GLN 4 HA GLN 4 3.589 -7.453 26.882 861 HB2 GLN 4 HB2 GLN 4 1.994 -8.155 28.679 862 HB3 GLN 4 HB1 GLN 4 0.799 -8.489 27.435 863 HG2 GLN 4 HG2 GLN 4 2.279 -10.184 26.475 864 HG3 GLN 4 HG1 GLN 4 3.463 -9.857 27.740 865 HE21 GLN 4 HE21 GLN 4 3.019 -10.480 29.857 866 HE22 GLN 4 HE22 GLN 4 1.808 -11.664 30.224 867 H SER 5 HN SER 5 4.029 -8.520 25.002 868 HA SER 5 HA SER 5 3.943 -9.055 22.786 869 HB2 SER 5 HB2 SER 5 0.957 -9.266 23.242 870 HB3 SER 5 HB1 SER 5 1.897 -10.069 21.982 871 HG SER 5 HG SER 5 2.976 -11.238 23.620 872 H ASP 6 HN ASP 6 3.903 -6.298 23.430 873 HA ASP 6 HA ASP 6 1.839 -4.971 21.908 874 HB2 ASP 6 HB2 ASP 6 2.847 -2.915 22.721 875 HB3 ASP 6 HB1 ASP 6 2.687 -4.061 24.049 876 H ARG 7 HN ARG 7 4.885 -6.241 21.159 877 HA ARG 7 HA ARG 7 5.970 -4.252 19.500 878 HB2 ARG 7 HB2 ARG 7 6.335 -7.248 19.416 879 HB3 ARG 7 HB1 ARG 7 7.248 -6.132 18.416 880 HG2 ARG 7 HG2 ARG 7 8.658 -6.621 20.207 881 HG3 ARG 7 HG1 ARG 7 7.990 -5.034 20.590 882 HD2 ARG 7 HD2 ARG 7 8.045 -6.562 22.533 883 HD3 ARG 7 HD1 ARG 7 6.418 -6.013 22.128 884 HE ARG 7 HE ARG 7 6.770 -8.399 20.777 885 HH11 ARG 7 HH11 ARG 7 6.842 -7.362 24.119 886 HH12 ARG 7 HH12 ARG 7 6.265 -8.881 24.740 887 HH21 ARG 7 HH21 ARG 7 6.010 -10.385 21.559 888 HH22 ARG 7 HH22 ARG 7 5.772 -10.611 23.269 889 H LYS 8 HN LYS 8 3.435 -6.529 18.949 890 HA LYS 8 HA LYS 8 3.420 -6.709 16.166 891 HB2 LYS 8 HB2 LYS 8 2.013 -8.031 17.757 892 HB3 LYS 8 HB1 LYS 8 1.016 -6.606 17.995 893 HG2 LYS 8 HG2 LYS 8 -0.100 -8.026 16.454 894 HG3 LYS 8 HG1 LYS 8 0.516 -6.639 15.550 895 HD2 LYS 8 HD2 LYS 8 2.364 -7.939 14.722 896 HD3 LYS 8 HD1 LYS 8 1.911 -9.306 15.742 897 HE2 LYS 8 HE2 LYS 8 0.234 -8.158 13.511 898 HE3 LYS 8 HE1 LYS 8 1.229 -9.608 13.394 899 HZ1 LYS 8 HZ1 LYS 8 -0.130 -10.599 15.165 900 HZ2 LYS 8 HZ2 LYS 8 -1.050 -10.208 13.796 901 HZ3 LYS 8 HZ3 LYS 8 -1.124 -9.223 15.176 902 H ALA 9 HN ALA 9 1.803 -4.370 18.301 903 HA ALA 9 HA ALA 9 0.484 -2.922 16.290 904 HB1 ALA 9 HB1 ALA 9 -0.139 -2.786 18.644 905 HB2 ALA 9 HB2 ALA 9 0.190 -1.185 17.982 906 HB3 ALA 9 HB3 ALA 9 1.386 -1.978 19.007 907 H ALA 10 HN ALA 10 3.693 -2.590 17.695 908 HA ALA 10 HA ALA 10 4.334 -0.096 16.527 909 HB1 ALA 10 HB1 ALA 10 6.635 -0.618 17.099 910 HB2 ALA 10 HB2 ALA 10 6.205 -2.305 17.377 911 HB3 ALA 10 HB3 ALA 10 5.565 -1.045 18.432 912 H LEU 11 HN LEU 11 4.507 -3.404 15.403 913 HA LEU 11 HA LEU 11 6.120 -2.850 13.111 914 HB2 LEU 11 HB2 LEU 11 5.960 -5.094 14.115 915 HB3 LEU 11 HB1 LEU 11 4.266 -5.165 13.676 916 HG LEU 11 HG LEU 11 4.879 -5.120 11.293 917 HD11 LEU 11 HD11 LEU 11 7.709 -5.178 12.335 918 HD12 LEU 11 HD12 LEU 11 6.950 -3.869 11.427 919 HD13 LEU 11 HD13 LEU 11 7.236 -5.427 10.654 920 HD21 LEU 11 HD21 LEU 11 6.313 -7.254 12.869 921 HD22 LEU 11 HD22 LEU 11 5.811 -7.367 11.182 922 HD23 LEU 11 HD23 LEU 11 4.599 -7.255 12.460 923 H LEU 12 HN LEU 12 2.650 -3.259 13.697 924 HA LEU 12 HA LEU 12 1.788 -2.931 11.045 925 HB2 LEU 12 HB2 LEU 12 0.345 -2.205 13.597 926 HB3 LEU 12 HB1 LEU 12 -0.402 -2.351 12.019 927 HG LEU 12 HG LEU 12 0.865 -4.599 13.591 928 HD11 LEU 12 HD11 LEU 12 -2.015 -4.012 12.926 929 HD12 LEU 12 HD12 LEU 12 -1.264 -3.867 14.516 930 HD13 LEU 12 HD13 LEU 12 -1.418 -5.451 13.753 931 HD21 LEU 12 HD21 LEU 12 1.167 -4.898 11.176 932 HD22 LEU 12 HD22 LEU 12 -0.563 -4.656 10.929 933 HD23 LEU 12 HD23 LEU 12 0.012 -6.061 11.828 934 H ASP 13 HN ASP 13 2.540 -0.613 13.569 935 HA ASP 13 HA ASP 13 1.598 1.715 12.293 936 HB2 ASP 13 HB2 ASP 13 2.153 1.725 14.652 937 HB3 ASP 13 HB1 ASP 13 3.829 1.318 14.298 938 H GLN 14 HN GLN 14 4.731 0.073 12.192 939 HA GLN 14 HA GLN 14 6.024 2.016 10.562 940 HB2 GLN 14 HB2 GLN 14 7.154 0.274 12.000 941 HB3 GLN 14 HB1 GLN 14 6.697 -0.922 10.796 942 HG2 GLN 14 HG2 GLN 14 8.982 -0.265 10.466 943 HG3 GLN 14 HG1 GLN 14 8.004 0.293 9.112 944 HE21 GLN 14 HE21 GLN 14 7.978 1.869 12.233 945 HE22 GLN 14 HE22 GLN 14 8.798 3.306 11.727 946 H VAL 15 HN VAL 15 4.313 -1.014 9.874 947 HA VAL 15 HA VAL 15 4.693 -0.986 7.080 948 HB VAL 15 HB VAL 15 2.292 -2.098 8.557 949 HG11 VAL 15 HG11 VAL 15 2.100 -3.600 6.636 950 HG12 VAL 15 HG12 VAL 15 3.472 -2.800 5.870 951 HG13 VAL 15 HG13 VAL 15 1.974 -1.911 6.142 952 HG21 VAL 15 HG21 VAL 15 4.359 -2.999 9.485 953 HG22 VAL 15 HG22 VAL 15 4.912 -3.432 7.868 954 HG23 VAL 15 HG23 VAL 15 3.503 -4.234 8.561 955 H ALA 16 HN ALA 16 2.354 0.576 9.191 956 HA ALA 16 HA ALA 16 0.604 1.595 7.253 957 HB1 ALA 16 HB1 ALA 16 1.368 2.824 9.900 958 HB2 ALA 16 HB2 ALA 16 0.098 1.626 9.642 959 HB3 ALA 16 HB3 ALA 16 -0.051 3.237 8.936 960 H ARG 17 HN ARG 17 3.699 2.743 8.426 961 HA ARG 17 HA ARG 17 3.780 5.247 7.183 962 HB2 ARG 17 HB2 ARG 17 5.473 4.357 8.792 963 HB3 ARG 17 HB1 ARG 17 6.071 3.295 7.525 964 HG2 ARG 17 HG2 ARG 17 7.553 5.099 7.548 965 HG3 ARG 17 HG1 ARG 17 6.488 5.417 6.177 966 HD2 ARG 17 HD2 ARG 17 6.086 6.574 8.925 967 HD3 ARG 17 HD1 ARG 17 6.963 7.398 7.637 968 HE ARG 17 HE ARG 17 4.793 7.222 6.353 969 HH11 ARG 17 HH11 ARG 17 4.891 7.316 9.845 970 HH12 ARG 17 HH12 ARG 17 3.324 8.052 10.003 971 HH21 ARG 17 HH21 ARG 17 2.738 8.202 6.545 972 HH22 ARG 17 HH22 ARG 17 2.101 8.555 8.121 973 H VAL 18 HN VAL 18 4.901 2.084 6.033 974 HA VAL 18 HA VAL 18 5.600 2.891 3.425 975 HB VAL 18 HB VAL 18 4.641 0.143 4.247 976 HG11 VAL 18 HG11 VAL 18 6.488 1.018 2.026 977 HG12 VAL 18 HG12 VAL 18 4.821 0.474 1.830 978 HG13 VAL 18 HG13 VAL 18 6.052 -0.644 2.417 979 HG21 VAL 18 HG21 VAL 18 6.406 0.930 5.755 980 HG22 VAL 18 HG22 VAL 18 7.435 1.279 4.366 981 HG23 VAL 18 HG23 VAL 18 6.972 -0.385 4.727 982 H GLY 19 HN GLY 19 2.604 1.475 4.704 983 HA2 GLY 19 HA2 GLY 19 1.265 1.144 2.265 984 HA3 GLY 19 HA1 GLY 19 0.498 1.278 3.837 985 H LYS 20 HN LYS 20 1.064 3.857 4.582 986 HA LYS 20 HA LYS 20 -0.809 5.323 3.096 987 HB2 LYS 20 HB2 LYS 20 1.242 6.175 5.120 988 HB3 LYS 20 HB1 LYS 20 0.194 7.336 4.322 989 HG2 LYS 20 HG2 LYS 20 -1.717 5.784 5.143 990 HG3 LYS 20 HG1 LYS 20 -0.499 5.191 6.274 991 HD2 LYS 20 HD2 LYS 20 -1.835 7.000 7.254 992 HD3 LYS 20 HD1 LYS 20 -0.139 7.464 7.093 993 HE2 LYS 20 HE2 LYS 20 -0.638 8.729 5.093 994 HE3 LYS 20 HE1 LYS 20 -2.312 8.184 5.131 995 HZ1 LYS 20 HZ1 LYS 20 -1.973 10.454 5.990 996 HZ2 LYS 20 HZ2 LYS 20 -1.045 9.818 7.264 997 HZ3 LYS 20 HZ3 LYS 20 -2.685 9.408 7.123 998 H ALA 21 HN ALA 21 2.698 5.150 2.859 999 HA ALA 21 HA ALA 21 2.971 7.306 1.025 1000 HB1 ALA 21 HB1 ALA 21 5.186 6.423 0.585 1001 HB2 ALA 21 HB2 ALA 21 4.758 4.901 1.366 1002 HB3 ALA 21 HB3 ALA 21 4.852 6.384 2.317 1003 H LEU 22 HN LEU 22 2.138 3.933 0.696 1004 HA LEU 22 HA LEU 22 2.417 3.833 -2.154 1005 HB2 LEU 22 HB2 LEU 22 0.968 2.037 -0.209 1006 HB3 LEU 22 HB1 LEU 22 1.098 1.709 -1.925 1007 HG LEU 22 HG LEU 22 3.456 1.939 -0.051 1008 HD11 LEU 22 HD11 LEU 22 2.070 -0.004 0.480 1009 HD12 LEU 22 HD12 LEU 22 3.605 -0.486 -0.246 1010 HD13 LEU 22 HD13 LEU 22 2.126 -0.508 -1.211 1011 HD21 LEU 22 HD21 LEU 22 4.692 0.950 -1.924 1012 HD22 LEU 22 HD22 LEU 22 3.991 2.508 -2.357 1013 HD23 LEU 22 HD23 LEU 22 3.234 1.015 -2.916 1014 H ALA 23 HN ALA 23 -0.014 4.933 0.019 1015 HA ALA 23 HA ALA 23 -2.204 4.688 -1.811 1016 HB1 ALA 23 HB1 ALA 23 -3.488 5.921 -0.185 1017 HB2 ALA 23 HB2 ALA 23 -2.017 6.402 0.662 1018 HB3 ALA 23 HB3 ALA 23 -2.507 4.707 0.638 1019 H ASN 24 HN ASN 24 -1.366 5.661 -3.687 1020 HA ASN 24 HA ASN 24 -2.003 8.461 -3.862 1021 HB2 ASN 24 HB2 ASN 24 0.126 9.212 -4.739 1022 HB3 ASN 24 HB1 ASN 24 0.388 8.502 -3.151 1023 HD21 ASN 24 HD21 ASN 24 1.478 6.539 -2.985 1024 HD22 ASN 24 HD22 ASN 24 2.412 5.902 -4.291 1025 H GLY 25 HN GLY 25 -2.267 9.143 -6.071 1026 HA2 GLY 25 HA2 GLY 25 -2.801 6.818 -7.791 1027 HA3 GLY 25 HA1 GLY 25 -3.593 8.379 -7.912 1028 H ARG 26 HN ARG 26 -2.270 10.194 -8.695 1029 HA ARG 26 HA ARG 26 -0.914 9.342 -11.074 1030 HB2 ARG 26 HB2 ARG 26 -1.584 12.048 -9.939 1031 HB3 ARG 26 HB1 ARG 26 -0.662 11.854 -11.425 1032 HG2 ARG 26 HG2 ARG 26 -2.505 10.656 -12.447 1033 HG3 ARG 26 HG1 ARG 26 -3.429 10.766 -10.948 1034 HD2 ARG 26 HD2 ARG 26 -2.442 13.161 -12.485 1035 HD3 ARG 26 HD1 ARG 26 -4.037 12.448 -12.712 1036 HE ARG 26 HE ARG 26 -4.045 12.885 -10.080 1037 HH11 ARG 26 HH11 ARG 26 -3.044 14.943 -12.727 1038 HH12 ARG 26 HH12 ARG 26 -3.538 16.416 -11.954 1039 HH21 ARG 26 HH21 ARG 26 -4.708 14.822 -9.043 1040 HH22 ARG 26 HH22 ARG 26 -4.452 16.352 -9.840 1041 H ARG 27 HN ARG 27 0.081 10.040 -7.920 1042 HA ARG 27 HA ARG 27 2.716 10.960 -8.468 1043 HB2 ARG 27 HB2 ARG 27 1.693 11.274 -6.281 1044 HB3 ARG 27 HB1 ARG 27 1.576 9.536 -6.054 1045 HG2 ARG 27 HG2 ARG 27 4.040 9.397 -6.074 1046 HG3 ARG 27 HG1 ARG 27 4.110 11.156 -6.215 1047 HD2 ARG 27 HD2 ARG 27 2.795 9.653 -3.958 1048 HD3 ARG 27 HD1 ARG 27 4.413 10.348 -3.897 1049 HE ARG 27 HE ARG 27 3.231 12.546 -4.349 1050 HH11 ARG 27 HH11 ARG 27 1.697 9.899 -2.633 1051 HH12 ARG 27 HH12 ARG 27 0.630 10.930 -1.728 1052 HH21 ARG 27 HH21 ARG 27 1.830 13.899 -3.176 1053 HH22 ARG 27 HH22 ARG 27 0.719 13.216 -2.020 1054 H LEU 28 HN LEU 28 1.186 7.917 -8.756 1055 HA LEU 28 HA LEU 28 3.405 6.221 -8.327 1056 HB2 LEU 28 HB2 LEU 28 0.863 5.844 -9.892 1057 HB3 LEU 28 HB1 LEU 28 2.074 4.587 -9.736 1058 HG LEU 28 HG LEU 28 0.582 5.851 -7.433 1059 HD11 LEU 28 HD11 LEU 28 0.288 3.137 -8.712 1060 HD12 LEU 28 HD12 LEU 28 -0.862 4.467 -8.839 1061 HD13 LEU 28 HD13 LEU 28 -0.564 3.704 -7.277 1062 HD21 LEU 28 HD21 LEU 28 2.470 3.499 -7.512 1063 HD22 LEU 28 HD22 LEU 28 1.597 4.089 -6.097 1064 HD23 LEU 28 HD23 LEU 28 2.839 5.090 -6.848 1065 H GLN 29 HN GLN 29 2.712 8.383 -10.862 1066 HA GLN 29 HA GLN 29 4.004 7.159 -13.029 1067 HB2 GLN 29 HB2 GLN 29 3.895 10.082 -12.252 1068 HB3 GLN 29 HB1 GLN 29 4.506 9.492 -13.789 1069 HG2 GLN 29 HG2 GLN 29 2.299 8.549 -14.293 1070 HG3 GLN 29 HG1 GLN 29 1.694 9.185 -12.761 1071 HE21 GLN 29 HE21 GLN 29 0.187 10.502 -13.763 1072 HE22 GLN 29 HE22 GLN 29 0.629 11.930 -14.632 1073 H ILE 30 HN ILE 30 5.214 8.763 -10.180 1074 HA ILE 30 HA ILE 30 7.924 8.977 -10.976 1075 HB ILE 30 HB ILE 30 6.759 8.747 -8.192 1076 HG12 ILE 30 HG12 ILE 30 7.555 11.189 -9.796 1077 HG13 ILE 30 HG11 ILE 30 5.901 10.667 -9.496 1078 HG21 ILE 30 HG21 ILE 30 9.130 8.201 -8.213 1079 HG22 ILE 30 HG22 ILE 30 8.865 9.767 -7.445 1080 HG23 ILE 30 HG23 ILE 30 9.480 9.688 -9.096 1081 HD11 ILE 30 HD11 ILE 30 6.259 11.000 -7.088 1082 HD12 ILE 30 HD12 ILE 30 6.486 12.479 -8.022 1083 HD13 ILE 30 HD13 ILE 30 7.888 11.586 -7.432 1084 H LEU 31 HN LEU 31 6.154 6.536 -9.084 1085 HA LEU 31 HA LEU 31 8.411 4.868 -8.679 1086 HB2 LEU 31 HB2 LEU 31 5.458 4.283 -8.508 1087 HB3 LEU 31 HB1 LEU 31 6.711 3.156 -8.023 1088 HG LEU 31 HG LEU 31 6.196 5.863 -6.780 1089 HD11 LEU 31 HD11 LEU 31 5.520 4.565 -4.818 1090 HD12 LEU 31 HD12 LEU 31 5.742 3.073 -5.730 1091 HD13 LEU 31 HD13 LEU 31 4.492 4.220 -6.208 1092 HD21 LEU 31 HD21 LEU 31 8.188 3.720 -6.041 1093 HD22 LEU 31 HD22 LEU 31 7.875 5.199 -5.131 1094 HD23 LEU 31 HD23 LEU 31 8.569 5.290 -6.750 1095 H ASP 32 HN ASP 32 5.916 5.026 -11.147 1096 HA ASP 32 HA ASP 32 6.531 2.661 -12.535 1097 HB2 ASP 32 HB2 ASP 32 4.531 4.007 -13.011 1098 HB3 ASP 32 HB1 ASP 32 5.540 5.314 -13.616 1099 H LEU 33 HN LEU 33 7.689 5.977 -13.009 1100 HA LEU 33 HA LEU 33 9.517 5.428 -15.064 1101 HB2 LEU 33 HB2 LEU 33 8.648 7.676 -14.395 1102 HB3 LEU 33 HB1 LEU 33 9.684 7.608 -12.981 1103 HG LEU 33 HG LEU 33 11.655 7.473 -14.511 1104 HD11 LEU 33 HD11 LEU 33 10.492 6.587 -16.469 1105 HD12 LEU 33 HD12 LEU 33 11.360 8.073 -16.848 1106 HD13 LEU 33 HD13 LEU 33 9.610 8.107 -16.634 1107 HD21 LEU 33 HD21 LEU 33 9.887 9.889 -14.859 1108 HD22 LEU 33 HD22 LEU 33 11.635 9.836 -15.080 1109 HD23 LEU 33 HD23 LEU 33 10.941 9.578 -13.481 1110 H LEU 34 HN LEU 34 9.838 5.385 -11.555 1111 HA LEU 34 HA LEU 34 12.675 5.033 -11.578 1112 HB2 LEU 34 HB2 LEU 34 10.550 5.158 -9.541 1113 HB3 LEU 34 HB1 LEU 34 11.957 4.205 -9.109 1114 HG LEU 34 HG LEU 34 12.221 6.458 -8.279 1115 HD11 LEU 34 HD11 LEU 34 13.986 5.949 -10.666 1116 HD12 LEU 34 HD12 LEU 34 14.217 5.293 -9.046 1117 HD13 LEU 34 HD13 LEU 34 14.352 7.031 -9.322 1118 HD21 LEU 34 HD21 LEU 34 12.340 8.383 -9.766 1119 HD22 LEU 34 HD22 LEU 34 10.757 7.610 -9.874 1120 HD23 LEU 34 HD23 LEU 34 11.952 7.356 -11.147 1121 H ALA 35 HN ALA 35 9.960 2.887 -11.736 1122 HA ALA 35 HA ALA 35 11.348 0.521 -10.957 1123 HB1 ALA 35 HB1 ALA 35 8.877 0.818 -12.668 1124 HB2 ALA 35 HB2 ALA 35 8.906 0.663 -10.909 1125 HB3 ALA 35 HB3 ALA 35 9.451 -0.674 -11.923 1126 H GLN 36 HN GLN 36 11.223 2.424 -13.810 1127 HA GLN 36 HA GLN 36 12.235 0.309 -15.523 1128 HB2 GLN 36 HB2 GLN 36 11.942 3.238 -16.184 1129 HB3 GLN 36 HB1 GLN 36 12.106 1.901 -17.312 1130 HG2 GLN 36 HG2 GLN 36 9.914 1.049 -16.562 1131 HG3 GLN 36 HG1 GLN 36 9.748 2.471 -15.531 1132 HE21 GLN 36 HE21 GLN 36 7.974 3.312 -16.569 1133 HE22 GLN 36 HE22 GLN 36 8.046 3.944 -18.183 1134 H GLY 37 HN GLY 37 13.496 2.596 -13.374 1135 HA2 GLY 37 HA2 GLY 37 16.077 1.879 -13.382 1136 HA3 GLY 37 HA1 GLY 37 16.018 2.962 -14.763 1137 H GLU 38 HN GLU 38 17.656 3.512 -12.632 1138 HA GLU 38 HA GLU 38 16.332 5.344 -10.828 1139 HB2 GLU 38 HB2 GLU 38 18.609 5.787 -9.956 1140 HB3 GLU 38 HB1 GLU 38 18.193 4.082 -9.946 1141 HG2 GLU 38 HG2 GLU 38 19.779 5.281 -12.185 1142 HG3 GLU 38 HG1 GLU 38 20.547 4.769 -10.685 1143 H ARG 39 HN ARG 39 16.407 7.547 -10.859 1144 HA ARG 39 HA ARG 39 17.813 8.864 -13.055 1145 HB2 ARG 39 HB2 ARG 39 14.829 8.904 -12.664 1146 HB3 ARG 39 HB1 ARG 39 15.663 10.207 -13.492 1147 HG2 ARG 39 HG2 ARG 39 16.541 8.558 -15.114 1148 HG3 ARG 39 HG1 ARG 39 15.574 7.314 -14.315 1149 HD2 ARG 39 HD2 ARG 39 13.541 8.459 -14.862 1150 HD3 ARG 39 HD1 ARG 39 14.435 9.849 -15.479 1151 HE ARG 39 HE ARG 39 14.999 7.353 -16.829 1152 HH11 ARG 39 HH11 ARG 39 12.985 10.205 -16.728 1153 HH12 ARG 39 HH12 ARG 39 12.540 10.127 -18.404 1154 HH21 ARG 39 HH21 ARG 39 14.429 7.241 -19.060 1155 HH22 ARG 39 HH22 ARG 39 13.362 8.433 -19.726 1156 H ALA 40 HN ALA 40 17.959 11.167 -12.842 1157 HA ALA 40 HA ALA 40 18.153 12.020 -10.098 1158 HB1 ALA 40 HB1 ALA 40 19.080 14.074 -11.007 1159 HB2 ALA 40 HB2 ALA 40 18.603 13.590 -12.634 1160 HB3 ALA 40 HB3 ALA 40 19.834 12.674 -11.769 1161 H VAL 41 HN VAL 41 17.173 13.993 -9.302 1162 HA VAL 41 HA VAL 41 14.432 14.008 -9.319 1163 HB VAL 41 HB VAL 41 16.144 16.454 -8.855 1164 HG11 VAL 41 HG11 VAL 41 13.783 16.973 -8.993 1165 HG12 VAL 41 HG12 VAL 41 14.341 17.122 -7.326 1166 HG13 VAL 41 HG13 VAL 41 13.412 15.707 -7.822 1167 HG21 VAL 41 HG21 VAL 41 16.202 15.763 -6.504 1168 HG22 VAL 41 HG22 VAL 41 16.990 14.584 -7.552 1169 HG23 VAL 41 HG23 VAL 41 15.371 14.266 -6.931 1170 H GLU 42 HN GLU 42 16.578 15.964 -11.355 1171 HA GLU 42 HA GLU 42 14.609 17.629 -12.457 1172 HB2 GLU 42 HB2 GLU 42 17.026 18.091 -12.591 1173 HB3 GLU 42 HB1 GLU 42 17.219 16.737 -13.699 1174 HG2 GLU 42 HG2 GLU 42 15.722 17.871 -15.292 1175 HG3 GLU 42 HG1 GLU 42 15.626 19.241 -14.192 1176 H ALA 43 HN ALA 43 15.810 14.466 -13.464 1177 HA ALA 43 HA ALA 43 14.409 14.426 -15.944 1178 HB1 ALA 43 HB1 ALA 43 15.020 12.079 -16.041 1179 HB2 ALA 43 HB2 ALA 43 15.478 12.110 -14.338 1180 HB3 ALA 43 HB3 ALA 43 16.399 13.046 -15.516 1181 H ILE 44 HN ILE 44 13.711 13.332 -12.687 1182 HA ILE 44 HA ILE 44 11.345 11.889 -13.298 1183 HB ILE 44 HB ILE 44 12.147 13.190 -10.690 1184 HG12 ILE 44 HG12 ILE 44 12.558 10.337 -11.608 1185 HG13 ILE 44 HG11 ILE 44 13.812 11.573 -11.621 1186 HG21 ILE 44 HG21 ILE 44 9.777 12.629 -10.758 1187 HG22 ILE 44 HG22 ILE 44 10.641 11.561 -9.653 1188 HG23 ILE 44 HG23 ILE 44 10.169 10.981 -11.250 1189 HD11 ILE 44 HD11 ILE 44 13.602 11.786 -9.188 1190 HD12 ILE 44 HD12 ILE 44 14.043 10.152 -9.683 1191 HD13 ILE 44 HD13 ILE 44 12.386 10.508 -9.195 1192 H ALA 45 HN ALA 45 11.934 15.196 -12.140 1193 HA ALA 45 HA ALA 45 9.226 15.919 -11.847 1194 HB1 ALA 45 HB1 ALA 45 10.023 18.199 -11.699 1195 HB2 ALA 45 HB2 ALA 45 11.584 17.719 -12.367 1196 HB3 ALA 45 HB3 ALA 45 11.082 17.124 -10.784 1197 H THR 46 HN THR 46 11.513 16.471 -14.515 1198 HA THR 46 HA THR 46 9.756 17.981 -16.102 1199 HB THR 46 HB THR 46 12.058 16.257 -17.038 1200 HG1 THR 46 HG1 THR 46 13.079 17.645 -15.766 1201 HG21 THR 46 HG21 THR 46 10.591 17.039 -18.853 1202 HG22 THR 46 HG22 THR 46 12.177 17.807 -18.917 1203 HG23 THR 46 HG23 THR 46 10.789 18.698 -18.288 1204 H ALA 47 HN ALA 47 10.416 14.492 -16.008 1205 HA ALA 47 HA ALA 47 8.906 13.796 -18.279 1206 HB1 ALA 47 HB1 ALA 47 9.534 12.114 -15.855 1207 HB2 ALA 47 HB2 ALA 47 10.558 12.305 -17.278 1208 HB3 ALA 47 HB3 ALA 47 8.987 11.517 -17.423 1209 H THR 48 HN THR 48 7.997 14.239 -14.911 1210 HA THR 48 HA THR 48 5.320 13.233 -15.371 1211 HB THR 48 HB THR 48 4.987 13.997 -12.953 1212 HG1 THR 48 HG1 THR 48 7.815 14.044 -12.831 1213 HG21 THR 48 HG21 THR 48 6.202 12.076 -12.051 1214 HG22 THR 48 HG22 THR 48 7.151 11.969 -13.533 1215 HG23 THR 48 HG23 THR 48 5.416 11.662 -13.574 1216 H GLY 49 HN GLY 49 6.944 16.211 -15.627 1217 HA2 GLY 49 HA2 GLY 49 6.074 18.191 -16.489 1218 HA3 GLY 49 HA1 GLY 49 4.454 17.543 -16.276 1219 H MET 50 HN MET 50 6.784 17.577 -13.669 1220 HA MET 50 HA MET 50 5.215 19.722 -12.386 1221 HB2 MET 50 HB2 MET 50 6.473 17.273 -11.146 1222 HB3 MET 50 HB1 MET 50 5.879 18.635 -10.206 1223 HG2 MET 50 HG2 MET 50 3.636 18.276 -11.123 1224 HG3 MET 50 HG1 MET 50 4.239 16.894 -12.033 1225 HE1 MET 50 HE1 MET 50 5.178 14.363 -9.226 1226 HE2 MET 50 HE2 MET 50 6.239 15.513 -10.040 1227 HE3 MET 50 HE3 MET 50 5.023 14.629 -10.962 1228 H ASN 51 HN ASN 51 6.494 20.772 -10.533 1229 HA ASN 51 HA ASN 51 8.967 21.749 -11.636 1230 HB2 ASN 51 HB2 ASN 51 7.431 22.393 -9.122 1231 HB3 ASN 51 HB1 ASN 51 9.019 23.080 -9.444 1232 HD21 ASN 51 HD21 ASN 51 9.268 24.501 -11.187 1233 HD22 ASN 51 HD22 ASN 51 7.913 25.342 -11.868 1234 H LEU 52 HN LEU 52 10.970 21.850 -10.425 1235 HA LEU 52 HA LEU 52 11.817 19.281 -9.629 1236 HB2 LEU 52 HB2 LEU 52 13.163 21.951 -9.201 1237 HB3 LEU 52 HB1 LEU 52 13.936 20.386 -9.021 1238 HG LEU 52 HG LEU 52 12.876 21.584 -11.581 1239 HD11 LEU 52 HD11 LEU 52 15.666 20.948 -10.643 1240 HD12 LEU 52 HD12 LEU 52 14.978 22.553 -10.887 1241 HD13 LEU 52 HD13 LEU 52 15.238 21.484 -12.267 1242 HD21 LEU 52 HD21 LEU 52 13.764 19.594 -12.678 1243 HD22 LEU 52 HD22 LEU 52 12.484 19.181 -11.537 1244 HD23 LEU 52 HD23 LEU 52 14.172 18.906 -11.106 1245 H THR 53 HN THR 53 10.963 22.171 -7.781 1246 HA THR 53 HA THR 53 11.661 21.119 -5.242 1247 HB THR 53 HB THR 53 9.624 23.264 -5.892 1248 HG1 THR 53 HG1 THR 53 11.552 23.959 -6.705 1249 HG21 THR 53 HG21 THR 53 11.158 22.682 -3.355 1250 HG22 THR 53 HG22 THR 53 9.425 22.454 -3.598 1251 HG23 THR 53 HG23 THR 53 10.113 24.077 -3.623 1252 H THR 54 HN THR 54 8.738 20.982 -7.200 1253 HA THR 54 HA THR 54 7.060 19.849 -5.212 1254 HB THR 54 HB THR 54 6.785 19.456 -8.191 1255 HG1 THR 54 HG1 THR 54 6.359 21.730 -6.562 1256 HG21 THR 54 HG21 THR 54 5.239 18.177 -6.773 1257 HG22 THR 54 HG22 THR 54 4.388 19.430 -7.680 1258 HG23 THR 54 HG23 THR 54 4.746 19.670 -5.970 1259 H ALA 55 HN ALA 55 9.051 18.486 -7.811 1260 HA ALA 55 HA ALA 55 8.352 15.797 -7.437 1261 HB1 ALA 55 HB1 ALA 55 9.521 16.649 -9.422 1262 HB2 ALA 55 HB2 ALA 55 10.339 15.259 -8.706 1263 HB3 ALA 55 HB3 ALA 55 10.974 16.886 -8.447 1264 H SER 56 HN SER 56 11.076 17.665 -6.115 1265 HA SER 56 HA SER 56 12.278 15.526 -4.752 1266 HB2 SER 56 HB2 SER 56 13.348 17.414 -3.378 1267 HB3 SER 56 HB1 SER 56 13.634 17.416 -5.118 1268 HG SER 56 HG SER 56 12.357 19.130 -5.355 1269 H ALA 57 HN ALA 57 9.772 17.807 -3.752 1270 HA ALA 57 HA ALA 57 9.700 17.051 -1.029 1271 HB1 ALA 57 HB1 ALA 57 7.482 18.171 -2.740 1272 HB2 ALA 57 HB2 ALA 57 8.681 19.115 -1.855 1273 HB3 ALA 57 HB3 ALA 57 7.511 18.129 -0.978 1274 H ASN 58 HN ASN 58 7.969 15.886 -3.882 1275 HA ASN 58 HA ASN 58 6.383 13.986 -2.474 1276 HB2 ASN 58 HB2 ASN 58 7.053 14.426 -5.368 1277 HB3 ASN 58 HB1 ASN 58 6.225 12.954 -4.871 1278 HD21 ASN 58 HD21 ASN 58 5.997 16.433 -5.103 1279 HD22 ASN 58 HD22 ASN 58 4.280 16.518 -4.908 1280 H LEU 59 HN LEU 59 9.503 13.876 -4.088 1281 HA LEU 59 HA LEU 59 9.945 11.102 -3.854 1282 HB2 LEU 59 HB2 LEU 59 11.882 13.412 -3.964 1283 HB3 LEU 59 HB1 LEU 59 12.370 11.729 -4.029 1284 HG LEU 59 HG LEU 59 10.540 13.030 -6.046 1285 HD11 LEU 59 HD11 LEU 59 13.490 12.435 -6.218 1286 HD12 LEU 59 HD12 LEU 59 12.756 14.036 -6.136 1287 HD13 LEU 59 HD13 LEU 59 12.474 13.008 -7.540 1288 HD21 LEU 59 HD21 LEU 59 11.988 10.382 -6.048 1289 HD22 LEU 59 HD22 LEU 59 11.008 11.026 -7.367 1290 HD23 LEU 59 HD23 LEU 59 10.253 10.613 -5.827 1291 H GLN 60 HN GLN 60 10.603 13.812 -1.695 1292 HA GLN 60 HA GLN 60 11.997 12.425 0.302 1293 HB2 GLN 60 HB2 GLN 60 11.797 14.901 0.168 1294 HB3 GLN 60 HB1 GLN 60 10.113 14.767 0.654 1295 HG2 GLN 60 HG2 GLN 60 11.457 15.396 2.544 1296 HG3 GLN 60 HG1 GLN 60 10.831 13.764 2.783 1297 HE21 GLN 60 HE21 GLN 60 13.650 15.695 2.153 1298 HE22 GLN 60 HE22 GLN 60 14.820 14.453 2.470 1299 H ALA 61 HN ALA 61 8.537 12.929 -0.211 1300 HA ALA 61 HA ALA 61 7.623 11.693 2.150 1301 HB1 ALA 61 HB1 ALA 61 6.186 13.108 0.772 1302 HB2 ALA 61 HB2 ALA 61 5.464 11.516 1.008 1303 HB3 ALA 61 HB3 ALA 61 6.241 11.915 -0.526 1304 H LEU 62 HN LEU 62 8.110 10.399 -1.134 1305 HA LEU 62 HA LEU 62 7.309 7.756 -0.522 1306 HB2 LEU 62 HB2 LEU 62 9.151 8.778 -2.686 1307 HB3 LEU 62 HB1 LEU 62 8.511 7.148 -2.613 1308 HG LEU 62 HG LEU 62 6.856 9.656 -2.911 1309 HD11 LEU 62 HD11 LEU 62 7.580 7.520 -4.910 1310 HD12 LEU 62 HD12 LEU 62 8.156 9.186 -4.906 1311 HD13 LEU 62 HD13 LEU 62 6.450 8.845 -5.185 1312 HD21 LEU 62 HD21 LEU 62 4.997 8.130 -3.320 1313 HD22 LEU 62 HD22 LEU 62 5.677 7.875 -1.712 1314 HD23 LEU 62 HD23 LEU 62 6.051 6.749 -3.017 1315 H LYS 63 HN LYS 63 10.389 9.428 -0.321 1316 HA LYS 63 HA LYS 63 11.955 7.133 0.262 1317 HB2 LYS 63 HB2 LYS 63 12.912 9.276 -0.531 1318 HB3 LYS 63 HB1 LYS 63 12.474 10.022 1.000 1319 HG2 LYS 63 HG2 LYS 63 13.976 8.537 2.185 1320 HG3 LYS 63 HG1 LYS 63 14.380 7.713 0.680 1321 HD2 LYS 63 HD2 LYS 63 15.330 9.787 -0.201 1322 HD3 LYS 63 HD1 LYS 63 14.911 10.618 1.299 1323 HE2 LYS 63 HE2 LYS 63 16.817 8.295 1.011 1324 HE3 LYS 63 HE1 LYS 63 17.261 9.978 1.293 1325 HZ1 LYS 63 HZ1 LYS 63 15.733 8.221 3.146 1326 HZ2 LYS 63 HZ2 LYS 63 16.026 9.869 3.406 1327 HZ3 LYS 63 HZ3 LYS 63 17.322 8.777 3.362 1328 H SER 64 HN SER 64 10.073 9.367 2.208 1329 HA SER 64 HA SER 64 10.970 8.407 4.734 1330 HB2 SER 64 HB2 SER 64 8.394 9.826 4.010 1331 HB3 SER 64 HB1 SER 64 9.035 9.626 5.642 1332 HG SER 64 HG SER 64 10.227 11.067 3.496 1333 H GLY 65 HN GLY 65 8.695 7.300 2.394 1334 HA2 GLY 65 HA2 GLY 65 7.362 5.492 4.236 1335 HA3 GLY 65 HA1 GLY 65 7.058 5.637 2.511 1336 H GLY 66 HN GLY 66 10.223 5.462 2.459 1337 HA2 GLY 66 HA2 GLY 66 11.816 3.752 2.523 1338 HA3 GLY 66 HA1 GLY 66 10.559 2.632 3.024 1339 H LEU 67 HN LEU 67 9.830 4.598 0.308 1340 HA LEU 67 HA LEU 67 9.779 2.246 -1.374 1341 HB2 LEU 67 HB2 LEU 67 8.871 5.085 -1.775 1342 HB3 LEU 67 HB1 LEU 67 8.904 3.939 -3.098 1343 HG LEU 67 HG LEU 67 6.675 4.021 -2.283 1344 HD11 LEU 67 HD11 LEU 67 7.474 1.809 -2.880 1345 HD12 LEU 67 HD12 LEU 67 6.294 1.720 -1.574 1346 HD13 LEU 67 HD13 LEU 67 8.012 1.543 -1.222 1347 HD21 LEU 67 HD21 LEU 67 7.097 4.993 -0.095 1348 HD22 LEU 67 HD22 LEU 67 7.790 3.468 0.463 1349 HD23 LEU 67 HD23 LEU 67 6.078 3.561 0.042 1350 H VAL 68 HN VAL 68 11.387 5.412 -1.432 1351 HA VAL 68 HA VAL 68 13.323 4.277 -3.331 1352 HB VAL 68 HB VAL 68 13.546 6.508 -4.381 1353 HG11 VAL 68 HG11 VAL 68 12.143 4.840 -5.443 1354 HG12 VAL 68 HG12 VAL 68 11.445 6.447 -5.658 1355 HG13 VAL 68 HG13 VAL 68 10.765 5.342 -4.461 1356 HG21 VAL 68 HG21 VAL 68 12.740 7.879 -2.529 1357 HG22 VAL 68 HG22 VAL 68 11.117 7.217 -2.737 1358 HG23 VAL 68 HG23 VAL 68 11.834 8.213 -4.006 1359 H GLU 69 HN GLU 69 15.428 5.131 -3.253 1360 HA GLU 69 HA GLU 69 16.104 6.536 -0.754 1361 HB2 GLU 69 HB2 GLU 69 17.263 4.200 -2.061 1362 HB3 GLU 69 HB1 GLU 69 18.464 5.444 -1.734 1363 HG2 GLU 69 HG2 GLU 69 16.603 4.221 0.292 1364 HG3 GLU 69 HG1 GLU 69 18.309 3.827 0.085 1365 H ALA 70 HN ALA 70 18.268 7.764 -1.017 1366 HA ALA 70 HA ALA 70 18.160 9.229 -3.578 1367 HB1 ALA 70 HB1 ALA 70 18.615 10.423 -0.846 1368 HB2 ALA 70 HB2 ALA 70 17.119 10.522 -1.772 1369 HB3 ALA 70 HB3 ALA 70 18.582 11.301 -2.375 1370 H ARG 71 HN ARG 71 19.959 9.029 -4.664 1371 HA ARG 71 HA ARG 71 22.510 8.733 -3.236 1372 HB2 ARG 71 HB2 ARG 71 21.650 8.042 -6.043 1373 HB3 ARG 71 HB1 ARG 71 23.342 8.098 -5.571 1374 HG2 ARG 71 HG2 ARG 71 21.265 6.347 -4.278 1375 HG3 ARG 71 HG1 ARG 71 22.383 5.826 -5.542 1376 HD2 ARG 71 HD2 ARG 71 24.269 6.457 -4.065 1377 HD3 ARG 71 HD1 ARG 71 23.107 6.846 -2.799 1378 HE ARG 71 HE ARG 71 22.600 4.547 -2.580 1379 HH11 ARG 71 HH11 ARG 71 25.186 5.191 -4.856 1380 HH12 ARG 71 HH12 ARG 71 25.759 3.548 -4.858 1381 HH21 ARG 71 HH21 ARG 71 23.389 2.395 -2.555 1382 HH22 ARG 71 HH22 ARG 71 24.774 1.982 -3.517 1383 H ARG 72 HN ARG 72 24.361 9.931 -4.115 1384 HA ARG 72 HA ARG 72 23.540 12.489 -5.318 1385 HB2 ARG 72 HB2 ARG 72 25.264 12.096 -2.868 1386 HB3 ARG 72 HB1 ARG 72 25.098 13.625 -3.719 1387 HG2 ARG 72 HG2 ARG 72 22.822 13.818 -3.138 1388 HG3 ARG 72 HG1 ARG 72 22.741 12.142 -2.597 1389 HD2 ARG 72 HD2 ARG 72 22.806 13.658 -0.702 1390 HD3 ARG 72 HD1 ARG 72 24.258 12.662 -0.756 1391 HE ARG 72 HE ARG 72 24.848 15.023 -2.095 1392 HH11 ARG 72 HH11 ARG 72 23.981 14.002 1.139 1393 HH12 ARG 72 HH12 ARG 72 24.806 15.322 1.912 1394 HH21 ARG 72 HH21 ARG 72 25.930 16.766 -1.076 1395 HH22 ARG 72 HH22 ARG 72 25.919 16.872 0.659 1396 H GLU 73 HN GLU 73 24.652 12.828 -7.109 1397 HA GLU 73 HA GLU 73 27.478 12.021 -7.189 1398 HB2 GLU 73 HB2 GLU 73 25.452 11.615 -9.398 1399 HB3 GLU 73 HB1 GLU 73 27.185 11.373 -9.570 1400 HG2 GLU 73 HG2 GLU 73 27.074 9.625 -7.830 1401 HG3 GLU 73 HG1 GLU 73 25.324 9.836 -7.772 1402 H GLY 74 HN GLY 74 28.458 13.925 -7.126 1403 HA2 GLY 74 HA2 GLY 74 29.167 16.004 -7.775 1404 HA3 GLY 74 HA1 GLY 74 28.366 15.712 -9.311 1405 H THR 75 HN THR 75 26.662 16.886 -9.793 1406 HA THR 75 HA THR 75 25.460 18.538 -7.673 1407 HB THR 75 HB THR 75 25.202 19.035 -10.639 1408 HG1 THR 75 HG1 THR 75 27.159 19.915 -10.671 1409 HG21 THR 75 HG21 THR 75 24.884 21.361 -9.914 1410 HG22 THR 75 HG22 THR 75 25.085 20.864 -8.233 1411 HG23 THR 75 HG23 THR 75 23.700 20.290 -9.163 1412 H ARG 76 HN ARG 76 24.928 15.733 -9.196 1413 HA ARG 76 HA ARG 76 22.061 16.167 -9.649 1414 HB2 ARG 76 HB2 ARG 76 23.854 13.872 -10.440 1415 HB3 ARG 76 HB1 ARG 76 22.126 13.940 -10.742 1416 HG2 ARG 76 HG2 ARG 76 22.426 15.871 -12.175 1417 HG3 ARG 76 HG1 ARG 76 24.160 15.866 -11.837 1418 HD2 ARG 76 HD2 ARG 76 24.341 13.629 -12.810 1419 HD3 ARG 76 HD1 ARG 76 22.613 13.634 -13.148 1420 HE ARG 76 HE ARG 76 22.986 14.998 -14.964 1421 HH11 ARG 76 HH11 ARG 76 25.905 14.743 -13.046 1422 HH12 ARG 76 HH12 ARG 76 26.905 15.509 -14.236 1423 HH21 ARG 76 HH21 ARG 76 24.315 15.994 -16.540 1424 HH22 ARG 76 HH22 ARG 76 26.006 16.229 -16.205 1425 H GLN 77 HN GLN 77 20.525 15.027 -8.581 1426 HA GLN 77 HA GLN 77 21.440 13.196 -6.465 1427 HB2 GLN 77 HB2 GLN 77 18.908 14.857 -6.508 1428 HB3 GLN 77 HB1 GLN 77 19.361 13.719 -5.249 1429 HG2 GLN 77 HG2 GLN 77 21.401 15.125 -4.859 1430 HG3 GLN 77 HG1 GLN 77 20.687 16.319 -5.943 1431 HE21 GLN 77 HE21 GLN 77 17.971 15.597 -5.007 1432 HE22 GLN 77 HE22 GLN 77 17.801 16.350 -3.463 1433 H TYR 78 HN TYR 78 21.152 11.190 -7.135 1434 HA TYR 78 HA TYR 78 19.025 10.588 -9.045 1435 HB2 TYR 78 HB2 TYR 78 21.493 9.116 -8.157 1436 HB3 TYR 78 HB1 TYR 78 20.219 8.303 -9.058 1437 HD1 TYR 78 HD2 TYR 78 22.663 11.082 -9.208 1438 HD2 TYR 78 HD1 TYR 78 20.053 8.534 -11.392 1439 HE1 TYR 78 HE2 TYR 78 23.645 11.890 -11.313 1440 HE2 TYR 78 HE1 TYR 78 21.024 9.332 -13.503 1441 HH TYR 78 HH TYR 78 22.234 11.180 -14.383 1442 H TYR 79 HN TYR 79 17.191 9.716 -8.402 1443 HA TYR 79 HA TYR 79 17.122 8.373 -5.801 1444 HB2 TYR 79 HB2 TYR 79 14.993 9.631 -7.510 1445 HB3 TYR 79 HB1 TYR 79 14.570 8.466 -6.260 1446 HD1 TYR 79 HD2 TYR 79 16.365 11.691 -6.782 1447 HD2 TYR 79 HD1 TYR 79 14.314 9.157 -4.044 1448 HE1 TYR 79 HE2 TYR 79 16.415 13.480 -5.094 1449 HE2 TYR 79 HE1 TYR 79 14.361 10.937 -2.349 1450 HH TYR 79 HH TYR 79 15.595 12.935 -1.813 1451 H ARG 80 HN ARG 80 16.230 6.329 -5.593 1452 HA ARG 80 HA ARG 80 15.593 4.779 -7.958 1453 HB2 ARG 80 HB2 ARG 80 18.059 4.657 -7.874 1454 HB3 ARG 80 HB1 ARG 80 17.977 4.096 -6.211 1455 HG2 ARG 80 HG2 ARG 80 16.649 2.130 -7.078 1456 HG3 ARG 80 HG1 ARG 80 17.113 2.654 -8.697 1457 HD2 ARG 80 HD2 ARG 80 19.445 2.390 -8.174 1458 HD3 ARG 80 HD1 ARG 80 19.066 2.046 -6.485 1459 HE ARG 80 HE ARG 80 18.462 0.273 -8.771 1460 HH11 ARG 80 HH11 ARG 80 18.964 0.796 -5.351 1461 HH12 ARG 80 HH12 ARG 80 18.966 -0.889 -4.943 1462 HH21 ARG 80 HH21 ARG 80 18.450 -1.964 -8.260 1463 HH22 ARG 80 HH22 ARG 80 18.713 -2.466 -6.616 1464 H ILE 81 HN ILE 81 14.624 2.723 -7.378 1465 HA ILE 81 HA ILE 81 13.075 2.659 -5.065 1466 HB ILE 81 HB ILE 81 14.069 0.259 -6.621 1467 HG12 ILE 81 HG12 ILE 81 12.998 1.911 -8.100 1468 HG13 ILE 81 HG11 ILE 81 12.007 0.465 -7.938 1469 HG21 ILE 81 HG21 ILE 81 12.018 -0.822 -5.812 1470 HG22 ILE 81 HG22 ILE 81 11.647 0.614 -4.858 1471 HG23 ILE 81 HG23 ILE 81 13.081 -0.347 -4.489 1472 HD11 ILE 81 HD11 ILE 81 10.648 2.472 -7.885 1473 HD12 ILE 81 HD12 ILE 81 11.568 3.076 -6.507 1474 HD13 ILE 81 HD13 ILE 81 10.575 1.629 -6.339 1475 H ALA 82 HN ALA 82 13.428 2.002 -3.016 1476 HA ALA 82 HA ALA 82 15.999 2.102 -1.971 1477 HB1 ALA 82 HB1 ALA 82 15.021 1.448 0.143 1478 HB2 ALA 82 HB2 ALA 82 13.577 0.858 -0.678 1479 HB3 ALA 82 HB3 ALA 82 13.960 2.581 -0.691 1480 H GLY 83 HN GLY 83 13.978 -0.772 -2.552 1481 HA2 GLY 83 HA2 GLY 83 16.419 -2.376 -2.607 1482 HA3 GLY 83 HA1 GLY 83 15.195 -2.814 -1.424 1483 H GLU 84 HN GLU 84 15.982 -4.637 -3.265 1484 HA GLU 84 HA GLU 84 14.387 -4.718 -5.611 1485 HB2 GLU 84 HB2 GLU 84 16.431 -6.085 -5.266 1486 HB3 GLU 84 HB1 GLU 84 15.589 -7.001 -4.027 1487 HG2 GLU 84 HG2 GLU 84 14.028 -7.851 -5.666 1488 HG3 GLU 84 HG1 GLU 84 14.779 -6.869 -6.921 1489 H ASP 85 HN ASP 85 13.942 -5.717 -2.307 1490 HA ASP 85 HA ASP 85 11.584 -7.206 -2.539 1491 HB2 ASP 85 HB2 ASP 85 11.235 -6.517 -0.124 1492 HB3 ASP 85 HB1 ASP 85 12.781 -7.281 -0.477 1493 H VAL 86 HN VAL 86 12.115 -3.733 -2.168 1494 HA VAL 86 HA VAL 86 9.365 -3.036 -2.009 1495 HB VAL 86 HB VAL 86 11.690 -1.318 -2.905 1496 HG11 VAL 86 HG11 VAL 86 10.301 0.562 -2.198 1497 HG12 VAL 86 HG12 VAL 86 8.982 -0.550 -1.827 1498 HG13 VAL 86 HG13 VAL 86 9.535 -0.359 -3.492 1499 HG21 VAL 86 HG21 VAL 86 11.793 -0.548 -0.587 1500 HG22 VAL 86 HG22 VAL 86 12.098 -2.281 -0.702 1501 HG23 VAL 86 HG23 VAL 86 10.529 -1.697 -0.148 1502 H ALA 87 HN ALA 87 11.693 -3.283 -4.648 1503 HA ALA 87 HA ALA 87 10.087 -2.195 -6.687 1504 HB1 ALA 87 HB1 ALA 87 12.257 -4.274 -6.947 1505 HB2 ALA 87 HB2 ALA 87 12.511 -2.529 -6.902 1506 HB3 ALA 87 HB3 ALA 87 11.620 -3.257 -8.241 1507 H ARG 88 HN ARG 88 10.504 -5.537 -5.560 1508 HA ARG 88 HA ARG 88 8.747 -6.632 -7.529 1509 HB2 ARG 88 HB2 ARG 88 9.632 -7.862 -4.915 1510 HB3 ARG 88 HB1 ARG 88 8.936 -8.717 -6.284 1511 HG2 ARG 88 HG2 ARG 88 10.909 -7.953 -7.633 1512 HG3 ARG 88 HG1 ARG 88 11.618 -7.376 -6.125 1513 HD2 ARG 88 HD2 ARG 88 12.533 -9.511 -6.447 1514 HD3 ARG 88 HD1 ARG 88 11.263 -9.736 -5.243 1515 HE ARG 88 HE ARG 88 10.090 -10.192 -7.709 1516 HH11 ARG 88 HH11 ARG 88 12.647 -11.613 -5.774 1517 HH12 ARG 88 HH12 ARG 88 12.479 -13.187 -6.498 1518 HH21 ARG 88 HH21 ARG 88 9.857 -12.246 -8.631 1519 HH22 ARG 88 HH22 ARG 88 10.878 -13.552 -8.112 1520 H LEU 89 HN LEU 89 8.339 -5.217 -4.396 1521 HA LEU 89 HA LEU 89 5.753 -6.204 -3.819 1522 HB2 LEU 89 HB2 LEU 89 7.370 -4.983 -2.266 1523 HB3 LEU 89 HB1 LEU 89 6.843 -3.501 -3.034 1524 HG LEU 89 HG LEU 89 4.886 -5.349 -1.685 1525 HD11 LEU 89 HD11 LEU 89 6.443 -3.085 -0.435 1526 HD12 LEU 89 HD12 LEU 89 6.609 -4.800 -0.052 1527 HD13 LEU 89 HD13 LEU 89 5.106 -3.956 0.318 1528 HD21 LEU 89 HD21 LEU 89 4.842 -2.387 -2.280 1529 HD22 LEU 89 HD22 LEU 89 3.560 -3.302 -1.484 1530 HD23 LEU 89 HD23 LEU 89 3.963 -3.632 -3.169 1531 H PHE 90 HN PHE 90 6.906 -3.284 -5.481 1532 HA PHE 90 HA PHE 90 4.386 -2.225 -6.138 1533 HB2 PHE 90 HB2 PHE 90 6.429 -0.898 -6.321 1534 HB3 PHE 90 HB1 PHE 90 7.027 -1.953 -7.595 1535 HD1 PHE 90 HD1 PHE 90 4.300 0.438 -6.771 1536 HD2 PHE 90 HD2 PHE 90 6.532 -1.514 -9.827 1537 HE1 PHE 90 HE1 PHE 90 3.256 1.889 -8.459 1538 HE2 PHE 90 HE2 PHE 90 5.490 -0.068 -11.518 1539 HZ PHE 90 HZ PHE 90 3.848 1.637 -10.838 1540 H ALA 91 HN ALA 91 6.399 -4.639 -7.692 1541 HA ALA 91 HA ALA 91 4.875 -4.891 -10.063 1542 HB1 ALA 91 HB1 ALA 91 6.610 -6.964 -8.722 1543 HB2 ALA 91 HB2 ALA 91 7.174 -5.732 -9.850 1544 HB3 ALA 91 HB3 ALA 91 6.059 -6.984 -10.396 1545 H LEU 92 HN LEU 92 4.750 -6.530 -6.926 1546 HA LEU 92 HA LEU 92 2.776 -8.424 -7.644 1547 HB2 LEU 92 HB2 LEU 92 4.233 -8.673 -5.689 1548 HB3 LEU 92 HB1 LEU 92 3.451 -7.303 -4.924 1549 HG LEU 92 HG LEU 92 1.332 -8.563 -4.844 1550 HD11 LEU 92 HD11 LEU 92 1.673 -9.983 -6.793 1551 HD12 LEU 92 HD12 LEU 92 1.310 -10.946 -5.363 1552 HD13 LEU 92 HD13 LEU 92 2.968 -10.839 -5.955 1553 HD21 LEU 92 HD21 LEU 92 1.991 -10.155 -3.118 1554 HD22 LEU 92 HD22 LEU 92 2.867 -8.634 -2.945 1555 HD23 LEU 92 HD23 LEU 92 3.671 -10.039 -3.643 1556 H VAL 93 HN VAL 93 2.523 -5.250 -6.024 1557 HA VAL 93 HA VAL 93 -0.294 -5.370 -5.750 1558 HB VAL 93 HB VAL 93 1.155 -3.830 -4.432 1559 HG11 VAL 93 HG11 VAL 93 1.768 -1.654 -5.415 1560 HG12 VAL 93 HG12 VAL 93 1.283 -2.262 -7.000 1561 HG13 VAL 93 HG13 VAL 93 2.634 -3.009 -6.142 1562 HG21 VAL 93 HG21 VAL 93 -0.416 -1.944 -4.427 1563 HG22 VAL 93 HG22 VAL 93 -1.244 -3.500 -4.476 1564 HG23 VAL 93 HG23 VAL 93 -1.107 -2.528 -5.942 1565 H GLN 94 HN GLN 94 1.820 -4.405 -8.348 1566 HA GLN 94 HA GLN 94 -0.046 -3.123 -10.014 1567 HB2 GLN 94 HB2 GLN 94 2.406 -3.175 -10.423 1568 HB3 GLN 94 HB1 GLN 94 2.281 -4.880 -10.832 1569 HG2 GLN 94 HG2 GLN 94 0.749 -4.256 -12.688 1570 HG3 GLN 94 HG1 GLN 94 1.071 -2.561 -12.317 1571 HE21 GLN 94 HE21 GLN 94 3.124 -1.714 -12.732 1572 HE22 GLN 94 HE22 GLN 94 4.244 -2.509 -13.780 1573 H VAL 95 HN VAL 95 0.813 -6.536 -9.609 1574 HA VAL 95 HA VAL 95 -0.886 -7.599 -11.586 1575 HB VAL 95 HB VAL 95 0.020 -8.863 -8.990 1576 HG11 VAL 95 HG11 VAL 95 -1.900 -10.045 -9.909 1577 HG12 VAL 95 HG12 VAL 95 -0.433 -11.008 -10.086 1578 HG13 VAL 95 HG13 VAL 95 -1.100 -10.153 -11.476 1579 HG21 VAL 95 HG21 VAL 95 1.182 -9.020 -11.767 1580 HG22 VAL 95 HG22 VAL 95 1.744 -9.929 -10.364 1581 HG23 VAL 95 HG23 VAL 95 1.884 -8.170 -10.390 1582 H VAL 96 HN VAL 96 -1.425 -6.810 -8.190 1583 HA VAL 96 HA VAL 96 -4.000 -7.927 -7.943 1584 HB VAL 96 HB VAL 96 -2.818 -5.594 -6.418 1585 HG11 VAL 96 HG11 VAL 96 -5.105 -7.436 -5.722 1586 HG12 VAL 96 HG12 VAL 96 -5.231 -5.726 -6.132 1587 HG13 VAL 96 HG13 VAL 96 -4.408 -6.218 -4.652 1588 HG21 VAL 96 HG21 VAL 96 -2.190 -7.265 -4.745 1589 HG22 VAL 96 HG22 VAL 96 -1.412 -7.585 -6.296 1590 HG23 VAL 96 HG23 VAL 96 -2.804 -8.544 -5.795 1591 H ALA 97 HN ALA 97 -2.881 -4.912 -9.285 1592 HA ALA 97 HA ALA 97 -5.592 -3.853 -9.440 1593 HB1 ALA 97 HB1 ALA 97 -3.749 -2.369 -8.798 1594 HB2 ALA 97 HB2 ALA 97 -4.558 -1.826 -10.268 1595 HB3 ALA 97 HB3 ALA 97 -2.997 -2.641 -10.373 1596 H ASP 98 HN ASP 98 -3.172 -5.316 -11.487 1597 HA ASP 98 HA ASP 98 -4.586 -4.560 -13.923 1598 HB2 ASP 98 HB2 ASP 98 -2.075 -4.470 -13.723 1599 HB3 ASP 98 HB1 ASP 98 -2.079 -6.227 -13.646 1600 H GLU 99 HN GLU 99 -3.158 -7.640 -12.848 1601 HA GLU 99 HA GLU 99 -4.754 -9.220 -14.576 1602 HB2 GLU 99 HB2 GLU 99 -3.149 -9.977 -12.126 1603 HB3 GLU 99 HB1 GLU 99 -3.831 -11.126 -13.266 1604 HG2 GLU 99 HG2 GLU 99 -1.898 -8.999 -14.116 1605 HG3 GLU 99 HG1 GLU 99 -1.365 -10.557 -13.484 1606 H HIS 100 HN HIS 100 -4.918 -8.429 -11.162 1607 HA HIS 100 HA HIS 100 -6.946 -10.338 -10.537 1608 HB2 HIS 100 HB2 HIS 100 -5.346 -9.730 -8.866 1609 HB3 HIS 100 HB1 HIS 100 -5.722 -8.024 -9.035 1610 HD1 HIS 100 HD1 HIS 100 -7.450 -7.087 -7.530 1611 HD2 HIS 100 HD2 HIS 100 -7.426 -11.240 -7.502 1612 HE1 HIS 100 HE1 HIS 100 -8.973 -7.755 -5.646 1613 HE2 HIS 100 HE2 HIS 100 -8.691 -10.252 -5.473 1614 H LEU 101 HN LEU 101 -7.069 -7.258 -11.964 1615 HA LEU 101 HA LEU 101 -9.631 -6.517 -10.823 1616 HB2 LEU 101 HB2 LEU 101 -7.956 -4.799 -11.380 1617 HB3 LEU 101 HB1 LEU 101 -8.074 -5.240 -13.072 1618 HG LEU 101 HG LEU 101 -10.454 -4.533 -13.062 1619 HD11 LEU 101 HD11 LEU 101 -9.816 -3.578 -10.275 1620 HD12 LEU 101 HD12 LEU 101 -10.937 -4.868 -10.705 1621 HD13 LEU 101 HD13 LEU 101 -11.284 -3.204 -11.180 1622 HD21 LEU 101 HD21 LEU 101 -8.461 -2.455 -12.164 1623 HD22 LEU 101 HD22 LEU 101 -10.000 -2.119 -12.954 1624 HD23 LEU 101 HD23 LEU 101 -8.738 -2.995 -13.820 1625 H GLU 102 HN GLU 102 -8.533 -6.926 -14.196 1626 HA GLU 102 HA GLU 102 -10.614 -8.652 -14.976 1627 HB2 GLU 102 HB2 GLU 102 -11.913 -7.016 -16.370 1628 HB3 GLU 102 HB1 GLU 102 -12.128 -6.826 -14.636 1629 HG2 GLU 102 HG2 GLU 102 -10.538 -4.958 -14.660 1630 HG3 GLU 102 HG1 GLU 102 -10.372 -5.137 -16.406 1631 H HIS 103 HN HIS 103 -10.933 -7.483 -17.640 1632 HA HIS 103 HA HIS 103 -9.927 -7.357 -19.668 1633 HB2 HIS 103 HB2 HIS 103 -8.536 -5.598 -18.702 1634 HB3 HIS 103 HB1 HIS 103 -7.441 -6.794 -18.028 1635 HD1 HIS 103 HD1 HIS 103 -5.346 -6.867 -19.288 1636 HD2 HIS 103 HD2 HIS 103 -8.584 -6.062 -21.769 1637 HE1 HIS 103 HE1 HIS 103 -4.388 -6.646 -21.604 1638 HE2 HIS 103 HE2 HIS 103 -6.399 -6.434 -23.110 1639 H HIS 104 HN HIS 104 -9.902 -9.827 -17.812 1640 HA HIS 104 HA HIS 104 -7.683 -11.337 -18.913 1641 HB2 HIS 104 HB2 HIS 104 -8.419 -13.175 -17.468 1642 HB3 HIS 104 HB1 HIS 104 -8.231 -11.686 -16.556 1643 HD1 HIS 104 HD1 HIS 104 -9.978 -11.541 -14.815 1644 HD2 HIS 104 HD2 HIS 104 -11.405 -13.348 -18.284 1645 HE1 HIS 104 HE1 HIS 104 -12.399 -12.066 -14.370 1646 HE2 HIS 104 HE2 HIS 104 -13.218 -13.243 -16.446 1647 H HIS 105 HN HIS 105 -10.965 -10.758 -19.661 1648 HA HIS 105 HA HIS 105 -10.928 -13.039 -21.537 1649 HB2 HIS 105 HB2 HIS 105 -12.648 -13.176 -19.699 1650 HB3 HIS 105 HB1 HIS 105 -13.403 -11.739 -20.378 1651 HD1 HIS 105 HD1 HIS 105 -12.419 -15.229 -21.569 1652 HD2 HIS 105 HD2 HIS 105 -15.344 -12.329 -22.169 1653 HE1 HIS 105 HE1 HIS 105 -14.075 -16.253 -23.158 1654 HE2 HIS 105 HE2 HIS 105 -15.934 -14.560 -23.343 1655 H HIS 106 HN HIS 106 -10.397 -9.902 -21.453 1656 HA HIS 106 HA HIS 106 -12.089 -8.960 -23.574 1657 HB2 HIS 106 HB2 HIS 106 -11.046 -7.533 -21.735 1658 HB3 HIS 106 HB1 HIS 106 -9.520 -7.701 -22.592 1659 HD1 HIS 106 HD1 HIS 106 -13.039 -6.407 -23.252 1660 HD2 HIS 106 HD2 HIS 106 -9.107 -5.768 -24.440 1661 HE1 HIS 106 HE1 HIS 106 -13.107 -4.407 -24.770 1662 HE2 HIS 106 HE2 HIS 106 -10.689 -3.900 -25.277 1663 H HIS 107 HN HIS 107 -11.573 -8.755 -25.734 1664 HA HIS 107 HA HIS 107 -10.023 -10.840 -26.787 1665 HB2 HIS 107 HB2 HIS 107 -12.011 -9.550 -27.821 1666 HB3 HIS 107 HB1 HIS 107 -10.794 -8.415 -28.387 1667 HD1 HIS 107 HD1 HIS 107 -12.434 -11.544 -29.244 1668 HD2 HIS 107 HD2 HIS 107 -8.827 -9.678 -30.158 1669 HE1 HIS 107 HE1 HIS 107 -11.564 -12.704 -31.306 1670 HE2 HIS 107 HE2 HIS 107 -9.275 -11.716 -31.684 1671 H HIS 108 HN HIS 108 -9.268 -7.451 -26.282 1672 HA HIS 108 HA HIS 108 -6.472 -8.066 -26.927 1673 HB2 HIS 108 HB2 HIS 108 -7.345 -6.739 -28.777 1674 HB3 HIS 108 HB1 HIS 108 -7.966 -5.534 -27.654 1675 HD1 HIS 108 HD1 HIS 108 -6.246 -3.930 -26.571 1676 HD2 HIS 108 HD2 HIS 108 -4.596 -6.578 -29.314 1677 HE1 HIS 108 HE1 HIS 108 -3.959 -3.021 -27.092 1678 HE2 HIS 108 HE2 HIS 108 -2.916 -4.736 -28.614 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 -2.724 7.159 -27.578 2 H2 MET 1 HT2 MET 1 -1.144 6.621 -27.875 3 H3 MET 1 HT3 MET 1 -2.456 5.876 -28.657 4 HA MET 1 HA MET 1 -1.551 8.671 -29.037 5 HB2 MET 1 HB2 MET 1 -1.442 6.255 -30.859 6 HB3 MET 1 HB1 MET 1 -1.084 7.900 -31.364 7 HG2 MET 1 HG2 MET 1 0.974 6.775 -30.989 8 HG3 MET 1 HG1 MET 1 0.752 7.946 -29.692 9 HE1 MET 1 HE1 MET 1 2.671 5.023 -27.922 10 HE2 MET 1 HE2 MET 1 2.679 6.740 -28.325 11 HE3 MET 1 HE3 MET 1 2.878 5.535 -29.597 12 H ALA 2 HN ALA 2 -2.613 9.583 -31.028 13 HA ALA 2 HA ALA 2 -4.416 10.204 -32.248 14 HB1 ALA 2 HB1 ALA 2 -5.615 7.530 -31.544 15 HB2 ALA 2 HB2 ALA 2 -4.580 7.857 -32.936 16 HB3 ALA 2 HB3 ALA 2 -6.163 8.627 -32.812 17 H GLY 3 HN GLY 3 -5.657 8.460 -29.373 18 HA2 GLY 3 HA2 GLY 3 -7.261 10.876 -28.809 19 HA3 GLY 3 HA1 GLY 3 -7.960 9.270 -28.703 20 H GLN 4 HN GLN 4 -7.865 8.226 -26.824 21 HA GLN 4 HA GLN 4 -6.077 9.215 -24.723 22 HB2 GLN 4 HB2 GLN 4 -8.201 10.475 -24.547 23 HB3 GLN 4 HB1 GLN 4 -9.079 8.959 -24.430 24 HG2 GLN 4 HG2 GLN 4 -7.821 8.459 -22.347 25 HG3 GLN 4 HG1 GLN 4 -7.107 10.067 -22.447 26 HE21 GLN 4 HE21 GLN 4 -10.400 9.328 -23.368 27 HE22 GLN 4 HE22 GLN 4 -11.159 10.197 -22.077 28 H SER 5 HN SER 5 -5.528 7.671 -23.204 29 HA SER 5 HA SER 5 -6.947 5.112 -23.288 30 HB2 SER 5 HB2 SER 5 -4.844 4.967 -24.668 31 HB3 SER 5 HB1 SER 5 -3.928 5.299 -23.199 32 HG SER 5 HG SER 5 -5.337 3.015 -23.958 33 H ASP 6 HN ASP 6 -7.548 4.515 -21.335 34 HA ASP 6 HA ASP 6 -6.454 5.944 -19.015 35 HB2 ASP 6 HB2 ASP 6 -8.529 5.392 -17.904 36 HB3 ASP 6 HB1 ASP 6 -8.914 6.041 -19.497 37 H ARG 7 HN ARG 7 -5.606 3.293 -20.492 38 HA ARG 7 HA ARG 7 -6.135 1.109 -18.851 39 HB2 ARG 7 HB2 ARG 7 -3.728 1.596 -20.607 40 HB3 ARG 7 HB1 ARG 7 -4.195 0.039 -19.943 41 HG2 ARG 7 HG2 ARG 7 -5.816 1.680 -21.879 42 HG3 ARG 7 HG1 ARG 7 -4.842 0.267 -22.280 43 HD2 ARG 7 HD2 ARG 7 -6.888 -0.717 -22.085 44 HD3 ARG 7 HD1 ARG 7 -6.325 -0.863 -20.422 45 HE ARG 7 HE ARG 7 -7.687 1.540 -20.557 46 HH11 ARG 7 HH11 ARG 7 -8.421 -1.842 -21.056 47 HH12 ARG 7 HH12 ARG 7 -10.095 -1.675 -20.630 48 HH21 ARG 7 HH21 ARG 7 -9.886 1.786 -20.024 49 HH22 ARG 7 HH22 ARG 7 -10.939 0.399 -20.055 50 H LYS 8 HN LYS 8 -3.163 3.102 -18.906 51 HA LYS 8 HA LYS 8 -2.078 1.687 -16.657 52 HB2 LYS 8 HB2 LYS 8 -0.682 2.686 -18.476 53 HB3 LYS 8 HB1 LYS 8 -1.124 4.280 -17.883 54 HG2 LYS 8 HG2 LYS 8 -0.062 3.770 -15.736 55 HG3 LYS 8 HG1 LYS 8 0.403 2.183 -16.354 56 HD2 LYS 8 HD2 LYS 8 1.705 3.285 -18.131 57 HD3 LYS 8 HD1 LYS 8 1.272 4.855 -17.455 58 HE2 LYS 8 HE2 LYS 8 3.491 4.242 -16.717 59 HE3 LYS 8 HE1 LYS 8 2.386 4.220 -15.345 60 HZ1 LYS 8 HZ1 LYS 8 3.152 1.794 -16.874 61 HZ2 LYS 8 HZ2 LYS 8 2.307 1.858 -15.403 62 HZ3 LYS 8 HZ3 LYS 8 3.944 2.299 -15.462 63 H ALA 9 HN ALA 9 -3.759 4.707 -17.194 64 HA ALA 9 HA ALA 9 -3.339 5.946 -14.727 65 HB1 ALA 9 HB1 ALA 9 -5.355 7.221 -15.193 66 HB2 ALA 9 HB2 ALA 9 -5.822 6.063 -16.439 67 HB3 ALA 9 HB3 ALA 9 -4.380 7.054 -16.652 68 H ALA 10 HN ALA 10 -5.856 3.648 -15.723 69 HA ALA 10 HA ALA 10 -7.260 3.601 -13.289 70 HB1 ALA 10 HB1 ALA 10 -8.270 1.555 -14.089 71 HB2 ALA 10 HB2 ALA 10 -7.014 1.384 -15.315 72 HB3 ALA 10 HB3 ALA 10 -8.156 2.727 -15.402 73 H LEU 11 HN LEU 11 -4.339 2.004 -14.322 74 HA LEU 11 HA LEU 11 -4.271 0.018 -12.297 75 HB2 LEU 11 HB2 LEU 11 -1.956 1.308 -13.748 76 HB3 LEU 11 HB1 LEU 11 -1.896 -0.188 -12.838 77 HG LEU 11 HG LEU 11 -3.410 0.280 -15.404 78 HD11 LEU 11 HD11 LEU 11 -0.996 0.091 -15.693 79 HD12 LEU 11 HD12 LEU 11 -1.831 -1.322 -16.341 80 HD13 LEU 11 HD13 LEU 11 -1.001 -1.423 -14.787 81 HD21 LEU 11 HD21 LEU 11 -3.907 -2.123 -15.302 82 HD22 LEU 11 HD22 LEU 11 -4.651 -1.229 -13.977 83 HD23 LEU 11 HD23 LEU 11 -3.199 -2.189 -13.689 84 H LEU 12 HN LEU 12 -2.852 3.253 -12.585 85 HA LEU 12 HA LEU 12 -1.597 3.194 -10.035 86 HB2 LEU 12 HB2 LEU 12 -2.341 5.531 -11.793 87 HB3 LEU 12 HB1 LEU 12 -1.320 5.633 -10.370 88 HG LEU 12 HG LEU 12 -0.693 4.092 -12.892 89 HD11 LEU 12 HD11 LEU 12 1.090 5.754 -13.155 90 HD12 LEU 12 HD12 LEU 12 0.484 6.616 -11.740 91 HD13 LEU 12 HD13 LEU 12 -0.510 6.492 -13.191 92 HD21 LEU 12 HD21 LEU 12 0.197 2.977 -10.905 93 HD22 LEU 12 HD22 LEU 12 0.950 4.488 -10.392 94 HD23 LEU 12 HD23 LEU 12 1.491 3.691 -11.870 95 H ASP 13 HN ASP 13 -4.744 4.227 -11.188 96 HA ASP 13 HA ASP 13 -5.616 5.435 -8.778 97 HB2 ASP 13 HB2 ASP 13 -6.927 4.409 -11.241 98 HB3 ASP 13 HB1 ASP 13 -7.939 4.571 -9.811 99 H GLN 14 HN GLN 14 -5.863 2.136 -10.035 100 HA GLN 14 HA GLN 14 -7.434 1.121 -7.922 101 HB2 GLN 14 HB2 GLN 14 -7.198 0.021 -10.128 102 HB3 GLN 14 HB1 GLN 14 -5.535 -0.382 -9.729 103 HG2 GLN 14 HG2 GLN 14 -6.980 -2.294 -9.410 104 HG3 GLN 14 HG1 GLN 14 -6.305 -1.764 -7.872 105 HE21 GLN 14 HE21 GLN 14 -7.939 -2.751 -6.699 106 HE22 GLN 14 HE22 GLN 14 -9.560 -2.141 -6.651 107 H VAL 15 HN VAL 15 -3.903 1.149 -8.442 108 HA VAL 15 HA VAL 15 -3.334 -0.362 -6.111 109 HB VAL 15 HB VAL 15 -1.013 0.337 -6.354 110 HG11 VAL 15 HG11 VAL 15 -2.339 -0.314 -8.979 111 HG12 VAL 15 HG12 VAL 15 -1.786 -1.465 -7.763 112 HG13 VAL 15 HG13 VAL 15 -0.618 -0.481 -8.642 113 HG21 VAL 15 HG21 VAL 15 -2.011 2.203 -8.501 114 HG22 VAL 15 HG22 VAL 15 -0.319 1.872 -8.125 115 HG23 VAL 15 HG23 VAL 15 -1.347 2.676 -6.938 116 H ALA 16 HN ALA 16 -3.783 3.071 -6.686 117 HA ALA 16 HA ALA 16 -2.912 3.929 -4.117 118 HB1 ALA 16 HB1 ALA 16 -3.079 5.489 -5.982 119 HB2 ALA 16 HB2 ALA 16 -4.086 6.020 -4.636 120 HB3 ALA 16 HB3 ALA 16 -4.826 5.254 -6.039 121 H ARG 17 HN ARG 17 -6.010 2.976 -5.483 122 HA ARG 17 HA ARG 17 -7.717 3.479 -3.347 123 HB2 ARG 17 HB2 ARG 17 -8.422 2.777 -5.600 124 HB3 ARG 17 HB1 ARG 17 -7.749 1.183 -5.315 125 HG2 ARG 17 HG2 ARG 17 -9.412 0.729 -3.636 126 HG3 ARG 17 HG1 ARG 17 -10.035 2.379 -3.761 127 HD2 ARG 17 HD2 ARG 17 -10.669 2.003 -6.063 128 HD3 ARG 17 HD1 ARG 17 -9.954 0.397 -6.029 129 HE ARG 17 HE ARG 17 -11.757 0.073 -4.161 130 HH11 ARG 17 HH11 ARG 17 -12.068 1.866 -7.162 131 HH12 ARG 17 HH12 ARG 17 -13.749 1.456 -7.375 132 HH21 ARG 17 HH21 ARG 17 -13.981 -0.470 -4.465 133 HH22 ARG 17 HH22 ARG 17 -14.822 0.156 -5.850 134 H VAL 18 HN VAL 18 -5.752 0.598 -4.025 135 HA VAL 18 HA VAL 18 -6.438 -0.871 -1.726 136 HB VAL 18 HB VAL 18 -3.831 -0.921 -3.267 137 HG11 VAL 18 HG11 VAL 18 -3.600 -1.986 -1.097 138 HG12 VAL 18 HG12 VAL 18 -3.602 -3.201 -2.374 139 HG13 VAL 18 HG13 VAL 18 -5.046 -2.950 -1.395 140 HG21 VAL 18 HG21 VAL 18 -5.779 -1.334 -4.690 141 HG22 VAL 18 HG22 VAL 18 -6.316 -2.604 -3.593 142 HG23 VAL 18 HG23 VAL 18 -4.809 -2.792 -4.491 143 H GLY 19 HN GLY 19 -3.787 1.407 -2.347 144 HA2 GLY 19 HA2 GLY 19 -2.532 1.231 0.154 145 HA3 GLY 19 HA1 GLY 19 -2.451 2.613 -0.927 146 H LYS 20 HN LYS 20 -5.238 3.215 -0.926 147 HA LYS 20 HA LYS 20 -5.443 4.863 1.339 148 HB2 LYS 20 HB2 LYS 20 -7.550 3.911 -0.606 149 HB3 LYS 20 HB1 LYS 20 -7.845 5.127 0.630 150 HG2 LYS 20 HG2 LYS 20 -6.321 6.645 -0.381 151 HG3 LYS 20 HG1 LYS 20 -5.716 5.401 -1.477 152 HD2 LYS 20 HD2 LYS 20 -7.199 6.853 -2.692 153 HD3 LYS 20 HD1 LYS 20 -7.969 5.277 -2.506 154 HE2 LYS 20 HE2 LYS 20 -9.285 6.156 -0.634 155 HE3 LYS 20 HE1 LYS 20 -8.518 7.730 -0.836 156 HZ1 LYS 20 HZ1 LYS 20 -9.457 7.834 -3.084 157 HZ2 LYS 20 HZ2 LYS 20 -10.672 7.703 -1.907 158 HZ3 LYS 20 HZ3 LYS 20 -10.239 6.350 -2.832 159 H ALA 21 HN ALA 21 -6.743 1.650 0.664 160 HA ALA 21 HA ALA 21 -8.323 1.482 3.026 161 HB1 ALA 21 HB1 ALA 21 -8.469 -0.901 2.526 162 HB2 ALA 21 HB2 ALA 21 -7.181 -0.737 1.332 163 HB3 ALA 21 HB3 ALA 21 -8.731 0.065 1.075 164 H LEU 22 HN LEU 22 -4.973 0.794 2.294 165 HA LEU 22 HA LEU 22 -4.522 -0.661 4.762 166 HB2 LEU 22 HB2 LEU 22 -2.605 0.269 2.623 167 HB3 LEU 22 HB1 LEU 22 -2.179 -0.763 3.975 168 HG LEU 22 HG LEU 22 -4.169 -1.505 1.826 169 HD11 LEU 22 HD11 LEU 22 -1.920 -1.302 0.906 170 HD12 LEU 22 HD12 LEU 22 -2.426 -2.990 0.982 171 HD13 LEU 22 HD13 LEU 22 -1.296 -2.351 2.178 172 HD21 LEU 22 HD21 LEU 22 -4.562 -2.614 3.960 173 HD22 LEU 22 HD22 LEU 22 -2.878 -3.136 4.010 174 HD23 LEU 22 HD23 LEU 22 -3.956 -3.752 2.757 175 H ALA 23 HN ALA 23 -4.828 2.546 4.089 176 HA ALA 23 HA ALA 23 -2.472 3.559 5.393 177 HB1 ALA 23 HB1 ALA 23 -4.945 5.011 4.473 178 HB2 ALA 23 HB2 ALA 23 -3.484 4.748 3.521 179 HB3 ALA 23 HB3 ALA 23 -3.426 5.757 4.966 180 H ASN 24 HN ASN 24 -4.646 1.942 6.895 181 HA ASN 24 HA ASN 24 -4.700 3.710 9.220 182 HB2 ASN 24 HB2 ASN 24 -6.856 4.026 8.042 183 HB3 ASN 24 HB1 ASN 24 -7.167 2.299 8.189 184 HD21 ASN 24 HD21 ASN 24 -7.044 5.336 9.832 185 HD22 ASN 24 HD22 ASN 24 -7.786 4.812 11.308 186 H GLY 25 HN GLY 25 -3.880 2.643 10.865 187 HA2 GLY 25 HA2 GLY 25 -3.208 -0.074 10.788 188 HA3 GLY 25 HA1 GLY 25 -3.157 0.944 12.215 189 H ARG 26 HN ARG 26 -6.033 1.514 12.148 190 HA ARG 26 HA ARG 26 -6.848 -0.673 13.760 191 HB2 ARG 26 HB2 ARG 26 -8.378 1.705 12.700 192 HB3 ARG 26 HB1 ARG 26 -9.055 0.530 13.822 193 HG2 ARG 26 HG2 ARG 26 -7.389 1.085 15.475 194 HG3 ARG 26 HG1 ARG 26 -6.597 2.184 14.347 195 HD2 ARG 26 HD2 ARG 26 -8.582 3.599 14.319 196 HD3 ARG 26 HD1 ARG 26 -9.402 2.487 15.418 197 HE ARG 26 HE ARG 26 -7.901 3.135 17.146 198 HH11 ARG 26 HH11 ARG 26 -7.714 5.084 14.239 199 HH12 ARG 26 HH12 ARG 26 -6.780 6.340 14.993 200 HH21 ARG 26 HH21 ARG 26 -6.638 4.780 18.124 201 HH22 ARG 26 HH22 ARG 26 -6.152 6.160 17.185 202 H ARG 27 HN ARG 27 -7.241 0.085 10.399 203 HA ARG 27 HA ARG 27 -9.290 -1.916 9.986 204 HB2 ARG 27 HB2 ARG 27 -7.525 -0.609 7.902 205 HB3 ARG 27 HB1 ARG 27 -9.041 -1.451 7.624 206 HG2 ARG 27 HG2 ARG 27 -10.238 0.299 8.840 207 HG3 ARG 27 HG1 ARG 27 -8.712 1.147 9.109 208 HD2 ARG 27 HD2 ARG 27 -8.451 1.110 6.565 209 HD3 ARG 27 HD1 ARG 27 -10.157 0.665 6.521 210 HE ARG 27 HE ARG 27 -10.369 2.831 7.960 211 HH11 ARG 27 HH11 ARG 27 -8.211 2.291 5.258 212 HH12 ARG 27 HH12 ARG 27 -8.150 3.964 4.796 213 HH21 ARG 27 HH21 ARG 27 -10.297 5.050 7.367 214 HH22 ARG 27 HH22 ARG 27 -9.340 5.531 5.995 215 H LEU 28 HN LEU 28 -5.831 -1.641 9.879 216 HA LEU 28 HA LEU 28 -5.311 -4.065 8.492 217 HB2 LEU 28 HB2 LEU 28 -3.514 -2.514 10.357 218 HB3 LEU 28 HB1 LEU 28 -3.004 -3.753 9.225 219 HG LEU 28 HG LEU 28 -4.240 -1.105 8.454 220 HD11 LEU 28 HD11 LEU 28 -1.993 -0.869 9.403 221 HD12 LEU 28 HD12 LEU 28 -2.026 -0.508 7.676 222 HD13 LEU 28 HD13 LEU 28 -1.390 -2.053 8.242 223 HD21 LEU 28 HD21 LEU 28 -4.730 -2.894 6.865 224 HD22 LEU 28 HD22 LEU 28 -3.011 -3.278 6.766 225 HD23 LEU 28 HD23 LEU 28 -3.602 -1.720 6.187 226 H GLN 29 HN GLN 29 -5.821 -3.215 11.847 227 HA GLN 29 HA GLN 29 -4.983 -5.583 13.081 228 HB2 GLN 29 HB2 GLN 29 -7.320 -3.797 13.810 229 HB3 GLN 29 HB1 GLN 29 -6.613 -5.015 14.862 230 HG2 GLN 29 HG2 GLN 29 -4.478 -3.777 14.798 231 HG3 GLN 29 HG1 GLN 29 -5.261 -2.535 13.822 232 HE21 GLN 29 HE21 GLN 29 -4.919 -0.933 15.354 233 HE22 GLN 29 HE22 GLN 29 -5.782 -0.882 16.854 234 H ILE 30 HN ILE 30 -7.880 -4.778 11.308 235 HA ILE 30 HA ILE 30 -9.324 -7.153 11.905 236 HB ILE 30 HB ILE 30 -9.599 -5.320 9.513 237 HG12 ILE 30 HG12 ILE 30 -11.079 -5.330 12.155 238 HG13 ILE 30 HG11 ILE 30 -9.856 -4.156 11.681 239 HG21 ILE 30 HG21 ILE 30 -11.527 -7.325 10.682 240 HG22 ILE 30 HG22 ILE 30 -10.638 -7.502 9.169 241 HG23 ILE 30 HG23 ILE 30 -11.857 -6.238 9.332 242 HD11 ILE 30 HD11 ILE 30 -11.285 -3.387 9.873 243 HD12 ILE 30 HD12 ILE 30 -12.110 -3.274 11.427 244 HD13 ILE 30 HD13 ILE 30 -12.502 -4.583 10.314 245 H LEU 31 HN LEU 31 -7.220 -6.150 9.237 246 HA LEU 31 HA LEU 31 -7.474 -8.422 7.626 247 HB2 LEU 31 HB2 LEU 31 -5.201 -6.480 7.984 248 HB3 LEU 31 HB1 LEU 31 -5.155 -7.778 6.806 249 HG LEU 31 HG LEU 31 -7.195 -5.553 6.864 250 HD11 LEU 31 HD11 LEU 31 -4.828 -6.023 5.061 251 HD12 LEU 31 HD12 LEU 31 -4.995 -4.735 6.255 252 HD13 LEU 31 HD13 LEU 31 -6.051 -4.772 4.844 253 HD21 LEU 31 HD21 LEU 31 -7.857 -6.419 4.674 254 HD22 LEU 31 HD22 LEU 31 -8.090 -7.626 5.940 255 HD23 LEU 31 HD23 LEU 31 -6.709 -7.747 4.851 256 H ASP 32 HN ASP 32 -5.339 -7.753 10.354 257 HA ASP 32 HA ASP 32 -3.786 -10.088 10.241 258 HB2 ASP 32 HB2 ASP 32 -3.182 -8.240 11.698 259 HB3 ASP 32 HB1 ASP 32 -4.660 -8.451 12.631 260 H LEU 33 HN LEU 33 -6.783 -9.410 12.023 261 HA LEU 33 HA LEU 33 -7.163 -11.932 13.153 262 HB2 LEU 33 HB2 LEU 33 -9.254 -9.970 12.202 263 HB3 LEU 33 HB1 LEU 33 -9.544 -11.309 13.294 264 HG LEU 33 HG LEU 33 -7.732 -8.972 13.892 265 HD11 LEU 33 HD11 LEU 33 -10.047 -8.256 13.743 266 HD12 LEU 33 HD12 LEU 33 -9.512 -8.259 15.422 267 HD13 LEU 33 HD13 LEU 33 -10.541 -9.561 14.823 268 HD21 LEU 33 HD21 LEU 33 -8.765 -11.190 15.657 269 HD22 LEU 33 HD22 LEU 33 -7.755 -9.837 16.167 270 HD23 LEU 33 HD23 LEU 33 -7.117 -11.042 15.048 271 H LEU 34 HN LEU 34 -8.060 -10.669 9.991 272 HA LEU 34 HA LEU 34 -9.562 -12.993 9.244 273 HB2 LEU 34 HB2 LEU 34 -8.509 -10.753 7.523 274 HB3 LEU 34 HB1 LEU 34 -9.704 -11.942 7.041 275 HG LEU 34 HG LEU 34 -10.026 -9.779 9.119 276 HD11 LEU 34 HD11 LEU 34 -11.787 -8.985 7.629 277 HD12 LEU 34 HD12 LEU 34 -11.412 -10.279 6.490 278 HD13 LEU 34 HD13 LEU 34 -10.222 -9.021 6.819 279 HD21 LEU 34 HD21 LEU 34 -11.120 -11.822 9.883 280 HD22 LEU 34 HD22 LEU 34 -11.968 -11.952 8.342 281 HD23 LEU 34 HD23 LEU 34 -12.302 -10.599 9.421 282 H ALA 35 HN ALA 35 -6.258 -12.223 9.296 283 HA ALA 35 HA ALA 35 -5.464 -14.026 7.200 284 HB1 ALA 35 HB1 ALA 35 -3.834 -12.844 9.449 285 HB2 ALA 35 HB2 ALA 35 -4.024 -12.153 7.836 286 HB3 ALA 35 HB3 ALA 35 -3.195 -13.697 8.043 287 H GLN 36 HN GLN 36 -5.869 -14.129 10.683 288 HA GLN 36 HA GLN 36 -4.906 -16.774 11.058 289 HB2 GLN 36 HB2 GLN 36 -6.508 -14.840 12.669 290 HB3 GLN 36 HB1 GLN 36 -6.559 -16.533 13.135 291 HG2 GLN 36 HG2 GLN 36 -4.880 -15.295 14.388 292 HG3 GLN 36 HG1 GLN 36 -4.161 -16.570 13.408 293 HE21 GLN 36 HE21 GLN 36 -4.466 -13.155 13.902 294 HE22 GLN 36 HE22 GLN 36 -3.223 -12.676 12.794 295 H GLY 37 HN GLY 37 -8.060 -15.402 10.321 296 HA2 GLY 37 HA2 GLY 37 -8.992 -17.613 8.924 297 HA3 GLY 37 HA1 GLY 37 -9.549 -17.797 10.584 298 H GLU 38 HN GLU 38 -11.633 -17.651 9.217 299 HA GLU 38 HA GLU 38 -12.355 -14.984 8.418 300 HB2 GLU 38 HB2 GLU 38 -14.718 -16.221 8.355 301 HB3 GLU 38 HB1 GLU 38 -13.535 -16.370 7.069 302 HG2 GLU 38 HG2 GLU 38 -14.423 -18.526 7.556 303 HG3 GLU 38 HG1 GLU 38 -12.745 -18.472 8.085 304 H ARG 39 HN ARG 39 -13.858 -13.647 9.377 305 HA ARG 39 HA ARG 39 -14.611 -14.289 12.138 306 HB2 ARG 39 HB2 ARG 39 -13.170 -11.768 11.292 307 HB3 ARG 39 HB1 ARG 39 -13.886 -12.028 12.874 308 HG2 ARG 39 HG2 ARG 39 -11.630 -13.630 11.685 309 HG3 ARG 39 HG1 ARG 39 -11.465 -12.352 12.890 310 HD2 ARG 39 HD2 ARG 39 -12.878 -13.669 14.426 311 HD3 ARG 39 HD1 ARG 39 -12.951 -14.955 13.224 312 HE ARG 39 HE ARG 39 -10.495 -14.096 14.612 313 HH11 ARG 39 HH11 ARG 39 -12.347 -16.497 12.880 314 HH12 ARG 39 HH12 ARG 39 -11.266 -17.803 13.264 315 HH21 ARG 39 HH21 ARG 39 -9.049 -15.812 15.115 316 HH22 ARG 39 HH22 ARG 39 -9.397 -17.415 14.536 317 H ALA 40 HN ALA 40 -16.632 -13.729 12.576 318 HA ALA 40 HA ALA 40 -18.242 -12.283 10.701 319 HB1 ALA 40 HB1 ALA 40 -19.221 -14.018 12.109 320 HB2 ALA 40 HB2 ALA 40 -20.007 -12.465 12.408 321 HB3 ALA 40 HB3 ALA 40 -18.823 -13.089 13.554 322 H VAL 41 HN VAL 41 -19.374 -10.278 11.184 323 HA VAL 41 HA VAL 41 -17.797 -8.127 11.832 324 HB VAL 41 HB VAL 41 -20.780 -8.276 12.316 325 HG11 VAL 41 HG11 VAL 41 -18.993 -5.907 11.774 326 HG12 VAL 41 HG12 VAL 41 -19.765 -6.299 13.310 327 HG13 VAL 41 HG13 VAL 41 -20.750 -5.862 11.914 328 HG21 VAL 41 HG21 VAL 41 -19.250 -7.575 9.811 329 HG22 VAL 41 HG22 VAL 41 -20.993 -7.403 10.024 330 HG23 VAL 41 HG23 VAL 41 -20.254 -9.003 10.065 331 H GLU 42 HN GLU 42 -19.874 -9.967 14.028 332 HA GLU 42 HA GLU 42 -19.546 -8.463 16.354 333 HB2 GLU 42 HB2 GLU 42 -19.859 -11.456 16.070 334 HB3 GLU 42 HB1 GLU 42 -20.133 -10.537 17.542 335 HG2 GLU 42 HG2 GLU 42 -22.101 -9.647 16.789 336 HG3 GLU 42 HG1 GLU 42 -21.648 -9.809 15.092 337 H ALA 43 HN ALA 43 -17.711 -11.311 15.259 338 HA ALA 43 HA ALA 43 -15.975 -11.414 17.469 339 HB1 ALA 43 HB1 ALA 43 -14.666 -12.978 16.164 340 HB2 ALA 43 HB2 ALA 43 -15.502 -12.485 14.689 341 HB3 ALA 43 HB3 ALA 43 -16.385 -13.315 15.972 342 H ILE 44 HN ILE 44 -15.687 -9.863 14.315 343 HA ILE 44 HA ILE 44 -13.015 -9.013 14.524 344 HB ILE 44 HB ILE 44 -15.327 -7.708 13.069 345 HG12 ILE 44 HG12 ILE 44 -13.140 -9.546 12.072 346 HG13 ILE 44 HG11 ILE 44 -14.805 -10.028 12.378 347 HG21 ILE 44 HG21 ILE 44 -13.522 -6.108 13.438 348 HG22 ILE 44 HG22 ILE 44 -13.617 -6.563 11.736 349 HG23 ILE 44 HG23 ILE 44 -12.359 -7.251 12.763 350 HD11 ILE 44 HD11 ILE 44 -14.442 -9.687 10.022 351 HD12 ILE 44 HD12 ILE 44 -13.868 -8.045 10.319 352 HD13 ILE 44 HD13 ILE 44 -15.551 -8.464 10.642 353 H ALA 45 HN ALA 45 -16.053 -7.411 15.402 354 HA ALA 45 HA ALA 45 -14.982 -5.007 16.337 355 HB1 ALA 45 HB1 ALA 45 -17.466 -6.429 17.282 356 HB2 ALA 45 HB2 ALA 45 -17.362 -5.359 15.885 357 HB3 ALA 45 HB3 ALA 45 -17.099 -4.721 17.506 358 H THR 46 HN THR 46 -15.836 -7.951 18.142 359 HA THR 46 HA THR 46 -15.075 -7.016 20.671 360 HB THR 46 HB THR 46 -15.005 -9.892 19.740 361 HG1 THR 46 HG1 THR 46 -17.150 -9.910 19.890 362 HG21 THR 46 HG21 THR 46 -15.520 -10.403 22.073 363 HG22 THR 46 HG22 THR 46 -15.502 -8.683 22.465 364 HG23 THR 46 HG23 THR 46 -14.017 -9.487 21.958 365 H ALA 47 HN ALA 47 -13.235 -8.824 18.226 366 HA ALA 47 HA ALA 47 -10.993 -9.315 19.875 367 HB1 ALA 47 HB1 ALA 47 -9.870 -10.026 17.855 368 HB2 ALA 47 HB2 ALA 47 -11.112 -9.255 16.868 369 HB3 ALA 47 HB3 ALA 47 -11.525 -10.641 17.881 370 H THR 48 HN THR 48 -11.917 -6.560 17.958 371 HA THR 48 HA THR 48 -9.236 -5.417 18.228 372 HB THR 48 HB THR 48 -10.202 -3.542 16.826 373 HG1 THR 48 HG1 THR 48 -12.289 -5.390 16.264 374 HG21 THR 48 HG21 THR 48 -8.819 -5.308 15.852 375 HG22 THR 48 HG22 THR 48 -10.101 -4.832 14.736 376 HG23 THR 48 HG23 THR 48 -10.244 -6.328 15.659 377 H GLY 49 HN GLY 49 -12.232 -5.418 19.790 378 HA2 GLY 49 HA2 GLY 49 -12.932 -4.266 21.667 379 HA3 GLY 49 HA1 GLY 49 -11.428 -3.357 21.622 380 H MET 50 HN MET 50 -13.631 -3.612 18.929 381 HA MET 50 HA MET 50 -14.380 -0.784 19.309 382 HB2 MET 50 HB2 MET 50 -13.943 -2.292 16.713 383 HB3 MET 50 HB1 MET 50 -14.600 -0.664 16.819 384 HG2 MET 50 HG2 MET 50 -12.487 0.049 17.917 385 HG3 MET 50 HG1 MET 50 -11.844 -1.563 17.618 386 HE1 MET 50 HE1 MET 50 -11.277 -2.538 15.272 387 HE2 MET 50 HE2 MET 50 -11.572 -1.714 13.741 388 HE3 MET 50 HE3 MET 50 -12.931 -2.299 14.707 389 H ASN 51 HN ASN 51 -16.483 -0.305 18.025 390 HA ASN 51 HA ASN 51 -18.447 -2.258 18.884 391 HB2 ASN 51 HB2 ASN 51 -18.765 0.211 19.238 392 HB3 ASN 51 HB1 ASN 51 -18.903 0.396 17.493 393 HD21 ASN 51 HD21 ASN 51 -20.995 1.240 17.757 394 HD22 ASN 51 HD22 ASN 51 -22.345 0.216 18.124 395 H LEU 52 HN LEU 52 -20.168 -2.966 17.405 396 HA LEU 52 HA LEU 52 -19.091 -4.311 15.211 397 HB2 LEU 52 HB2 LEU 52 -21.911 -3.764 16.068 398 HB3 LEU 52 HB1 LEU 52 -21.585 -4.589 14.558 399 HG LEU 52 HG LEU 52 -20.320 -6.321 15.864 400 HD11 LEU 52 HD11 LEU 52 -19.822 -5.020 17.855 401 HD12 LEU 52 HD12 LEU 52 -20.734 -6.473 18.267 402 HD13 LEU 52 HD13 LEU 52 -21.543 -4.906 18.225 403 HD21 LEU 52 HD21 LEU 52 -22.607 -6.679 15.108 404 HD22 LEU 52 HD22 LEU 52 -23.218 -5.929 16.582 405 HD23 LEU 52 HD23 LEU 52 -22.324 -7.447 16.670 406 H THR 53 HN THR 53 -20.963 -1.312 15.329 407 HA THR 53 HA THR 53 -21.152 -1.015 12.510 408 HB THR 53 HB THR 53 -21.682 1.404 13.130 409 HG1 THR 53 HG1 THR 53 -21.724 1.932 15.233 410 HG21 THR 53 HG21 THR 53 -23.404 -0.316 12.761 411 HG22 THR 53 HG22 THR 53 -23.873 0.822 14.024 412 HG23 THR 53 HG23 THR 53 -23.285 -0.783 14.458 413 H THR 54 HN THR 54 -18.936 0.204 14.965 414 HA THR 54 HA THR 54 -17.343 1.861 13.381 415 HB THR 54 HB THR 54 -16.223 0.120 15.569 416 HG1 THR 54 HG1 THR 54 -17.401 2.573 16.240 417 HG21 THR 54 HG21 THR 54 -14.921 2.152 16.075 418 HG22 THR 54 HG22 THR 54 -15.705 2.977 14.728 419 HG23 THR 54 HG23 THR 54 -14.656 1.594 14.424 420 H ALA 55 HN ALA 55 -16.999 -1.593 14.153 421 HA ALA 55 HA ALA 55 -14.757 -2.070 12.508 422 HB1 ALA 55 HB1 ALA 55 -16.892 -4.003 13.409 423 HB2 ALA 55 HB2 ALA 55 -15.421 -3.598 14.292 424 HB3 ALA 55 HB3 ALA 55 -15.318 -4.439 12.747 425 H SER 56 HN SER 56 -18.235 -2.280 11.930 426 HA SER 56 HA SER 56 -18.230 -3.402 9.388 427 HB2 SER 56 HB2 SER 56 -20.275 -3.030 10.713 428 HB3 SER 56 HB1 SER 56 -20.111 -1.292 10.483 429 HG SER 56 HG SER 56 -21.491 -2.774 8.987 430 H ALA 57 HN ALA 57 -18.042 0.031 10.319 431 HA ALA 57 HA ALA 57 -17.967 1.154 7.775 432 HB1 ALA 57 HB1 ALA 57 -16.860 3.064 8.828 433 HB2 ALA 57 HB2 ALA 57 -16.526 2.086 10.257 434 HB3 ALA 57 HB3 ALA 57 -18.192 2.467 9.819 435 H ASN 58 HN ASN 58 -15.277 0.033 9.801 436 HA ASN 58 HA ASN 58 -13.197 0.627 8.011 437 HB2 ASN 58 HB2 ASN 58 -13.386 -1.527 10.129 438 HB3 ASN 58 HB1 ASN 58 -11.903 -1.093 9.285 439 HD21 ASN 58 HD21 ASN 58 -12.644 -0.964 12.127 440 HD22 ASN 58 HD22 ASN 58 -12.371 0.671 12.606 441 H LEU 59 HN LEU 59 -15.169 -2.267 8.430 442 HA LEU 59 HA LEU 59 -13.827 -3.905 6.567 443 HB2 LEU 59 HB2 LEU 59 -16.671 -3.951 7.581 444 HB3 LEU 59 HB1 LEU 59 -15.981 -5.202 6.564 445 HG LEU 59 HG LEU 59 -14.870 -4.460 9.268 446 HD11 LEU 59 HD11 LEU 59 -16.729 -6.720 8.538 447 HD12 LEU 59 HD12 LEU 59 -17.161 -5.299 9.490 448 HD13 LEU 59 HD13 LEU 59 -15.983 -6.454 10.114 449 HD21 LEU 59 HD21 LEU 59 -13.742 -6.622 9.069 450 HD22 LEU 59 HD22 LEU 59 -13.289 -5.527 7.763 451 HD23 LEU 59 HD23 LEU 59 -14.436 -6.831 7.460 452 H GLN 60 HN GLN 60 -16.500 -1.620 6.222 453 HA GLN 60 HA GLN 60 -17.258 -2.282 3.607 454 HB2 GLN 60 HB2 GLN 60 -17.359 0.387 5.024 455 HB3 GLN 60 HB1 GLN 60 -18.177 0.031 3.508 456 HG2 GLN 60 HG2 GLN 60 -19.551 -1.625 4.581 457 HG3 GLN 60 HG1 GLN 60 -18.668 -1.425 6.094 458 HE21 GLN 60 HE21 GLN 60 -20.490 -0.849 7.252 459 HE22 GLN 60 HE22 GLN 60 -21.284 0.680 7.042 460 H ALA 61 HN ALA 61 -14.864 0.054 4.791 461 HA ALA 61 HA ALA 61 -14.025 0.909 2.215 462 HB1 ALA 61 HB1 ALA 61 -12.536 0.965 4.841 463 HB2 ALA 61 HB2 ALA 61 -13.586 2.237 4.214 464 HB3 ALA 61 HB3 ALA 61 -12.080 1.847 3.383 465 H LEU 62 HN LEU 62 -12.900 -1.566 4.450 466 HA LEU 62 HA LEU 62 -10.615 -2.429 3.112 467 HB2 LEU 62 HB2 LEU 62 -11.575 -2.939 5.458 468 HB3 LEU 62 HB1 LEU 62 -12.470 -4.215 4.657 469 HG LEU 62 HG LEU 62 -10.285 -5.135 3.870 470 HD11 LEU 62 HD11 LEU 62 -9.187 -3.130 5.829 471 HD12 LEU 62 HD12 LEU 62 -8.965 -3.093 4.079 472 HD13 LEU 62 HD13 LEU 62 -8.261 -4.401 5.032 473 HD21 LEU 62 HD21 LEU 62 -10.626 -4.910 6.859 474 HD22 LEU 62 HD22 LEU 62 -9.752 -6.179 5.999 475 HD23 LEU 62 HD23 LEU 62 -11.501 -6.033 5.819 476 H LYS 63 HN LYS 63 -13.990 -3.342 2.828 477 HA LYS 63 HA LYS 63 -13.644 -5.468 0.990 478 HB2 LYS 63 HB2 LYS 63 -15.649 -5.044 2.466 479 HB3 LYS 63 HB1 LYS 63 -16.101 -3.750 1.369 480 HG2 LYS 63 HG2 LYS 63 -16.289 -5.370 -0.456 481 HG3 LYS 63 HG1 LYS 63 -15.848 -6.664 0.659 482 HD2 LYS 63 HD2 LYS 63 -17.822 -6.062 2.049 483 HD3 LYS 63 HD1 LYS 63 -18.288 -4.898 0.810 484 HE2 LYS 63 HE2 LYS 63 -18.011 -7.877 0.437 485 HE3 LYS 63 HE1 LYS 63 -19.526 -6.987 0.570 486 HZ1 LYS 63 HZ1 LYS 63 -18.835 -5.742 -1.449 487 HZ2 LYS 63 HZ2 LYS 63 -19.112 -7.394 -1.710 488 HZ3 LYS 63 HZ3 LYS 63 -17.522 -6.809 -1.610 489 H SER 64 HN SER 64 -14.401 -2.010 0.605 490 HA SER 64 HA SER 64 -14.752 -2.154 -2.205 491 HB2 SER 64 HB2 SER 64 -14.546 0.325 -2.151 492 HB3 SER 64 HB1 SER 64 -15.714 -0.302 -0.988 493 HG SER 64 HG SER 64 -13.330 -0.178 0.204 494 H GLY 65 HN GLY 65 -11.945 -1.974 -0.194 495 HA2 GLY 65 HA2 GLY 65 -10.134 -1.072 -2.219 496 HA3 GLY 65 HA1 GLY 65 -9.702 -1.878 -0.713 497 H GLY 66 HN GLY 66 -11.758 -4.010 -1.636 498 HA2 GLY 66 HA2 GLY 66 -11.781 -5.878 -3.024 499 HA3 GLY 66 HA1 GLY 66 -10.336 -5.276 -3.822 500 H LEU 67 HN LEU 67 -10.318 -5.366 -0.381 501 HA LEU 67 HA LEU 67 -8.179 -7.332 -0.525 502 HB2 LEU 67 HB2 LEU 67 -9.031 -5.262 1.411 503 HB3 LEU 67 HB1 LEU 67 -8.234 -6.676 2.073 504 HG LEU 67 HG LEU 67 -6.253 -6.252 0.764 505 HD11 LEU 67 HD11 LEU 67 -7.266 -5.405 -1.267 506 HD12 LEU 67 HD12 LEU 67 -6.054 -4.272 -0.668 507 HD13 LEU 67 HD13 LEU 67 -7.769 -3.935 -0.429 508 HD21 LEU 67 HD21 LEU 67 -6.466 -5.086 2.890 509 HD22 LEU 67 HD22 LEU 67 -7.253 -3.731 2.078 510 HD23 LEU 67 HD23 LEU 67 -5.567 -4.115 1.723 511 H VAL 68 HN VAL 68 -11.373 -6.976 0.927 512 HA VAL 68 HA VAL 68 -11.217 -9.804 1.714 513 HB VAL 68 HB VAL 68 -12.535 -9.338 3.724 514 HG11 VAL 68 HG11 VAL 68 -9.995 -7.725 3.528 515 HG12 VAL 68 HG12 VAL 68 -10.120 -9.444 3.908 516 HG13 VAL 68 HG13 VAL 68 -10.765 -8.242 5.028 517 HG21 VAL 68 HG21 VAL 68 -12.163 -6.429 2.999 518 HG22 VAL 68 HG22 VAL 68 -12.855 -7.036 4.505 519 HG23 VAL 68 HG23 VAL 68 -13.685 -7.320 2.974 520 H GLU 69 HN GLU 69 -13.232 -10.898 1.887 521 HA GLU 69 HA GLU 69 -15.384 -9.661 0.300 522 HB2 GLU 69 HB2 GLU 69 -14.660 -12.585 0.558 523 HB3 GLU 69 HB1 GLU 69 -16.066 -11.970 -0.300 524 HG2 GLU 69 HG2 GLU 69 -14.445 -10.665 -1.734 525 HG3 GLU 69 HG1 GLU 69 -13.171 -11.641 -1.004 526 H ALA 70 HN ALA 70 -17.557 -10.309 0.884 527 HA ALA 70 HA ALA 70 -17.774 -10.846 3.770 528 HB1 ALA 70 HB1 ALA 70 -18.582 -8.637 3.113 529 HB2 ALA 70 HB2 ALA 70 -19.898 -9.649 3.705 530 HB3 ALA 70 HB3 ALA 70 -19.702 -9.381 1.973 531 H ARG 71 HN ARG 71 -18.248 -12.899 4.107 532 HA ARG 71 HA ARG 71 -20.026 -14.307 2.250 533 HB2 ARG 71 HB2 ARG 71 -18.290 -15.329 4.506 534 HB3 ARG 71 HB1 ARG 71 -19.295 -16.340 3.480 535 HG2 ARG 71 HG2 ARG 71 -17.123 -14.589 2.371 536 HG3 ARG 71 HG1 ARG 71 -16.823 -16.232 2.936 537 HD2 ARG 71 HD2 ARG 71 -17.158 -16.218 0.538 538 HD3 ARG 71 HD1 ARG 71 -18.474 -17.075 1.333 539 HE ARG 71 HE ARG 71 -19.778 -14.952 1.027 540 HH11 ARG 71 HH11 ARG 71 -17.094 -15.740 -1.088 541 HH12 ARG 71 HH12 ARG 71 -17.742 -14.855 -2.439 542 HH21 ARG 71 HH21 ARG 71 -20.623 -13.796 -0.735 543 HH22 ARG 71 HH22 ARG 71 -19.741 -13.738 -2.229 544 H ARG 72 HN ARG 72 -22.101 -14.017 2.746 545 HA ARG 72 HA ARG 72 -22.868 -13.636 5.527 546 HB2 ARG 72 HB2 ARG 72 -23.728 -12.183 3.649 547 HB3 ARG 72 HB1 ARG 72 -24.654 -13.572 3.098 548 HG2 ARG 72 HG2 ARG 72 -25.977 -13.584 5.060 549 HG3 ARG 72 HG1 ARG 72 -24.911 -12.427 5.865 550 HD2 ARG 72 HD2 ARG 72 -26.688 -11.924 3.481 551 HD3 ARG 72 HD1 ARG 72 -26.880 -11.273 5.109 552 HE ARG 72 HE ARG 72 -24.378 -10.478 4.247 553 HH11 ARG 72 HH11 ARG 72 -27.709 -9.977 3.302 554 HH12 ARG 72 HH12 ARG 72 -27.397 -8.439 2.543 555 HH21 ARG 72 HH21 ARG 72 -23.949 -8.476 3.266 556 HH22 ARG 72 HH22 ARG 72 -25.240 -7.591 2.509 557 H GLU 73 HN GLU 73 -23.182 -15.371 6.682 558 HA GLU 73 HA GLU 73 -24.466 -17.712 5.441 559 HB2 GLU 73 HB2 GLU 73 -22.048 -17.894 6.290 560 HB3 GLU 73 HB1 GLU 73 -22.719 -17.740 7.904 561 HG2 GLU 73 HG2 GLU 73 -23.587 -19.883 5.991 562 HG3 GLU 73 HG1 GLU 73 -22.217 -20.074 7.082 563 H GLY 74 HN GLY 74 -26.556 -17.676 5.985 564 HA2 GLY 74 HA2 GLY 74 -28.439 -17.670 7.316 565 HA3 GLY 74 HA1 GLY 74 -27.389 -17.609 8.726 566 H THR 75 HN THR 75 -27.611 -15.834 9.910 567 HA THR 75 HA THR 75 -28.376 -13.346 8.525 568 HB THR 75 HB THR 75 -29.964 -14.118 10.283 569 HG1 THR 75 HG1 THR 75 -28.552 -11.670 10.681 570 HG21 THR 75 HG21 THR 75 -29.307 -13.923 12.645 571 HG22 THR 75 HG22 THR 75 -27.644 -13.601 12.150 572 HG23 THR 75 HG23 THR 75 -28.379 -15.167 11.808 573 H ARG 76 HN ARG 76 -25.768 -14.921 9.663 574 HA ARG 76 HA ARG 76 -24.461 -12.524 10.728 575 HB2 ARG 76 HB2 ARG 76 -23.877 -15.455 10.982 576 HB3 ARG 76 HB1 ARG 76 -22.608 -14.269 11.257 577 HG2 ARG 76 HG2 ARG 76 -23.999 -13.207 12.976 578 HG3 ARG 76 HG1 ARG 76 -25.226 -14.449 12.725 579 HD2 ARG 76 HD2 ARG 76 -23.938 -16.104 13.678 580 HD3 ARG 76 HD1 ARG 76 -22.424 -15.260 13.343 581 HE ARG 76 HE ARG 76 -23.311 -13.603 15.093 582 HH11 ARG 76 HH11 ARG 76 -23.806 -17.082 15.197 583 HH12 ARG 76 HH12 ARG 76 -23.983 -17.123 16.929 584 HH21 ARG 76 HH21 ARG 76 -23.503 -13.659 17.332 585 HH22 ARG 76 HH22 ARG 76 -23.812 -15.167 18.151 586 H GLN 77 HN GLN 77 -22.685 -11.658 9.788 587 HA GLN 77 HA GLN 77 -22.020 -12.727 7.130 588 HB2 GLN 77 HB2 GLN 77 -23.165 -10.437 7.336 589 HB3 GLN 77 HB1 GLN 77 -21.636 -9.865 7.988 590 HG2 GLN 77 HG2 GLN 77 -20.498 -10.383 5.954 591 HG3 GLN 77 HG1 GLN 77 -21.927 -11.188 5.306 592 HE21 GLN 77 HE21 GLN 77 -22.094 -8.214 7.123 593 HE22 GLN 77 HE22 GLN 77 -22.536 -7.197 5.791 594 H TYR 78 HN TYR 78 -20.116 -13.627 7.022 595 HA TYR 78 HA TYR 78 -18.058 -12.926 8.992 596 HB2 TYR 78 HB2 TYR 78 -18.250 -15.300 7.123 597 HB3 TYR 78 HB1 TYR 78 -16.997 -15.049 8.331 598 HD1 TYR 78 HD1 TYR 78 -20.530 -15.914 7.797 599 HD2 TYR 78 HD2 TYR 78 -17.420 -15.471 10.667 600 HE1 TYR 78 HE1 TYR 78 -21.894 -17.118 9.451 601 HE2 TYR 78 HE2 TYR 78 -18.777 -16.674 12.330 602 HH TYR 78 HH TYR 78 -21.480 -18.485 11.524 603 H TYR 79 HN TYR 79 -16.251 -11.903 8.383 604 HA TYR 79 HA TYR 79 -15.859 -11.455 5.515 605 HB2 TYR 79 HB2 TYR 79 -14.960 -9.948 7.960 606 HB3 TYR 79 HB1 TYR 79 -14.187 -9.696 6.399 607 HD1 TYR 79 HD1 TYR 79 -17.475 -9.543 8.131 608 HD2 TYR 79 HD2 TYR 79 -15.143 -8.278 4.805 609 HE1 TYR 79 HE1 TYR 79 -19.238 -7.944 7.507 610 HE2 TYR 79 HE2 TYR 79 -16.899 -6.677 4.173 611 HH TYR 79 HH TYR 79 -19.444 -5.835 6.227 612 H ARG 80 HN ARG 80 -13.924 -11.838 4.534 613 HA ARG 80 HA ARG 80 -11.706 -12.991 5.996 614 HB2 ARG 80 HB2 ARG 80 -11.639 -14.989 4.458 615 HB3 ARG 80 HB1 ARG 80 -12.948 -15.013 5.633 616 HG2 ARG 80 HG2 ARG 80 -14.568 -14.607 4.029 617 HG3 ARG 80 HG1 ARG 80 -13.408 -13.936 2.882 618 HD2 ARG 80 HD2 ARG 80 -13.237 -16.799 3.734 619 HD3 ARG 80 HD1 ARG 80 -14.360 -16.303 2.469 620 HE ARG 80 HE ARG 80 -11.827 -15.264 1.859 621 HH11 ARG 80 HH11 ARG 80 -13.378 -18.383 2.174 622 HH12 ARG 80 HH12 ARG 80 -12.460 -19.125 0.896 623 HH21 ARG 80 HH21 ARG 80 -10.612 -16.224 0.163 624 HH22 ARG 80 HH22 ARG 80 -10.901 -17.885 -0.266 625 H ILE 81 HN ILE 81 -9.818 -13.282 4.572 626 HA ILE 81 HA ILE 81 -9.421 -11.196 2.745 627 HB ILE 81 HB ILE 81 -7.922 -13.824 2.842 628 HG12 ILE 81 HG12 ILE 81 -7.979 -12.754 5.055 629 HG13 ILE 81 HG11 ILE 81 -6.362 -12.705 4.365 630 HG21 ILE 81 HG21 ILE 81 -6.052 -12.514 1.923 631 HG22 ILE 81 HG22 ILE 81 -7.118 -11.115 1.792 632 HG23 ILE 81 HG23 ILE 81 -7.439 -12.562 0.835 633 HD11 ILE 81 HD11 ILE 81 -6.912 -10.621 5.466 634 HD12 ILE 81 HD12 ILE 81 -8.326 -10.425 4.430 635 HD13 ILE 81 HD13 ILE 81 -6.706 -10.372 3.734 636 H ALA 82 HN ALA 82 -9.695 -11.034 0.563 637 HA ALA 82 HA ALA 82 -11.663 -12.530 -0.700 638 HB1 ALA 82 HB1 ALA 82 -9.461 -10.952 -2.025 639 HB2 ALA 82 HB2 ALA 82 -10.967 -10.281 -1.397 640 HB3 ALA 82 HB3 ALA 82 -11.002 -11.415 -2.749 641 H GLY 83 HN GLY 83 -8.163 -12.646 -1.386 642 HA2 GLY 83 HA2 GLY 83 -8.417 -15.503 -1.914 643 HA3 GLY 83 HA1 GLY 83 -7.858 -14.492 -3.238 644 H GLU 84 HN GLU 84 -6.295 -16.513 -2.318 645 HA GLU 84 HA GLU 84 -4.472 -15.967 -0.308 646 HB2 GLU 84 HB2 GLU 84 -3.023 -17.578 -1.327 647 HB3 GLU 84 HB1 GLU 84 -4.675 -18.121 -1.560 648 HG2 GLU 84 HG2 GLU 84 -2.975 -16.753 -3.637 649 HG3 GLU 84 HG1 GLU 84 -3.275 -18.485 -3.534 650 H ASP 85 HN ASP 85 -4.544 -14.808 -3.617 651 HA ASP 85 HA ASP 85 -1.964 -13.697 -3.721 652 HB2 ASP 85 HB2 ASP 85 -3.492 -14.114 -5.665 653 HB3 ASP 85 HB1 ASP 85 -4.425 -12.709 -5.166 654 H VAL 86 HN VAL 86 -5.046 -12.363 -2.619 655 HA VAL 86 HA VAL 86 -4.099 -9.727 -2.138 656 HB VAL 86 HB VAL 86 -6.374 -11.141 -0.735 657 HG11 VAL 86 HG11 VAL 86 -5.646 -9.092 0.374 658 HG12 VAL 86 HG12 VAL 86 -7.241 -8.895 -0.353 659 HG13 VAL 86 HG13 VAL 86 -5.823 -8.205 -1.140 660 HG21 VAL 86 HG21 VAL 86 -6.392 -9.511 -3.273 661 HG22 VAL 86 HG22 VAL 86 -7.822 -10.093 -2.423 662 HG23 VAL 86 HG23 VAL 86 -6.693 -11.243 -3.140 663 H ALA 87 HN ALA 87 -4.263 -12.675 -0.218 664 HA ALA 87 HA ALA 87 -3.336 -11.583 2.217 665 HB1 ALA 87 HB1 ALA 87 -3.085 -14.399 1.159 666 HB2 ALA 87 HB2 ALA 87 -4.415 -13.760 2.126 667 HB3 ALA 87 HB3 ALA 87 -2.803 -13.902 2.827 668 H ARG 88 HN ARG 88 -1.710 -12.934 -0.605 669 HA ARG 88 HA ARG 88 0.927 -12.940 0.279 670 HB2 ARG 88 HB2 ARG 88 -0.106 -12.213 -2.470 671 HB3 ARG 88 HB1 ARG 88 1.563 -12.610 -2.093 672 HG2 ARG 88 HG2 ARG 88 0.927 -14.865 -1.500 673 HG3 ARG 88 HG1 ARG 88 -0.776 -14.476 -1.769 674 HD2 ARG 88 HD2 ARG 88 0.095 -15.634 -3.700 675 HD3 ARG 88 HD1 ARG 88 -0.249 -13.959 -4.128 676 HE ARG 88 HE ARG 88 2.484 -14.751 -3.392 677 HH11 ARG 88 HH11 ARG 88 0.231 -13.456 -5.771 678 HH12 ARG 88 HH12 ARG 88 1.491 -13.063 -6.903 679 HH21 ARG 88 HH21 ARG 88 4.103 -14.198 -4.850 680 HH22 ARG 88 HH22 ARG 88 3.702 -13.452 -6.371 681 H LEU 89 HN LEU 89 -1.027 -10.294 -1.000 682 HA LEU 89 HA LEU 89 1.022 -8.372 -1.154 683 HB2 LEU 89 HB2 LEU 89 -1.293 -8.277 -2.179 684 HB3 LEU 89 HB1 LEU 89 -1.889 -7.811 -0.601 685 HG LEU 89 HG LEU 89 0.256 -6.205 -1.964 686 HD11 LEU 89 HD11 LEU 89 -1.498 -4.784 -2.898 687 HD12 LEU 89 HD12 LEU 89 -2.726 -5.904 -2.308 688 HD13 LEU 89 HD13 LEU 89 -1.586 -6.419 -3.551 689 HD21 LEU 89 HD21 LEU 89 -0.174 -5.730 0.393 690 HD22 LEU 89 HD22 LEU 89 -1.888 -5.506 0.046 691 HD23 LEU 89 HD23 LEU 89 -0.699 -4.387 -0.624 692 H PHE 90 HN PHE 90 -1.376 -8.988 1.420 693 HA PHE 90 HA PHE 90 -0.390 -6.985 3.161 694 HB2 PHE 90 HB2 PHE 90 -2.663 -7.937 3.342 695 HB3 PHE 90 HB1 PHE 90 -1.970 -9.473 3.855 696 HD1 PHE 90 HD2 PHE 90 -1.842 -5.855 4.803 697 HD2 PHE 90 HD1 PHE 90 -1.908 -9.908 6.106 698 HE1 PHE 90 HE2 PHE 90 -1.903 -5.099 7.144 699 HE2 PHE 90 HE1 PHE 90 -1.966 -9.159 8.449 700 HZ PHE 90 HZ PHE 90 -1.960 -6.752 8.973 701 H ALA 91 HN ALA 91 0.338 -10.413 2.795 702 HA ALA 91 HA ALA 91 2.040 -10.633 5.046 703 HB1 ALA 91 HB1 ALA 91 2.066 -12.210 2.473 704 HB2 ALA 91 HB2 ALA 91 1.130 -12.595 3.916 705 HB3 ALA 91 HB3 ALA 91 2.891 -12.661 3.964 706 H LEU 92 HN LEU 92 2.590 -9.721 1.679 707 HA LEU 92 HA LEU 92 5.405 -9.703 1.781 708 HB2 LEU 92 HB2 LEU 92 4.163 -9.750 -0.316 709 HB3 LEU 92 HB1 LEU 92 3.538 -8.143 -0.002 710 HG LEU 92 HG LEU 92 5.820 -7.227 -0.156 711 HD11 LEU 92 HD11 LEU 92 7.631 -8.654 -1.022 712 HD12 LEU 92 HD12 LEU 92 6.580 -10.062 -0.854 713 HD13 LEU 92 HD13 LEU 92 7.084 -9.162 0.576 714 HD21 LEU 92 HD21 LEU 92 4.399 -7.292 -2.135 715 HD22 LEU 92 HD22 LEU 92 5.000 -8.906 -2.523 716 HD23 LEU 92 HD23 LEU 92 6.094 -7.523 -2.566 717 H VAL 93 HN VAL 93 3.036 -7.058 2.159 718 HA VAL 93 HA VAL 93 4.957 -5.040 2.556 719 HB VAL 93 HB VAL 93 3.182 -3.669 3.527 720 HG11 VAL 93 HG11 VAL 93 3.287 -3.836 1.116 721 HG12 VAL 93 HG12 VAL 93 1.606 -3.721 1.640 722 HG13 VAL 93 HG13 VAL 93 2.271 -5.280 1.144 723 HG21 VAL 93 HG21 VAL 93 1.468 -6.148 3.423 724 HG22 VAL 93 HG22 VAL 93 0.928 -4.525 3.855 725 HG23 VAL 93 HG23 VAL 93 2.078 -5.375 4.887 726 H GLN 94 HN GLN 94 3.512 -7.357 4.750 727 HA GLN 94 HA GLN 94 4.504 -6.240 7.154 728 HB2 GLN 94 HB2 GLN 94 2.730 -7.880 7.194 729 HB3 GLN 94 HB1 GLN 94 3.766 -9.080 6.434 730 HG2 GLN 94 HG2 GLN 94 5.202 -9.096 8.409 731 HG3 GLN 94 HG1 GLN 94 4.169 -7.887 9.168 732 HE21 GLN 94 HE21 GLN 94 1.719 -9.074 8.119 733 HE22 GLN 94 HE22 GLN 94 1.442 -10.497 9.060 734 H VAL 95 HN VAL 95 5.785 -8.710 4.939 735 HA VAL 95 HA VAL 95 8.153 -9.256 6.362 736 HB VAL 95 HB VAL 95 7.660 -9.413 3.379 737 HG11 VAL 95 HG11 VAL 95 10.049 -9.339 3.882 738 HG12 VAL 95 HG12 VAL 95 9.570 -10.942 3.326 739 HG13 VAL 95 HG13 VAL 95 9.852 -10.653 5.043 740 HG21 VAL 95 HG21 VAL 95 6.139 -10.811 4.671 741 HG22 VAL 95 HG22 VAL 95 7.507 -11.521 5.532 742 HG23 VAL 95 HG23 VAL 95 7.312 -11.801 3.802 743 H VAL 96 HN VAL 96 7.500 -6.982 3.707 744 HA VAL 96 HA VAL 96 10.012 -5.813 3.498 745 HB VAL 96 HB VAL 96 7.303 -4.501 3.181 746 HG11 VAL 96 HG11 VAL 96 10.024 -3.558 2.280 747 HG12 VAL 96 HG12 VAL 96 8.986 -2.791 3.482 748 HG13 VAL 96 HG13 VAL 96 8.490 -2.838 1.791 749 HG21 VAL 96 HG21 VAL 96 7.640 -6.410 1.702 750 HG22 VAL 96 HG22 VAL 96 9.166 -5.722 1.144 751 HG23 VAL 96 HG23 VAL 96 7.645 -4.901 0.788 752 H ALA 97 HN ALA 97 7.301 -4.967 5.637 753 HA ALA 97 HA ALA 97 8.475 -2.811 6.963 754 HB1 ALA 97 HB1 ALA 97 6.100 -3.433 7.165 755 HB2 ALA 97 HB2 ALA 97 6.874 -3.199 8.733 756 HB3 ALA 97 HB3 ALA 97 6.568 -4.831 8.136 757 H ASP 98 HN ASP 98 8.411 -6.239 7.916 758 HA ASP 98 HA ASP 98 9.893 -6.082 10.250 759 HB2 ASP 98 HB2 ASP 98 8.812 -8.127 9.786 760 HB3 ASP 98 HB1 ASP 98 9.573 -8.269 8.206 761 H GLU 99 HN GLU 99 11.097 -6.614 6.942 762 HA GLU 99 HA GLU 99 13.748 -7.111 7.576 763 HB2 GLU 99 HB2 GLU 99 12.538 -5.893 5.099 764 HB3 GLU 99 HB1 GLU 99 14.244 -6.302 5.227 765 HG2 GLU 99 HG2 GLU 99 13.536 -8.653 5.764 766 HG3 GLU 99 HG1 GLU 99 11.893 -8.174 5.343 767 H HIS 100 HN HIS 100 12.171 -3.948 7.156 768 HA HIS 100 HA HIS 100 14.776 -2.696 7.606 769 HB2 HIS 100 HB2 HIS 100 13.802 -0.583 6.994 770 HB3 HIS 100 HB1 HIS 100 13.378 -1.778 5.780 771 HD1 HIS 100 HD1 HIS 100 11.820 0.092 8.707 772 HD2 HIS 100 HD2 HIS 100 10.706 -1.977 5.265 773 HE1 HIS 100 HE1 HIS 100 9.346 0.463 8.457 774 HE2 HIS 100 HE2 HIS 100 8.742 -0.631 6.273 775 H LEU 101 HN LEU 101 11.832 -3.383 9.282 776 HA LEU 101 HA LEU 101 12.119 -1.316 11.245 777 HB2 LEU 101 HB2 LEU 101 9.929 -2.256 10.718 778 HB3 LEU 101 HB1 LEU 101 10.453 -3.831 11.283 779 HG LEU 101 HG LEU 101 10.682 -2.930 13.564 780 HD11 LEU 101 HD11 LEU 101 11.183 -0.621 13.043 781 HD12 LEU 101 HD12 LEU 101 9.754 -0.709 14.073 782 HD13 LEU 101 HD13 LEU 101 9.578 -0.403 12.344 783 HD21 LEU 101 HD21 LEU 101 7.991 -2.461 12.284 784 HD22 LEU 101 HD22 LEU 101 8.284 -2.655 14.012 785 HD23 LEU 101 HD23 LEU 101 8.600 -3.994 12.910 786 H GLU 102 HN GLU 102 12.518 -4.875 11.420 787 HA GLU 102 HA GLU 102 13.778 -4.558 14.006 788 HB2 GLU 102 HB2 GLU 102 12.230 -6.453 13.579 789 HB3 GLU 102 HB1 GLU 102 13.376 -7.092 12.406 790 HG2 GLU 102 HG2 GLU 102 15.020 -7.450 14.111 791 HG3 GLU 102 HG1 GLU 102 14.021 -6.632 15.311 792 H HIS 103 HN HIS 103 15.534 -3.296 13.286 793 HA HIS 103 HA HIS 103 17.589 -4.345 11.640 794 HB2 HIS 103 HB2 HIS 103 19.031 -2.607 12.834 795 HB3 HIS 103 HB1 HIS 103 17.646 -2.006 11.935 796 HD1 HIS 103 HD1 HIS 103 19.284 -1.688 15.119 797 HD2 HIS 103 HD2 HIS 103 15.353 -1.470 13.777 798 HE1 HIS 103 HE1 HIS 103 18.016 -0.466 16.917 799 HE2 HIS 103 HE2 HIS 103 15.607 -0.529 16.169 800 H HIS 104 HN HIS 104 18.980 -5.901 12.033 801 HA HIS 104 HA HIS 104 18.703 -7.453 14.374 802 HB2 HIS 104 HB2 HIS 104 20.536 -8.851 13.415 803 HB3 HIS 104 HB1 HIS 104 19.185 -8.585 12.324 804 HD1 HIS 104 HD1 HIS 104 19.744 -7.737 10.050 805 HD2 HIS 104 HD2 HIS 104 22.890 -7.249 12.733 806 HE1 HIS 104 HE1 HIS 104 21.706 -6.973 8.673 807 HE2 HIS 104 HE2 HIS 104 23.634 -6.828 10.286 808 H HIS 105 HN HIS 105 19.731 -7.493 16.217 809 HA HIS 105 HA HIS 105 22.403 -6.344 16.437 810 HB2 HIS 105 HB2 HIS 105 21.737 -5.092 18.505 811 HB3 HIS 105 HB1 HIS 105 21.071 -4.445 17.012 812 HD1 HIS 105 HD1 HIS 105 18.511 -4.722 16.641 813 HD2 HIS 105 HD2 HIS 105 19.871 -5.990 20.358 814 HE1 HIS 105 HE1 HIS 105 16.454 -4.963 18.066 815 HE2 HIS 105 HE2 HIS 105 17.339 -5.457 20.377 816 H HIS 106 HN HIS 106 20.379 -8.856 17.035 817 HA HIS 106 HA HIS 106 21.479 -9.577 19.613 818 HB2 HIS 106 HB2 HIS 106 20.133 -11.557 19.525 819 HB3 HIS 106 HB1 HIS 106 19.143 -10.228 18.950 820 HD1 HIS 106 HD1 HIS 106 20.143 -13.607 18.123 821 HD2 HIS 106 HD2 HIS 106 18.960 -10.234 15.979 822 HE1 HIS 106 HE1 HIS 106 19.437 -14.444 15.859 823 HE2 HIS 106 HE2 HIS 106 18.584 -12.409 14.630 824 H HIS 107 HN HIS 107 23.384 -10.509 19.882 825 HA HIS 107 HA HIS 107 24.897 -11.467 17.630 826 HB2 HIS 107 HB2 HIS 107 26.027 -10.325 19.494 827 HB3 HIS 107 HB1 HIS 107 25.512 -11.599 20.595 828 HD1 HIS 107 HD1 HIS 107 27.250 -13.282 21.036 829 HD2 HIS 107 HD2 HIS 107 27.693 -11.559 17.273 830 HE1 HIS 107 HE1 HIS 107 29.328 -14.315 20.053 831 HE2 HIS 107 HE2 HIS 107 29.523 -13.326 17.738 832 H HIS 108 HN HIS 108 23.055 -12.796 20.250 833 HA HIS 108 HA HIS 108 23.064 -15.388 18.901 834 HB2 HIS 108 HB2 HIS 108 24.695 -15.566 20.752 835 HB3 HIS 108 HB1 HIS 108 23.468 -15.013 21.883 836 HD1 HIS 108 HD1 HIS 108 22.058 -16.774 22.946 837 HD2 HIS 108 HD2 HIS 108 24.058 -18.177 19.581 838 HE1 HIS 108 HE1 HIS 108 21.647 -19.254 22.897 839 HE2 HIS 108 HE2 HIS 108 22.660 -20.034 20.724 840 H1 MET 1 HT1 MET 1 -2.133 -5.970 31.431 841 H2 MET 1 HT2 MET 1 -1.088 -6.950 30.522 842 H3 MET 1 HT3 MET 1 -1.252 -5.303 30.144 843 HA MET 1 HA MET 1 -0.264 -4.670 32.218 844 HB2 MET 1 HB2 MET 1 -0.030 -7.656 32.654 845 HB3 MET 1 HB1 MET 1 0.796 -6.447 33.625 846 HG2 MET 1 HG2 MET 1 -1.104 -7.117 34.843 847 HG3 MET 1 HG1 MET 1 -1.455 -5.514 34.204 848 HE1 MET 1 HE1 MET 1 -2.079 -9.334 33.914 849 HE2 MET 1 HE2 MET 1 -1.552 -8.990 32.266 850 HE3 MET 1 HE3 MET 1 -3.226 -9.451 32.580 851 H ALA 2 HN ALA 2 2.210 -5.316 32.796 852 HA ALA 2 HA ALA 2 4.360 -5.384 32.080 853 HB1 ALA 2 HB1 ALA 2 3.813 -7.706 31.524 854 HB2 ALA 2 HB2 ALA 2 4.983 -7.023 30.396 855 HB3 ALA 2 HB3 ALA 2 3.294 -7.195 29.918 856 H GLY 3 HN GLY 3 2.550 -3.318 31.099 857 HA2 GLY 3 HA2 GLY 3 3.144 -1.406 29.847 858 HA3 GLY 3 HA1 GLY 3 4.207 -2.406 28.865 859 H GLN 4 HN GLN 4 3.475 -2.097 26.845 860 HA GLN 4 HA GLN 4 0.707 -2.949 26.332 861 HB2 GLN 4 HB2 GLN 4 0.793 -0.502 26.209 862 HB3 GLN 4 HB1 GLN 4 2.113 -0.595 25.056 863 HG2 GLN 4 HG2 GLN 4 0.655 -1.643 23.432 864 HG3 GLN 4 HG1 GLN 4 -0.666 -1.646 24.595 865 HE21 GLN 4 HE21 GLN 4 1.381 0.341 22.591 866 HE22 GLN 4 HE22 GLN 4 0.330 1.719 22.555 867 H SER 5 HN SER 5 3.881 -3.526 25.883 868 HA SER 5 HA SER 5 5.090 -4.910 24.558 869 HB2 SER 5 HB2 SER 5 2.495 -5.471 23.099 870 HB3 SER 5 HB1 SER 5 3.981 -6.416 22.988 871 HG SER 5 HG SER 5 3.133 -7.499 24.574 872 H ASP 6 HN ASP 6 2.654 -3.475 22.386 873 HA ASP 6 HA ASP 6 2.768 -1.763 20.900 874 HB2 ASP 6 HB2 ASP 6 5.659 -1.431 21.715 875 HB3 ASP 6 HB1 ASP 6 4.700 -0.288 20.784 876 H ARG 7 HN ARG 7 4.720 -4.501 20.708 877 HA ARG 7 HA ARG 7 6.189 -3.828 18.368 878 HB2 ARG 7 HB2 ARG 7 5.688 -6.451 19.763 879 HB3 ARG 7 HB1 ARG 7 6.691 -6.307 18.321 880 HG2 ARG 7 HG2 ARG 7 8.197 -4.811 19.461 881 HG3 ARG 7 HG1 ARG 7 7.160 -4.808 20.888 882 HD2 ARG 7 HD2 ARG 7 7.610 -7.134 21.282 883 HD3 ARG 7 HD1 ARG 7 8.504 -7.260 19.766 884 HE ARG 7 HE ARG 7 10.080 -5.597 20.801 885 HH11 ARG 7 HH11 ARG 7 8.169 -7.766 22.782 886 HH12 ARG 7 HH12 ARG 7 9.310 -7.771 24.094 887 HH21 ARG 7 HH21 ARG 7 11.580 -5.630 22.517 888 HH22 ARG 7 HH22 ARG 7 11.247 -6.576 23.935 889 H LYS 8 HN LYS 8 3.237 -5.735 18.912 890 HA LYS 8 HA LYS 8 2.859 -6.546 16.252 891 HB2 LYS 8 HB2 LYS 8 1.566 -7.412 18.187 892 HB3 LYS 8 HB1 LYS 8 0.727 -5.872 18.295 893 HG2 LYS 8 HG2 LYS 8 -0.227 -6.235 16.070 894 HG3 LYS 8 HG1 LYS 8 0.611 -7.787 15.971 895 HD2 LYS 8 HD2 LYS 8 -0.623 -8.580 17.928 896 HD3 LYS 8 HD1 LYS 8 -1.446 -7.025 18.045 897 HE2 LYS 8 HE2 LYS 8 -2.921 -8.589 16.985 898 HE3 LYS 8 HE1 LYS 8 -2.391 -7.413 15.784 899 HZ1 LYS 8 HZ1 LYS 8 -2.383 -9.696 14.936 900 HZ2 LYS 8 HZ2 LYS 8 -1.251 -10.140 16.118 901 HZ3 LYS 8 HZ3 LYS 8 -0.826 -9.019 14.919 902 H ALA 9 HN ALA 9 1.661 -3.673 17.960 903 HA ALA 9 HA ALA 9 0.267 -2.542 15.790 904 HB1 ALA 9 HB1 ALA 9 1.472 -1.168 18.188 905 HB2 ALA 9 HB2 ALA 9 -0.135 -1.889 18.107 906 HB3 ALA 9 HB3 ALA 9 0.253 -0.488 17.109 907 H ALA 10 HN ALA 10 3.622 -2.405 16.769 908 HA ALA 10 HA ALA 10 4.450 -0.200 15.250 909 HB1 ALA 10 HB1 ALA 10 6.697 -1.076 15.469 910 HB2 ALA 10 HB2 ALA 10 6.061 -2.653 15.939 911 HB3 ALA 10 HB3 ALA 10 5.824 -1.259 16.993 912 H LEU 11 HN LEU 11 4.029 -3.606 14.372 913 HA LEU 11 HA LEU 11 5.254 -3.353 11.804 914 HB2 LEU 11 HB2 LEU 11 3.544 -5.403 13.139 915 HB3 LEU 11 HB1 LEU 11 3.720 -5.471 11.397 916 HG LEU 11 HG LEU 11 6.184 -5.625 11.687 917 HD11 LEU 11 HD11 LEU 11 6.381 -4.538 13.857 918 HD12 LEU 11 HD12 LEU 11 7.094 -6.151 13.886 919 HD13 LEU 11 HD13 LEU 11 5.513 -5.875 14.613 920 HD21 LEU 11 HD21 LEU 11 4.814 -7.622 11.393 921 HD22 LEU 11 HD22 LEU 11 4.594 -7.730 13.140 922 HD23 LEU 11 HD23 LEU 11 6.198 -7.936 12.438 923 H LEU 12 HN LEU 12 1.982 -3.065 13.036 924 HA LEU 12 HA LEU 12 0.705 -2.878 10.516 925 HB2 LEU 12 HB2 LEU 12 -0.188 -1.882 13.220 926 HB3 LEU 12 HB1 LEU 12 -1.211 -2.002 11.801 927 HG LEU 12 HG LEU 12 0.090 -4.321 13.235 928 HD11 LEU 12 HD11 LEU 12 -2.788 -3.439 13.098 929 HD12 LEU 12 HD12 LEU 12 -1.731 -3.342 14.508 930 HD13 LEU 12 HD13 LEU 12 -2.196 -4.917 13.859 931 HD21 LEU 12 HD21 LEU 12 -0.088 -4.755 10.853 932 HD22 LEU 12 HD22 LEU 12 -1.782 -4.271 10.869 933 HD23 LEU 12 HD23 LEU 12 -1.271 -5.716 11.740 934 H ASP 13 HN ASP 13 2.288 -0.538 12.582 935 HA ASP 13 HA ASP 13 1.217 1.731 11.190 936 HB2 ASP 13 HB2 ASP 13 2.084 1.774 13.566 937 HB3 ASP 13 HB1 ASP 13 3.710 1.693 12.891 938 H GLN 14 HN GLN 14 4.128 -0.226 10.967 939 HA GLN 14 HA GLN 14 5.539 1.432 9.170 940 HB2 GLN 14 HB2 GLN 14 5.692 -1.565 9.550 941 HB3 GLN 14 HB1 GLN 14 6.843 -0.610 8.626 942 HG2 GLN 14 HG2 GLN 14 6.291 -0.366 11.570 943 HG3 GLN 14 HG1 GLN 14 7.702 -1.118 10.830 944 HE21 GLN 14 HE21 GLN 14 7.476 1.137 12.679 945 HE22 GLN 14 HE22 GLN 14 8.271 2.460 11.905 946 H VAL 15 HN VAL 15 3.324 -1.290 8.643 947 HA VAL 15 HA VAL 15 3.549 -1.171 5.801 948 HB VAL 15 HB VAL 15 1.674 -2.716 5.716 949 HG11 VAL 15 HG11 VAL 15 3.856 -3.643 6.173 950 HG12 VAL 15 HG12 VAL 15 2.628 -4.544 7.065 951 HG13 VAL 15 HG13 VAL 15 3.643 -3.366 7.900 952 HG21 VAL 15 HG21 VAL 15 0.546 -3.484 7.746 953 HG22 VAL 15 HG22 VAL 15 0.278 -1.763 7.468 954 HG23 VAL 15 HG23 VAL 15 1.435 -2.287 8.691 955 H ALA 16 HN ALA 16 1.585 0.444 8.169 956 HA ALA 16 HA ALA 16 -0.314 1.516 6.329 957 HB1 ALA 16 HB1 ALA 16 -0.929 3.032 8.126 958 HB2 ALA 16 HB2 ALA 16 0.521 2.588 9.026 959 HB3 ALA 16 HB3 ALA 16 -0.747 1.393 8.751 960 H ARG 17 HN ARG 17 2.804 2.563 7.608 961 HA ARG 17 HA ARG 17 2.846 5.186 6.660 962 HB2 ARG 17 HB2 ARG 17 4.553 4.297 8.187 963 HB3 ARG 17 HB1 ARG 17 5.169 3.260 6.904 964 HG2 ARG 17 HG2 ARG 17 5.543 5.432 5.592 965 HG3 ARG 17 HG1 ARG 17 5.329 6.243 7.143 966 HD2 ARG 17 HD2 ARG 17 7.364 4.100 6.556 967 HD3 ARG 17 HD1 ARG 17 7.691 5.829 6.611 968 HE ARG 17 HE ARG 17 6.520 4.784 9.023 969 HH11 ARG 17 HH11 ARG 17 9.490 5.432 7.280 970 HH12 ARG 17 HH12 ARG 17 10.478 5.391 8.706 971 HH21 ARG 17 HH21 ARG 17 7.810 4.766 10.899 972 HH22 ARG 17 HH22 ARG 17 9.533 5.014 10.759 973 H VAL 18 HN VAL 18 4.079 2.233 5.078 974 HA VAL 18 HA VAL 18 4.802 3.565 2.682 975 HB VAL 18 HB VAL 18 5.815 1.436 3.233 976 HG11 VAL 18 HG11 VAL 18 3.087 0.228 2.838 977 HG12 VAL 18 HG12 VAL 18 3.958 0.370 4.363 978 HG13 VAL 18 HG13 VAL 18 4.585 -0.668 3.083 979 HG21 VAL 18 HG21 VAL 18 4.162 1.261 0.717 980 HG22 VAL 18 HG22 VAL 18 5.591 0.292 1.076 981 HG23 VAL 18 HG23 VAL 18 5.735 2.039 0.889 982 H GLY 19 HN GLY 19 1.833 2.022 3.774 983 HA2 GLY 19 HA2 GLY 19 0.427 2.069 1.334 984 HA3 GLY 19 HA1 GLY 19 -0.303 2.112 2.935 985 H LYS 20 HN LYS 20 0.692 4.493 3.914 986 HA LYS 20 HA LYS 20 -0.992 6.443 2.821 987 HB2 LYS 20 HB2 LYS 20 1.515 6.831 4.469 988 HB3 LYS 20 HB1 LYS 20 0.299 8.065 4.175 989 HG2 LYS 20 HG2 LYS 20 -1.329 6.862 5.441 990 HG3 LYS 20 HG1 LYS 20 -0.259 5.463 5.583 991 HD2 LYS 20 HD2 LYS 20 1.345 6.864 6.839 992 HD3 LYS 20 HD1 LYS 20 0.205 8.207 6.751 993 HE2 LYS 20 HE2 LYS 20 -1.428 6.935 8.017 994 HE3 LYS 20 HE1 LYS 20 -0.347 5.541 8.051 995 HZ1 LYS 20 HZ1 LYS 20 0.223 8.192 9.278 996 HZ2 LYS 20 HZ2 LYS 20 1.234 6.827 9.341 997 HZ3 LYS 20 HZ3 LYS 20 -0.269 6.803 10.120 998 H ALA 21 HN ALA 21 2.378 5.675 2.197 999 HA ALA 21 HA ALA 21 2.888 8.024 0.630 1000 HB1 ALA 21 HB1 ALA 21 4.681 6.922 1.878 1001 HB2 ALA 21 HB2 ALA 21 5.050 6.984 0.154 1002 HB3 ALA 21 HB3 ALA 21 4.490 5.477 0.884 1003 H LEU 22 HN LEU 22 1.665 4.855 0.013 1004 HA LEU 22 HA LEU 22 2.258 4.869 -2.811 1005 HB2 LEU 22 HB2 LEU 22 2.216 2.783 -1.495 1006 HB3 LEU 22 HB1 LEU 22 0.509 3.023 -1.181 1007 HG LEU 22 HG LEU 22 0.105 2.852 -3.651 1008 HD11 LEU 22 HD11 LEU 22 1.864 1.843 -5.024 1009 HD12 LEU 22 HD12 LEU 22 2.993 1.990 -3.677 1010 HD13 LEU 22 HD13 LEU 22 2.327 3.439 -4.433 1011 HD21 LEU 22 HD21 LEU 22 1.425 0.476 -2.345 1012 HD22 LEU 22 HD22 LEU 22 0.329 0.426 -3.726 1013 HD23 LEU 22 HD23 LEU 22 -0.261 0.956 -2.152 1014 H ALA 23 HN ALA 23 -0.392 5.770 -0.753 1015 HA ALA 23 HA ALA 23 -2.405 5.656 -2.776 1016 HB1 ALA 23 HB1 ALA 23 -3.861 6.698 -1.140 1017 HB2 ALA 23 HB2 ALA 23 -2.475 7.061 -0.110 1018 HB3 ALA 23 HB3 ALA 23 -2.941 5.387 -0.406 1019 H ASN 24 HN ASN 24 -1.187 6.891 -4.391 1020 HA ASN 24 HA ASN 24 -2.454 9.351 -4.818 1021 HB2 ASN 24 HB2 ASN 24 -0.777 10.163 -3.138 1022 HB3 ASN 24 HB1 ASN 24 0.501 9.666 -4.247 1023 HD21 ASN 24 HD21 ASN 24 -2.009 11.952 -3.608 1024 HD22 ASN 24 HD22 ASN 24 -1.578 13.090 -4.841 1025 H GLY 25 HN GLY 25 -2.873 8.722 -6.859 1026 HA2 GLY 25 HA2 GLY 25 -1.206 7.074 -8.400 1027 HA3 GLY 25 HA1 GLY 25 -2.581 7.978 -9.003 1028 H ARG 26 HN ARG 26 -1.137 10.532 -8.054 1029 HA ARG 26 HA ARG 26 -0.080 11.066 -10.645 1030 HB2 ARG 26 HB2 ARG 26 -0.052 12.765 -8.151 1031 HB3 ARG 26 HB1 ARG 26 0.439 13.320 -9.745 1032 HG2 ARG 26 HG2 ARG 26 -2.307 12.453 -8.877 1033 HG3 ARG 26 HG1 ARG 26 -1.785 14.070 -9.353 1034 HD2 ARG 26 HD2 ARG 26 -1.930 11.634 -11.127 1035 HD3 ARG 26 HD1 ARG 26 -3.036 13.005 -11.149 1036 HE ARG 26 HE ARG 26 -0.564 14.105 -11.584 1037 HH11 ARG 26 HH11 ARG 26 -2.481 11.611 -13.138 1038 HH12 ARG 26 HH12 ARG 26 -1.840 11.937 -14.717 1039 HH21 ARG 26 HH21 ARG 26 0.309 14.494 -13.676 1040 HH22 ARG 26 HH22 ARG 26 -0.251 13.547 -15.024 1041 H ARG 27 HN ARG 27 1.458 10.822 -7.427 1042 HA ARG 27 HA ARG 27 4.045 11.235 -8.633 1043 HB2 ARG 27 HB2 ARG 27 4.937 10.882 -6.333 1044 HB3 ARG 27 HB1 ARG 27 3.794 12.204 -6.490 1045 HG2 ARG 27 HG2 ARG 27 2.050 10.859 -5.488 1046 HG3 ARG 27 HG1 ARG 27 3.146 9.474 -5.399 1047 HD2 ARG 27 HD2 ARG 27 4.465 10.458 -3.764 1048 HD3 ARG 27 HD1 ARG 27 3.905 12.083 -4.154 1049 HE ARG 27 HE ARG 27 2.222 10.078 -2.781 1050 HH11 ARG 27 HH11 ARG 27 3.374 13.348 -3.267 1051 HH12 ARG 27 HH12 ARG 27 2.425 14.019 -1.972 1052 HH21 ARG 27 HH21 ARG 27 0.975 10.940 -1.066 1053 HH22 ARG 27 HH22 ARG 27 1.072 12.647 -0.703 1054 H LEU 28 HN LEU 28 2.050 8.573 -8.232 1055 HA LEU 28 HA LEU 28 3.992 6.546 -7.847 1056 HB2 LEU 28 HB2 LEU 28 1.332 6.449 -9.269 1057 HB3 LEU 28 HB1 LEU 28 2.307 5.041 -8.894 1058 HG LEU 28 HG LEU 28 1.033 6.909 -6.897 1059 HD11 LEU 28 HD11 LEU 28 0.459 4.036 -7.598 1060 HD12 LEU 28 HD12 LEU 28 -0.555 5.426 -7.985 1061 HD13 LEU 28 HD13 LEU 28 -0.309 4.954 -6.303 1062 HD21 LEU 28 HD21 LEU 28 2.680 4.426 -6.425 1063 HD22 LEU 28 HD22 LEU 28 1.870 5.394 -5.192 1064 HD23 LEU 28 HD23 LEU 28 3.205 6.083 -6.116 1065 H GLN 29 HN GLN 29 3.155 8.531 -10.525 1066 HA GLN 29 HA GLN 29 4.217 7.052 -12.657 1067 HB2 GLN 29 HB2 GLN 29 4.115 10.034 -12.177 1068 HB3 GLN 29 HB1 GLN 29 4.607 9.310 -13.701 1069 HG2 GLN 29 HG2 GLN 29 2.418 8.293 -13.955 1070 HG3 GLN 29 HG1 GLN 29 1.916 8.949 -12.398 1071 HE21 GLN 29 HE21 GLN 29 3.231 11.488 -12.772 1072 HE22 GLN 29 HE22 GLN 29 2.309 12.358 -13.945 1073 H ILE 30 HN ILE 30 5.718 8.872 -10.101 1074 HA ILE 30 HA ILE 30 8.325 9.049 -11.210 1075 HB ILE 30 HB ILE 30 7.453 9.069 -8.313 1076 HG12 ILE 30 HG12 ILE 30 8.066 11.357 -10.201 1077 HG13 ILE 30 HG11 ILE 30 6.455 10.869 -9.686 1078 HG21 ILE 30 HG21 ILE 30 9.820 8.520 -8.539 1079 HG22 ILE 30 HG22 ILE 30 9.606 10.133 -7.858 1080 HG23 ILE 30 HG23 ILE 30 10.060 9.946 -9.551 1081 HD11 ILE 30 HD11 ILE 30 7.201 12.810 -8.457 1082 HD12 ILE 30 HD12 ILE 30 8.638 11.945 -7.916 1083 HD13 ILE 30 HD13 ILE 30 7.042 11.429 -7.373 1084 H LEU 31 HN LEU 31 6.736 6.747 -9.033 1085 HA LEU 31 HA LEU 31 8.978 5.106 -8.568 1086 HB2 LEU 31 HB2 LEU 31 6.033 4.440 -8.519 1087 HB3 LEU 31 HB1 LEU 31 7.298 3.378 -7.929 1088 HG LEU 31 HG LEU 31 6.638 6.106 -6.808 1089 HD11 LEU 31 HD11 LEU 31 4.918 4.449 -6.320 1090 HD12 LEU 31 HD12 LEU 31 5.831 4.859 -4.867 1091 HD13 LEU 31 HD13 LEU 31 6.146 3.341 -5.709 1092 HD21 LEU 31 HD21 LEU 31 8.591 4.010 -5.860 1093 HD22 LEU 31 HD22 LEU 31 8.205 5.521 -5.034 1094 HD23 LEU 31 HD23 LEU 31 9.012 5.555 -6.602 1095 H ASP 32 HN ASP 32 6.435 5.021 -11.012 1096 HA ASP 32 HA ASP 32 7.176 2.660 -12.317 1097 HB2 ASP 32 HB2 ASP 32 5.073 3.727 -12.814 1098 HB3 ASP 32 HB1 ASP 32 5.887 5.182 -13.377 1099 H LEU 33 HN LEU 33 8.400 5.933 -12.580 1100 HA LEU 33 HA LEU 33 10.051 5.417 -14.863 1101 HB2 LEU 33 HB2 LEU 33 9.193 7.652 -14.395 1102 HB3 LEU 33 HB1 LEU 33 10.068 7.689 -12.877 1103 HG LEU 33 HG LEU 33 12.202 7.533 -14.183 1104 HD11 LEU 33 HD11 LEU 33 12.116 8.107 -16.569 1105 HD12 LEU 33 HD12 LEU 33 10.356 8.001 -16.520 1106 HD13 LEU 33 HD13 LEU 33 11.334 6.564 -16.228 1107 HD21 LEU 33 HD21 LEU 33 10.415 9.893 -14.753 1108 HD22 LEU 33 HD22 LEU 33 12.173 9.880 -14.882 1109 HD23 LEU 33 HD23 LEU 33 11.402 9.654 -13.310 1110 H LEU 34 HN LEU 34 10.535 5.477 -11.367 1111 HA LEU 34 HA LEU 34 13.402 5.200 -11.620 1112 HB2 LEU 34 HB2 LEU 34 11.653 4.992 -9.170 1113 HB3 LEU 34 HB1 LEU 34 13.403 5.090 -9.176 1114 HG LEU 34 HG LEU 34 11.473 7.248 -10.019 1115 HD11 LEU 34 HD11 LEU 34 12.483 8.481 -8.156 1116 HD12 LEU 34 HD12 LEU 34 13.436 7.058 -7.746 1117 HD13 LEU 34 HD13 LEU 34 11.680 7.006 -7.620 1118 HD21 LEU 34 HD21 LEU 34 13.435 8.639 -10.414 1119 HD22 LEU 34 HD22 LEU 34 13.424 7.239 -11.488 1120 HD23 LEU 34 HD23 LEU 34 14.488 7.264 -10.081 1121 H ALA 35 HN ALA 35 10.844 3.090 -11.856 1122 HA ALA 35 HA ALA 35 12.082 0.818 -10.583 1123 HB1 ALA 35 HB1 ALA 35 9.684 0.974 -12.406 1124 HB2 ALA 35 HB2 ALA 35 9.657 1.008 -10.643 1125 HB3 ALA 35 HB3 ALA 35 10.188 -0.445 -11.489 1126 H GLN 36 HN GLN 36 12.405 2.384 -13.567 1127 HA GLN 36 HA GLN 36 13.405 -0.061 -14.857 1128 HB2 GLN 36 HB2 GLN 36 13.233 1.171 -16.977 1129 HB3 GLN 36 HB1 GLN 36 11.690 1.102 -16.137 1130 HG2 GLN 36 HG2 GLN 36 12.081 3.387 -15.303 1131 HG3 GLN 36 HG1 GLN 36 13.572 3.444 -16.243 1132 HE21 GLN 36 HE21 GLN 36 10.104 3.458 -16.362 1133 HE22 GLN 36 HE22 GLN 36 9.962 3.941 -18.021 1134 H GLY 37 HN GLY 37 14.575 2.302 -13.006 1135 HA2 GLY 37 HA2 GLY 37 17.188 1.841 -13.152 1136 HA3 GLY 37 HA1 GLY 37 16.976 2.871 -14.559 1137 H GLU 38 HN GLU 38 18.661 3.676 -12.599 1138 HA GLU 38 HA GLU 38 17.309 5.413 -10.745 1139 HB2 GLU 38 HB2 GLU 38 19.657 6.192 -10.231 1140 HB3 GLU 38 HB1 GLU 38 19.349 4.484 -9.964 1141 HG2 GLU 38 HG2 GLU 38 20.390 3.999 -12.157 1142 HG3 GLU 38 HG1 GLU 38 20.798 5.708 -12.299 1143 H ARG 39 HN ARG 39 16.566 7.354 -11.201 1144 HA ARG 39 HA ARG 39 17.712 8.768 -13.520 1145 HB2 ARG 39 HB2 ARG 39 14.898 8.978 -12.436 1146 HB3 ARG 39 HB1 ARG 39 15.533 9.836 -13.829 1147 HG2 ARG 39 HG2 ARG 39 15.142 6.857 -13.597 1148 HG3 ARG 39 HG1 ARG 39 14.141 7.979 -14.517 1149 HD2 ARG 39 HD2 ARG 39 16.319 8.568 -15.763 1150 HD3 ARG 39 HD1 ARG 39 16.954 7.081 -15.059 1151 HE ARG 39 HE ARG 39 14.554 7.151 -16.777 1152 HH11 ARG 39 HH11 ARG 39 17.602 5.674 -15.843 1153 HH12 ARG 39 HH12 ARG 39 17.427 4.351 -16.955 1154 HH21 ARG 39 HH21 ARG 39 14.370 5.418 -18.261 1155 HH22 ARG 39 HH22 ARG 39 15.616 4.199 -18.301 1156 H ALA 40 HN ALA 40 18.170 10.947 -13.308 1157 HA ALA 40 HA ALA 40 18.516 11.940 -10.633 1158 HB1 ALA 40 HB1 ALA 40 20.162 12.433 -12.378 1159 HB2 ALA 40 HB2 ALA 40 19.479 13.913 -11.703 1160 HB3 ALA 40 HB3 ALA 40 18.940 13.330 -13.279 1161 H VAL 41 HN VAL 41 17.650 14.011 -9.917 1162 HA VAL 41 HA VAL 41 14.898 14.096 -9.875 1163 HB VAL 41 HB VAL 41 16.701 16.491 -9.487 1164 HG11 VAL 41 HG11 VAL 41 14.945 17.316 -8.021 1165 HG12 VAL 41 HG12 VAL 41 13.975 15.878 -8.346 1166 HG13 VAL 41 HG13 VAL 41 14.310 17.029 -9.641 1167 HG21 VAL 41 HG21 VAL 41 17.457 14.589 -8.149 1168 HG22 VAL 41 HG22 VAL 41 15.832 14.407 -7.486 1169 HG23 VAL 41 HG23 VAL 41 16.771 15.857 -7.132 1170 H GLU 42 HN GLU 42 17.083 15.729 -12.094 1171 HA GLU 42 HA GLU 42 15.265 17.482 -13.311 1172 HB2 GLU 42 HB2 GLU 42 17.568 16.081 -14.670 1173 HB3 GLU 42 HB1 GLU 42 16.846 17.618 -15.122 1174 HG2 GLU 42 HG2 GLU 42 17.682 18.651 -13.114 1175 HG3 GLU 42 HG1 GLU 42 18.318 17.103 -12.550 1176 H ALA 43 HN ALA 43 16.310 14.227 -14.295 1177 HA ALA 43 HA ALA 43 14.606 13.955 -16.504 1178 HB1 ALA 43 HB1 ALA 43 16.539 12.498 -16.098 1179 HB2 ALA 43 HB2 ALA 43 15.061 11.568 -16.350 1180 HB3 ALA 43 HB3 ALA 43 15.701 11.778 -14.721 1181 H ILE 44 HN ILE 44 14.205 13.035 -13.116 1182 HA ILE 44 HA ILE 44 11.743 11.727 -13.322 1183 HB ILE 44 HB ILE 44 12.795 13.351 -11.000 1184 HG12 ILE 44 HG12 ILE 44 12.971 10.375 -11.524 1185 HG13 ILE 44 HG11 ILE 44 14.292 11.513 -11.766 1186 HG21 ILE 44 HG21 ILE 44 10.412 12.969 -10.781 1187 HG22 ILE 44 HG22 ILE 44 11.290 11.959 -9.631 1188 HG23 ILE 44 HG23 ILE 44 10.634 11.248 -11.107 1189 HD11 ILE 44 HD11 ILE 44 12.943 10.921 -9.143 1190 HD12 ILE 44 HD12 ILE 44 14.287 12.034 -9.392 1191 HD13 ILE 44 HD13 ILE 44 14.511 10.307 -9.665 1192 H ALA 45 HN ALA 45 12.437 15.115 -12.512 1193 HA ALA 45 HA ALA 45 9.813 15.999 -12.207 1194 HB1 ALA 45 HB1 ALA 45 10.706 18.236 -12.518 1195 HB2 ALA 45 HB2 ALA 45 12.181 17.567 -13.216 1196 HB3 ALA 45 HB3 ALA 45 11.796 17.271 -11.520 1197 H THR 46 HN THR 46 11.874 15.987 -15.093 1198 HA THR 46 HA THR 46 10.084 17.329 -16.793 1199 HB THR 46 HB THR 46 12.171 15.303 -17.625 1200 HG1 THR 46 HG1 THR 46 13.264 16.759 -16.369 1201 HG21 THR 46 HG21 THR 46 11.041 17.727 -19.034 1202 HG22 THR 46 HG22 THR 46 10.679 16.044 -19.422 1203 HG23 THR 46 HG23 THR 46 12.311 16.671 -19.654 1204 H ALA 47 HN ALA 47 10.656 13.861 -16.263 1205 HA ALA 47 HA ALA 47 8.916 12.969 -18.311 1206 HB1 ALA 47 HB1 ALA 47 9.884 11.479 -15.876 1207 HB2 ALA 47 HB2 ALA 47 10.748 11.615 -17.407 1208 HB3 ALA 47 HB3 ALA 47 9.204 10.766 -17.339 1209 H THR 48 HN THR 48 8.364 13.913 -15.008 1210 HA THR 48 HA THR 48 5.701 12.700 -15.054 1211 HB THR 48 HB THR 48 5.605 13.437 -12.648 1212 HG1 THR 48 HG1 THR 48 8.413 13.784 -12.846 1213 HG21 THR 48 HG21 THR 48 6.211 11.145 -13.300 1214 HG22 THR 48 HG22 THR 48 7.075 11.657 -11.853 1215 HG23 THR 48 HG23 THR 48 7.903 11.628 -13.409 1216 H GLY 49 HN GLY 49 7.122 15.609 -15.854 1217 HA2 GLY 49 HA2 GLY 49 6.100 17.537 -16.615 1218 HA3 GLY 49 HA1 GLY 49 4.550 16.862 -16.135 1219 H MET 50 HN MET 50 7.352 17.322 -14.034 1220 HA MET 50 HA MET 50 5.938 19.532 -12.714 1221 HB2 MET 50 HB2 MET 50 6.467 18.613 -10.504 1222 HB3 MET 50 HB1 MET 50 5.439 17.520 -11.418 1223 HG2 MET 50 HG2 MET 50 7.407 16.164 -11.970 1224 HG3 MET 50 HG1 MET 50 8.407 17.252 -11.010 1225 HE1 MET 50 HE1 MET 50 5.577 14.506 -10.938 1226 HE2 MET 50 HE2 MET 50 4.761 15.943 -10.320 1227 HE3 MET 50 HE3 MET 50 5.076 14.578 -9.248 1228 H ASN 51 HN ASN 51 7.472 20.505 -10.970 1229 HA ASN 51 HA ASN 51 9.986 21.071 -12.321 1230 HB2 ASN 51 HB2 ASN 51 8.714 22.985 -11.564 1231 HB3 ASN 51 HB1 ASN 51 8.637 22.344 -9.927 1232 HD21 ASN 51 HD21 ASN 51 10.710 23.780 -12.351 1233 HD22 ASN 51 HD22 ASN 51 11.957 24.285 -11.255 1234 H LEU 52 HN LEU 52 12.016 21.100 -11.118 1235 HA LEU 52 HA LEU 52 12.633 18.686 -9.931 1236 HB2 LEU 52 HB2 LEU 52 14.008 21.346 -9.894 1237 HB3 LEU 52 HB1 LEU 52 14.656 20.007 -8.970 1238 HG LEU 52 HG LEU 52 14.752 18.689 -11.117 1239 HD11 LEU 52 HD11 LEU 52 14.213 21.387 -12.345 1240 HD12 LEU 52 HD12 LEU 52 13.148 19.982 -12.413 1241 HD13 LEU 52 HD13 LEU 52 14.720 19.938 -13.212 1242 HD21 LEU 52 HD21 LEU 52 16.791 19.795 -11.890 1243 HD22 LEU 52 HD22 LEU 52 16.724 19.716 -10.129 1244 HD23 LEU 52 HD23 LEU 52 16.365 21.231 -10.959 1245 H THR 53 HN THR 53 11.839 21.760 -8.332 1246 HA THR 53 HA THR 53 12.324 20.850 -5.700 1247 HB THR 53 HB THR 53 10.429 23.037 -6.593 1248 HG1 THR 53 HG1 THR 53 12.178 24.331 -6.686 1249 HG21 THR 53 HG21 THR 53 10.123 22.385 -4.245 1250 HG22 THR 53 HG22 THR 53 10.846 23.989 -4.372 1251 HG23 THR 53 HG23 THR 53 11.851 22.599 -3.960 1252 H THR 54 HN THR 54 9.398 20.918 -7.701 1253 HA THR 54 HA THR 54 7.598 19.917 -5.791 1254 HB THR 54 HB THR 54 7.496 19.350 -8.759 1255 HG1 THR 54 HG1 THR 54 7.355 21.738 -7.406 1256 HG21 THR 54 HG21 THR 54 5.063 19.406 -8.393 1257 HG22 THR 54 HG22 THR 54 5.335 19.661 -6.669 1258 HG23 THR 54 HG23 THR 54 5.843 18.152 -7.429 1259 H ALA 55 HN ALA 55 9.639 18.308 -8.191 1260 HA ALA 55 HA ALA 55 8.829 15.674 -7.646 1261 HB1 ALA 55 HB1 ALA 55 10.861 15.004 -8.818 1262 HB2 ALA 55 HB2 ALA 55 11.473 16.655 -8.713 1263 HB3 ALA 55 HB3 ALA 55 10.034 16.306 -9.674 1264 H SER 56 HN SER 56 11.583 17.571 -6.436 1265 HA SER 56 HA SER 56 12.779 15.624 -4.856 1266 HB2 SER 56 HB2 SER 56 13.779 17.833 -5.402 1267 HB3 SER 56 HB1 SER 56 12.651 18.599 -4.284 1268 HG SER 56 HG SER 56 14.777 18.136 -3.405 1269 H ALA 57 HN ALA 57 10.149 17.861 -4.049 1270 HA ALA 57 HA ALA 57 9.933 17.230 -1.325 1271 HB1 ALA 57 HB1 ALA 57 8.809 19.150 -2.329 1272 HB2 ALA 57 HB2 ALA 57 7.658 18.122 -1.474 1273 HB3 ALA 57 HB3 ALA 57 7.751 18.069 -3.235 1274 H ASN 58 HN ASN 58 8.277 15.823 -4.145 1275 HA ASN 58 HA ASN 58 6.800 13.915 -2.645 1276 HB2 ASN 58 HB2 ASN 58 7.492 14.128 -5.568 1277 HB3 ASN 58 HB1 ASN 58 6.593 12.755 -4.930 1278 HD21 ASN 58 HD21 ASN 58 6.502 16.132 -5.705 1279 HD22 ASN 58 HD22 ASN 58 4.798 16.338 -5.484 1280 H LEU 59 HN LEU 59 9.926 13.864 -4.235 1281 HA LEU 59 HA LEU 59 10.466 11.117 -3.991 1282 HB2 LEU 59 HB2 LEU 59 12.307 13.503 -4.078 1283 HB3 LEU 59 HB1 LEU 59 12.871 11.843 -4.137 1284 HG LEU 59 HG LEU 59 10.990 13.057 -6.163 1285 HD11 LEU 59 HD11 LEU 59 12.924 13.131 -7.657 1286 HD12 LEU 59 HD12 LEU 59 13.969 12.622 -6.330 1287 HD13 LEU 59 HD13 LEU 59 13.144 14.180 -6.257 1288 HD21 LEU 59 HD21 LEU 59 11.562 11.084 -7.485 1289 HD22 LEU 59 HD22 LEU 59 10.822 10.633 -5.947 1290 HD23 LEU 59 HD23 LEU 59 12.566 10.485 -6.164 1291 H GLN 60 HN GLN 60 10.949 13.816 -1.771 1292 HA GLN 60 HA GLN 60 12.375 12.326 0.185 1293 HB2 GLN 60 HB2 GLN 60 11.497 15.006 -0.153 1294 HB3 GLN 60 HB1 GLN 60 10.900 14.451 1.403 1295 HG2 GLN 60 HG2 GLN 60 12.973 15.423 1.852 1296 HG3 GLN 60 HG1 GLN 60 13.261 13.687 1.889 1297 HE21 GLN 60 HE21 GLN 60 13.201 13.520 -1.072 1298 HE22 GLN 60 HE22 GLN 60 14.718 14.161 -1.598 1299 H ALA 61 HN ALA 61 8.967 12.891 -0.438 1300 HA ALA 61 HA ALA 61 7.995 11.761 1.980 1301 HB1 ALA 61 HB1 ALA 61 6.627 12.021 -0.698 1302 HB2 ALA 61 HB2 ALA 61 6.622 13.225 0.592 1303 HB3 ALA 61 HB3 ALA 61 5.835 11.667 0.837 1304 H LEU 62 HN LEU 62 8.636 10.442 -1.240 1305 HA LEU 62 HA LEU 62 7.749 7.808 -0.647 1306 HB2 LEU 62 HB2 LEU 62 9.685 8.796 -2.745 1307 HB3 LEU 62 HB1 LEU 62 9.010 7.179 -2.689 1308 HG LEU 62 HG LEU 62 7.385 9.700 -3.039 1309 HD11 LEU 62 HD11 LEU 62 8.811 9.315 -4.970 1310 HD12 LEU 62 HD12 LEU 62 7.129 8.961 -5.363 1311 HD13 LEU 62 HD13 LEU 62 8.261 7.641 -5.064 1312 HD21 LEU 62 HD21 LEU 62 5.576 8.174 -3.609 1313 HD22 LEU 62 HD22 LEU 62 6.170 7.857 -1.977 1314 HD23 LEU 62 HD23 LEU 62 6.630 6.794 -3.305 1315 H LYS 63 HN LYS 63 10.744 9.530 -0.191 1316 HA LYS 63 HA LYS 63 12.366 7.237 0.295 1317 HB2 LYS 63 HB2 LYS 63 13.224 9.479 -0.399 1318 HB3 LYS 63 HB1 LYS 63 12.829 10.079 1.206 1319 HG2 LYS 63 HG2 LYS 63 14.414 8.566 2.209 1320 HG3 LYS 63 HG1 LYS 63 14.754 7.835 0.639 1321 HD2 LYS 63 HD2 LYS 63 15.562 10.037 -0.160 1322 HD3 LYS 63 HD1 LYS 63 15.318 10.684 1.465 1323 HE2 LYS 63 HE2 LYS 63 17.108 8.345 0.818 1324 HE3 LYS 63 HE1 LYS 63 17.669 10.008 0.963 1325 HZ1 LYS 63 HZ1 LYS 63 17.929 8.593 2.986 1326 HZ2 LYS 63 HZ2 LYS 63 16.242 8.596 3.149 1327 HZ3 LYS 63 HZ3 LYS 63 17.110 10.053 3.237 1328 H SER 64 HN SER 64 10.491 9.423 2.346 1329 HA SER 64 HA SER 64 11.410 8.279 4.790 1330 HB2 SER 64 HB2 SER 64 9.265 9.495 5.665 1331 HB3 SER 64 HB1 SER 64 10.625 10.450 5.072 1332 HG SER 64 HG SER 64 9.514 10.991 3.318 1333 H GLY 65 HN GLY 65 8.753 7.596 2.583 1334 HA2 GLY 65 HA2 GLY 65 7.484 5.641 4.218 1335 HA3 GLY 65 HA1 GLY 65 7.368 5.757 2.466 1336 H GLY 66 HN GLY 66 10.383 5.645 2.342 1337 HA2 GLY 66 HA2 GLY 66 12.098 4.052 2.619 1338 HA3 GLY 66 HA1 GLY 66 10.903 2.898 3.190 1339 H LEU 67 HN LEU 67 10.346 4.745 0.289 1340 HA LEU 67 HA LEU 67 10.286 2.236 -1.198 1341 HB2 LEU 67 HB2 LEU 67 9.261 4.992 -1.858 1342 HB3 LEU 67 HB1 LEU 67 9.231 3.666 -3.000 1343 HG LEU 67 HG LEU 67 7.063 3.773 -2.120 1344 HD11 LEU 67 HD11 LEU 67 8.555 1.631 -0.625 1345 HD12 LEU 67 HD12 LEU 67 7.849 1.510 -2.238 1346 HD13 LEU 67 HD13 LEU 67 6.806 1.691 -0.828 1347 HD21 LEU 67 HD21 LEU 67 7.470 5.237 -0.237 1348 HD22 LEU 67 HD22 LEU 67 8.267 3.928 0.638 1349 HD23 LEU 67 HD23 LEU 67 6.544 3.824 0.274 1350 H VAL 68 HN VAL 68 11.764 5.469 -1.485 1351 HA VAL 68 HA VAL 68 13.487 4.342 -3.592 1352 HB VAL 68 HB VAL 68 13.715 6.607 -4.518 1353 HG11 VAL 68 HG11 VAL 68 12.038 5.141 -5.454 1354 HG12 VAL 68 HG12 VAL 68 11.440 6.798 -5.441 1355 HG13 VAL 68 HG13 VAL 68 10.871 5.646 -4.233 1356 HG21 VAL 68 HG21 VAL 68 13.331 7.916 -2.512 1357 HG22 VAL 68 HG22 VAL 68 11.657 7.366 -2.449 1358 HG23 VAL 68 HG23 VAL 68 12.197 8.391 -3.777 1359 H GLU 69 HN GLU 69 15.624 5.103 -3.759 1360 HA GLU 69 HA GLU 69 16.724 6.227 -1.269 1361 HB2 GLU 69 HB2 GLU 69 17.955 4.368 -3.300 1362 HB3 GLU 69 HB1 GLU 69 18.905 5.221 -2.092 1363 HG2 GLU 69 HG2 GLU 69 17.466 4.131 -0.348 1364 HG3 GLU 69 HG1 GLU 69 16.797 3.134 -1.642 1365 H ALA 70 HN ALA 70 18.727 7.525 -1.605 1366 HA ALA 70 HA ALA 70 18.606 9.039 -4.129 1367 HB1 ALA 70 HB1 ALA 70 18.916 11.112 -2.915 1368 HB2 ALA 70 HB2 ALA 70 18.972 10.236 -1.384 1369 HB3 ALA 70 HB3 ALA 70 17.478 10.280 -2.321 1370 H ARG 71 HN ARG 71 20.491 9.257 -5.116 1371 HA ARG 71 HA ARG 71 22.958 9.112 -3.510 1372 HB2 ARG 71 HB2 ARG 71 22.503 8.043 -6.302 1373 HB3 ARG 71 HB1 ARG 71 24.075 8.154 -5.529 1374 HG2 ARG 71 HG2 ARG 71 21.755 6.427 -4.689 1375 HG3 ARG 71 HG1 ARG 71 23.286 5.899 -5.392 1376 HD2 ARG 71 HD2 ARG 71 24.352 7.058 -3.343 1377 HD3 ARG 71 HD1 ARG 71 22.733 6.982 -2.653 1378 HE ARG 71 HE ARG 71 24.527 4.742 -3.203 1379 HH11 ARG 71 HH11 ARG 71 21.339 5.795 -2.172 1380 HH12 ARG 71 HH12 ARG 71 20.957 4.292 -1.381 1381 HH21 ARG 71 HH21 ARG 71 24.041 2.786 -2.135 1382 HH22 ARG 71 HH22 ARG 71 22.498 2.593 -1.349 1383 H ARG 72 HN ARG 72 23.816 11.082 -3.447 1384 HA ARG 72 HA ARG 72 23.317 12.950 -5.641 1385 HB2 ARG 72 HB2 ARG 72 23.062 13.640 -3.224 1386 HB3 ARG 72 HB1 ARG 72 24.806 13.475 -3.063 1387 HG2 ARG 72 HG2 ARG 72 24.807 15.080 -5.153 1388 HG3 ARG 72 HG1 ARG 72 23.219 15.514 -4.522 1389 HD2 ARG 72 HD2 ARG 72 25.838 15.636 -3.035 1390 HD3 ARG 72 HD1 ARG 72 24.934 17.009 -3.666 1391 HE ARG 72 HE ARG 72 24.101 15.300 -1.409 1392 HH11 ARG 72 HH11 ARG 72 23.773 18.245 -3.270 1393 HH12 ARG 72 HH12 ARG 72 22.957 19.108 -2.002 1394 HH21 ARG 72 HH21 ARG 72 23.038 16.422 0.258 1395 HH22 ARG 72 HH22 ARG 72 22.550 18.072 0.016 1396 H GLU 73 HN GLU 73 24.724 13.130 -7.255 1397 HA GLU 73 HA GLU 73 27.581 12.829 -6.635 1398 HB2 GLU 73 HB2 GLU 73 26.210 11.749 -9.102 1399 HB3 GLU 73 HB1 GLU 73 27.943 11.736 -8.810 1400 HG2 GLU 73 HG2 GLU 73 27.392 10.372 -6.717 1401 HG3 GLU 73 HG1 GLU 73 25.801 10.150 -7.445 1402 H GLY 74 HN GLY 74 28.743 14.515 -7.231 1403 HA2 GLY 74 HA2 GLY 74 29.400 16.409 -8.384 1404 HA3 GLY 74 HA1 GLY 74 28.162 16.059 -9.586 1405 H THR 75 HN THR 75 26.297 17.177 -9.551 1406 HA THR 75 HA THR 75 25.655 18.689 -7.110 1407 HB THR 75 HB THR 75 26.607 20.237 -8.796 1408 HG1 THR 75 HG1 THR 75 23.903 20.419 -7.999 1409 HG21 THR 75 HG21 THR 75 24.222 19.446 -10.474 1410 HG22 THR 75 HG22 THR 75 25.897 19.014 -10.815 1411 HG23 THR 75 HG23 THR 75 25.398 20.704 -10.860 1412 H ARG 76 HN ARG 76 24.739 16.286 -9.100 1413 HA ARG 76 HA ARG 76 21.879 16.982 -9.012 1414 HB2 ARG 76 HB2 ARG 76 23.175 14.876 -10.745 1415 HB3 ARG 76 HB1 ARG 76 21.535 15.498 -10.867 1416 HG2 ARG 76 HG2 ARG 76 22.426 17.687 -11.512 1417 HG3 ARG 76 HG1 ARG 76 24.063 17.032 -11.416 1418 HD2 ARG 76 HD2 ARG 76 23.140 15.243 -13.068 1419 HD3 ARG 76 HD1 ARG 76 21.898 16.451 -13.391 1420 HE ARG 76 HE ARG 76 24.668 17.334 -13.564 1421 HH11 ARG 76 HH11 ARG 76 21.729 16.417 -15.233 1422 HH12 ARG 76 HH12 ARG 76 22.311 16.931 -16.785 1423 HH21 ARG 76 HH21 ARG 76 25.418 18.037 -15.567 1424 HH22 ARG 76 HH22 ARG 76 24.418 17.872 -16.980 1425 H GLN 77 HN GLN 77 20.395 15.449 -8.303 1426 HA GLN 77 HA GLN 77 21.555 13.324 -6.638 1427 HB2 GLN 77 HB2 GLN 77 18.852 14.653 -6.384 1428 HB3 GLN 77 HB1 GLN 77 19.508 13.434 -5.302 1429 HG2 GLN 77 HG2 GLN 77 21.321 14.990 -4.698 1430 HG3 GLN 77 HG1 GLN 77 20.580 16.213 -5.727 1431 HE21 GLN 77 HE21 GLN 77 17.873 15.318 -4.964 1432 HE22 GLN 77 HE22 GLN 77 17.607 15.946 -3.373 1433 H TYR 78 HN TYR 78 21.232 11.310 -7.254 1434 HA TYR 78 HA TYR 78 19.209 10.763 -9.303 1435 HB2 TYR 78 HB2 TYR 78 21.562 9.129 -8.329 1436 HB3 TYR 78 HB1 TYR 78 20.424 8.594 -9.558 1437 HD1 TYR 78 HD2 TYR 78 22.915 11.246 -8.797 1438 HD2 TYR 78 HD1 TYR 78 20.756 9.155 -11.808 1439 HE1 TYR 78 HE2 TYR 78 24.287 12.330 -10.524 1440 HE2 TYR 78 HE1 TYR 78 22.124 10.232 -13.544 1441 HH TYR 78 HH TYR 78 23.523 12.085 -13.908 1442 H TYR 79 HN TYR 79 17.393 9.746 -8.798 1443 HA TYR 79 HA TYR 79 17.258 8.343 -6.213 1444 HB2 TYR 79 HB2 TYR 79 15.152 9.846 -7.758 1445 HB3 TYR 79 HB1 TYR 79 14.738 8.706 -6.484 1446 HD1 TYR 79 HD1 TYR 79 16.623 11.843 -7.154 1447 HD2 TYR 79 HD2 TYR 79 14.776 9.363 -4.229 1448 HE1 TYR 79 HE1 TYR 79 16.884 13.625 -5.481 1449 HE2 TYR 79 HE2 TYR 79 15.033 11.140 -2.552 1450 HH TYR 79 HH TYR 79 16.559 13.141 -2.197 1451 H ARG 80 HN ARG 80 16.178 6.369 -6.121 1452 HA ARG 80 HA ARG 80 15.114 5.128 -8.463 1453 HB2 ARG 80 HB2 ARG 80 16.883 3.194 -8.219 1454 HB3 ARG 80 HB1 ARG 80 17.209 4.585 -9.236 1455 HG2 ARG 80 HG2 ARG 80 19.185 4.155 -8.027 1456 HG3 ARG 80 HG1 ARG 80 18.460 5.582 -7.295 1457 HD2 ARG 80 HD2 ARG 80 19.259 4.154 -5.548 1458 HD3 ARG 80 HD1 ARG 80 17.499 4.120 -5.533 1459 HE ARG 80 HE ARG 80 17.544 1.895 -6.153 1460 HH11 ARG 80 HH11 ARG 80 20.776 3.247 -6.352 1461 HH12 ARG 80 HH12 ARG 80 21.550 1.698 -6.462 1462 HH21 ARG 80 HH21 ARG 80 18.587 -0.150 -6.300 1463 HH22 ARG 80 HH22 ARG 80 20.319 -0.209 -6.419 1464 H ILE 81 HN ILE 81 14.396 2.902 -8.038 1465 HA ILE 81 HA ILE 81 13.109 2.561 -5.590 1466 HB ILE 81 HB ILE 81 13.953 0.469 -7.605 1467 HG12 ILE 81 HG12 ILE 81 12.450 2.157 -8.518 1468 HG13 ILE 81 HG11 ILE 81 11.613 0.616 -8.363 1469 HG21 ILE 81 HG21 ILE 81 13.543 -0.583 -5.450 1470 HG22 ILE 81 HG22 ILE 81 12.265 -0.988 -6.597 1471 HG23 ILE 81 HG23 ILE 81 11.976 0.220 -5.344 1472 HD11 ILE 81 HD11 ILE 81 10.185 2.456 -7.697 1473 HD12 ILE 81 HD12 ILE 81 11.370 2.963 -6.493 1474 HD13 ILE 81 HD13 ILE 81 10.539 1.418 -6.317 1475 H ALA 82 HN ALA 82 13.734 1.819 -3.652 1476 HA ALA 82 HA ALA 82 16.398 1.815 -2.917 1477 HB1 ALA 82 HB1 ALA 82 15.673 0.962 -0.771 1478 HB2 ALA 82 HB2 ALA 82 14.139 0.440 -1.472 1479 HB3 ALA 82 HB3 ALA 82 14.525 2.158 -1.371 1480 H GLY 83 HN GLY 83 14.399 -1.148 -2.711 1481 HA2 GLY 83 HA2 GLY 83 16.544 -2.661 -3.951 1482 HA3 GLY 83 HA1 GLY 83 16.283 -2.985 -2.245 1483 H GLU 84 HN GLU 84 15.789 -5.102 -2.683 1484 HA GLU 84 HA GLU 84 13.998 -6.042 -4.617 1485 HB2 GLU 84 HB2 GLU 84 15.719 -7.369 -3.348 1486 HB3 GLU 84 HB1 GLU 84 14.649 -7.321 -1.955 1487 HG2 GLU 84 HG2 GLU 84 14.318 -9.413 -2.965 1488 HG3 GLU 84 HG1 GLU 84 12.916 -8.437 -3.398 1489 H ASP 85 HN ASP 85 13.532 -5.265 -1.204 1490 HA ASP 85 HA ASP 85 10.961 -6.268 -0.869 1491 HB2 ASP 85 HB2 ASP 85 10.823 -4.694 1.069 1492 HB3 ASP 85 HB1 ASP 85 12.288 -5.667 1.042 1493 H VAL 86 HN VAL 86 11.985 -3.033 -1.876 1494 HA VAL 86 HA VAL 86 9.365 -1.940 -1.980 1495 HB VAL 86 HB VAL 86 11.840 -1.013 -3.447 1496 HG11 VAL 86 HG11 VAL 86 10.721 1.168 -3.493 1497 HG12 VAL 86 HG12 VAL 86 9.297 0.445 -2.745 1498 HG13 VAL 86 HG13 VAL 86 9.797 -0.061 -4.359 1499 HG21 VAL 86 HG21 VAL 86 12.239 -1.142 -1.058 1500 HG22 VAL 86 HG22 VAL 86 10.764 -0.231 -0.743 1501 HG23 VAL 86 HG23 VAL 86 12.117 0.542 -1.568 1502 H ALA 87 HN ALA 87 11.515 -3.330 -4.424 1503 HA ALA 87 HA ALA 87 9.911 -2.759 -6.665 1504 HB1 ALA 87 HB1 ALA 87 12.279 -3.356 -6.820 1505 HB2 ALA 87 HB2 ALA 87 11.281 -4.390 -7.840 1506 HB3 ALA 87 HB3 ALA 87 11.899 -5.000 -6.305 1507 H ARG 88 HN ARG 88 10.013 -5.536 -4.487 1508 HA ARG 88 HA ARG 88 8.205 -7.172 -5.911 1509 HB2 ARG 88 HB2 ARG 88 8.848 -7.069 -2.958 1510 HB3 ARG 88 HB1 ARG 88 7.896 -8.335 -3.721 1511 HG2 ARG 88 HG2 ARG 88 9.757 -9.090 -4.986 1512 HG3 ARG 88 HG1 ARG 88 10.717 -7.684 -4.527 1513 HD2 ARG 88 HD2 ARG 88 11.464 -9.539 -3.228 1514 HD3 ARG 88 HD1 ARG 88 10.579 -8.452 -2.160 1515 HE ARG 88 HE ARG 88 8.704 -10.263 -2.971 1516 HH11 ARG 88 HH11 ARG 88 11.828 -10.454 -1.406 1517 HH12 ARG 88 HH12 ARG 88 11.487 -11.963 -0.623 1518 HH21 ARG 88 HH21 ARG 88 8.235 -12.229 -1.908 1519 HH22 ARG 88 HH22 ARG 88 9.452 -12.977 -0.916 1520 H LEU 89 HN LEU 89 7.750 -4.746 -3.394 1521 HA LEU 89 HA LEU 89 5.019 -5.237 -2.908 1522 HB2 LEU 89 HB2 LEU 89 6.699 -3.949 -1.488 1523 HB3 LEU 89 HB1 LEU 89 6.432 -2.595 -2.565 1524 HG LEU 89 HG LEU 89 4.164 -3.879 -1.051 1525 HD11 LEU 89 HD11 LEU 89 4.453 -2.127 0.641 1526 HD12 LEU 89 HD12 LEU 89 5.944 -1.613 -0.153 1527 HD13 LEU 89 HD13 LEU 89 5.842 -3.215 0.579 1528 HD21 LEU 89 HD21 LEU 89 4.546 -1.125 -2.232 1529 HD22 LEU 89 HD22 LEU 89 3.125 -1.678 -1.345 1530 HD23 LEU 89 HD23 LEU 89 3.536 -2.409 -2.897 1531 H PHE 90 HN PHE 90 6.584 -2.668 -4.841 1532 HA PHE 90 HA PHE 90 4.171 -1.502 -5.710 1533 HB2 PHE 90 HB2 PHE 90 6.315 -0.307 -5.767 1534 HB3 PHE 90 HB1 PHE 90 6.900 -1.400 -7.016 1535 HD1 PHE 90 HD1 PHE 90 4.210 1.080 -6.322 1536 HD2 PHE 90 HD2 PHE 90 6.595 -0.875 -9.255 1537 HE1 PHE 90 HE1 PHE 90 3.305 2.576 -8.051 1538 HE2 PHE 90 HE2 PHE 90 5.693 0.617 -10.989 1539 HZ PHE 90 HZ PHE 90 4.045 2.347 -10.388 1540 H ALA 91 HN ALA 91 6.208 -4.007 -7.148 1541 HA ALA 91 HA ALA 91 4.851 -4.088 -9.630 1542 HB1 ALA 91 HB1 ALA 91 6.445 -6.271 -8.292 1543 HB2 ALA 91 HB2 ALA 91 7.101 -5.004 -9.329 1544 HB3 ALA 91 HB3 ALA 91 5.993 -6.203 -9.995 1545 H LEU 92 HN LEU 92 4.465 -5.925 -6.620 1546 HA LEU 92 HA LEU 92 2.648 -7.820 -7.617 1547 HB2 LEU 92 HB2 LEU 92 3.859 -8.067 -5.484 1548 HB3 LEU 92 HB1 LEU 92 2.889 -6.779 -4.794 1549 HG LEU 92 HG LEU 92 0.863 -8.165 -5.085 1550 HD11 LEU 92 HD11 LEU 92 1.083 -10.524 -5.668 1551 HD12 LEU 92 HD12 LEU 92 2.804 -10.294 -5.976 1552 HD13 LEU 92 HD13 LEU 92 1.612 -9.489 -6.994 1553 HD21 LEU 92 HD21 LEU 92 1.379 -9.802 -3.331 1554 HD22 LEU 92 HD22 LEU 92 2.046 -8.211 -2.963 1555 HD23 LEU 92 HD23 LEU 92 3.101 -9.494 -3.561 1556 H VAL 93 HN VAL 93 2.086 -4.713 -5.977 1557 HA VAL 93 HA VAL 93 -0.735 -4.982 -5.976 1558 HB VAL 93 HB VAL 93 0.521 -3.450 -4.461 1559 HG11 VAL 93 HG11 VAL 93 1.190 -1.252 -5.225 1560 HG12 VAL 93 HG12 VAL 93 0.713 -1.657 -6.873 1561 HG13 VAL 93 HG13 VAL 93 2.062 -2.501 -6.114 1562 HG21 VAL 93 HG21 VAL 93 -1.655 -2.146 -6.091 1563 HG22 VAL 93 HG22 VAL 93 -1.151 -1.676 -4.467 1564 HG23 VAL 93 HG23 VAL 93 -1.892 -3.253 -4.740 1565 H GLN 94 HN GLN 94 1.553 -3.739 -8.334 1566 HA GLN 94 HA GLN 94 -0.407 -2.549 -10.026 1567 HB2 GLN 94 HB2 GLN 94 2.050 -2.063 -10.138 1568 HB3 GLN 94 HB1 GLN 94 2.288 -3.658 -10.839 1569 HG2 GLN 94 HG2 GLN 94 0.906 -3.049 -12.741 1570 HG3 GLN 94 HG1 GLN 94 0.601 -1.464 -12.034 1571 HE21 GLN 94 HE21 GLN 94 2.866 -3.478 -13.687 1572 HE22 GLN 94 HE22 GLN 94 4.053 -2.251 -14.005 1573 H VAL 95 HN VAL 95 1.024 -5.757 -9.767 1574 HA VAL 95 HA VAL 95 -0.154 -6.891 -12.055 1575 HB VAL 95 HB VAL 95 0.677 -8.208 -9.464 1576 HG11 VAL 95 HG11 VAL 95 -0.049 -9.487 -12.099 1577 HG12 VAL 95 HG12 VAL 95 -0.967 -9.605 -10.599 1578 HG13 VAL 95 HG13 VAL 95 0.640 -10.324 -10.709 1579 HG21 VAL 95 HG21 VAL 95 2.630 -8.934 -10.789 1580 HG22 VAL 95 HG22 VAL 95 2.522 -7.179 -10.643 1581 HG23 VAL 95 HG23 VAL 95 2.040 -7.970 -12.145 1582 H VAL 96 HN VAL 96 -1.310 -6.718 -8.674 1583 HA VAL 96 HA VAL 96 -3.646 -8.247 -9.161 1584 HB VAL 96 HB VAL 96 -4.466 -7.574 -7.031 1585 HG11 VAL 96 HG11 VAL 96 -1.460 -7.743 -6.916 1586 HG12 VAL 96 HG12 VAL 96 -2.588 -9.099 -6.963 1587 HG13 VAL 96 HG13 VAL 96 -2.558 -8.024 -5.564 1588 HG21 VAL 96 HG21 VAL 96 -4.175 -5.165 -7.203 1589 HG22 VAL 96 HG22 VAL 96 -2.429 -5.351 -7.042 1590 HG23 VAL 96 HG23 VAL 96 -3.488 -5.772 -5.697 1591 H ALA 97 HN ALA 97 -2.876 -4.900 -9.669 1592 HA ALA 97 HA ALA 97 -5.596 -4.083 -10.137 1593 HB1 ALA 97 HB1 ALA 97 -3.006 -2.740 -10.905 1594 HB2 ALA 97 HB2 ALA 97 -3.899 -2.478 -9.408 1595 HB3 ALA 97 HB3 ALA 97 -4.609 -2.004 -10.954 1596 H ASP 98 HN ASP 98 -2.772 -4.689 -12.214 1597 HA ASP 98 HA ASP 98 -4.084 -4.138 -14.644 1598 HB2 ASP 98 HB2 ASP 98 -1.665 -4.046 -14.457 1599 HB3 ASP 98 HB1 ASP 98 -1.598 -5.769 -14.098 1600 H GLU 99 HN GLU 99 -3.368 -7.241 -13.050 1601 HA GLU 99 HA GLU 99 -4.427 -8.791 -15.184 1602 HB2 GLU 99 HB2 GLU 99 -2.752 -9.576 -13.476 1603 HB3 GLU 99 HB1 GLU 99 -4.073 -9.670 -12.320 1604 HG2 GLU 99 HG2 GLU 99 -5.196 -11.318 -13.678 1605 HG3 GLU 99 HG1 GLU 99 -3.954 -11.177 -14.920 1606 H HIS 100 HN HIS 100 -5.845 -7.225 -12.438 1607 HA HIS 100 HA HIS 100 -8.331 -8.711 -12.735 1608 HB2 HIS 100 HB2 HIS 100 -7.268 -6.818 -10.710 1609 HB3 HIS 100 HB1 HIS 100 -9.015 -6.847 -10.941 1610 HD1 HIS 100 HD1 HIS 100 -10.172 -9.235 -10.615 1611 HD2 HIS 100 HD2 HIS 100 -6.277 -8.880 -9.189 1612 HE1 HIS 100 HE1 HIS 100 -9.839 -11.180 -9.049 1613 HE2 HIS 100 HE2 HIS 100 -7.411 -11.066 -8.383 1614 H LEU 101 HN LEU 101 -6.899 -6.170 -14.254 1615 HA LEU 101 HA LEU 101 -9.293 -4.618 -14.724 1616 HB2 LEU 101 HB2 LEU 101 -6.624 -4.066 -14.917 1617 HB3 LEU 101 HB1 LEU 101 -7.030 -4.353 -16.599 1618 HG LEU 101 HG LEU 101 -8.755 -2.602 -16.488 1619 HD11 LEU 101 HD11 LEU 101 -8.917 -1.165 -14.524 1620 HD12 LEU 101 HD12 LEU 101 -7.749 -2.178 -13.675 1621 HD13 LEU 101 HD13 LEU 101 -9.326 -2.831 -14.117 1622 HD21 LEU 101 HD21 LEU 101 -6.491 -2.015 -17.178 1623 HD22 LEU 101 HD22 LEU 101 -6.043 -1.728 -15.496 1624 HD23 LEU 101 HD23 LEU 101 -7.236 -0.692 -16.282 1625 H GLU 102 HN GLU 102 -7.833 -7.428 -15.884 1626 HA GLU 102 HA GLU 102 -9.067 -7.584 -18.449 1627 HB2 GLU 102 HB2 GLU 102 -7.132 -8.946 -17.990 1628 HB3 GLU 102 HB1 GLU 102 -7.897 -9.655 -16.578 1629 HG2 GLU 102 HG2 GLU 102 -7.853 -11.237 -18.390 1630 HG3 GLU 102 HG1 GLU 102 -9.514 -10.781 -18.026 1631 H HIS 103 HN HIS 103 -11.083 -8.218 -18.949 1632 HA HIS 103 HA HIS 103 -12.812 -9.147 -16.747 1633 HB2 HIS 103 HB2 HIS 103 -13.208 -6.762 -17.529 1634 HB3 HIS 103 HB1 HIS 103 -13.706 -7.434 -19.078 1635 HD1 HIS 103 HD1 HIS 103 -16.177 -7.178 -19.165 1636 HD2 HIS 103 HD2 HIS 103 -14.875 -8.498 -15.438 1637 HE1 HIS 103 HE1 HIS 103 -18.261 -7.623 -17.834 1638 HE2 HIS 103 HE2 HIS 103 -17.457 -8.541 -15.632 1639 H HIS 104 HN HIS 104 -11.229 -10.589 -18.718 1640 HA HIS 104 HA HIS 104 -11.383 -12.540 -19.852 1641 HB2 HIS 104 HB2 HIS 104 -13.211 -13.198 -18.364 1642 HB3 HIS 104 HB1 HIS 104 -14.364 -12.317 -19.357 1643 HD1 HIS 104 HD1 HIS 104 -15.667 -13.796 -20.820 1644 HD2 HIS 104 HD2 HIS 104 -11.862 -15.315 -20.113 1645 HE1 HIS 104 HE1 HIS 104 -15.576 -15.989 -22.044 1646 HE2 HIS 104 HE2 HIS 104 -13.345 -16.983 -21.428 1647 H HIS 105 HN HIS 105 -10.710 -10.732 -21.395 1648 HA HIS 105 HA HIS 105 -12.556 -10.678 -23.699 1649 HB2 HIS 105 HB2 HIS 105 -10.192 -8.933 -22.991 1650 HB3 HIS 105 HB1 HIS 105 -10.993 -8.879 -24.554 1651 HD1 HIS 105 HD1 HIS 105 -10.850 -6.889 -21.783 1652 HD2 HIS 105 HD2 HIS 105 -14.060 -8.619 -23.790 1653 HE1 HIS 105 HE1 HIS 105 -12.861 -5.489 -21.192 1654 HE2 HIS 105 HE2 HIS 105 -14.724 -6.408 -22.629 1655 H HIS 106 HN HIS 106 -10.515 -12.792 -22.711 1656 HA HIS 106 HA HIS 106 -8.579 -12.822 -24.849 1657 HB2 HIS 106 HB2 HIS 106 -9.133 -14.710 -22.574 1658 HB3 HIS 106 HB1 HIS 106 -8.010 -15.124 -23.862 1659 HD1 HIS 106 HD1 HIS 106 -6.314 -12.758 -24.246 1660 HD2 HIS 106 HD2 HIS 106 -7.686 -13.859 -20.475 1661 HE1 HIS 106 HE1 HIS 106 -4.715 -11.711 -22.604 1662 HE2 HIS 106 HE2 HIS 106 -5.506 -12.473 -20.330 1663 H HIS 107 HN HIS 107 -10.050 -12.848 -26.618 1664 HA HIS 107 HA HIS 107 -10.310 -15.510 -27.626 1665 HB2 HIS 107 HB2 HIS 107 -12.436 -15.311 -26.333 1666 HB3 HIS 107 HB1 HIS 107 -12.867 -13.918 -27.318 1667 HD1 HIS 107 HD1 HIS 107 -13.628 -14.361 -29.745 1668 HD2 HIS 107 HD2 HIS 107 -12.702 -17.811 -27.611 1669 HE1 HIS 107 HE1 HIS 107 -14.511 -16.267 -31.123 1670 HE2 HIS 107 HE2 HIS 107 -13.809 -18.351 -29.890 1671 H HIS 108 HN HIS 108 -9.139 -14.976 -29.389 1672 HA HIS 108 HA HIS 108 -9.973 -12.671 -30.977 1673 HB2 HIS 108 HB2 HIS 108 -7.570 -12.908 -30.605 1674 HB3 HIS 108 HB1 HIS 108 -7.601 -14.536 -31.270 1675 HD1 HIS 108 HD1 HIS 108 -6.556 -14.528 -33.497 1676 HD2 HIS 108 HD2 HIS 108 -8.753 -11.063 -32.821 1677 HE1 HIS 108 HE1 HIS 108 -6.387 -13.195 -35.622 1678 HE2 HIS 108 HE2 HIS 108 -7.851 -11.178 -35.249 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -6.731 12.647 -33.565 2 H2 MET 1 HT2 MET 1 -6.056 12.491 -35.113 3 H3 MET 1 HT3 MET 1 -6.091 14.006 -34.350 4 HA MET 1 HA MET 1 -4.594 11.641 -33.396 5 HB2 MET 1 HB2 MET 1 -2.573 12.889 -34.069 6 HB3 MET 1 HB1 MET 1 -3.595 12.487 -35.440 7 HG2 MET 1 HG2 MET 1 -4.455 14.757 -35.491 8 HG3 MET 1 HG1 MET 1 -3.483 15.169 -34.080 9 HE1 MET 1 HE1 MET 1 0.159 14.881 -35.492 10 HE2 MET 1 HE2 MET 1 -0.770 13.638 -34.654 11 HE3 MET 1 HE3 MET 1 -0.830 15.310 -34.096 12 H ALA 2 HN ALA 2 -4.019 11.733 -31.349 13 HA ALA 2 HA ALA 2 -3.404 14.194 -30.005 14 HB1 ALA 2 HB1 ALA 2 -5.860 12.678 -29.110 15 HB2 ALA 2 HB2 ALA 2 -5.856 14.260 -29.888 16 HB3 ALA 2 HB3 ALA 2 -5.134 14.063 -28.290 17 H GLY 3 HN GLY 3 -4.587 10.929 -29.190 18 HA2 GLY 3 HA2 GLY 3 -2.981 9.249 -28.405 19 HA3 GLY 3 HA1 GLY 3 -2.131 10.555 -27.585 20 H GLN 4 HN GLN 4 -2.643 8.600 -25.949 21 HA GLN 4 HA GLN 4 -4.989 9.541 -24.443 22 HB2 GLN 4 HB2 GLN 4 -5.392 7.328 -25.605 23 HB3 GLN 4 HB1 GLN 4 -4.149 6.647 -24.567 24 HG2 GLN 4 HG2 GLN 4 -5.485 7.328 -22.597 25 HG3 GLN 4 HG1 GLN 4 -6.754 7.872 -23.694 26 HE21 GLN 4 HE21 GLN 4 -8.275 6.434 -22.984 27 HE22 GLN 4 HE22 GLN 4 -8.172 4.728 -23.265 28 H SER 5 HN SER 5 -2.683 6.964 -23.694 29 HA SER 5 HA SER 5 -1.044 6.720 -22.157 30 HB2 SER 5 HB2 SER 5 -0.158 8.871 -23.001 31 HB3 SER 5 HB1 SER 5 -1.144 9.725 -21.817 32 HG SER 5 HG SER 5 0.131 9.051 -20.223 33 H ASP 6 HN ASP 6 -3.778 8.703 -21.267 34 HA ASP 6 HA ASP 6 -3.515 8.695 -18.484 35 HB2 ASP 6 HB2 ASP 6 -5.075 10.113 -19.843 36 HB3 ASP 6 HB1 ASP 6 -6.098 8.695 -20.052 37 H ARG 7 HN ARG 7 -4.236 6.133 -20.578 38 HA ARG 7 HA ARG 7 -5.990 4.557 -19.097 39 HB2 ARG 7 HB2 ARG 7 -5.395 4.053 -21.406 40 HB3 ARG 7 HB1 ARG 7 -3.743 3.691 -20.922 41 HG2 ARG 7 HG2 ARG 7 -4.481 1.776 -19.664 42 HG3 ARG 7 HG1 ARG 7 -6.170 2.174 -19.987 43 HD2 ARG 7 HD2 ARG 7 -5.369 0.386 -21.450 44 HD3 ARG 7 HD1 ARG 7 -5.820 1.825 -22.361 45 HE ARG 7 HE ARG 7 -3.028 1.768 -21.724 46 HH11 ARG 7 HH11 ARG 7 -5.466 0.648 -23.965 47 HH12 ARG 7 HH12 ARG 7 -4.325 0.281 -25.226 48 HH21 ARG 7 HH21 ARG 7 -1.535 1.364 -23.391 49 HH22 ARG 7 HH22 ARG 7 -2.088 0.744 -24.920 50 H LYS 8 HN LYS 8 -2.446 4.830 -18.881 51 HA LYS 8 HA LYS 8 -2.214 2.702 -17.000 52 HB2 LYS 8 HB2 LYS 8 0.071 3.315 -16.750 53 HB3 LYS 8 HB1 LYS 8 -0.334 3.533 -18.444 54 HG2 LYS 8 HG2 LYS 8 -0.459 5.928 -18.144 55 HG3 LYS 8 HG1 LYS 8 -0.178 5.750 -16.408 56 HD2 LYS 8 HD2 LYS 8 2.002 4.650 -16.969 57 HD3 LYS 8 HD1 LYS 8 1.721 5.089 -18.654 58 HE2 LYS 8 HE2 LYS 8 1.655 7.453 -18.027 59 HE3 LYS 8 HE1 LYS 8 1.919 7.016 -16.338 60 HZ1 LYS 8 HZ1 LYS 8 3.804 6.555 -18.590 61 HZ2 LYS 8 HZ2 LYS 8 4.058 6.036 -16.995 62 HZ3 LYS 8 HZ3 LYS 8 3.986 7.695 -17.347 63 H ALA 9 HN ALA 9 -2.789 6.128 -16.770 64 HA ALA 9 HA ALA 9 -2.240 6.470 -14.030 65 HB1 ALA 9 HB1 ALA 9 -3.531 8.522 -14.201 66 HB2 ALA 9 HB2 ALA 9 -4.200 7.995 -15.746 67 HB3 ALA 9 HB3 ALA 9 -2.476 8.343 -15.605 68 H ALA 10 HN ALA 10 -5.090 5.398 -15.785 69 HA ALA 10 HA ALA 10 -6.888 5.400 -13.617 70 HB1 ALA 10 HB1 ALA 10 -8.253 3.910 -14.975 71 HB2 ALA 10 HB2 ALA 10 -6.887 3.622 -16.052 72 HB3 ALA 10 HB3 ALA 10 -7.608 5.230 -15.951 73 H LEU 11 HN LEU 11 -4.467 3.101 -14.696 74 HA LEU 11 HA LEU 11 -5.336 0.944 -13.035 75 HB2 LEU 11 HB2 LEU 11 -2.626 1.481 -14.261 76 HB3 LEU 11 HB1 LEU 11 -3.126 -0.031 -13.531 77 HG LEU 11 HG LEU 11 -4.353 1.196 -16.004 78 HD11 LEU 11 HD11 LEU 11 -3.261 -0.648 -17.185 79 HD12 LEU 11 HD12 LEU 11 -2.493 -1.156 -15.681 80 HD13 LEU 11 HD13 LEU 11 -2.085 0.403 -16.396 81 HD21 LEU 11 HD21 LEU 11 -5.519 -0.942 -16.214 82 HD22 LEU 11 HD22 LEU 11 -5.947 -0.134 -14.707 83 HD23 LEU 11 HD23 LEU 11 -4.814 -1.484 -14.692 84 H LEU 12 HN LEU 12 -2.848 3.434 -12.801 85 HA LEU 12 HA LEU 12 -1.873 2.680 -10.255 86 HB2 LEU 12 HB2 LEU 12 -1.813 5.384 -11.600 87 HB3 LEU 12 HB1 LEU 12 -0.832 4.902 -10.230 88 HG LEU 12 HG LEU 12 -0.678 3.706 -13.002 89 HD11 LEU 12 HD11 LEU 12 1.479 4.816 -13.141 90 HD12 LEU 12 HD12 LEU 12 1.235 5.524 -11.543 91 HD13 LEU 12 HD13 LEU 12 0.190 5.993 -12.885 92 HD21 LEU 12 HD21 LEU 12 1.319 2.561 -12.145 93 HD22 LEU 12 HD22 LEU 12 -0.143 2.066 -11.292 94 HD23 LEU 12 HD23 LEU 12 0.980 3.195 -10.534 95 H ASP 13 HN ASP 13 -4.511 4.684 -11.336 96 HA ASP 13 HA ASP 13 -5.072 6.030 -8.937 97 HB2 ASP 13 HB2 ASP 13 -6.029 6.625 -11.149 98 HB3 ASP 13 HB1 ASP 13 -7.022 5.173 -11.083 99 H GLN 14 HN GLN 14 -6.207 2.916 -10.201 100 HA GLN 14 HA GLN 14 -7.905 2.285 -8.038 101 HB2 GLN 14 HB2 GLN 14 -7.946 1.060 -10.181 102 HB3 GLN 14 HB1 GLN 14 -6.357 0.394 -9.828 103 HG2 GLN 14 HG2 GLN 14 -8.117 -1.220 -9.367 104 HG3 GLN 14 HG1 GLN 14 -7.262 -0.778 -7.892 105 HE21 GLN 14 HE21 GLN 14 -8.972 -1.372 -6.560 106 HE22 GLN 14 HE22 GLN 14 -10.445 -0.464 -6.469 107 H VAL 15 HN VAL 15 -4.478 1.656 -8.631 108 HA VAL 15 HA VAL 15 -3.898 0.192 -6.319 109 HB VAL 15 HB VAL 15 -2.132 2.123 -7.838 110 HG11 VAL 15 HG11 VAL 15 -0.249 0.921 -6.828 111 HG12 VAL 15 HG12 VAL 15 -1.379 -0.021 -5.855 112 HG13 VAL 15 HG13 VAL 15 -1.242 1.720 -5.608 113 HG21 VAL 15 HG21 VAL 15 -2.974 0.307 -9.221 114 HG22 VAL 15 HG22 VAL 15 -2.418 -0.873 -8.034 115 HG23 VAL 15 HG23 VAL 15 -1.247 0.109 -8.916 116 H ALA 16 HN ALA 16 -3.981 3.668 -6.913 117 HA ALA 16 HA ALA 16 -3.008 4.570 -4.461 118 HB1 ALA 16 HB1 ALA 16 -5.064 5.896 -6.225 119 HB2 ALA 16 HB2 ALA 16 -3.315 6.009 -6.419 120 HB3 ALA 16 HB3 ALA 16 -4.086 6.684 -4.984 121 H ARG 17 HN ARG 17 -6.289 3.615 -5.398 122 HA ARG 17 HA ARG 17 -7.529 4.485 -3.001 123 HB2 ARG 17 HB2 ARG 17 -8.330 2.603 -5.188 124 HB3 ARG 17 HB1 ARG 17 -9.281 2.672 -3.711 125 HG2 ARG 17 HG2 ARG 17 -9.553 5.105 -4.049 126 HG3 ARG 17 HG1 ARG 17 -8.704 4.954 -5.587 127 HD2 ARG 17 HD2 ARG 17 -11.181 3.379 -4.925 128 HD3 ARG 17 HD1 ARG 17 -11.238 4.968 -5.686 129 HE ARG 17 HE ARG 17 -10.050 2.548 -6.879 130 HH11 ARG 17 HH11 ARG 17 -11.496 5.716 -7.162 131 HH12 ARG 17 HH12 ARG 17 -11.505 5.699 -8.896 132 HH21 ARG 17 HH21 ARG 17 -10.122 2.487 -9.165 133 HH22 ARG 17 HH22 ARG 17 -10.712 3.870 -10.038 134 H VAL 18 HN VAL 18 -6.151 1.372 -3.977 135 HA VAL 18 HA VAL 18 -6.868 -0.085 -1.676 136 HB VAL 18 HB VAL 18 -4.382 -0.449 -3.365 137 HG11 VAL 18 HG11 VAL 18 -4.272 -1.683 -1.279 138 HG12 VAL 18 HG12 VAL 18 -4.514 -2.792 -2.628 139 HG13 VAL 18 HG13 VAL 18 -5.868 -2.372 -1.577 140 HG21 VAL 18 HG21 VAL 18 -7.132 -1.645 -3.707 141 HG22 VAL 18 HG22 VAL 18 -5.700 -2.069 -4.648 142 HG23 VAL 18 HG23 VAL 18 -6.379 -0.445 -4.756 143 H GLY 19 HN GLY 19 -3.884 1.655 -2.493 144 HA2 GLY 19 HA2 GLY 19 -2.591 1.239 -0.017 145 HA3 GLY 19 HA1 GLY 19 -2.192 2.487 -1.189 146 H LYS 20 HN LYS 20 -4.921 3.624 -1.076 147 HA LYS 20 HA LYS 20 -4.413 5.543 0.949 148 HB2 LYS 20 HB2 LYS 20 -5.712 5.835 -1.251 149 HB3 LYS 20 HB1 LYS 20 -7.081 5.143 -0.392 150 HG2 LYS 20 HG2 LYS 20 -6.962 6.951 1.249 151 HG3 LYS 20 HG1 LYS 20 -5.595 7.648 0.377 152 HD2 LYS 20 HD2 LYS 20 -7.098 7.751 -1.654 153 HD3 LYS 20 HD1 LYS 20 -8.435 7.349 -0.577 154 HE2 LYS 20 HE2 LYS 20 -6.627 9.752 -0.352 155 HE3 LYS 20 HE1 LYS 20 -8.291 9.756 -0.932 156 HZ1 LYS 20 HZ1 LYS 20 -9.001 9.002 1.272 157 HZ2 LYS 20 HZ2 LYS 20 -8.173 10.481 1.354 158 HZ3 LYS 20 HZ3 LYS 20 -7.392 9.049 1.810 159 H ALA 21 HN ALA 21 -6.493 2.714 0.765 160 HA ALA 21 HA ALA 21 -7.875 3.256 3.215 161 HB1 ALA 21 HB1 ALA 21 -8.863 1.846 1.472 162 HB2 ALA 21 HB2 ALA 21 -8.742 0.987 3.007 163 HB3 ALA 21 HB3 ALA 21 -7.590 0.649 1.716 164 H LEU 22 HN LEU 22 -5.000 1.478 2.290 165 HA LEU 22 HA LEU 22 -4.594 0.345 4.915 166 HB2 LEU 22 HB2 LEU 22 -3.876 -0.797 2.849 167 HB3 LEU 22 HB1 LEU 22 -2.751 0.505 2.524 168 HG LEU 22 HG LEU 22 -2.424 -0.902 5.118 169 HD11 LEU 22 HD11 LEU 22 -1.623 -2.151 2.489 170 HD12 LEU 22 HD12 LEU 22 -2.907 -2.739 3.546 171 HD13 LEU 22 HD13 LEU 22 -1.232 -2.755 4.099 172 HD21 LEU 22 HD21 LEU 22 -0.067 -0.597 4.590 173 HD22 LEU 22 HD22 LEU 22 -0.936 0.927 4.411 174 HD23 LEU 22 HD23 LEU 22 -0.484 -0.004 2.983 175 H ALA 23 HN ALA 23 -3.968 3.333 3.437 176 HA ALA 23 HA ALA 23 -1.495 3.997 4.653 177 HB1 ALA 23 HB1 ALA 23 -2.312 5.064 2.604 178 HB2 ALA 23 HB2 ALA 23 -1.897 6.241 3.850 179 HB3 ALA 23 HB3 ALA 23 -3.588 5.850 3.533 180 H ASN 24 HN ASN 24 -1.531 3.733 6.825 181 HA ASN 24 HA ASN 24 -1.526 4.492 8.945 182 HB2 ASN 24 HB2 ASN 24 -1.006 6.667 8.095 183 HB3 ASN 24 HB1 ASN 24 -2.688 6.970 7.674 184 HD21 ASN 24 HD21 ASN 24 -0.466 6.491 10.363 185 HD22 ASN 24 HD22 ASN 24 -1.398 7.386 11.516 186 H GLY 25 HN GLY 25 -2.798 3.193 10.088 187 HA2 GLY 25 HA2 GLY 25 -5.085 4.152 11.292 188 HA3 GLY 25 HA1 GLY 25 -5.633 3.212 9.916 189 H ARG 26 HN ARG 26 -5.906 2.830 12.849 190 HA ARG 26 HA ARG 26 -4.571 0.324 13.332 191 HB2 ARG 26 HB2 ARG 26 -6.386 2.116 14.797 192 HB3 ARG 26 HB1 ARG 26 -6.633 0.407 15.126 193 HG2 ARG 26 HG2 ARG 26 -5.074 1.570 16.684 194 HG3 ARG 26 HG1 ARG 26 -4.403 0.148 15.895 195 HD2 ARG 26 HD2 ARG 26 -2.764 1.925 15.937 196 HD3 ARG 26 HD1 ARG 26 -3.263 1.603 14.278 197 HE ARG 26 HE ARG 26 -4.898 3.633 15.040 198 HH11 ARG 26 HH11 ARG 26 -1.421 3.178 15.091 199 HH12 ARG 26 HH12 ARG 26 -1.060 4.866 14.890 200 HH21 ARG 26 HH21 ARG 26 -4.432 5.855 14.746 201 HH22 ARG 26 HH22 ARG 26 -2.774 6.386 14.690 202 H ARG 27 HN ARG 27 -7.087 1.331 11.421 203 HA ARG 27 HA ARG 27 -8.914 -0.772 11.424 204 HB2 ARG 27 HB2 ARG 27 -7.790 0.746 9.056 205 HB3 ARG 27 HB1 ARG 27 -9.238 -0.248 9.020 206 HG2 ARG 27 HG2 ARG 27 -10.369 1.235 10.523 207 HG3 ARG 27 HG1 ARG 27 -8.896 2.179 10.763 208 HD2 ARG 27 HD2 ARG 27 -8.914 2.873 8.450 209 HD3 ARG 27 HD1 ARG 27 -10.300 1.834 8.116 210 HE ARG 27 HE ARG 27 -11.264 3.425 10.043 211 HH11 ARG 27 HH11 ARG 27 -9.430 4.202 7.167 212 HH12 ARG 27 HH12 ARG 27 -10.254 5.704 6.896 213 HH21 ARG 27 HH21 ARG 27 -12.341 5.412 9.686 214 HH22 ARG 27 HH22 ARG 27 -11.908 6.393 8.316 215 H LEU 28 HN LEU 28 -5.604 -0.692 10.544 216 HA LEU 28 HA LEU 28 -5.486 -2.885 8.786 217 HB2 LEU 28 HB2 LEU 28 -3.446 -1.640 10.617 218 HB3 LEU 28 HB1 LEU 28 -3.062 -2.929 9.487 219 HG LEU 28 HG LEU 28 -4.142 -0.211 8.735 220 HD11 LEU 28 HD11 LEU 28 -1.877 -0.032 9.535 221 HD12 LEU 28 HD12 LEU 28 -1.897 0.139 7.779 222 HD13 LEU 28 HD13 LEU 28 -1.372 -1.378 8.511 223 HD21 LEU 28 HD21 LEU 28 -4.841 -1.980 7.201 224 HD22 LEU 28 HD22 LEU 28 -3.161 -2.479 7.010 225 HD23 LEU 28 HD23 LEU 28 -3.679 -0.891 6.445 226 H GLN 29 HN GLN 29 -6.090 -2.743 12.150 227 HA GLN 29 HA GLN 29 -5.124 -5.280 12.933 228 HB2 GLN 29 HB2 GLN 29 -7.415 -3.604 13.957 229 HB3 GLN 29 HB1 GLN 29 -6.982 -5.151 14.671 230 HG2 GLN 29 HG2 GLN 29 -4.734 -4.277 15.144 231 HG3 GLN 29 HG1 GLN 29 -5.227 -2.715 14.487 232 HE21 GLN 29 HE21 GLN 29 -5.597 -4.977 17.102 233 HE22 GLN 29 HE22 GLN 29 -6.368 -3.886 18.204 234 H ILE 30 HN ILE 30 -7.866 -4.275 11.063 235 HA ILE 30 HA ILE 30 -9.418 -6.631 11.240 236 HB ILE 30 HB ILE 30 -9.192 -4.710 8.915 237 HG12 ILE 30 HG12 ILE 30 -9.849 -3.535 10.944 238 HG13 ILE 30 HG11 ILE 30 -11.225 -3.660 9.855 239 HG21 ILE 30 HG21 ILE 30 -11.326 -6.727 9.590 240 HG22 ILE 30 HG22 ILE 30 -10.196 -6.801 8.238 241 HG23 ILE 30 HG23 ILE 30 -11.422 -5.534 8.293 242 HD11 ILE 30 HD11 ILE 30 -12.088 -5.524 11.193 243 HD12 ILE 30 HD12 ILE 30 -11.905 -4.046 12.136 244 HD13 ILE 30 HD13 ILE 30 -10.723 -5.345 12.296 245 H LEU 31 HN LEU 31 -7.039 -5.554 8.820 246 HA LEU 31 HA LEU 31 -6.985 -7.960 7.351 247 HB2 LEU 31 HB2 LEU 31 -4.869 -5.826 7.656 248 HB3 LEU 31 HB1 LEU 31 -4.837 -7.102 6.453 249 HG LEU 31 HG LEU 31 -6.948 -4.952 6.645 250 HD11 LEU 31 HD11 LEU 31 -4.670 -5.276 4.696 251 HD12 LEU 31 HD12 LEU 31 -4.771 -4.063 5.970 252 HD13 LEU 31 HD13 LEU 31 -5.922 -4.036 4.635 253 HD21 LEU 31 HD21 LEU 31 -6.466 -7.110 4.595 254 HD22 LEU 31 HD22 LEU 31 -7.629 -5.794 4.435 255 HD23 LEU 31 HD23 LEU 31 -7.831 -6.998 5.707 256 H ASP 32 HN ASP 32 -5.156 -6.790 10.105 257 HA ASP 32 HA ASP 32 -3.228 -8.797 10.308 258 HB2 ASP 32 HB2 ASP 32 -3.092 -6.787 11.640 259 HB3 ASP 32 HB1 ASP 32 -4.621 -7.150 12.429 260 H LEU 33 HN LEU 33 -6.489 -8.609 11.664 261 HA LEU 33 HA LEU 33 -6.406 -11.112 12.997 262 HB2 LEU 33 HB2 LEU 33 -7.953 -9.247 13.554 263 HB3 LEU 33 HB1 LEU 33 -8.801 -9.537 12.049 264 HG LEU 33 HG LEU 33 -9.353 -11.836 12.875 265 HD11 LEU 33 HD11 LEU 33 -7.548 -12.049 14.504 266 HD12 LEU 33 HD12 LEU 33 -9.127 -12.300 15.248 267 HD13 LEU 33 HD13 LEU 33 -8.276 -10.771 15.479 268 HD21 LEU 33 HD21 LEU 33 -10.294 -9.506 14.540 269 HD22 LEU 33 HD22 LEU 33 -11.096 -11.073 14.425 270 HD23 LEU 33 HD23 LEU 33 -10.975 -10.039 13.002 271 H LEU 34 HN LEU 34 -7.457 -10.086 9.790 272 HA LEU 34 HA LEU 34 -8.661 -12.609 9.132 273 HB2 LEU 34 HB2 LEU 34 -7.869 -10.305 7.350 274 HB3 LEU 34 HB1 LEU 34 -8.850 -11.674 6.862 275 HG LEU 34 HG LEU 34 -9.591 -9.564 8.888 276 HD11 LEU 34 HD11 LEU 34 -9.766 -8.788 6.607 277 HD12 LEU 34 HD12 LEU 34 -11.377 -9.052 7.276 278 HD13 LEU 34 HD13 LEU 34 -10.682 -10.228 6.160 279 HD21 LEU 34 HD21 LEU 34 -11.759 -10.703 9.004 280 HD22 LEU 34 HD22 LEU 34 -10.448 -11.719 9.604 281 HD23 LEU 34 HD23 LEU 34 -11.124 -12.004 7.998 282 H ALA 35 HN ALA 35 -5.479 -11.377 9.096 283 HA ALA 35 HA ALA 35 -4.404 -13.133 7.114 284 HB1 ALA 35 HB1 ALA 35 -2.227 -12.490 8.000 285 HB2 ALA 35 HB2 ALA 35 -2.998 -11.745 9.399 286 HB3 ALA 35 HB3 ALA 35 -3.252 -11.072 7.788 287 H GLN 36 HN GLN 36 -5.507 -13.528 10.286 288 HA GLN 36 HA GLN 36 -3.981 -15.942 10.825 289 HB2 GLN 36 HB2 GLN 36 -6.369 -14.811 12.303 290 HB3 GLN 36 HB1 GLN 36 -5.269 -16.053 12.883 291 HG2 GLN 36 HG2 GLN 36 -3.478 -14.483 13.055 292 HG3 GLN 36 HG1 GLN 36 -4.437 -13.233 12.260 293 HE21 GLN 36 HE21 GLN 36 -3.176 -13.202 14.893 294 HE22 GLN 36 HE22 GLN 36 -4.458 -12.915 16.021 295 H GLY 37 HN GLY 37 -6.962 -14.960 9.408 296 HA2 GLY 37 HA2 GLY 37 -7.641 -17.140 8.017 297 HA3 GLY 37 HA1 GLY 37 -8.224 -17.560 9.622 298 H GLU 38 HN GLU 38 -10.091 -17.485 7.755 299 HA GLU 38 HA GLU 38 -11.290 -14.931 7.349 300 HB2 GLU 38 HB2 GLU 38 -11.651 -16.868 5.857 301 HB3 GLU 38 HB1 GLU 38 -12.497 -17.698 7.155 302 HG2 GLU 38 HG2 GLU 38 -14.232 -16.003 7.132 303 HG3 GLU 38 HG1 GLU 38 -13.370 -15.122 5.868 304 H ARG 39 HN ARG 39 -12.656 -13.823 8.613 305 HA ARG 39 HA ARG 39 -13.537 -15.120 11.115 306 HB2 ARG 39 HB2 ARG 39 -12.814 -12.208 10.758 307 HB3 ARG 39 HB1 ARG 39 -13.257 -13.000 12.260 308 HG2 ARG 39 HG2 ARG 39 -10.791 -13.633 10.657 309 HG3 ARG 39 HG1 ARG 39 -10.841 -12.543 12.043 310 HD2 ARG 39 HD2 ARG 39 -11.740 -14.475 13.384 311 HD3 ARG 39 HD1 ARG 39 -11.373 -15.507 12.002 312 HE ARG 39 HE ARG 39 -9.092 -13.999 12.718 313 HH11 ARG 39 HH11 ARG 39 -11.032 -16.698 13.804 314 HH12 ARG 39 HH12 ARG 39 -9.719 -17.473 14.635 315 HH21 ARG 39 HH21 ARG 39 -7.372 -14.978 13.857 316 HH22 ARG 39 HH22 ARG 39 -7.623 -16.511 14.642 317 H ALA 40 HN ALA 40 -15.597 -14.593 11.886 318 HA ALA 40 HA ALA 40 -17.448 -13.463 9.972 319 HB1 ALA 40 HB1 ALA 40 -19.158 -13.958 11.664 320 HB2 ALA 40 HB2 ALA 40 -17.892 -14.427 12.800 321 HB3 ALA 40 HB3 ALA 40 -18.148 -15.365 11.328 322 H VAL 41 HN VAL 41 -18.849 -11.633 10.532 323 HA VAL 41 HA VAL 41 -17.402 -9.352 11.158 324 HB VAL 41 HB VAL 41 -20.395 -9.714 11.392 325 HG11 VAL 41 HG11 VAL 41 -20.537 -7.302 11.081 326 HG12 VAL 41 HG12 VAL 41 -18.777 -7.190 11.055 327 HG13 VAL 41 HG13 VAL 41 -19.608 -7.690 12.527 328 HG21 VAL 41 HG21 VAL 41 -18.693 -8.793 9.079 329 HG22 VAL 41 HG22 VAL 41 -20.456 -8.796 9.115 330 HG23 VAL 41 HG23 VAL 41 -19.570 -10.319 9.187 331 H GLU 42 HN GLU 42 -19.592 -11.209 13.253 332 HA GLU 42 HA GLU 42 -19.374 -9.523 15.506 333 HB2 GLU 42 HB2 GLU 42 -19.747 -12.465 15.865 334 HB3 GLU 42 HB1 GLU 42 -20.548 -11.134 16.683 335 HG2 GLU 42 HG2 GLU 42 -22.251 -11.934 15.398 336 HG3 GLU 42 HG1 GLU 42 -21.584 -10.707 14.318 337 H ALA 43 HN ALA 43 -17.567 -12.388 14.511 338 HA ALA 43 HA ALA 43 -15.929 -12.616 16.787 339 HB1 ALA 43 HB1 ALA 43 -14.488 -14.007 15.391 340 HB2 ALA 43 HB2 ALA 43 -15.325 -13.439 13.947 341 HB3 ALA 43 HB3 ALA 43 -16.186 -14.414 15.140 342 H ILE 44 HN ILE 44 -15.524 -10.863 13.737 343 HA ILE 44 HA ILE 44 -12.932 -9.891 14.173 344 HB ILE 44 HB ILE 44 -15.208 -8.612 12.643 345 HG12 ILE 44 HG12 ILE 44 -12.851 -10.260 11.695 346 HG13 ILE 44 HG11 ILE 44 -14.506 -10.846 11.836 347 HG21 ILE 44 HG21 ILE 44 -12.258 -7.980 12.610 348 HG22 ILE 44 HG22 ILE 44 -13.543 -6.946 13.234 349 HG23 ILE 44 HG23 ILE 44 -13.462 -7.306 11.509 350 HD11 ILE 44 HD11 ILE 44 -13.950 -10.298 9.537 351 HD12 ILE 44 HD12 ILE 44 -13.564 -8.644 10.015 352 HD13 ILE 44 HD13 ILE 44 -15.220 -9.236 10.149 353 H ALA 45 HN ALA 45 -16.090 -8.455 14.930 354 HA ALA 45 HA ALA 45 -15.190 -6.071 16.062 355 HB1 ALA 45 HB1 ALA 45 -17.371 -5.956 17.150 356 HB2 ALA 45 HB2 ALA 45 -17.643 -7.665 16.805 357 HB3 ALA 45 HB3 ALA 45 -17.529 -6.507 15.480 358 H THR 46 HN THR 46 -16.071 -9.104 17.706 359 HA THR 46 HA THR 46 -15.436 -8.282 20.296 360 HB THR 46 HB THR 46 -15.339 -11.087 19.168 361 HG1 THR 46 HG1 THR 46 -17.471 -9.550 20.293 362 HG21 THR 46 HG21 THR 46 -15.741 -10.118 22.002 363 HG22 THR 46 HG22 THR 46 -14.293 -10.913 21.379 364 HG23 THR 46 HG23 THR 46 -15.817 -11.795 21.461 365 H ALA 47 HN ALA 47 -13.421 -10.008 17.909 366 HA ALA 47 HA ALA 47 -11.264 -10.476 19.667 367 HB1 ALA 47 HB1 ALA 47 -11.595 -11.773 17.636 368 HB2 ALA 47 HB2 ALA 47 -9.987 -11.049 17.669 369 HB3 ALA 47 HB3 ALA 47 -11.249 -10.348 16.656 370 H THR 48 HN THR 48 -12.033 -7.748 17.588 371 HA THR 48 HA THR 48 -9.411 -6.568 17.958 372 HB THR 48 HB THR 48 -10.431 -4.615 16.719 373 HG1 THR 48 HG1 THR 48 -12.554 -6.385 16.090 374 HG21 THR 48 HG21 THR 48 -9.108 -6.323 15.571 375 HG22 THR 48 HG22 THR 48 -10.435 -5.768 14.550 376 HG23 THR 48 HG23 THR 48 -10.547 -7.322 15.377 377 H GLY 49 HN GLY 49 -12.385 -6.600 19.601 378 HA2 GLY 49 HA2 GLY 49 -12.752 -5.661 21.720 379 HA3 GLY 49 HA1 GLY 49 -11.406 -4.564 21.445 380 H MET 50 HN MET 50 -13.645 -4.813 18.877 381 HA MET 50 HA MET 50 -14.799 -2.215 19.653 382 HB2 MET 50 HB2 MET 50 -14.311 -3.387 16.908 383 HB3 MET 50 HB1 MET 50 -15.238 -1.921 17.189 384 HG2 MET 50 HG2 MET 50 -13.230 -0.934 18.269 385 HG3 MET 50 HG1 MET 50 -12.329 -2.372 17.796 386 HE1 MET 50 HE1 MET 50 -11.760 -3.037 15.343 387 HE2 MET 50 HE2 MET 50 -12.287 -2.148 13.914 388 HE3 MET 50 HE3 MET 50 -13.465 -3.030 14.886 389 H ASN 51 HN ASN 51 -16.979 -1.909 18.322 390 HA ASN 51 HA ASN 51 -18.635 -4.236 19.007 391 HB2 ASN 51 HB2 ASN 51 -20.523 -2.682 19.174 392 HB3 ASN 51 HB1 ASN 51 -19.205 -2.185 20.225 393 HD21 ASN 51 HD21 ASN 51 -21.378 -0.612 19.226 394 HD22 ASN 51 HD22 ASN 51 -20.687 0.687 18.316 395 H LEU 52 HN LEU 52 -20.746 -4.276 17.640 396 HA LEU 52 HA LEU 52 -19.898 -5.256 15.163 397 HB2 LEU 52 HB2 LEU 52 -22.569 -4.772 16.400 398 HB3 LEU 52 HB1 LEU 52 -22.490 -5.175 14.698 399 HG LEU 52 HG LEU 52 -22.927 -7.169 15.979 400 HD11 LEU 52 HD11 LEU 52 -20.110 -7.100 14.920 401 HD12 LEU 52 HD12 LEU 52 -21.576 -7.448 14.004 402 HD13 LEU 52 HD13 LEU 52 -21.034 -8.565 15.256 403 HD21 LEU 52 HD21 LEU 52 -20.384 -6.530 17.471 404 HD22 LEU 52 HD22 LEU 52 -21.284 -8.039 17.604 405 HD23 LEU 52 HD23 LEU 52 -22.022 -6.524 18.127 406 H THR 53 HN THR 53 -21.617 -2.235 15.905 407 HA THR 53 HA THR 53 -22.141 -1.515 13.241 408 HB THR 53 HB THR 53 -22.307 0.843 14.200 409 HG1 THR 53 HG1 THR 53 -22.355 0.824 16.564 410 HG21 THR 53 HG21 THR 53 -24.361 0.320 15.445 411 HG22 THR 53 HG22 THR 53 -23.887 -1.378 15.503 412 HG23 THR 53 HG23 THR 53 -24.249 -0.616 13.954 413 H THR 54 HN THR 54 -19.486 -0.551 15.403 414 HA THR 54 HA THR 54 -18.182 1.095 13.514 415 HB THR 54 HB THR 54 -16.902 -0.339 15.851 416 HG1 THR 54 HG1 THR 54 -18.297 0.833 16.943 417 HG21 THR 54 HG21 THR 54 -15.375 1.594 15.845 418 HG22 THR 54 HG22 THR 54 -16.184 2.215 14.406 419 HG23 THR 54 HG23 THR 54 -15.299 0.691 14.331 420 H ALA 55 HN ALA 55 -17.837 -2.319 14.384 421 HA ALA 55 HA ALA 55 -15.583 -2.890 12.814 422 HB1 ALA 55 HB1 ALA 55 -17.873 -4.726 13.503 423 HB2 ALA 55 HB2 ALA 55 -16.455 -4.428 14.507 424 HB3 ALA 55 HB3 ALA 55 -16.278 -5.221 12.942 425 H SER 56 HN SER 56 -19.041 -3.166 12.051 426 HA SER 56 HA SER 56 -18.759 -4.175 9.454 427 HB2 SER 56 HB2 SER 56 -20.997 -2.432 10.515 428 HB3 SER 56 HB1 SER 56 -21.085 -3.526 9.134 429 HG SER 56 HG SER 56 -20.749 -4.188 11.875 430 H ALA 57 HN ALA 57 -18.786 -0.872 10.669 431 HA ALA 57 HA ALA 57 -18.962 0.443 8.180 432 HB1 ALA 57 HB1 ALA 57 -17.671 1.426 10.725 433 HB2 ALA 57 HB2 ALA 57 -19.387 1.544 10.338 434 HB3 ALA 57 HB3 ALA 57 -18.202 2.420 9.368 435 H ASN 58 HN ASN 58 -16.167 -0.465 10.173 436 HA ASN 58 HA ASN 58 -14.242 0.625 8.389 437 HB2 ASN 58 HB2 ASN 58 -14.046 -1.314 10.684 438 HB3 ASN 58 HB1 ASN 58 -12.642 -0.897 9.711 439 HD21 ASN 58 HD21 ASN 58 -14.951 0.228 12.041 440 HD22 ASN 58 HD22 ASN 58 -14.126 1.692 12.447 441 H LEU 59 HN LEU 59 -15.665 -2.576 8.787 442 HA LEU 59 HA LEU 59 -14.056 -3.996 6.990 443 HB2 LEU 59 HB2 LEU 59 -16.982 -4.322 7.657 444 HB3 LEU 59 HB1 LEU 59 -16.066 -5.470 6.700 445 HG LEU 59 HG LEU 59 -15.435 -4.749 9.565 446 HD11 LEU 59 HD11 LEU 59 -16.798 -7.192 8.441 447 HD12 LEU 59 HD12 LEU 59 -17.571 -5.916 9.383 448 HD13 LEU 59 HD13 LEU 59 -16.339 -6.937 10.125 449 HD21 LEU 59 HD21 LEU 59 -13.487 -5.481 8.309 450 HD22 LEU 59 HD22 LEU 59 -14.363 -6.905 7.748 451 HD23 LEU 59 HD23 LEU 59 -13.983 -6.721 9.460 452 H GLN 60 HN GLN 60 -17.029 -2.150 6.440 453 HA GLN 60 HA GLN 60 -17.253 -2.683 3.686 454 HB2 GLN 60 HB2 GLN 60 -19.089 -1.793 5.077 455 HB3 GLN 60 HB1 GLN 60 -18.228 -0.268 5.223 456 HG2 GLN 60 HG2 GLN 60 -18.389 0.049 2.803 457 HG3 GLN 60 HG1 GLN 60 -19.266 -1.474 2.671 458 HE21 GLN 60 HE21 GLN 60 -20.097 1.225 1.947 459 HE22 GLN 60 HE22 GLN 60 -21.548 1.530 2.841 460 H ALA 61 HN ALA 61 -15.712 -0.030 5.449 461 HA ALA 61 HA ALA 61 -14.999 1.555 3.258 462 HB1 ALA 61 HB1 ALA 61 -13.559 1.270 5.893 463 HB2 ALA 61 HB2 ALA 61 -14.928 2.336 5.576 464 HB3 ALA 61 HB3 ALA 61 -13.389 2.607 4.757 465 H LEU 62 HN LEU 62 -13.143 -0.979 4.939 466 HA LEU 62 HA LEU 62 -10.860 -0.773 3.259 467 HB2 LEU 62 HB2 LEU 62 -11.817 -3.044 5.001 468 HB3 LEU 62 HB1 LEU 62 -10.250 -2.989 4.218 469 HG LEU 62 HG LEU 62 -11.231 -1.064 6.331 470 HD11 LEU 62 HD11 LEU 62 -9.548 -2.119 7.750 471 HD12 LEU 62 HD12 LEU 62 -9.154 -3.247 6.453 472 HD13 LEU 62 HD13 LEU 62 -10.747 -3.294 7.208 473 HD21 LEU 62 HD21 LEU 62 -8.944 -0.198 6.306 474 HD22 LEU 62 HD22 LEU 62 -9.725 0.019 4.741 475 HD23 LEU 62 HD23 LEU 62 -8.546 -1.274 4.967 476 H LYS 63 HN LYS 63 -13.872 -2.491 3.042 477 HA LYS 63 HA LYS 63 -13.061 -4.307 1.003 478 HB2 LYS 63 HB2 LYS 63 -15.072 -4.549 2.543 479 HB3 LYS 63 HB1 LYS 63 -15.880 -3.367 1.522 480 HG2 LYS 63 HG2 LYS 63 -15.636 -4.820 -0.399 481 HG3 LYS 63 HG1 LYS 63 -14.763 -5.996 0.582 482 HD2 LYS 63 HD2 LYS 63 -16.808 -6.144 2.035 483 HD3 LYS 63 HD1 LYS 63 -17.649 -5.176 0.819 484 HE2 LYS 63 HE2 LYS 63 -16.337 -7.856 0.398 485 HE3 LYS 63 HE1 LYS 63 -18.069 -7.533 0.437 486 HZ1 LYS 63 HZ1 LYS 63 -17.040 -7.756 -1.820 487 HZ2 LYS 63 HZ2 LYS 63 -16.249 -6.281 -1.545 488 HZ3 LYS 63 HZ3 LYS 63 -17.943 -6.341 -1.571 489 H SER 64 HN SER 64 -14.512 -1.094 1.037 490 HA SER 64 HA SER 64 -14.952 -0.873 -1.742 491 HB2 SER 64 HB2 SER 64 -14.316 1.334 0.229 492 HB3 SER 64 HB1 SER 64 -15.090 1.529 -1.345 493 HG SER 64 HG SER 64 -16.541 -0.249 -0.131 494 H GLY 65 HN GLY 65 -12.139 -0.346 0.298 495 HA2 GLY 65 HA2 GLY 65 -10.477 0.781 -1.716 496 HA3 GLY 65 HA1 GLY 65 -9.933 0.030 -0.221 497 H GLY 66 HN GLY 66 -11.456 -2.452 -0.963 498 HA2 GLY 66 HA2 GLY 66 -11.296 -4.206 -2.548 499 HA3 GLY 66 HA1 GLY 66 -9.901 -3.406 -3.254 500 H LEU 67 HN LEU 67 -10.039 -3.687 0.180 501 HA LEU 67 HA LEU 67 -7.705 -5.403 0.118 502 HB2 LEU 67 HB2 LEU 67 -9.126 -3.918 2.317 503 HB3 LEU 67 HB1 LEU 67 -7.870 -5.085 2.668 504 HG LEU 67 HG LEU 67 -6.901 -2.905 2.739 505 HD11 LEU 67 HD11 LEU 67 -6.133 -4.264 0.165 506 HD12 LEU 67 HD12 LEU 67 -5.505 -4.635 1.770 507 HD13 LEU 67 HD13 LEU 67 -5.166 -3.070 1.030 508 HD21 LEU 67 HD21 LEU 67 -6.926 -1.367 0.857 509 HD22 LEU 67 HD22 LEU 67 -8.564 -1.706 1.417 510 HD23 LEU 67 HD23 LEU 67 -7.954 -2.474 -0.050 511 H VAL 68 HN VAL 68 -11.048 -5.553 1.254 512 HA VAL 68 HA VAL 68 -10.617 -8.399 1.855 513 HB VAL 68 HB VAL 68 -12.293 -8.240 3.652 514 HG11 VAL 68 HG11 VAL 68 -10.900 -7.043 5.279 515 HG12 VAL 68 HG12 VAL 68 -9.971 -6.341 3.954 516 HG13 VAL 68 HG13 VAL 68 -9.943 -8.083 4.225 517 HG21 VAL 68 HG21 VAL 68 -12.174 -5.270 3.133 518 HG22 VAL 68 HG22 VAL 68 -12.981 -6.044 4.499 519 HG23 VAL 68 HG23 VAL 68 -13.561 -6.326 2.857 520 H GLU 69 HN GLU 69 -12.421 -9.765 1.685 521 HA GLU 69 HA GLU 69 -14.594 -8.795 -0.051 522 HB2 GLU 69 HB2 GLU 69 -12.744 -10.957 -0.441 523 HB3 GLU 69 HB1 GLU 69 -14.358 -11.622 -0.239 524 HG2 GLU 69 HG2 GLU 69 -13.702 -9.431 -2.188 525 HG3 GLU 69 HG1 GLU 69 -13.675 -11.147 -2.596 526 H ALA 70 HN ALA 70 -16.567 -10.403 0.213 527 HA ALA 70 HA ALA 70 -16.800 -11.182 3.032 528 HB1 ALA 70 HB1 ALA 70 -18.936 -10.023 3.263 529 HB2 ALA 70 HB2 ALA 70 -18.759 -9.364 1.635 530 HB3 ALA 70 HB3 ALA 70 -17.627 -8.896 2.905 531 H ARG 71 HN ARG 71 -17.813 -13.041 3.318 532 HA ARG 71 HA ARG 71 -19.724 -13.952 1.266 533 HB2 ARG 71 HB2 ARG 71 -17.610 -15.248 1.120 534 HB3 ARG 71 HB1 ARG 71 -17.794 -15.703 2.810 535 HG2 ARG 71 HG2 ARG 71 -19.929 -16.816 2.231 536 HG3 ARG 71 HG1 ARG 71 -19.619 -16.448 0.533 537 HD2 ARG 71 HD2 ARG 71 -17.524 -17.733 0.663 538 HD3 ARG 71 HD1 ARG 71 -17.891 -18.133 2.341 539 HE ARG 71 HE ARG 71 -19.705 -18.927 0.158 540 HH11 ARG 71 HH11 ARG 71 -17.729 -19.723 2.934 541 HH12 ARG 71 HH12 ARG 71 -18.211 -21.387 2.960 542 HH21 ARG 71 HH21 ARG 71 -20.376 -21.108 0.204 543 HH22 ARG 71 HH22 ARG 71 -19.716 -22.184 1.410 544 H ARG 72 HN ARG 72 -21.696 -14.313 2.094 545 HA ARG 72 HA ARG 72 -21.924 -14.358 5.012 546 HB2 ARG 72 HB2 ARG 72 -24.241 -13.715 4.717 547 HB3 ARG 72 HB1 ARG 72 -23.198 -12.623 3.820 548 HG2 ARG 72 HG2 ARG 72 -23.719 -13.921 1.763 549 HG3 ARG 72 HG1 ARG 72 -24.888 -14.848 2.706 550 HD2 ARG 72 HD2 ARG 72 -24.912 -11.890 2.150 551 HD3 ARG 72 HD1 ARG 72 -26.055 -13.096 1.559 552 HE ARG 72 HE ARG 72 -25.869 -12.071 4.314 553 HH11 ARG 72 HH11 ARG 72 -27.594 -13.904 1.866 554 HH12 ARG 72 HH12 ARG 72 -29.029 -14.066 2.835 555 HH21 ARG 72 HH21 ARG 72 -27.763 -12.281 5.562 556 HH22 ARG 72 HH22 ARG 72 -29.132 -13.133 4.914 557 H GLU 73 HN GLU 73 -22.854 -15.998 6.113 558 HA GLU 73 HA GLU 73 -23.866 -18.286 4.573 559 HB2 GLU 73 HB2 GLU 73 -21.952 -18.389 6.910 560 HB3 GLU 73 HB1 GLU 73 -22.800 -19.790 6.273 561 HG2 GLU 73 HG2 GLU 73 -21.706 -19.351 4.073 562 HG3 GLU 73 HG1 GLU 73 -20.742 -18.108 4.869 563 H GLY 74 HN GLY 74 -25.967 -18.194 5.036 564 HA2 GLY 74 HA2 GLY 74 -27.891 -18.426 6.276 565 HA3 GLY 74 HA1 GLY 74 -26.883 -18.750 7.679 566 H THR 75 HN THR 75 -26.681 -17.232 9.196 567 HA THR 75 HA THR 75 -27.922 -14.616 8.647 568 HB THR 75 HB THR 75 -27.428 -15.831 11.370 569 HG1 THR 75 HG1 THR 75 -28.841 -17.163 10.074 570 HG21 THR 75 HG21 THR 75 -27.826 -13.409 11.323 571 HG22 THR 75 HG22 THR 75 -29.172 -14.260 12.080 572 HG23 THR 75 HG23 THR 75 -29.321 -13.670 10.424 573 H ARG 76 HN ARG 76 -24.990 -16.211 9.308 574 HA ARG 76 HA ARG 76 -23.725 -13.821 10.406 575 HB2 ARG 76 HB2 ARG 76 -22.675 -16.618 9.971 576 HB3 ARG 76 HB1 ARG 76 -21.699 -15.288 10.580 577 HG2 ARG 76 HG2 ARG 76 -23.329 -15.064 12.460 578 HG3 ARG 76 HG1 ARG 76 -24.090 -16.549 11.888 579 HD2 ARG 76 HD2 ARG 76 -21.193 -16.292 12.672 580 HD3 ARG 76 HD1 ARG 76 -22.465 -16.908 13.725 581 HE ARG 76 HE ARG 76 -22.292 -18.311 11.226 582 HH11 ARG 76 HH11 ARG 76 -20.910 -18.035 14.431 583 HH12 ARG 76 HH12 ARG 76 -20.420 -19.703 14.506 584 HH21 ARG 76 HH21 ARG 76 -21.610 -20.494 11.295 585 HH22 ARG 76 HH22 ARG 76 -20.801 -21.092 12.712 586 H GLN 77 HN GLN 77 -21.723 -13.050 9.488 587 HA GLN 77 HA GLN 77 -21.467 -13.532 6.610 588 HB2 GLN 77 HB2 GLN 77 -22.801 -11.483 6.990 589 HB3 GLN 77 HB1 GLN 77 -21.485 -10.819 7.943 590 HG2 GLN 77 HG2 GLN 77 -20.053 -10.776 5.998 591 HG3 GLN 77 HG1 GLN 77 -21.314 -11.536 5.026 592 HE21 GLN 77 HE21 GLN 77 -21.375 -9.803 3.600 593 HE22 GLN 77 HE22 GLN 77 -22.103 -8.288 4.021 594 H TYR 78 HN TYR 78 -19.450 -13.996 6.089 595 HA TYR 78 HA TYR 78 -17.357 -13.502 8.076 596 HB2 TYR 78 HB2 TYR 78 -17.541 -15.430 5.760 597 HB3 TYR 78 HB1 TYR 78 -16.068 -15.183 6.691 598 HD1 TYR 78 HD2 TYR 78 -19.621 -16.245 7.006 599 HD2 TYR 78 HD1 TYR 78 -15.709 -16.348 8.675 600 HE1 TYR 78 HE2 TYR 78 -20.367 -17.928 8.634 601 HE2 TYR 78 HE1 TYR 78 -16.442 -18.034 10.306 602 HH TYR 78 HH TYR 78 -19.297 -19.752 9.995 603 H TYR 79 HN TYR 79 -15.683 -12.221 7.686 604 HA TYR 79 HA TYR 79 -15.396 -11.134 4.972 605 HB2 TYR 79 HB2 TYR 79 -14.948 -9.922 7.666 606 HB3 TYR 79 HB1 TYR 79 -13.923 -9.399 6.331 607 HD1 TYR 79 HD2 TYR 79 -17.481 -9.733 7.364 608 HD2 TYR 79 HD1 TYR 79 -14.689 -7.836 4.773 609 HE1 TYR 79 HE2 TYR 79 -19.245 -8.204 6.589 610 HE2 TYR 79 HE1 TYR 79 -16.445 -6.305 3.988 611 HH TYR 79 HH TYR 79 -19.447 -5.999 5.552 612 H ARG 80 HN ARG 80 -13.482 -11.258 3.959 613 HA ARG 80 HA ARG 80 -11.241 -12.583 5.278 614 HB2 ARG 80 HB2 ARG 80 -12.758 -14.365 4.434 615 HB3 ARG 80 HB1 ARG 80 -12.642 -13.674 2.825 616 HG2 ARG 80 HG2 ARG 80 -10.023 -14.217 3.861 617 HG3 ARG 80 HG1 ARG 80 -11.041 -15.656 3.953 618 HD2 ARG 80 HD2 ARG 80 -11.701 -14.965 1.514 619 HD3 ARG 80 HD1 ARG 80 -10.173 -14.088 1.567 620 HE ARG 80 HE ARG 80 -10.422 -16.997 2.012 621 HH11 ARG 80 HH11 ARG 80 -8.686 -14.216 0.745 622 HH12 ARG 80 HH12 ARG 80 -7.404 -15.180 0.071 623 HH21 ARG 80 HH21 ARG 80 -8.740 -18.242 1.099 624 HH22 ARG 80 HH22 ARG 80 -7.426 -17.443 0.267 625 H ILE 81 HN ILE 81 -9.268 -12.156 4.215 626 HA ILE 81 HA ILE 81 -9.033 -9.827 2.726 627 HB ILE 81 HB ILE 81 -7.128 -12.175 2.632 628 HG12 ILE 81 HG12 ILE 81 -7.220 -9.817 4.530 629 HG13 ILE 81 HG11 ILE 81 -7.630 -11.477 4.945 630 HG21 ILE 81 HG21 ILE 81 -6.738 -10.472 0.903 631 HG22 ILE 81 HG22 ILE 81 -5.438 -10.500 2.095 632 HG23 ILE 81 HG23 ILE 81 -6.661 -9.231 2.155 633 HD11 ILE 81 HD11 ILE 81 -5.416 -10.917 5.735 634 HD12 ILE 81 HD12 ILE 81 -4.924 -10.466 4.102 635 HD13 ILE 81 HD13 ILE 81 -5.319 -12.145 4.471 636 H ALA 82 HN ALA 82 -9.137 -9.336 0.587 637 HA ALA 82 HA ALA 82 -10.974 -10.545 -0.976 638 HB1 ALA 82 HB1 ALA 82 -10.159 -9.266 -2.845 639 HB2 ALA 82 HB2 ALA 82 -8.591 -9.065 -2.062 640 HB3 ALA 82 HB3 ALA 82 -10.026 -8.310 -1.367 641 H GLY 83 HN GLY 83 -7.476 -11.151 -1.279 642 HA2 GLY 83 HA2 GLY 83 -8.012 -13.847 -2.143 643 HA3 GLY 83 HA1 GLY 83 -7.344 -12.822 -3.407 644 H GLU 84 HN GLU 84 -5.815 -14.865 -2.874 645 HA GLU 84 HA GLU 84 -3.978 -14.606 -0.753 646 HB2 GLU 84 HB2 GLU 84 -3.944 -15.989 -3.404 647 HB3 GLU 84 HB1 GLU 84 -2.450 -15.867 -2.488 648 HG2 GLU 84 HG2 GLU 84 -3.602 -17.982 -2.101 649 HG3 GLU 84 HG1 GLU 84 -3.447 -17.027 -0.630 650 H ASP 85 HN ASP 85 -4.137 -13.224 -3.957 651 HA ASP 85 HA ASP 85 -1.658 -11.998 -4.159 652 HB2 ASP 85 HB2 ASP 85 -4.357 -10.941 -5.040 653 HB3 ASP 85 HB1 ASP 85 -2.804 -10.320 -5.587 654 H VAL 86 HN VAL 86 -4.615 -10.864 -2.586 655 HA VAL 86 HA VAL 86 -3.410 -8.384 -1.757 656 HB VAL 86 HB VAL 86 -6.040 -9.563 -0.847 657 HG11 VAL 86 HG11 VAL 86 -5.267 -7.749 0.560 658 HG12 VAL 86 HG12 VAL 86 -6.635 -7.212 -0.414 659 HG13 VAL 86 HG13 VAL 86 -4.997 -6.732 -0.855 660 HG21 VAL 86 HG21 VAL 86 -7.080 -8.204 -2.608 661 HG22 VAL 86 HG22 VAL 86 -5.995 -9.424 -3.280 662 HG23 VAL 86 HG23 VAL 86 -5.479 -7.739 -3.186 663 H ALA 87 HN ALA 87 -4.102 -11.516 -0.341 664 HA ALA 87 HA ALA 87 -3.581 -10.876 2.354 665 HB1 ALA 87 HB1 ALA 87 -3.238 -13.276 2.671 666 HB2 ALA 87 HB2 ALA 87 -3.166 -13.503 0.923 667 HB3 ALA 87 HB3 ALA 87 -4.665 -12.963 1.683 668 H ARG 88 HN ARG 88 -1.491 -12.114 -0.231 669 HA ARG 88 HA ARG 88 0.874 -12.053 1.340 670 HB2 ARG 88 HB2 ARG 88 0.433 -12.183 -1.640 671 HB3 ARG 88 HB1 ARG 88 2.030 -12.214 -0.905 672 HG2 ARG 88 HG2 ARG 88 1.368 -14.227 0.360 673 HG3 ARG 88 HG1 ARG 88 -0.176 -14.218 -0.494 674 HD2 ARG 88 HD2 ARG 88 0.956 -14.485 -2.611 675 HD3 ARG 88 HD1 ARG 88 2.526 -14.393 -1.813 676 HE ARG 88 HE ARG 88 0.601 -16.557 -1.253 677 HH11 ARG 88 HH11 ARG 88 3.840 -15.458 -2.030 678 HH12 ARG 88 HH12 ARG 88 4.518 -17.059 -2.007 679 HH21 ARG 88 HH21 ARG 88 1.490 -18.640 -1.193 680 HH22 ARG 88 HH22 ARG 88 3.187 -18.870 -1.490 681 H LEU 89 HN LEU 89 -0.857 -9.658 -0.473 682 HA LEU 89 HA LEU 89 1.211 -7.759 -0.763 683 HB2 LEU 89 HB2 LEU 89 -1.054 -7.692 -1.855 684 HB3 LEU 89 HB1 LEU 89 -1.731 -7.225 -0.310 685 HG LEU 89 HG LEU 89 0.401 -5.557 -1.623 686 HD11 LEU 89 HD11 LEU 89 -2.577 -5.405 -2.084 687 HD12 LEU 89 HD12 LEU 89 -1.354 -5.839 -3.279 688 HD13 LEU 89 HD13 LEU 89 -1.396 -4.207 -2.612 689 HD21 LEU 89 HD21 LEU 89 -0.682 -3.762 -0.341 690 HD22 LEU 89 HD22 LEU 89 -0.111 -5.062 0.706 691 HD23 LEU 89 HD23 LEU 89 -1.827 -4.930 0.319 692 H PHE 90 HN PHE 90 -1.203 -8.260 1.796 693 HA PHE 90 HA PHE 90 -0.214 -6.240 3.521 694 HB2 PHE 90 HB2 PHE 90 -2.480 -7.141 3.742 695 HB3 PHE 90 HB1 PHE 90 -1.830 -8.722 4.158 696 HD1 PHE 90 HD2 PHE 90 -1.848 -5.179 5.302 697 HD2 PHE 90 HD1 PHE 90 -1.490 -9.281 6.377 698 HE1 PHE 90 HE2 PHE 90 -1.855 -4.551 7.679 699 HE2 PHE 90 HE1 PHE 90 -1.498 -8.661 8.758 700 HZ PHE 90 HZ PHE 90 -1.680 -6.292 9.412 701 H ALA 91 HN ALA 91 0.459 -9.686 3.190 702 HA ALA 91 HA ALA 91 2.160 -9.918 5.432 703 HB1 ALA 91 HB1 ALA 91 1.206 -11.864 4.306 704 HB2 ALA 91 HB2 ALA 91 2.966 -11.972 4.373 705 HB3 ALA 91 HB3 ALA 91 2.167 -11.513 2.869 706 H LEU 92 HN LEU 92 2.807 -9.231 2.019 707 HA LEU 92 HA LEU 92 5.598 -9.210 2.142 708 HB2 LEU 92 HB2 LEU 92 4.123 -9.279 0.097 709 HB3 LEU 92 HB1 LEU 92 3.881 -7.557 0.296 710 HG LEU 92 HG LEU 92 6.660 -8.651 0.011 711 HD11 LEU 92 HD11 LEU 92 5.362 -9.600 -1.836 712 HD12 LEU 92 HD12 LEU 92 6.492 -8.370 -2.405 713 HD13 LEU 92 HD13 LEU 92 4.778 -7.988 -2.251 714 HD21 LEU 92 HD21 LEU 92 6.387 -6.308 0.644 715 HD22 LEU 92 HD22 LEU 92 5.360 -6.043 -0.766 716 HD23 LEU 92 HD23 LEU 92 7.063 -6.451 -0.978 717 H VAL 93 HN VAL 93 3.286 -6.497 2.451 718 HA VAL 93 HA VAL 93 5.293 -4.533 2.765 719 HB VAL 93 HB VAL 93 2.924 -4.019 2.181 720 HG11 VAL 93 HG11 VAL 93 1.757 -5.430 3.755 721 HG12 VAL 93 HG12 VAL 93 1.285 -3.747 3.994 722 HG13 VAL 93 HG13 VAL 93 2.417 -4.513 5.108 723 HG21 VAL 93 HG21 VAL 93 4.422 -2.246 2.851 724 HG22 VAL 93 HG22 VAL 93 4.062 -2.545 4.551 725 HG23 VAL 93 HG23 VAL 93 2.805 -1.933 3.478 726 H GLN 94 HN GLN 94 3.719 -6.695 5.036 727 HA GLN 94 HA GLN 94 4.738 -5.498 7.398 728 HB2 GLN 94 HB2 GLN 94 2.864 -7.131 7.374 729 HB3 GLN 94 HB1 GLN 94 3.998 -8.395 6.919 730 HG2 GLN 94 HG2 GLN 94 5.184 -8.107 9.025 731 HG3 GLN 94 HG1 GLN 94 4.081 -6.811 9.481 732 HE21 GLN 94 HE21 GLN 94 3.048 -9.688 7.802 733 HE22 GLN 94 HE22 GLN 94 2.147 -10.362 9.114 734 H VAL 95 HN VAL 95 5.936 -7.957 5.176 735 HA VAL 95 HA VAL 95 8.311 -8.591 6.573 736 HB VAL 95 HB VAL 95 7.697 -8.749 3.612 737 HG11 VAL 95 HG11 VAL 95 10.104 -8.697 3.972 738 HG12 VAL 95 HG12 VAL 95 9.583 -10.306 3.476 739 HG13 VAL 95 HG13 VAL 95 9.966 -9.986 5.168 740 HG21 VAL 95 HG21 VAL 95 6.237 -10.134 4.979 741 HG22 VAL 95 HG22 VAL 95 7.636 -10.849 5.777 742 HG23 VAL 95 HG23 VAL 95 7.359 -11.135 4.059 743 H VAL 96 HN VAL 96 7.559 -6.225 4.043 744 HA VAL 96 HA VAL 96 10.058 -5.113 3.631 745 HB VAL 96 HB VAL 96 7.378 -3.713 3.687 746 HG11 VAL 96 HG11 VAL 96 8.449 -1.962 2.328 747 HG12 VAL 96 HG12 VAL 96 10.008 -2.746 2.574 748 HG13 VAL 96 HG13 VAL 96 9.139 -2.062 3.949 749 HG21 VAL 96 HG21 VAL 96 7.473 -5.471 2.040 750 HG22 VAL 96 HG22 VAL 96 9.015 -4.867 1.436 751 HG23 VAL 96 HG23 VAL 96 7.550 -3.908 1.226 752 H ALA 97 HN ALA 97 7.785 -4.534 6.265 753 HA ALA 97 HA ALA 97 9.474 -2.521 7.454 754 HB1 ALA 97 HB1 ALA 97 7.052 -3.907 8.591 755 HB2 ALA 97 HB2 ALA 97 7.039 -2.393 7.685 756 HB3 ALA 97 HB3 ALA 97 7.842 -2.478 9.254 757 H ASP 98 HN ASP 98 8.230 -5.592 8.805 758 HA ASP 98 HA ASP 98 9.911 -5.509 11.039 759 HB2 ASP 98 HB2 ASP 98 7.804 -6.834 10.839 760 HB3 ASP 98 HB1 ASP 98 8.669 -7.980 9.820 761 H GLU 99 HN GLU 99 10.290 -7.333 8.020 762 HA GLU 99 HA GLU 99 12.614 -8.727 8.916 763 HB2 GLU 99 HB2 GLU 99 11.071 -9.634 7.227 764 HB3 GLU 99 HB1 GLU 99 11.522 -8.345 6.124 765 HG2 GLU 99 HG2 GLU 99 12.677 -10.301 5.460 766 HG3 GLU 99 HG1 GLU 99 13.858 -9.212 6.189 767 H HIS 100 HN HIS 100 12.059 -5.827 6.958 768 HA HIS 100 HA HIS 100 14.851 -5.737 6.182 769 HB2 HIS 100 HB2 HIS 100 12.546 -3.895 5.550 770 HB3 HIS 100 HB1 HIS 100 14.187 -3.643 4.964 771 HD1 HIS 100 HD1 HIS 100 14.504 -4.484 2.657 772 HD2 HIS 100 HD2 HIS 100 11.656 -6.697 4.732 773 HE1 HIS 100 HE1 HIS 100 13.674 -6.219 1.038 774 HE2 HIS 100 HE2 HIS 100 11.780 -7.377 2.240 775 H LEU 101 HN LEU 101 12.789 -4.170 8.543 776 HA LEU 101 HA LEU 101 14.732 -2.197 9.291 777 HB2 LEU 101 HB2 LEU 101 12.484 -3.410 10.915 778 HB3 LEU 101 HB1 LEU 101 13.424 -2.011 11.387 779 HG LEU 101 HG LEU 101 11.601 -2.136 8.979 780 HD11 LEU 101 HD11 LEU 101 11.223 -0.826 11.668 781 HD12 LEU 101 HD12 LEU 101 10.351 -2.236 11.064 782 HD13 LEU 101 HD13 LEU 101 10.142 -0.667 10.284 783 HD21 LEU 101 HD21 LEU 101 13.060 0.184 10.234 784 HD22 LEU 101 HD22 LEU 101 11.923 0.278 8.889 785 HD23 LEU 101 HD23 LEU 101 13.457 -0.569 8.689 786 H GLU 102 HN GLU 102 14.188 -5.526 9.891 787 HA GLU 102 HA GLU 102 15.282 -7.161 10.989 788 HB2 GLU 102 HB2 GLU 102 17.416 -5.054 11.217 789 HB3 GLU 102 HB1 GLU 102 17.595 -6.652 11.922 790 HG2 GLU 102 HG2 GLU 102 17.141 -7.535 9.566 791 HG3 GLU 102 HG1 GLU 102 17.448 -5.879 9.035 792 H HIS 103 HN HIS 103 15.943 -7.875 13.124 793 HA HIS 103 HA HIS 103 14.856 -6.128 15.220 794 HB2 HIS 103 HB2 HIS 103 15.248 -9.129 15.144 795 HB3 HIS 103 HB1 HIS 103 14.786 -8.246 16.598 796 HD1 HIS 103 HD1 HIS 103 12.367 -7.582 16.846 797 HD2 HIS 103 HD2 HIS 103 13.250 -9.122 13.085 798 HE1 HIS 103 HE1 HIS 103 10.148 -7.874 15.690 799 HE2 HIS 103 HE2 HIS 103 10.727 -8.615 13.347 800 H HIS 104 HN HIS 104 16.732 -4.871 15.242 801 HA HIS 104 HA HIS 104 19.291 -6.067 15.819 802 HB2 HIS 104 HB2 HIS 104 18.380 -3.185 15.668 803 HB3 HIS 104 HB1 HIS 104 20.030 -3.658 16.048 804 HD1 HIS 104 HD1 HIS 104 19.693 -1.922 13.658 805 HD2 HIS 104 HD2 HIS 104 19.483 -6.070 13.441 806 HE1 HIS 104 HE1 HIS 104 20.182 -2.502 11.257 807 HE2 HIS 104 HE2 HIS 104 19.964 -5.008 11.123 808 H HIS 105 HN HIS 105 20.561 -5.467 17.690 809 HA HIS 105 HA HIS 105 19.193 -5.684 20.158 810 HB2 HIS 105 HB2 HIS 105 21.480 -6.454 19.990 811 HB3 HIS 105 HB1 HIS 105 22.030 -4.861 19.483 812 HD1 HIS 105 HD1 HIS 105 22.921 -3.406 21.277 813 HD2 HIS 105 HD2 HIS 105 20.502 -6.440 22.776 814 HE1 HIS 105 HE1 HIS 105 23.046 -3.200 23.780 815 HE2 HIS 105 HE2 HIS 105 21.786 -5.201 24.649 816 H HIS 106 HN HIS 106 18.405 -4.132 21.487 817 HA HIS 106 HA HIS 106 17.934 -1.541 20.532 818 HB2 HIS 106 HB2 HIS 106 16.472 -2.560 22.180 819 HB3 HIS 106 HB1 HIS 106 17.782 -2.621 23.355 820 HD1 HIS 106 HD1 HIS 106 17.412 -0.922 25.093 821 HD2 HIS 106 HD2 HIS 106 16.255 0.445 21.340 822 HE1 HIS 106 HE1 HIS 106 16.669 1.457 25.437 823 HE2 HIS 106 HE2 HIS 106 16.257 2.334 23.108 824 H HIS 107 HN HIS 107 19.535 -0.201 20.075 825 HA HIS 107 HA HIS 107 21.356 0.529 22.272 826 HB2 HIS 107 HB2 HIS 107 23.150 0.961 20.639 827 HB3 HIS 107 HB1 HIS 107 22.667 -0.729 20.634 828 HD1 HIS 107 HD1 HIS 107 22.899 2.275 18.482 829 HD2 HIS 107 HD2 HIS 107 21.295 -1.555 18.269 830 HE1 HIS 107 HE1 HIS 107 22.370 1.893 16.054 831 HE2 HIS 107 HE2 HIS 107 21.286 -0.378 15.965 832 H HIS 108 HN HIS 108 18.778 1.472 21.055 833 HA HIS 108 HA HIS 108 19.511 4.206 20.304 834 HB2 HIS 108 HB2 HIS 108 18.017 3.069 18.748 835 HB3 HIS 108 HB1 HIS 108 16.900 2.695 20.055 836 HD1 HIS 108 HD1 HIS 108 14.972 4.208 20.177 837 HD2 HIS 108 HD2 HIS 108 18.265 6.059 18.440 838 HE1 HIS 108 HE1 HIS 108 14.183 6.496 19.501 839 HE2 HIS 108 HE2 HIS 108 16.114 7.480 18.216 840 H1 MET 1 HT1 MET 1 1.345 -3.546 34.764 841 H2 MET 1 HT2 MET 1 0.314 -4.096 35.995 842 H3 MET 1 HT3 MET 1 -0.261 -3.949 34.406 843 HA MET 1 HA MET 1 1.844 -5.824 35.305 844 HB2 MET 1 HB2 MET 1 -1.040 -6.279 34.499 845 HB3 MET 1 HB1 MET 1 0.141 -7.562 34.722 846 HG2 MET 1 HG2 MET 1 0.397 -6.915 37.067 847 HG3 MET 1 HG1 MET 1 -0.801 -5.642 36.841 848 HE1 MET 1 HE1 MET 1 -3.356 -6.086 36.332 849 HE2 MET 1 HE2 MET 1 -4.062 -7.691 36.145 850 HE3 MET 1 HE3 MET 1 -2.938 -7.077 34.932 851 H ALA 2 HN ALA 2 1.640 -7.697 33.428 852 HA ALA 2 HA ALA 2 2.766 -6.411 31.133 853 HB1 ALA 2 HB1 ALA 2 2.065 -9.312 31.540 854 HB2 ALA 2 HB2 ALA 2 3.604 -8.558 31.958 855 HB3 ALA 2 HB3 ALA 2 3.097 -8.657 30.271 856 H GLY 3 HN GLY 3 2.077 -6.827 28.928 857 HA2 GLY 3 HA2 GLY 3 -0.100 -7.705 27.765 858 HA3 GLY 3 HA1 GLY 3 -0.814 -6.404 28.710 859 H GLN 4 HN GLN 4 2.220 -6.681 26.882 860 HA GLN 4 HA GLN 4 1.654 -4.063 25.696 861 HB2 GLN 4 HB2 GLN 4 4.200 -5.689 25.790 862 HB3 GLN 4 HB1 GLN 4 4.051 -4.104 25.049 863 HG2 GLN 4 HG2 GLN 4 3.569 -4.691 27.960 864 HG3 GLN 4 HG1 GLN 4 5.075 -4.065 27.293 865 HE21 GLN 4 HE21 GLN 4 1.792 -3.355 28.115 866 HE22 GLN 4 HE22 GLN 4 1.898 -1.638 27.932 867 H SER 5 HN SER 5 0.347 -4.424 23.964 868 HA SER 5 HA SER 5 1.072 -6.450 21.999 869 HB2 SER 5 HB2 SER 5 -1.248 -4.500 22.020 870 HB3 SER 5 HB1 SER 5 -1.044 -5.859 20.915 871 HG SER 5 HG SER 5 -0.960 -7.153 22.964 872 H ASP 6 HN ASP 6 2.394 -3.696 22.658 873 HA ASP 6 HA ASP 6 2.112 -2.074 20.353 874 HB2 ASP 6 HB2 ASP 6 4.023 -0.831 21.208 875 HB3 ASP 6 HB1 ASP 6 2.920 -1.211 22.524 876 H ARG 7 HN ARG 7 4.052 -4.831 21.111 877 HA ARG 7 HA ARG 7 6.105 -4.709 19.276 878 HB2 ARG 7 HB2 ARG 7 6.056 -6.533 20.800 879 HB3 ARG 7 HB1 ARG 7 4.461 -7.038 20.263 880 HG2 ARG 7 HG2 ARG 7 5.424 -7.675 18.085 881 HG3 ARG 7 HG1 ARG 7 7.022 -7.244 18.695 882 HD2 ARG 7 HD2 ARG 7 6.984 -8.979 20.300 883 HD3 ARG 7 HD1 ARG 7 5.257 -9.255 20.069 884 HE ARG 7 HE ARG 7 6.343 -9.745 17.616 885 HH11 ARG 7 HH11 ARG 7 6.948 -11.008 20.843 886 HH12 ARG 7 HH12 ARG 7 7.436 -12.576 20.255 887 HH21 ARG 7 HH21 ARG 7 7.001 -11.790 16.872 888 HH22 ARG 7 HH22 ARG 7 7.460 -13.016 18.013 889 H LYS 8 HN LYS 8 2.821 -5.966 18.738 890 HA LYS 8 HA LYS 8 3.380 -6.236 15.901 891 HB2 LYS 8 HB2 LYS 8 1.069 -7.199 15.810 892 HB3 LYS 8 HB1 LYS 8 2.180 -8.061 16.863 893 HG2 LYS 8 HG2 LYS 8 0.564 -7.969 18.386 894 HG3 LYS 8 HG1 LYS 8 0.993 -6.269 18.571 895 HD2 LYS 8 HD2 LYS 8 -1.394 -6.470 18.250 896 HD3 LYS 8 HD1 LYS 8 -0.672 -5.694 16.837 897 HE2 LYS 8 HE2 LYS 8 -0.714 -7.820 15.640 898 HE3 LYS 8 HE1 LYS 8 -1.405 -8.615 17.054 899 HZ1 LYS 8 HZ1 LYS 8 -3.367 -7.249 16.846 900 HZ2 LYS 8 HZ2 LYS 8 -3.075 -8.059 15.381 901 HZ3 LYS 8 HZ3 LYS 8 -2.691 -6.419 15.535 902 H ALA 9 HN ALA 9 1.721 -4.095 18.071 903 HA ALA 9 HA ALA 9 0.048 -2.795 16.213 904 HB1 ALA 9 HB1 ALA 9 -0.208 -2.566 18.640 905 HB2 ALA 9 HB2 ALA 9 -0.090 -0.997 17.843 906 HB3 ALA 9 HB3 ALA 9 1.299 -1.653 18.709 907 H ALA 10 HN ALA 10 3.415 -2.337 17.099 908 HA ALA 10 HA ALA 10 3.853 0.083 15.718 909 HB1 ALA 10 HB1 ALA 10 6.218 -0.432 15.908 910 HB2 ALA 10 HB2 ALA 10 5.841 -2.105 16.324 911 HB3 ALA 10 HB3 ALA 10 5.390 -0.801 17.422 912 H LEU 11 HN LEU 11 3.752 -3.254 14.687 913 HA LEU 11 HA LEU 11 5.088 -2.917 12.209 914 HB2 LEU 11 HB2 LEU 11 3.005 -4.942 13.040 915 HB3 LEU 11 HB1 LEU 11 3.952 -5.032 11.566 916 HG LEU 11 HG LEU 11 5.078 -5.132 14.366 917 HD11 LEU 11 HD11 LEU 11 4.742 -7.317 12.314 918 HD12 LEU 11 HD12 LEU 11 3.786 -7.131 13.785 919 HD13 LEU 11 HD13 LEU 11 5.514 -7.476 13.892 920 HD21 LEU 11 HD21 LEU 11 6.406 -5.515 11.684 921 HD22 LEU 11 HD22 LEU 11 7.172 -5.726 13.259 922 HD23 LEU 11 HD23 LEU 11 6.618 -4.130 12.755 923 H LEU 12 HN LEU 12 1.708 -2.776 13.184 924 HA LEU 12 HA LEU 12 0.598 -2.379 10.634 925 HB2 LEU 12 HB2 LEU 12 -0.430 -1.430 13.310 926 HB3 LEU 12 HB1 LEU 12 -1.372 -1.544 11.836 927 HG LEU 12 HG LEU 12 -0.147 -3.877 13.311 928 HD11 LEU 12 HD11 LEU 12 -3.022 -3.011 13.066 929 HD12 LEU 12 HD12 LEU 12 -2.019 -2.856 14.509 930 HD13 LEU 12 HD13 LEU 12 -2.433 -4.455 13.889 931 HD21 LEU 12 HD21 LEU 12 -1.962 -3.809 10.901 932 HD22 LEU 12 HD22 LEU 12 -1.434 -5.257 11.760 933 HD23 LEU 12 HD23 LEU 12 -0.255 -4.262 10.902 934 H ASP 13 HN ASP 13 1.899 -0.122 13.016 935 HA ASP 13 HA ASP 13 1.030 2.214 11.648 936 HB2 ASP 13 HB2 ASP 13 1.552 2.378 13.992 937 HB3 ASP 13 HB1 ASP 13 3.202 1.826 13.710 938 H GLN 14 HN GLN 14 4.112 0.444 11.704 939 HA GLN 14 HA GLN 14 5.533 2.288 10.117 940 HB2 GLN 14 HB2 GLN 14 6.599 0.530 11.512 941 HB3 GLN 14 HB1 GLN 14 6.042 -0.680 10.367 942 HG2 GLN 14 HG2 GLN 14 8.341 -0.196 9.932 943 HG3 GLN 14 HG1 GLN 14 7.364 0.424 8.604 944 HE21 GLN 14 HE21 GLN 14 7.583 2.030 11.709 945 HE22 GLN 14 HE22 GLN 14 8.513 3.386 11.154 946 H VAL 15 HN VAL 15 3.719 -0.653 9.221 947 HA VAL 15 HA VAL 15 4.354 -0.473 6.455 948 HB VAL 15 HB VAL 15 2.593 -2.080 6.046 949 HG11 VAL 15 HG11 VAL 15 4.661 -2.940 6.968 950 HG12 VAL 15 HG12 VAL 15 3.288 -3.878 7.555 951 HG13 VAL 15 HG13 VAL 15 4.056 -2.687 8.605 952 HG21 VAL 15 HG21 VAL 15 0.836 -1.156 7.440 953 HG22 VAL 15 HG22 VAL 15 1.728 -1.603 8.894 954 HG23 VAL 15 HG23 VAL 15 1.093 -2.857 7.828 955 H ALA 16 HN ALA 16 1.921 0.966 8.475 956 HA ALA 16 HA ALA 16 0.224 1.897 6.404 957 HB1 ALA 16 HB1 ALA 16 -0.797 3.267 8.115 958 HB2 ALA 16 HB2 ALA 16 0.566 2.977 9.194 959 HB3 ALA 16 HB3 ALA 16 -0.497 1.646 8.737 960 H ARG 17 HN ARG 17 3.069 3.180 7.988 961 HA ARG 17 HA ARG 17 2.930 5.808 6.915 962 HB2 ARG 17 HB2 ARG 17 4.303 5.426 8.824 963 HB3 ARG 17 HB1 ARG 17 5.173 4.128 8.027 964 HG2 ARG 17 HG2 ARG 17 6.319 5.678 6.608 965 HG3 ARG 17 HG1 ARG 17 5.319 7.016 7.190 966 HD2 ARG 17 HD2 ARG 17 6.289 6.948 9.329 967 HD3 ARG 17 HD1 ARG 17 6.997 5.361 9.050 968 HE ARG 17 HE ARG 17 8.182 6.987 7.193 969 HH11 ARG 17 HH11 ARG 17 7.848 7.054 10.685 970 HH12 ARG 17 HH12 ARG 17 9.401 7.795 10.946 971 HH21 ARG 17 HH21 ARG 17 10.230 7.937 7.544 972 HH22 ARG 17 HH22 ARG 17 10.746 8.312 9.162 973 H VAL 18 HN VAL 18 4.569 2.835 5.888 974 HA VAL 18 HA VAL 18 5.733 3.858 3.536 975 HB VAL 18 HB VAL 18 4.757 1.036 4.030 976 HG11 VAL 18 HG11 VAL 18 6.846 2.063 2.109 977 HG12 VAL 18 HG12 VAL 18 5.229 1.515 1.670 978 HG13 VAL 18 HG13 VAL 18 6.392 0.376 2.350 979 HG21 VAL 18 HG21 VAL 18 7.067 0.571 4.728 980 HG22 VAL 18 HG22 VAL 18 6.276 1.741 5.785 981 HG23 VAL 18 HG23 VAL 18 7.444 2.287 4.581 982 H GLY 19 HN GLY 19 2.632 2.228 4.112 983 HA2 GLY 19 HA2 GLY 19 1.675 2.323 1.468 984 HA3 GLY 19 HA1 GLY 19 0.680 2.194 2.910 985 H LYS 20 HN LYS 20 1.630 4.718 4.026 986 HA LYS 20 HA LYS 20 -0.267 6.472 2.926 987 HB2 LYS 20 HB2 LYS 20 0.520 6.648 5.240 988 HB3 LYS 20 HB1 LYS 20 2.124 7.086 4.670 989 HG2 LYS 20 HG2 LYS 20 1.267 9.142 3.729 990 HG3 LYS 20 HG1 LYS 20 -0.376 8.697 4.195 991 HD2 LYS 20 HD2 LYS 20 0.286 8.747 6.554 992 HD3 LYS 20 HD1 LYS 20 1.931 9.182 6.084 993 HE2 LYS 20 HE2 LYS 20 0.732 11.164 6.769 994 HE3 LYS 20 HE1 LYS 20 1.060 11.235 5.039 995 HZ1 LYS 20 HZ1 LYS 20 -1.525 10.408 6.249 996 HZ2 LYS 20 HZ2 LYS 20 -1.205 10.581 4.590 997 HZ3 LYS 20 HZ3 LYS 20 -1.201 11.941 5.605 998 H ALA 21 HN ALA 21 3.262 6.326 2.561 999 HA ALA 21 HA ALA 21 3.351 8.562 0.762 1000 HB1 ALA 21 HB1 ALA 21 5.268 7.954 2.163 1001 HB2 ALA 21 HB2 ALA 21 5.691 7.967 0.451 1002 HB3 ALA 21 HB3 ALA 21 5.426 6.434 1.282 1003 H LEU 22 HN LEU 22 2.635 5.257 0.454 1004 HA LEU 22 HA LEU 22 3.412 4.966 -2.307 1005 HB2 LEU 22 HB2 LEU 22 3.428 3.154 -0.544 1006 HB3 LEU 22 HB1 LEU 22 1.682 3.166 -0.603 1007 HG LEU 22 HG LEU 22 2.912 1.327 -1.874 1008 HD11 LEU 22 HD11 LEU 22 0.543 1.741 -2.174 1009 HD12 LEU 22 HD12 LEU 22 1.307 1.325 -3.707 1010 HD13 LEU 22 HD13 LEU 22 0.897 3.003 -3.354 1011 HD21 LEU 22 HD21 LEU 22 4.613 2.698 -2.913 1012 HD22 LEU 22 HD22 LEU 22 3.377 3.597 -3.794 1013 HD23 LEU 22 HD23 LEU 22 3.636 1.887 -4.138 1014 H ALA 23 HN ALA 23 0.530 5.767 -0.504 1015 HA ALA 23 HA ALA 23 -1.311 5.164 -2.606 1016 HB1 ALA 23 HB1 ALA 23 -2.994 6.143 -1.157 1017 HB2 ALA 23 HB2 ALA 23 -1.733 6.790 -0.107 1018 HB3 ALA 23 HB3 ALA 23 -1.951 5.045 -0.251 1019 H ASN 24 HN ASN 24 -0.370 6.393 -4.354 1020 HA ASN 24 HA ASN 24 -1.932 8.706 -4.820 1021 HB2 ASN 24 HB2 ASN 24 -0.086 9.705 -3.425 1022 HB3 ASN 24 HB1 ASN 24 1.042 9.243 -4.697 1023 HD21 ASN 24 HD21 ASN 24 -1.525 11.371 -3.780 1024 HD22 ASN 24 HD22 ASN 24 -1.382 12.466 -5.116 1025 H GLY 25 HN GLY 25 -2.515 8.324 -6.849 1026 HA2 GLY 25 HA2 GLY 25 -1.164 6.513 -8.539 1027 HA3 GLY 25 HA1 GLY 25 -2.493 7.559 -9.009 1028 H ARG 26 HN ARG 26 -1.226 10.038 -8.448 1029 HA ARG 26 HA ARG 26 0.161 10.502 -10.856 1030 HB2 ARG 26 HB2 ARG 26 0.083 12.141 -8.315 1031 HB3 ARG 26 HB1 ARG 26 0.706 12.712 -9.857 1032 HG2 ARG 26 HG2 ARG 26 -1.460 12.582 -10.859 1033 HG3 ARG 26 HG1 ARG 26 -2.127 11.785 -9.430 1034 HD2 ARG 26 HD2 ARG 26 -1.723 13.786 -8.105 1035 HD3 ARG 26 HD1 ARG 26 -0.984 14.581 -9.494 1036 HE ARG 26 HE ARG 26 -3.105 14.817 -10.467 1037 HH11 ARG 26 HH11 ARG 26 -3.261 13.260 -7.337 1038 HH12 ARG 26 HH12 ARG 26 -4.968 13.541 -7.141 1039 HH21 ARG 26 HH21 ARG 26 -5.329 15.225 -10.198 1040 HH22 ARG 26 HH22 ARG 26 -6.141 14.665 -8.758 1041 H ARG 27 HN ARG 27 1.225 9.847 -7.592 1042 HA ARG 27 HA ARG 27 3.988 10.429 -8.072 1043 HB2 ARG 27 HB2 ARG 27 2.933 10.748 -5.884 1044 HB3 ARG 27 HB1 ARG 27 2.610 9.026 -5.779 1045 HG2 ARG 27 HG2 ARG 27 5.016 8.582 -5.734 1046 HG3 ARG 27 HG1 ARG 27 5.327 10.319 -5.820 1047 HD2 ARG 27 HD2 ARG 27 3.833 8.878 -3.631 1048 HD3 ARG 27 HD1 ARG 27 5.467 9.529 -3.516 1049 HE ARG 27 HE ARG 27 3.951 11.678 -4.224 1050 HH11 ARG 27 HH11 ARG 27 3.748 9.330 -1.627 1051 HH12 ARG 27 HH12 ARG 27 3.043 10.454 -0.498 1052 HH21 ARG 27 HH21 ARG 27 3.032 13.138 -2.774 1053 HH22 ARG 27 HH22 ARG 27 2.626 12.637 -1.159 1054 H LEU 28 HN LEU 28 1.971 7.614 -8.306 1055 HA LEU 28 HA LEU 28 3.901 5.613 -7.929 1056 HB2 LEU 28 HB2 LEU 28 1.352 5.586 -9.538 1057 HB3 LEU 28 HB1 LEU 28 2.326 4.162 -9.228 1058 HG LEU 28 HG LEU 28 0.979 5.849 -7.118 1059 HD11 LEU 28 HD11 LEU 28 -0.449 3.865 -6.808 1060 HD12 LEU 28 HD12 LEU 28 0.310 3.122 -8.217 1061 HD13 LEU 28 HD13 LEU 28 -0.641 4.596 -8.402 1062 HD21 LEU 28 HD21 LEU 28 2.526 3.270 -6.890 1063 HD22 LEU 28 HD22 LEU 28 1.648 4.063 -5.582 1064 HD23 LEU 28 HD23 LEU 28 3.049 4.851 -6.309 1065 H GLN 29 HN GLN 29 3.289 7.673 -10.639 1066 HA GLN 29 HA GLN 29 4.456 6.138 -12.688 1067 HB2 GLN 29 HB2 GLN 29 4.489 9.148 -12.406 1068 HB3 GLN 29 HB1 GLN 29 4.728 8.237 -13.891 1069 HG2 GLN 29 HG2 GLN 29 2.430 7.381 -13.708 1070 HG3 GLN 29 HG1 GLN 29 2.200 8.365 -12.262 1071 HE21 GLN 29 HE21 GLN 29 2.153 10.620 -12.463 1072 HE22 GLN 29 HE22 GLN 29 1.817 11.383 -13.978 1073 H ILE 30 HN ILE 30 5.821 8.135 -10.166 1074 HA ILE 30 HA ILE 30 8.470 8.282 -11.167 1075 HB ILE 30 HB ILE 30 7.506 8.411 -8.298 1076 HG12 ILE 30 HG12 ILE 30 8.100 10.644 -10.259 1077 HG13 ILE 30 HG11 ILE 30 6.486 10.114 -9.796 1078 HG21 ILE 30 HG21 ILE 30 10.109 9.337 -9.513 1079 HG22 ILE 30 HG22 ILE 30 9.899 7.932 -8.469 1080 HG23 ILE 30 HG23 ILE 30 9.613 9.553 -7.836 1081 HD11 ILE 30 HD11 ILE 30 6.933 10.783 -7.493 1082 HD12 ILE 30 HD12 ILE 30 7.132 12.130 -8.613 1083 HD13 ILE 30 HD13 ILE 30 8.550 11.307 -7.961 1084 H LEU 31 HN LEU 31 6.823 6.073 -8.947 1085 HA LEU 31 HA LEU 31 9.093 4.524 -8.295 1086 HB2 LEU 31 HB2 LEU 31 6.155 3.853 -8.206 1087 HB3 LEU 31 HB1 LEU 31 7.420 2.848 -7.521 1088 HG LEU 31 HG LEU 31 6.827 5.683 -6.657 1089 HD11 LEU 31 HD11 LEU 31 6.119 3.049 -5.379 1090 HD12 LEU 31 HD12 LEU 31 4.995 4.229 -6.058 1091 HD13 LEU 31 HD13 LEU 31 5.937 4.632 -4.622 1092 HD21 LEU 31 HD21 LEU 31 8.615 3.574 -5.443 1093 HD22 LEU 31 HD22 LEU 31 8.317 5.190 -4.800 1094 HD23 LEU 31 HD23 LEU 31 9.164 4.994 -6.336 1095 H ASP 32 HN ASP 32 6.661 4.275 -10.833 1096 HA ASP 32 HA ASP 32 7.394 1.780 -11.887 1097 HB2 ASP 32 HB2 ASP 32 5.365 2.896 -12.620 1098 HB3 ASP 32 HB1 ASP 32 6.297 4.235 -13.283 1099 H LEU 33 HN LEU 33 8.637 5.026 -12.525 1100 HA LEU 33 HA LEU 33 10.470 4.252 -14.546 1101 HB2 LEU 33 HB2 LEU 33 9.649 6.554 -14.259 1102 HB3 LEU 33 HB1 LEU 33 10.496 6.664 -12.728 1103 HG LEU 33 HG LEU 33 12.646 6.443 -13.900 1104 HD11 LEU 33 HD11 LEU 33 10.972 6.502 -16.406 1105 HD12 LEU 33 HD12 LEU 33 11.890 5.120 -15.804 1106 HD13 LEU 33 HD13 LEU 33 12.732 6.578 -16.334 1107 HD21 LEU 33 HD21 LEU 33 11.788 8.662 -13.461 1108 HD22 LEU 33 HD22 LEU 33 10.838 8.619 -14.946 1109 HD23 LEU 33 HD23 LEU 33 12.602 8.640 -15.025 1110 H LEU 34 HN LEU 34 10.675 4.485 -11.045 1111 HA LEU 34 HA LEU 34 13.539 4.075 -11.021 1112 HB2 LEU 34 HB2 LEU 34 11.561 4.061 -8.742 1113 HB3 LEU 34 HB1 LEU 34 13.308 4.080 -8.585 1114 HG LEU 34 HG LEU 34 11.582 6.281 -9.722 1115 HD11 LEU 34 HD11 LEU 34 12.350 7.557 -7.806 1116 HD12 LEU 34 HD12 LEU 34 13.297 6.180 -7.244 1117 HD13 LEU 34 HD13 LEU 34 11.536 6.083 -7.278 1118 HD21 LEU 34 HD21 LEU 34 14.582 6.148 -9.431 1119 HD22 LEU 34 HD22 LEU 34 13.654 7.562 -9.929 1120 HD23 LEU 34 HD23 LEU 34 13.685 6.124 -10.950 1121 H ALA 35 HN ALA 35 10.903 2.069 -11.380 1122 HA ALA 35 HA ALA 35 11.731 -0.158 -9.805 1123 HB1 ALA 35 HB1 ALA 35 9.850 -0.076 -12.160 1124 HB2 ALA 35 HB2 ALA 35 9.400 0.178 -10.474 1125 HB3 ALA 35 HB3 ALA 35 10.006 -1.393 -10.996 1126 H GLN 36 HN GLN 36 13.004 1.142 -12.608 1127 HA GLN 36 HA GLN 36 14.080 -1.469 -13.440 1128 HB2 GLN 36 HB2 GLN 36 14.520 -0.355 -15.648 1129 HB3 GLN 36 HB1 GLN 36 12.819 -0.548 -15.245 1130 HG2 GLN 36 HG2 GLN 36 12.645 1.765 -14.634 1131 HG3 GLN 36 HG1 GLN 36 14.381 1.990 -14.839 1132 HE21 GLN 36 HE21 GLN 36 14.027 3.625 -16.338 1133 HE22 GLN 36 HE22 GLN 36 13.528 3.288 -17.961 1134 H GLY 37 HN GLY 37 14.925 1.034 -11.596 1135 HA2 GLY 37 HA2 GLY 37 17.451 0.601 -11.064 1136 HA3 GLY 37 HA1 GLY 37 17.642 1.322 -12.656 1137 H GLU 38 HN GLU 38 18.920 2.925 -11.503 1138 HA GLU 38 HA GLU 38 17.345 4.794 -9.898 1139 HB2 GLU 38 HB2 GLU 38 19.513 5.872 -9.372 1140 HB3 GLU 38 HB1 GLU 38 19.437 4.190 -8.879 1141 HG2 GLU 38 HG2 GLU 38 20.741 5.098 -11.433 1142 HG3 GLU 38 HG1 GLU 38 21.602 4.956 -9.903 1143 H ARG 39 HN ARG 39 16.901 6.836 -10.501 1144 HA ARG 39 HA ARG 39 17.890 7.751 -13.115 1145 HB2 ARG 39 HB2 ARG 39 15.545 6.601 -13.118 1146 HB3 ARG 39 HB1 ARG 39 15.001 8.086 -12.355 1147 HG2 ARG 39 HG2 ARG 39 14.567 8.286 -14.669 1148 HG3 ARG 39 HG1 ARG 39 15.944 9.330 -14.315 1149 HD2 ARG 39 HD2 ARG 39 17.477 7.753 -15.247 1150 HD3 ARG 39 HD1 ARG 39 16.219 6.523 -15.378 1151 HE ARG 39 HE ARG 39 15.297 8.610 -16.890 1152 HH11 ARG 39 HH11 ARG 39 18.196 6.617 -16.927 1153 HH12 ARG 39 HH12 ARG 39 18.441 6.804 -18.641 1154 HH21 ARG 39 HH21 ARG 39 15.600 8.826 -19.116 1155 HH22 ARG 39 HH22 ARG 39 16.962 8.067 -19.890 1156 H ALA 40 HN ALA 40 18.061 10.005 -13.291 1157 HA ALA 40 HA ALA 40 18.398 11.409 -10.836 1158 HB1 ALA 40 HB1 ALA 40 19.819 11.827 -12.787 1159 HB2 ALA 40 HB2 ALA 40 19.035 13.304 -12.226 1160 HB3 ALA 40 HB3 ALA 40 18.427 12.472 -13.658 1161 H VAL 41 HN VAL 41 17.266 13.216 -10.053 1162 HA VAL 41 HA VAL 41 14.482 13.115 -10.167 1163 HB VAL 41 HB VAL 41 16.173 15.517 -9.443 1164 HG11 VAL 41 HG11 VAL 41 13.338 14.819 -8.686 1165 HG12 VAL 41 HG12 VAL 41 13.830 16.092 -9.801 1166 HG13 VAL 41 HG13 VAL 41 14.255 16.203 -8.093 1167 HG21 VAL 41 HG21 VAL 41 16.808 13.540 -8.155 1168 HG22 VAL 41 HG22 VAL 41 15.123 13.295 -7.695 1169 HG23 VAL 41 HG23 VAL 41 15.988 14.726 -7.137 1170 H GLU 42 HN GLU 42 16.761 15.121 -11.964 1171 HA GLU 42 HA GLU 42 14.984 16.760 -13.332 1172 HB2 GLU 42 HB2 GLU 42 17.421 17.052 -13.330 1173 HB3 GLU 42 HB1 GLU 42 17.608 15.588 -14.279 1174 HG2 GLU 42 HG2 GLU 42 15.965 17.834 -15.352 1175 HG3 GLU 42 HG1 GLU 42 17.724 17.932 -15.406 1176 H ALA 43 HN ALA 43 16.202 13.546 -14.216 1177 HA ALA 43 HA ALA 43 14.752 13.373 -16.648 1178 HB1 ALA 43 HB1 ALA 43 15.912 11.175 -14.939 1179 HB2 ALA 43 HB2 ALA 43 16.735 12.023 -16.249 1180 HB3 ALA 43 HB3 ALA 43 15.346 10.996 -16.599 1181 H ILE 44 HN ILE 44 14.103 12.335 -13.340 1182 HA ILE 44 HA ILE 44 11.785 10.825 -13.830 1183 HB ILE 44 HB ILE 44 12.515 12.434 -11.375 1184 HG12 ILE 44 HG12 ILE 44 12.825 9.478 -11.950 1185 HG13 ILE 44 HG11 ILE 44 14.131 10.657 -12.015 1186 HG21 ILE 44 HG21 ILE 44 10.919 11.007 -10.178 1187 HG22 ILE 44 HG22 ILE 44 10.443 10.263 -11.704 1188 HG23 ILE 44 HG23 ILE 44 10.126 11.975 -11.420 1189 HD11 ILE 44 HD11 ILE 44 13.855 11.105 -9.638 1190 HD12 ILE 44 HD12 ILE 44 14.166 9.395 -9.938 1191 HD13 ILE 44 HD13 ILE 44 12.530 9.943 -9.568 1192 H ALA 45 HN ALA 45 12.157 14.255 -12.963 1193 HA ALA 45 HA ALA 45 9.429 14.898 -12.885 1194 HB1 ALA 45 HB1 ALA 45 11.761 16.680 -13.578 1195 HB2 ALA 45 HB2 ALA 45 11.155 16.345 -11.955 1196 HB3 ALA 45 HB3 ALA 45 10.150 17.225 -13.107 1197 H THR 46 HN THR 46 11.760 15.069 -15.542 1198 HA THR 46 HA THR 46 10.018 16.231 -17.422 1199 HB THR 46 HB THR 46 12.393 14.443 -17.989 1200 HG1 THR 46 HG1 THR 46 13.446 16.021 -17.025 1201 HG21 THR 46 HG21 THR 46 12.552 15.762 -20.062 1202 HG22 THR 46 HG22 THR 46 11.074 16.620 -19.619 1203 HG23 THR 46 HG23 THR 46 11.022 14.890 -19.958 1204 H ALA 47 HN ALA 47 10.797 12.837 -16.705 1205 HA ALA 47 HA ALA 47 9.323 11.756 -18.880 1206 HB1 ALA 47 HB1 ALA 47 10.167 10.413 -16.320 1207 HB2 ALA 47 HB2 ALA 47 11.140 10.542 -17.785 1208 HB3 ALA 47 HB3 ALA 47 9.648 9.605 -17.798 1209 H THR 48 HN THR 48 8.377 12.881 -15.764 1210 HA THR 48 HA THR 48 5.824 11.464 -15.910 1211 HB THR 48 HB THR 48 5.449 12.588 -13.644 1212 HG1 THR 48 HG1 THR 48 8.264 12.908 -13.646 1213 HG21 THR 48 HG21 THR 48 6.875 10.958 -12.468 1214 HG22 THR 48 HG22 THR 48 7.759 10.665 -13.965 1215 HG23 THR 48 HG23 THR 48 6.053 10.232 -13.849 1216 H GLY 49 HN GLY 49 7.180 14.432 -16.791 1217 HA2 GLY 49 HA2 GLY 49 6.162 16.229 -17.842 1218 HA3 GLY 49 HA1 GLY 49 4.596 15.501 -17.508 1219 H MET 50 HN MET 50 7.009 16.084 -15.051 1220 HA MET 50 HA MET 50 5.292 18.207 -13.942 1221 HB2 MET 50 HB2 MET 50 6.933 16.154 -12.436 1222 HB3 MET 50 HB1 MET 50 6.039 17.475 -11.695 1223 HG2 MET 50 HG2 MET 50 3.954 16.512 -12.654 1224 HG3 MET 50 HG1 MET 50 4.904 15.131 -13.203 1225 HE1 MET 50 HE1 MET 50 6.173 13.655 -9.785 1226 HE2 MET 50 HE2 MET 50 6.994 14.862 -10.772 1227 HE3 MET 50 HE3 MET 50 6.202 13.486 -11.540 1228 H ASN 51 HN ASN 51 6.761 19.291 -12.049 1229 HA ASN 51 HA ASN 51 9.097 20.331 -13.476 1230 HB2 ASN 51 HB2 ASN 51 7.323 21.899 -12.611 1231 HB3 ASN 51 HB1 ASN 51 7.778 21.426 -10.978 1232 HD21 ASN 51 HD21 ASN 51 8.743 23.125 -13.852 1233 HD22 ASN 51 HD22 ASN 51 10.042 24.015 -13.124 1234 H LEU 52 HN LEU 52 11.058 20.772 -12.184 1235 HA LEU 52 HA LEU 52 12.069 18.460 -11.023 1236 HB2 LEU 52 HB2 LEU 52 13.032 21.301 -10.671 1237 HB3 LEU 52 HB1 LEU 52 13.956 19.866 -10.273 1238 HG LEU 52 HG LEU 52 13.047 20.652 -13.044 1239 HD11 LEU 52 HD11 LEU 52 14.817 22.099 -12.198 1240 HD12 LEU 52 HD12 LEU 52 15.430 21.033 -13.463 1241 HD13 LEU 52 HD13 LEU 52 15.780 20.687 -11.769 1242 HD21 LEU 52 HD21 LEU 52 13.134 18.235 -12.745 1243 HD22 LEU 52 HD22 LEU 52 14.776 18.368 -12.114 1244 HD23 LEU 52 HD23 LEU 52 14.440 18.796 -13.792 1245 H THR 53 HN THR 53 10.833 21.396 -9.466 1246 HA THR 53 HA THR 53 11.442 20.606 -6.820 1247 HB THR 53 HB THR 53 9.202 22.485 -7.555 1248 HG1 THR 53 HG1 THR 53 11.579 23.738 -7.234 1249 HG21 THR 53 HG21 THR 53 9.977 23.668 -5.535 1250 HG22 THR 53 HG22 THR 53 11.216 22.438 -5.302 1251 HG23 THR 53 HG23 THR 53 9.512 22.003 -5.180 1252 H THR 54 HN THR 54 8.637 20.134 -8.889 1253 HA THR 54 HA THR 54 6.824 19.260 -6.910 1254 HB THR 54 HB THR 54 6.784 18.367 -9.790 1255 HG1 THR 54 HG1 THR 54 6.357 20.922 -8.660 1256 HG21 THR 54 HG21 THR 54 4.356 18.488 -9.478 1257 HG22 THR 54 HG22 THR 54 4.592 19.029 -7.817 1258 HG23 THR 54 HG23 THR 54 5.091 17.406 -8.295 1259 H ALA 55 HN ALA 55 9.001 17.519 -9.108 1260 HA ALA 55 HA ALA 55 8.283 14.920 -8.270 1261 HB1 ALA 55 HB1 ALA 55 10.318 14.186 -9.393 1262 HB2 ALA 55 HB2 ALA 55 10.885 15.854 -9.482 1263 HB3 ALA 55 HB3 ALA 55 9.450 15.361 -10.381 1264 H SER 56 HN SER 56 10.867 17.124 -7.272 1265 HA SER 56 HA SER 56 12.207 15.377 -5.543 1266 HB2 SER 56 HB2 SER 56 13.004 17.630 -6.423 1267 HB3 SER 56 HB1 SER 56 12.016 18.368 -5.164 1268 HG SER 56 HG SER 56 13.347 17.627 -3.640 1269 H ALA 57 HN ALA 57 9.473 17.551 -4.982 1270 HA ALA 57 HA ALA 57 9.352 17.279 -2.183 1271 HB1 ALA 57 HB1 ALA 57 7.068 18.106 -2.371 1272 HB2 ALA 57 HB2 ALA 57 7.088 17.802 -4.108 1273 HB3 ALA 57 HB3 ALA 57 8.153 19.024 -3.415 1274 H ASN 58 HN ASN 58 7.717 15.473 -4.775 1275 HA ASN 58 HA ASN 58 6.319 13.742 -3.011 1276 HB2 ASN 58 HB2 ASN 58 6.930 13.668 -5.949 1277 HB3 ASN 58 HB1 ASN 58 6.193 12.277 -5.158 1278 HD21 ASN 58 HD21 ASN 58 5.756 15.569 -6.164 1279 HD22 ASN 58 HD22 ASN 58 4.041 15.630 -5.912 1280 H LEU 59 HN LEU 59 9.465 13.614 -4.552 1281 HA LEU 59 HA LEU 59 10.084 10.935 -3.895 1282 HB2 LEU 59 HB2 LEU 59 11.813 13.341 -4.441 1283 HB3 LEU 59 HB1 LEU 59 12.479 11.750 -4.122 1284 HG LEU 59 HG LEU 59 10.568 12.343 -6.380 1285 HD11 LEU 59 HD11 LEU 59 13.576 12.138 -6.399 1286 HD12 LEU 59 HD12 LEU 59 12.618 13.579 -6.743 1287 HD13 LEU 59 HD13 LEU 59 12.552 12.192 -7.832 1288 HD21 LEU 59 HD21 LEU 59 10.562 10.028 -5.646 1289 HD22 LEU 59 HD22 LEU 59 12.321 9.967 -5.764 1290 HD23 LEU 59 HD23 LEU 59 11.346 10.175 -7.219 1291 H GLN 60 HN GLN 60 10.380 13.963 -2.128 1292 HA GLN 60 HA GLN 60 11.892 12.947 0.036 1293 HB2 GLN 60 HB2 GLN 60 11.633 15.362 -0.393 1294 HB3 GLN 60 HB1 GLN 60 9.926 15.248 0.013 1295 HG2 GLN 60 HG2 GLN 60 11.177 16.158 1.869 1296 HG3 GLN 60 HG1 GLN 60 10.510 14.582 2.290 1297 HE21 GLN 60 HE21 GLN 60 13.318 15.041 0.257 1298 HE22 GLN 60 HE22 GLN 60 14.466 14.379 1.365 1299 H ALA 61 HN ALA 61 8.437 13.094 -0.634 1300 HA ALA 61 HA ALA 61 7.530 12.093 1.842 1301 HB1 ALA 61 HB1 ALA 61 5.469 11.534 0.675 1302 HB2 ALA 61 HB2 ALA 61 6.274 11.738 -0.880 1303 HB3 ALA 61 HB3 ALA 61 6.041 13.128 0.180 1304 H LEU 62 HN LEU 62 8.443 10.475 -1.176 1305 HA LEU 62 HA LEU 62 7.948 7.834 -0.319 1306 HB2 LEU 62 HB2 LEU 62 9.877 8.903 -2.376 1307 HB3 LEU 62 HB1 LEU 62 9.510 7.203 -2.163 1308 HG LEU 62 HG LEU 62 7.484 9.308 -2.925 1309 HD11 LEU 62 HD11 LEU 62 8.959 7.290 -4.609 1310 HD12 LEU 62 HD12 LEU 62 9.070 9.048 -4.714 1311 HD13 LEU 62 HD13 LEU 62 7.569 8.231 -5.150 1312 HD21 LEU 62 HD21 LEU 62 6.044 7.407 -3.419 1313 HD22 LEU 62 HD22 LEU 62 6.545 7.381 -1.728 1314 HD23 LEU 62 HD23 LEU 62 7.306 6.295 -2.891 1315 H LYS 63 HN LYS 63 10.784 9.919 -0.069 1316 HA LYS 63 HA LYS 63 12.531 7.987 1.024 1317 HB2 LYS 63 HB2 LYS 63 13.460 10.025 0.172 1318 HB3 LYS 63 HB1 LYS 63 12.477 10.998 1.257 1319 HG2 LYS 63 HG2 LYS 63 14.792 10.906 2.001 1320 HG3 LYS 63 HG1 LYS 63 13.716 10.141 3.171 1321 HD2 LYS 63 HD2 LYS 63 15.475 8.637 3.049 1322 HD3 LYS 63 HD1 LYS 63 14.310 7.952 1.917 1323 HE2 LYS 63 HE2 LYS 63 16.497 7.875 0.927 1324 HE3 LYS 63 HE1 LYS 63 15.526 9.074 0.071 1325 HZ1 LYS 63 HZ1 LYS 63 17.279 9.889 2.299 1326 HZ2 LYS 63 HZ2 LYS 63 16.713 10.815 0.989 1327 HZ3 LYS 63 HZ3 LYS 63 17.925 9.653 0.750 1328 H SER 64 HN SER 64 10.235 10.234 2.499 1329 HA SER 64 HA SER 64 10.848 9.577 5.180 1330 HB2 SER 64 HB2 SER 64 8.250 10.629 4.029 1331 HB3 SER 64 HB1 SER 64 8.720 10.666 5.731 1332 HG SER 64 HG SER 64 9.739 12.147 3.558 1333 H GLY 65 HN GLY 65 8.711 8.161 2.777 1334 HA2 GLY 65 HA2 GLY 65 7.501 6.255 4.516 1335 HA3 GLY 65 HA1 GLY 65 7.616 6.133 2.762 1336 H GLY 66 HN GLY 66 10.522 6.402 2.776 1337 HA2 GLY 66 HA2 GLY 66 12.467 5.263 3.360 1338 HA3 GLY 66 HA1 GLY 66 11.514 4.187 4.366 1339 H LEU 67 HN LEU 67 10.455 4.709 1.098 1340 HA LEU 67 HA LEU 67 11.272 1.939 0.553 1341 HB2 LEU 67 HB2 LEU 67 9.462 1.740 -0.982 1342 HB3 LEU 67 HB1 LEU 67 8.863 2.328 0.553 1343 HG LEU 67 HG LEU 67 9.445 4.314 -1.600 1344 HD11 LEU 67 HD11 LEU 67 8.208 2.483 -2.682 1345 HD12 LEU 67 HD12 LEU 67 7.239 3.951 -2.550 1346 HD13 LEU 67 HD13 LEU 67 6.965 2.609 -1.438 1347 HD21 LEU 67 HD21 LEU 67 8.770 5.060 0.647 1348 HD22 LEU 67 HD22 LEU 67 7.304 4.089 0.520 1349 HD23 LEU 67 HD23 LEU 67 7.554 5.457 -0.566 1350 H VAL 68 HN VAL 68 12.263 4.972 -0.178 1351 HA VAL 68 HA VAL 68 13.505 3.994 -2.657 1352 HB VAL 68 HB VAL 68 13.425 6.220 -3.654 1353 HG11 VAL 68 HG11 VAL 68 11.039 6.314 -4.177 1354 HG12 VAL 68 HG12 VAL 68 10.700 5.238 -2.820 1355 HG13 VAL 68 HG13 VAL 68 11.644 4.657 -4.194 1356 HG21 VAL 68 HG21 VAL 68 11.785 6.984 -1.243 1357 HG22 VAL 68 HG22 VAL 68 12.018 7.988 -2.675 1358 HG23 VAL 68 HG23 VAL 68 13.395 7.578 -1.652 1359 H GLU 69 HN GLU 69 15.543 4.995 -3.174 1360 HA GLU 69 HA GLU 69 16.904 6.185 -0.838 1361 HB2 GLU 69 HB2 GLU 69 18.021 4.344 -2.960 1362 HB3 GLU 69 HB1 GLU 69 19.017 5.228 -1.815 1363 HG2 GLU 69 HG2 GLU 69 17.784 4.054 0.018 1364 HG3 GLU 69 HG1 GLU 69 17.034 3.051 -1.227 1365 H ALA 70 HN ALA 70 18.404 7.844 -1.245 1366 HA ALA 70 HA ALA 70 18.193 9.066 -3.914 1367 HB1 ALA 70 HB1 ALA 70 17.376 10.495 -2.102 1368 HB2 ALA 70 HB2 ALA 70 18.822 11.176 -2.849 1369 HB3 ALA 70 HB3 ALA 70 18.935 10.360 -1.288 1370 H ARG 71 HN ARG 71 20.022 9.455 -5.068 1371 HA ARG 71 HA ARG 71 22.587 8.613 -3.873 1372 HB2 ARG 71 HB2 ARG 71 21.764 8.187 -6.753 1373 HB3 ARG 71 HB1 ARG 71 23.192 7.550 -5.951 1374 HG2 ARG 71 HG2 ARG 71 20.371 6.805 -5.209 1375 HG3 ARG 71 HG1 ARG 71 21.380 5.887 -6.327 1376 HD2 ARG 71 HD2 ARG 71 22.418 6.525 -3.603 1377 HD3 ARG 71 HD1 ARG 71 21.240 5.227 -3.793 1378 HE ARG 71 HE ARG 71 23.436 5.022 -5.628 1379 HH11 ARG 71 HH11 ARG 71 22.449 4.377 -2.326 1380 HH12 ARG 71 HH12 ARG 71 23.454 2.965 -2.171 1381 HH21 ARG 71 HH21 ARG 71 24.760 3.159 -5.420 1382 HH22 ARG 71 HH22 ARG 71 24.766 2.285 -3.916 1383 H ARG 72 HN ARG 72 24.179 10.115 -4.048 1384 HA ARG 72 HA ARG 72 23.579 12.475 -5.696 1385 HB2 ARG 72 HB2 ARG 72 25.431 12.169 -3.326 1386 HB3 ARG 72 HB1 ARG 72 25.195 13.656 -4.235 1387 HG2 ARG 72 HG2 ARG 72 23.040 12.195 -2.723 1388 HG3 ARG 72 HG1 ARG 72 23.925 13.601 -2.132 1389 HD2 ARG 72 HD2 ARG 72 22.234 13.544 -4.630 1390 HD3 ARG 72 HD1 ARG 72 21.707 14.173 -3.069 1391 HE ARG 72 HE ARG 72 24.111 15.332 -4.281 1392 HH11 ARG 72 HH11 ARG 72 20.701 15.632 -3.501 1393 HH12 ARG 72 HH12 ARG 72 20.667 17.354 -3.717 1394 HH21 ARG 72 HH21 ARG 72 24.075 17.609 -4.534 1395 HH22 ARG 72 HH22 ARG 72 22.588 18.477 -4.285 1396 H GLU 73 HN GLU 73 24.518 12.377 -7.615 1397 HA GLU 73 HA GLU 73 27.311 11.452 -7.748 1398 HB2 GLU 73 HB2 GLU 73 24.997 10.845 -9.412 1399 HB3 GLU 73 HB1 GLU 73 26.357 11.441 -10.354 1400 HG2 GLU 73 HG2 GLU 73 26.516 9.162 -8.393 1401 HG3 GLU 73 HG1 GLU 73 26.289 8.976 -10.132 1402 H GLY 74 HN GLY 74 28.532 13.211 -7.661 1403 HA2 GLY 74 HA2 GLY 74 29.482 15.202 -8.327 1404 HA3 GLY 74 HA1 GLY 74 28.427 15.176 -9.736 1405 H THR 75 HN THR 75 26.770 16.552 -9.808 1406 HA THR 75 HA THR 75 25.878 17.754 -7.266 1407 HB THR 75 HB THR 75 27.119 19.350 -8.775 1408 HG1 THR 75 HG1 THR 75 24.369 20.066 -8.476 1409 HG21 THR 75 HG21 THR 75 26.358 18.504 -10.932 1410 HG22 THR 75 HG22 THR 75 25.938 20.209 -10.755 1411 HG23 THR 75 HG23 THR 75 24.702 18.968 -10.547 1412 H ARG 76 HN ARG 76 25.091 15.540 -9.421 1413 HA ARG 76 HA ARG 76 22.307 16.340 -9.813 1414 HB2 ARG 76 HB2 ARG 76 23.737 13.865 -10.789 1415 HB3 ARG 76 HB1 ARG 76 22.123 14.380 -11.247 1416 HG2 ARG 76 HG2 ARG 76 23.096 16.383 -12.302 1417 HG3 ARG 76 HG1 ARG 76 24.707 15.773 -11.904 1418 HD2 ARG 76 HD2 ARG 76 24.091 13.674 -13.151 1419 HD3 ARG 76 HD1 ARG 76 22.655 14.525 -13.715 1420 HE ARG 76 HE ARG 76 24.883 16.107 -14.316 1421 HH11 ARG 76 HH11 ARG 76 23.490 13.028 -15.201 1422 HH12 ARG 76 HH12 ARG 76 24.180 13.009 -16.795 1423 HH21 ARG 76 HH21 ARG 76 25.811 16.100 -16.438 1424 HH22 ARG 76 HH22 ARG 76 25.504 14.745 -17.491 1425 H GLN 77 HN GLN 77 20.588 15.200 -8.965 1426 HA GLN 77 HA GLN 77 21.287 13.276 -6.856 1427 HB2 GLN 77 HB2 GLN 77 20.267 15.290 -5.956 1428 HB3 GLN 77 HB1 GLN 77 18.909 15.129 -7.061 1429 HG2 GLN 77 HG2 GLN 77 18.062 13.259 -5.925 1430 HG3 GLN 77 HG1 GLN 77 19.568 13.019 -5.032 1431 HE21 GLN 77 HE21 GLN 77 16.681 14.965 -5.317 1432 HE22 GLN 77 HE22 GLN 77 16.800 15.726 -3.767 1433 H TYR 78 HN TYR 78 20.836 11.272 -7.323 1434 HA TYR 78 HA TYR 78 18.713 10.653 -9.260 1435 HB2 TYR 78 HB2 TYR 78 21.093 9.043 -8.304 1436 HB3 TYR 78 HB1 TYR 78 19.833 8.389 -9.340 1437 HD1 TYR 78 HD1 TYR 78 22.306 11.193 -9.205 1438 HD2 TYR 78 HD2 TYR 78 20.090 8.492 -11.634 1439 HE1 TYR 78 HE1 TYR 78 23.520 11.990 -11.189 1440 HE2 TYR 78 HE2 TYR 78 21.296 9.283 -13.625 1441 HH TYR 78 HH TYR 78 24.095 11.276 -13.413 1442 H TYR 79 HN TYR 79 17.213 8.991 -8.783 1443 HA TYR 79 HA TYR 79 17.131 8.146 -5.966 1444 HB2 TYR 79 HB2 TYR 79 14.997 9.418 -7.603 1445 HB3 TYR 79 HB1 TYR 79 14.513 8.118 -6.519 1446 HD1 TYR 79 HD2 TYR 79 16.160 11.442 -6.629 1447 HD2 TYR 79 HD1 TYR 79 14.313 8.480 -4.202 1448 HE1 TYR 79 HE2 TYR 79 16.117 13.019 -4.743 1449 HE2 TYR 79 HE1 TYR 79 14.265 10.047 -2.309 1450 HH TYR 79 HH TYR 79 14.862 13.368 -2.661 1451 H ARG 80 HN ARG 80 15.998 6.137 -5.600 1452 HA ARG 80 HA ARG 80 15.333 4.461 -7.846 1453 HB2 ARG 80 HB2 ARG 80 17.013 2.784 -7.534 1454 HB3 ARG 80 HB1 ARG 80 17.852 4.321 -7.694 1455 HG2 ARG 80 HG2 ARG 80 18.148 4.440 -5.290 1456 HG3 ARG 80 HG1 ARG 80 17.245 2.937 -5.088 1457 HD2 ARG 80 HD2 ARG 80 18.989 1.872 -6.603 1458 HD3 ARG 80 HD1 ARG 80 19.933 3.344 -6.367 1459 HE ARG 80 HE ARG 80 19.136 2.309 -3.863 1460 HH11 ARG 80 HH11 ARG 80 21.407 1.746 -6.462 1461 HH12 ARG 80 HH12 ARG 80 22.495 0.814 -5.477 1462 HH21 ARG 80 HH21 ARG 80 20.558 1.144 -2.562 1463 HH22 ARG 80 HH22 ARG 80 22.000 0.460 -3.256 1464 H ILE 81 HN ILE 81 14.799 2.177 -6.981 1465 HA ILE 81 HA ILE 81 13.130 2.463 -4.655 1466 HB ILE 81 HB ILE 81 13.806 -0.047 -6.208 1467 HG12 ILE 81 HG12 ILE 81 12.799 1.643 -7.670 1468 HG13 ILE 81 HG11 ILE 81 11.673 0.323 -7.382 1469 HG21 ILE 81 HG21 ILE 81 11.695 -0.898 -5.268 1470 HG22 ILE 81 HG22 ILE 81 11.559 0.568 -4.296 1471 HG23 ILE 81 HG23 ILE 81 12.897 -0.547 -4.029 1472 HD11 ILE 81 HD11 ILE 81 10.551 2.475 -7.325 1473 HD12 ILE 81 HD12 ILE 81 11.618 3.011 -6.027 1474 HD13 ILE 81 HD13 ILE 81 10.485 1.688 -5.749 1475 H ALA 82 HN ALA 82 13.527 1.735 -2.599 1476 HA ALA 82 HA ALA 82 16.264 1.510 -1.858 1477 HB1 ALA 82 HB1 ALA 82 13.810 1.061 -0.170 1478 HB2 ALA 82 HB2 ALA 82 14.608 2.611 -0.440 1479 HB3 ALA 82 HB3 ALA 82 15.451 1.325 0.422 1480 H GLY 83 HN GLY 83 13.819 -0.852 -2.545 1481 HA2 GLY 83 HA2 GLY 83 15.783 -2.949 -2.246 1482 HA3 GLY 83 HA1 GLY 83 14.451 -3.044 -1.105 1483 H GLU 84 HN GLU 84 15.221 -4.896 -3.196 1484 HA GLU 84 HA GLU 84 13.506 -4.771 -5.417 1485 HB2 GLU 84 HB2 GLU 84 13.968 -7.135 -5.707 1486 HB3 GLU 84 HB1 GLU 84 15.445 -6.305 -5.247 1487 HG2 GLU 84 HG2 GLU 84 13.706 -7.959 -3.422 1488 HG3 GLU 84 HG1 GLU 84 15.232 -8.466 -4.139 1489 H ASP 85 HN ASP 85 13.062 -5.920 -2.151 1490 HA ASP 85 HA ASP 85 10.617 -7.262 -2.460 1491 HB2 ASP 85 HB2 ASP 85 12.348 -6.928 -0.433 1492 HB3 ASP 85 HB1 ASP 85 11.119 -5.767 0.053 1493 H VAL 86 HN VAL 86 11.407 -3.878 -2.053 1494 HA VAL 86 HA VAL 86 8.753 -2.934 -1.614 1495 HB VAL 86 HB VAL 86 11.129 -1.446 -2.755 1496 HG11 VAL 86 HG11 VAL 86 9.949 0.572 -2.017 1497 HG12 VAL 86 HG12 VAL 86 8.575 -0.420 -1.527 1498 HG13 VAL 86 HG13 VAL 86 9.028 -0.321 -3.228 1499 HG21 VAL 86 HG21 VAL 86 11.464 -0.623 -0.472 1500 HG22 VAL 86 HG22 VAL 86 11.620 -2.377 -0.556 1501 HG23 VAL 86 HG23 VAL 86 10.148 -1.655 0.091 1502 H ALA 87 HN ALA 87 10.804 -3.355 -4.461 1503 HA ALA 87 HA ALA 87 9.012 -2.303 -6.364 1504 HB1 ALA 87 HB1 ALA 87 11.157 -4.395 -6.705 1505 HB2 ALA 87 HB2 ALA 87 11.354 -2.652 -6.887 1506 HB3 ALA 87 HB3 ALA 87 10.340 -3.547 -8.018 1507 H ARG 88 HN ARG 88 9.296 -5.427 -4.831 1508 HA ARG 88 HA ARG 88 7.533 -6.881 -6.471 1509 HB2 ARG 88 HB2 ARG 88 8.141 -7.174 -3.525 1510 HB3 ARG 88 HB1 ARG 88 7.233 -8.343 -4.471 1511 HG2 ARG 88 HG2 ARG 88 9.167 -8.769 -5.860 1512 HG3 ARG 88 HG1 ARG 88 10.084 -7.532 -4.996 1513 HD2 ARG 88 HD2 ARG 88 9.848 -8.817 -2.924 1514 HD3 ARG 88 HD1 ARG 88 8.943 -10.052 -3.795 1515 HE ARG 88 HE ARG 88 11.162 -10.093 -5.194 1516 HH11 ARG 88 HH11 ARG 88 10.819 -9.790 -1.720 1517 HH12 ARG 88 HH12 ARG 88 12.308 -10.618 -1.380 1518 HH21 ARG 88 HH21 ARG 88 13.126 -11.177 -4.753 1519 HH22 ARG 88 HH22 ARG 88 13.634 -11.394 -3.099 1520 H LEU 89 HN LEU 89 6.976 -4.958 -3.543 1521 HA LEU 89 HA LEU 89 4.230 -5.413 -3.277 1522 HB2 LEU 89 HB2 LEU 89 5.592 -4.312 -1.557 1523 HB3 LEU 89 HB1 LEU 89 5.804 -2.922 -2.604 1524 HG LEU 89 HG LEU 89 3.303 -2.612 -2.539 1525 HD11 LEU 89 HD11 LEU 89 3.506 -4.599 -0.285 1526 HD12 LEU 89 HD12 LEU 89 2.713 -4.872 -1.837 1527 HD13 LEU 89 HD13 LEU 89 2.079 -3.661 -0.725 1528 HD21 LEU 89 HD21 LEU 89 3.320 -1.541 -0.357 1529 HD22 LEU 89 HD22 LEU 89 4.829 -1.244 -1.218 1530 HD23 LEU 89 HD23 LEU 89 4.777 -2.432 0.084 1531 H PHE 90 HN PHE 90 5.935 -2.790 -4.965 1532 HA PHE 90 HA PHE 90 3.693 -1.432 -5.918 1533 HB2 PHE 90 HB2 PHE 90 5.951 -0.481 -5.979 1534 HB3 PHE 90 HB1 PHE 90 6.432 -1.672 -7.183 1535 HD1 PHE 90 HD1 PHE 90 4.129 1.174 -6.596 1536 HD2 PHE 90 HD2 PHE 90 6.124 -1.259 -9.460 1537 HE1 PHE 90 HE1 PHE 90 3.412 2.703 -8.385 1538 HE2 PHE 90 HE2 PHE 90 5.414 0.268 -11.257 1539 HZ PHE 90 HZ PHE 90 4.054 2.249 -10.720 1540 H ALA 91 HN ALA 91 5.594 -4.014 -7.443 1541 HA ALA 91 HA ALA 91 4.115 -4.092 -9.846 1542 HB1 ALA 91 HB1 ALA 91 5.697 -6.301 -8.533 1543 HB2 ALA 91 HB2 ALA 91 6.341 -5.080 -9.630 1544 HB3 ALA 91 HB3 ALA 91 5.170 -6.260 -10.216 1545 H LEU 92 HN LEU 92 3.831 -5.909 -6.822 1546 HA LEU 92 HA LEU 92 1.881 -7.743 -7.647 1547 HB2 LEU 92 HB2 LEU 92 3.303 -7.815 -5.556 1548 HB3 LEU 92 HB1 LEU 92 2.215 -6.633 -4.861 1549 HG LEU 92 HG LEU 92 1.192 -9.286 -5.846 1550 HD11 LEU 92 HD11 LEU 92 2.278 -8.648 -3.105 1551 HD12 LEU 92 HD12 LEU 92 2.991 -9.761 -4.270 1552 HD13 LEU 92 HD13 LEU 92 1.420 -10.121 -3.554 1553 HD21 LEU 92 HD21 LEU 92 -0.560 -8.856 -4.180 1554 HD22 LEU 92 HD22 LEU 92 -0.471 -7.565 -5.378 1555 HD23 LEU 92 HD23 LEU 92 0.213 -7.324 -3.769 1556 H VAL 93 HN VAL 93 1.474 -4.646 -5.898 1557 HA VAL 93 HA VAL 93 -1.350 -4.846 -5.810 1558 HB VAL 93 HB VAL 93 -0.056 -3.418 -4.270 1559 HG11 VAL 93 HG11 VAL 93 0.690 -1.197 -4.992 1560 HG12 VAL 93 HG12 VAL 93 0.301 -1.623 -6.660 1561 HG13 VAL 93 HG13 VAL 93 1.572 -2.493 -5.800 1562 HG21 VAL 93 HG21 VAL 93 -1.607 -1.524 -4.237 1563 HG22 VAL 93 HG22 VAL 93 -2.441 -3.053 -4.518 1564 HG23 VAL 93 HG23 VAL 93 -2.151 -1.948 -5.862 1565 H GLN 94 HN GLN 94 0.868 -3.531 -8.171 1566 HA GLN 94 HA GLN 94 -1.045 -2.183 -9.768 1567 HB2 GLN 94 HB2 GLN 94 1.348 -1.754 -9.986 1568 HB3 GLN 94 HB1 GLN 94 1.618 -3.410 -10.511 1569 HG2 GLN 94 HG2 GLN 94 0.370 -3.015 -12.534 1570 HG3 GLN 94 HG1 GLN 94 -0.042 -1.387 -11.995 1571 HE21 GLN 94 HE21 GLN 94 2.489 -3.457 -13.180 1572 HE22 GLN 94 HE22 GLN 94 3.596 -2.196 -13.608 1573 H VAL 95 HN VAL 95 0.262 -5.477 -9.808 1574 HA VAL 95 HA VAL 95 -1.169 -6.427 -12.032 1575 HB VAL 95 HB VAL 95 -0.189 -7.914 -9.585 1576 HG11 VAL 95 HG11 VAL 95 -1.196 -9.042 -12.198 1577 HG12 VAL 95 HG12 VAL 95 -2.023 -9.143 -10.643 1578 HG13 VAL 95 HG13 VAL 95 -0.480 -9.965 -10.876 1579 HG21 VAL 95 HG21 VAL 95 0.930 -7.612 -12.369 1580 HG22 VAL 95 HG22 VAL 95 1.581 -8.689 -11.133 1581 HG23 VAL 95 HG23 VAL 95 1.602 -6.943 -10.882 1582 H VAL 96 HN VAL 96 -1.962 -6.477 -8.562 1583 HA VAL 96 HA VAL 96 -4.408 -7.757 -8.645 1584 HB VAL 96 HB VAL 96 -3.600 -5.444 -6.869 1585 HG11 VAL 96 HG11 VAL 96 -5.340 -6.214 -5.336 1586 HG12 VAL 96 HG12 VAL 96 -5.846 -7.426 -6.512 1587 HG13 VAL 96 HG13 VAL 96 -6.029 -5.711 -6.881 1588 HG21 VAL 96 HG21 VAL 96 -2.103 -7.324 -6.650 1589 HG22 VAL 96 HG22 VAL 96 -3.466 -8.430 -6.479 1590 HG23 VAL 96 HG23 VAL 96 -3.139 -7.233 -5.226 1591 H ALA 97 HN ALA 97 -3.738 -4.301 -9.128 1592 HA ALA 97 HA ALA 97 -6.413 -3.501 -9.498 1593 HB1 ALA 97 HB1 ALA 97 -5.509 -1.471 -10.470 1594 HB2 ALA 97 HB2 ALA 97 -3.925 -2.232 -10.637 1595 HB3 ALA 97 HB3 ALA 97 -4.591 -1.925 -9.032 1596 H ASP 98 HN ASP 98 -3.875 -4.049 -11.968 1597 HA ASP 98 HA ASP 98 -5.554 -3.643 -14.180 1598 HB2 ASP 98 HB2 ASP 98 -3.111 -3.570 -14.340 1599 HB3 ASP 98 HB1 ASP 98 -3.023 -5.293 -13.997 1600 H GLU 99 HN GLU 99 -4.834 -6.547 -12.342 1601 HA GLU 99 HA GLU 99 -5.994 -8.406 -14.128 1602 HB2 GLU 99 HB2 GLU 99 -4.454 -9.108 -12.385 1603 HB3 GLU 99 HB1 GLU 99 -5.569 -8.561 -11.141 1604 HG2 GLU 99 HG2 GLU 99 -7.184 -10.250 -11.848 1605 HG3 GLU 99 HG1 GLU 99 -6.057 -10.801 -13.088 1606 H HIS 100 HN HIS 100 -7.290 -6.880 -11.168 1607 HA HIS 100 HA HIS 100 -9.815 -8.195 -11.482 1608 HB2 HIS 100 HB2 HIS 100 -8.869 -6.049 -9.592 1609 HB3 HIS 100 HB1 HIS 100 -10.532 -6.629 -9.602 1610 HD1 HIS 100 HD1 HIS 100 -10.734 -9.352 -9.258 1611 HD2 HIS 100 HD2 HIS 100 -7.214 -7.512 -8.020 1612 HE1 HIS 100 HE1 HIS 100 -9.626 -10.980 -7.689 1613 HE2 HIS 100 HE2 HIS 100 -7.385 -9.945 -7.172 1614 H LEU 101 HN LEU 101 -8.504 -5.153 -12.534 1615 HA LEU 101 HA LEU 101 -11.053 -4.163 -13.444 1616 HB2 LEU 101 HB2 LEU 101 -8.261 -3.410 -14.325 1617 HB3 LEU 101 HB1 LEU 101 -9.727 -2.545 -14.742 1618 HG LEU 101 HG LEU 101 -8.545 -2.814 -11.975 1619 HD11 LEU 101 HD11 LEU 101 -7.302 -1.303 -13.434 1620 HD12 LEU 101 HD12 LEU 101 -8.143 -0.421 -12.159 1621 HD13 LEU 101 HD13 LEU 101 -8.788 -0.427 -13.799 1622 HD21 LEU 101 HD21 LEU 101 -10.986 -1.290 -12.880 1623 HD22 LEU 101 HD22 LEU 101 -10.294 -1.287 -11.257 1624 HD23 LEU 101 HD23 LEU 101 -10.992 -2.767 -11.915 1625 H GLU 102 HN GLU 102 -11.822 -6.055 -14.421 1626 HA GLU 102 HA GLU 102 -10.449 -7.735 -16.110 1627 HB2 GLU 102 HB2 GLU 102 -12.744 -8.464 -16.884 1628 HB3 GLU 102 HB1 GLU 102 -12.456 -8.510 -15.151 1629 HG2 GLU 102 HG2 GLU 102 -13.628 -6.341 -14.942 1630 HG3 GLU 102 HG1 GLU 102 -13.992 -6.415 -16.667 1631 H HIS 103 HN HIS 103 -9.422 -7.207 -17.876 1632 HA HIS 103 HA HIS 103 -10.383 -5.139 -19.638 1633 HB2 HIS 103 HB2 HIS 103 -8.026 -7.022 -19.855 1634 HB3 HIS 103 HB1 HIS 103 -8.405 -5.792 -21.054 1635 HD1 HIS 103 HD1 HIS 103 -7.875 -3.350 -20.462 1636 HD2 HIS 103 HD2 HIS 103 -6.946 -6.063 -17.449 1637 HE1 HIS 103 HE1 HIS 103 -6.472 -2.076 -18.809 1638 HE2 HIS 103 HE2 HIS 103 -5.697 -3.815 -17.160 1639 H HIS 104 HN HIS 104 -12.431 -6.109 -20.097 1640 HA HIS 104 HA HIS 104 -12.203 -7.905 -22.412 1641 HB2 HIS 104 HB2 HIS 104 -14.431 -8.019 -20.363 1642 HB3 HIS 104 HB1 HIS 104 -14.306 -9.005 -21.813 1643 HD1 HIS 104 HD1 HIS 104 -12.216 -10.743 -21.823 1644 HD2 HIS 104 HD2 HIS 104 -13.255 -9.074 -18.155 1645 HE1 HIS 104 HE1 HIS 104 -11.154 -12.215 -20.077 1646 HE2 HIS 104 HE2 HIS 104 -11.909 -11.262 -17.866 1647 H HIS 105 HN HIS 105 -12.286 -6.197 -23.790 1648 HA HIS 105 HA HIS 105 -13.227 -4.680 -25.177 1649 HB2 HIS 105 HB2 HIS 105 -15.856 -5.288 -23.804 1650 HB3 HIS 105 HB1 HIS 105 -15.652 -4.412 -25.316 1651 HD1 HIS 105 HD1 HIS 105 -16.885 -7.451 -24.365 1652 HD2 HIS 105 HD2 HIS 105 -13.906 -6.406 -27.078 1653 HE1 HIS 105 HE1 HIS 105 -16.660 -9.415 -25.923 1654 HE2 HIS 105 HE2 HIS 105 -14.947 -8.711 -27.633 1655 H HIS 106 HN HIS 106 -15.534 -3.997 -22.596 1656 HA HIS 106 HA HIS 106 -13.948 -1.709 -21.720 1657 HB2 HIS 106 HB2 HIS 106 -16.735 -1.467 -22.870 1658 HB3 HIS 106 HB1 HIS 106 -15.992 -0.219 -21.878 1659 HD1 HIS 106 HD1 HIS 106 -16.489 -1.100 -25.297 1660 HD2 HIS 106 HD2 HIS 106 -13.380 0.631 -23.138 1661 HE1 HIS 106 HE1 HIS 106 -15.046 0.062 -26.995 1662 HE2 HIS 106 HE2 HIS 106 -13.049 0.876 -25.693 1663 H HIS 107 HN HIS 107 -17.188 -3.155 -21.382 1664 HA HIS 107 HA HIS 107 -18.477 -3.638 -19.585 1665 HB2 HIS 107 HB2 HIS 107 -15.746 -4.312 -18.560 1666 HB3 HIS 107 HB1 HIS 107 -17.131 -4.396 -17.476 1667 HD1 HIS 107 HD1 HIS 107 -19.235 -5.634 -19.289 1668 HD2 HIS 107 HD2 HIS 107 -15.279 -6.919 -19.142 1669 HE1 HIS 107 HE1 HIS 107 -19.260 -8.012 -20.110 1670 HE2 HIS 107 HE2 HIS 107 -16.847 -8.742 -20.108 1671 H HIS 108 HN HIS 108 -18.436 -1.050 -19.908 1672 HA HIS 108 HA HIS 108 -18.162 0.011 -17.175 1673 HB2 HIS 108 HB2 HIS 108 -16.504 1.033 -18.703 1674 HB3 HIS 108 HB1 HIS 108 -17.816 1.558 -19.753 1675 HD1 HIS 108 HD1 HIS 108 -18.558 3.887 -19.361 1676 HD2 HIS 108 HD2 HIS 108 -16.864 2.207 -15.955 1677 HE1 HIS 108 HE1 HIS 108 -18.553 5.712 -17.638 1678 HE2 HIS 108 HE2 HIS 108 -17.741 4.605 -15.531 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 -12.345 7.986 -30.417 2 H2 MET 1 HT2 MET 1 -12.520 8.268 -28.753 3 H3 MET 1 HT3 MET 1 -13.774 8.681 -29.816 4 HA MET 1 HA MET 1 -14.249 6.646 -28.586 5 HB2 MET 1 HB2 MET 1 -13.796 6.268 -31.553 6 HB3 MET 1 HB1 MET 1 -14.797 5.228 -30.551 7 HG2 MET 1 HG2 MET 1 -16.284 7.115 -30.083 8 HG3 MET 1 HG1 MET 1 -15.276 8.151 -31.091 9 HE1 MET 1 HE1 MET 1 -17.755 5.130 -30.986 10 HE2 MET 1 HE2 MET 1 -16.317 4.387 -31.688 11 HE3 MET 1 HE3 MET 1 -17.768 4.599 -32.669 12 H ALA 2 HN ALA 2 -12.448 6.069 -27.282 13 HA ALA 2 HA ALA 2 -10.778 4.726 -26.548 14 HB1 ALA 2 HB1 ALA 2 -12.487 3.031 -27.047 15 HB2 ALA 2 HB2 ALA 2 -10.844 2.412 -27.225 16 HB3 ALA 2 HB3 ALA 2 -11.790 2.826 -28.655 17 H GLY 3 HN GLY 3 -9.047 6.062 -27.220 18 HA2 GLY 3 HA2 GLY 3 -7.383 4.780 -29.248 19 HA3 GLY 3 HA1 GLY 3 -7.824 6.455 -29.547 20 H GLN 4 HN GLN 4 -7.655 6.215 -26.287 21 HA GLN 4 HA GLN 4 -4.908 7.253 -26.316 22 HB2 GLN 4 HB2 GLN 4 -7.084 7.666 -24.254 23 HB3 GLN 4 HB1 GLN 4 -5.486 8.396 -24.221 24 HG2 GLN 4 HG2 GLN 4 -7.646 8.889 -26.257 25 HG3 GLN 4 HG1 GLN 4 -7.116 9.991 -24.987 26 HE21 GLN 4 HE21 GLN 4 -5.128 11.035 -25.189 27 HE22 GLN 4 HE22 GLN 4 -4.316 11.157 -26.715 28 H SER 5 HN SER 5 -3.824 6.987 -24.089 29 HA SER 5 HA SER 5 -3.873 4.163 -23.405 30 HB2 SER 5 HB2 SER 5 -1.710 5.307 -23.806 31 HB3 SER 5 HB1 SER 5 -2.040 6.381 -22.448 32 HG SER 5 HG SER 5 -0.958 4.877 -21.429 33 H ASP 6 HN ASP 6 -5.828 4.020 -22.317 34 HA ASP 6 HA ASP 6 -6.347 5.768 -20.064 35 HB2 ASP 6 HB2 ASP 6 -7.973 3.479 -21.191 36 HB3 ASP 6 HB1 ASP 6 -8.510 4.585 -19.932 37 H ARG 7 HN ARG 7 -5.136 2.578 -20.648 38 HA ARG 7 HA ARG 7 -5.925 1.337 -18.261 39 HB2 ARG 7 HB2 ARG 7 -3.633 0.790 -20.127 40 HB3 ARG 7 HB1 ARG 7 -3.902 -0.167 -18.680 41 HG2 ARG 7 HG2 ARG 7 -6.239 -0.590 -19.575 42 HG3 ARG 7 HG1 ARG 7 -5.647 0.071 -21.103 43 HD2 ARG 7 HD2 ARG 7 -3.869 -1.600 -21.140 44 HD3 ARG 7 HD1 ARG 7 -4.442 -2.254 -19.609 45 HE ARG 7 HE ARG 7 -6.143 -2.262 -22.021 46 HH11 ARG 7 HH11 ARG 7 -4.676 -3.909 -19.282 47 HH12 ARG 7 HH12 ARG 7 -5.404 -5.445 -19.667 48 HH21 ARG 7 HH21 ARG 7 -7.092 -4.304 -22.509 49 HH22 ARG 7 HH22 ARG 7 -6.765 -5.664 -21.473 50 H LYS 8 HN LYS 8 -3.089 3.294 -19.021 51 HA LYS 8 HA LYS 8 -1.602 2.710 -16.721 52 HB2 LYS 8 HB2 LYS 8 -0.848 3.987 -18.804 53 HB3 LYS 8 HB1 LYS 8 -1.621 5.398 -18.091 54 HG2 LYS 8 HG2 LYS 8 -0.157 5.164 -16.119 55 HG3 LYS 8 HG1 LYS 8 0.652 3.811 -16.911 56 HD2 LYS 8 HD2 LYS 8 1.154 5.389 -18.818 57 HD3 LYS 8 HD1 LYS 8 0.594 6.695 -17.774 58 HE2 LYS 8 HE2 LYS 8 2.984 6.567 -17.618 59 HE3 LYS 8 HE1 LYS 8 2.296 6.002 -16.097 60 HZ1 LYS 8 HZ1 LYS 8 3.270 4.260 -18.299 61 HZ2 LYS 8 HZ2 LYS 8 2.632 3.728 -16.822 62 HZ3 LYS 8 HZ3 LYS 8 4.101 4.575 -16.851 63 H ALA 9 HN ALA 9 -3.764 5.467 -17.362 64 HA ALA 9 HA ALA 9 -3.627 6.601 -14.805 65 HB1 ALA 9 HB1 ALA 9 -4.495 7.788 -16.764 66 HB2 ALA 9 HB2 ALA 9 -5.643 7.827 -15.425 67 HB3 ALA 9 HB3 ALA 9 -5.903 6.729 -16.780 68 H ALA 10 HN ALA 10 -5.821 4.184 -16.168 69 HA ALA 10 HA ALA 10 -7.510 4.018 -13.887 70 HB1 ALA 10 HB1 ALA 10 -8.264 3.312 -16.096 71 HB2 ALA 10 HB2 ALA 10 -8.401 1.995 -14.930 72 HB3 ALA 10 HB3 ALA 10 -7.074 2.009 -16.093 73 H LEU 11 HN LEU 11 -4.480 2.555 -14.741 74 HA LEU 11 HA LEU 11 -4.636 0.368 -12.906 75 HB2 LEU 11 HB2 LEU 11 -3.111 0.713 -14.996 76 HB3 LEU 11 HB1 LEU 11 -2.067 1.573 -13.886 77 HG LEU 11 HG LEU 11 -2.924 -1.288 -13.455 78 HD11 LEU 11 HD11 LEU 11 -0.723 -1.920 -14.310 79 HD12 LEU 11 HD12 LEU 11 -0.408 -0.238 -14.738 80 HD13 LEU 11 HD13 LEU 11 -1.698 -1.126 -15.547 81 HD21 LEU 11 HD21 LEU 11 -0.990 -1.364 -11.959 82 HD22 LEU 11 HD22 LEU 11 -2.160 -0.153 -11.440 83 HD23 LEU 11 HD23 LEU 11 -0.682 0.345 -12.267 84 H LEU 12 HN LEU 12 -2.974 3.509 -12.893 85 HA LEU 12 HA LEU 12 -1.972 3.302 -10.263 86 HB2 LEU 12 HB2 LEU 12 -2.615 5.797 -11.837 87 HB3 LEU 12 HB1 LEU 12 -1.590 5.716 -10.416 88 HG LEU 12 HG LEU 12 -1.017 4.462 -13.106 89 HD11 LEU 12 HD11 LEU 12 -0.713 6.858 -13.116 90 HD12 LEU 12 HD12 LEU 12 0.858 6.054 -13.140 91 HD13 LEU 12 HD13 LEU 12 0.255 6.767 -11.644 92 HD21 LEU 12 HD21 LEU 12 1.135 3.818 -12.163 93 HD22 LEU 12 HD22 LEU 12 -0.188 3.063 -11.274 94 HD23 LEU 12 HD23 LEU 12 0.652 4.455 -10.590 95 H ASP 13 HN ASP 13 -4.989 4.464 -11.587 96 HA ASP 13 HA ASP 13 -6.096 5.733 -9.375 97 HB2 ASP 13 HB2 ASP 13 -7.224 5.933 -11.446 98 HB3 ASP 13 HB1 ASP 13 -7.324 4.188 -11.652 99 H GLN 14 HN GLN 14 -6.375 2.302 -10.313 100 HA GLN 14 HA GLN 14 -8.028 1.730 -8.045 101 HB2 GLN 14 HB2 GLN 14 -7.925 -0.609 -8.815 102 HB3 GLN 14 HB1 GLN 14 -8.387 0.505 -10.093 103 HG2 GLN 14 HG2 GLN 14 -6.063 0.449 -10.925 104 HG3 GLN 14 HG1 GLN 14 -5.688 -0.758 -9.696 105 HE21 GLN 14 HE21 GLN 14 -5.583 -0.928 -12.600 106 HE22 GLN 14 HE22 GLN 14 -6.602 -2.252 -13.037 107 H VAL 15 HN VAL 15 -4.584 1.272 -8.793 108 HA VAL 15 HA VAL 15 -4.108 -0.338 -6.485 109 HB VAL 15 HB VAL 15 -1.717 0.087 -6.821 110 HG11 VAL 15 HG11 VAL 15 -2.793 -1.675 -8.097 111 HG12 VAL 15 HG12 VAL 15 -1.510 -0.917 -9.041 112 HG13 VAL 15 HG13 VAL 15 -3.197 -0.525 -9.371 113 HG21 VAL 15 HG21 VAL 15 -0.952 1.429 -8.734 114 HG22 VAL 15 HG22 VAL 15 -1.774 2.404 -7.516 115 HG23 VAL 15 HG23 VAL 15 -2.612 1.962 -9.005 116 H ALA 16 HN ALA 16 -4.123 3.120 -7.109 117 HA ALA 16 HA ALA 16 -3.087 3.900 -4.586 118 HB1 ALA 16 HB1 ALA 16 -4.066 6.088 -5.064 119 HB2 ALA 16 HB2 ALA 16 -4.971 5.395 -6.413 120 HB3 ALA 16 HB3 ALA 16 -3.210 5.457 -6.469 121 H ARG 17 HN ARG 17 -6.284 3.097 -5.790 122 HA ARG 17 HA ARG 17 -7.754 3.793 -3.493 123 HB2 ARG 17 HB2 ARG 17 -8.945 3.395 -5.524 124 HB3 ARG 17 HB1 ARG 17 -8.269 1.779 -5.681 125 HG2 ARG 17 HG2 ARG 17 -9.878 0.883 -4.438 126 HG3 ARG 17 HG1 ARG 17 -9.711 2.120 -3.191 127 HD2 ARG 17 HD2 ARG 17 -11.942 2.151 -4.150 128 HD3 ARG 17 HD1 ARG 17 -11.080 3.642 -4.509 129 HE ARG 17 HE ARG 17 -10.843 2.907 -6.769 130 HH11 ARG 17 HH11 ARG 17 -12.876 0.838 -4.811 131 HH12 ARG 17 HH12 ARG 17 -13.814 0.261 -6.157 132 HH21 ARG 17 HH21 ARG 17 -12.043 2.139 -8.549 133 HH22 ARG 17 HH22 ARG 17 -13.308 0.965 -8.301 134 H VAL 18 HN VAL 18 -6.112 0.805 -4.436 135 HA VAL 18 HA VAL 18 -6.799 -0.735 -2.188 136 HB VAL 18 HB VAL 18 -4.214 -0.810 -3.768 137 HG11 VAL 18 HG11 VAL 18 -4.018 -1.970 -1.632 138 HG12 VAL 18 HG12 VAL 18 -4.026 -3.120 -2.970 139 HG13 VAL 18 HG13 VAL 18 -5.475 -2.898 -1.987 140 HG21 VAL 18 HG21 VAL 18 -6.759 -2.388 -4.139 141 HG22 VAL 18 HG22 VAL 18 -5.262 -2.617 -5.042 142 HG23 VAL 18 HG23 VAL 18 -6.166 -1.111 -5.198 143 H GLY 19 HN GLY 19 -4.133 1.507 -2.794 144 HA2 GLY 19 HA2 GLY 19 -2.843 1.191 -0.301 145 HA3 GLY 19 HA1 GLY 19 -2.662 2.559 -1.389 146 H LYS 20 HN LYS 20 -5.660 2.992 -1.214 147 HA LYS 20 HA LYS 20 -5.639 4.788 1.001 148 HB2 LYS 20 HB2 LYS 20 -7.911 3.842 -0.754 149 HB3 LYS 20 HB1 LYS 20 -8.055 5.109 0.455 150 HG2 LYS 20 HG2 LYS 20 -6.434 6.464 -0.750 151 HG3 LYS 20 HG1 LYS 20 -6.249 5.186 -1.953 152 HD2 LYS 20 HD2 LYS 20 -7.745 6.899 -2.785 153 HD3 LYS 20 HD1 LYS 20 -8.633 5.399 -2.512 154 HE2 LYS 20 HE2 LYS 20 -9.388 6.290 -0.329 155 HE3 LYS 20 HE1 LYS 20 -8.570 7.806 -0.695 156 HZ1 LYS 20 HZ1 LYS 20 -10.887 7.989 -1.217 157 HZ2 LYS 20 HZ2 LYS 20 -10.833 6.613 -2.201 158 HZ3 LYS 20 HZ3 LYS 20 -10.005 8.017 -2.663 159 H ALA 21 HN ALA 21 -7.278 1.704 0.349 160 HA ALA 21 HA ALA 21 -8.479 1.568 2.935 161 HB1 ALA 21 HB1 ALA 21 -9.061 -0.715 2.340 162 HB2 ALA 21 HB2 ALA 21 -7.971 -0.649 0.955 163 HB3 ALA 21 HB3 ALA 21 -9.403 0.380 0.999 164 H LEU 22 HN LEU 22 -5.499 0.419 1.492 165 HA LEU 22 HA LEU 22 -4.691 -0.872 3.976 166 HB2 LEU 22 HB2 LEU 22 -4.207 -1.857 1.697 167 HB3 LEU 22 HB1 LEU 22 -3.074 -0.544 1.449 168 HG LEU 22 HG LEU 22 -1.886 -1.340 3.554 169 HD11 LEU 22 HD11 LEU 22 -3.609 -3.760 3.067 170 HD12 LEU 22 HD12 LEU 22 -3.674 -2.696 4.472 171 HD13 LEU 22 HD13 LEU 22 -2.241 -3.682 4.175 172 HD21 LEU 22 HD21 LEU 22 -1.974 -3.182 1.172 173 HD22 LEU 22 HD22 LEU 22 -0.688 -3.109 2.376 174 HD23 LEU 22 HD23 LEU 22 -0.992 -1.724 1.324 175 H ALA 23 HN ALA 23 -5.078 2.113 3.627 176 HA ALA 23 HA ALA 23 -2.437 3.193 3.983 177 HB1 ALA 23 HB1 ALA 23 -3.481 5.300 4.425 178 HB2 ALA 23 HB2 ALA 23 -5.054 4.531 4.642 179 HB3 ALA 23 HB3 ALA 23 -4.291 4.546 3.051 180 H ASN 24 HN ASN 24 -3.858 1.100 5.777 181 HA ASN 24 HA ASN 24 -3.290 0.276 7.790 182 HB2 ASN 24 HB2 ASN 24 -1.579 2.745 8.073 183 HB3 ASN 24 HB1 ASN 24 -1.450 1.269 9.028 184 HD21 ASN 24 HD21 ASN 24 -0.800 2.782 5.999 185 HD22 ASN 24 HD22 ASN 24 0.181 1.521 5.341 186 H GLY 25 HN GLY 25 -2.927 1.316 10.254 187 HA2 GLY 25 HA2 GLY 25 -3.989 2.887 11.782 188 HA3 GLY 25 HA1 GLY 25 -5.382 2.889 10.706 189 H ARG 26 HN ARG 26 -6.661 2.343 12.583 190 HA ARG 26 HA ARG 26 -6.289 -0.043 14.044 191 HB2 ARG 26 HB2 ARG 26 -8.653 0.245 14.728 192 HB3 ARG 26 HB1 ARG 26 -7.713 1.720 14.896 193 HG2 ARG 26 HG2 ARG 26 -8.645 2.505 12.740 194 HG3 ARG 26 HG1 ARG 26 -9.667 1.066 12.702 195 HD2 ARG 26 HD2 ARG 26 -10.809 3.098 13.580 196 HD3 ARG 26 HD1 ARG 26 -10.796 1.739 14.704 197 HE ARG 26 HE ARG 26 -8.935 2.886 15.853 198 HH11 ARG 26 HH11 ARG 26 -11.044 4.773 13.788 199 HH12 ARG 26 HH12 ARG 26 -10.720 6.265 14.619 200 HH21 ARG 26 HH21 ARG 26 -8.530 4.818 16.947 201 HH22 ARG 26 HH22 ARG 26 -9.292 6.292 16.424 202 H ARG 27 HN ARG 27 -7.543 0.552 10.900 203 HA ARG 27 HA ARG 27 -9.130 -1.803 10.703 204 HB2 ARG 27 HB2 ARG 27 -9.063 -1.311 8.229 205 HB3 ARG 27 HB1 ARG 27 -9.711 -0.035 9.248 206 HG2 ARG 27 HG2 ARG 27 -7.477 1.076 9.146 207 HG3 ARG 27 HG1 ARG 27 -6.997 -0.134 7.955 208 HD2 ARG 27 HD2 ARG 27 -8.777 0.563 6.475 209 HD3 ARG 27 HD1 ARG 27 -9.372 1.698 7.683 210 HE ARG 27 HE ARG 27 -6.645 2.062 6.715 211 HH11 ARG 27 HH11 ARG 27 -9.982 3.115 6.768 212 HH12 ARG 27 HH12 ARG 27 -9.652 4.638 5.988 213 HH21 ARG 27 HH21 ARG 27 -6.202 4.073 5.699 214 HH22 ARG 27 HH22 ARG 27 -7.497 5.181 5.377 215 H LEU 28 HN LEU 28 -5.777 -1.336 10.713 216 HA LEU 28 HA LEU 28 -5.073 -3.556 9.047 217 HB2 LEU 28 HB2 LEU 28 -3.584 -2.099 11.213 218 HB3 LEU 28 HB1 LEU 28 -2.905 -3.474 10.367 219 HG LEU 28 HG LEU 28 -3.646 -0.800 9.193 220 HD11 LEU 28 HD11 LEU 28 -1.266 -0.668 8.727 221 HD12 LEU 28 HD12 LEU 28 -1.021 -2.246 9.477 222 HD13 LEU 28 HD13 LEU 28 -1.560 -0.880 10.455 223 HD21 LEU 28 HD21 LEU 28 -4.223 -2.569 7.608 224 HD22 LEU 28 HD22 LEU 28 -2.615 -3.273 7.798 225 HD23 LEU 28 HD23 LEU 28 -2.799 -1.678 7.067 226 H GLN 29 HN GLN 29 -6.010 -3.122 12.360 227 HA GLN 29 HA GLN 29 -5.134 -5.606 13.374 228 HB2 GLN 29 HB2 GLN 29 -7.438 -3.852 14.252 229 HB3 GLN 29 HB1 GLN 29 -6.779 -5.191 15.183 230 HG2 GLN 29 HG2 GLN 29 -4.710 -4.066 15.496 231 HG3 GLN 29 HG1 GLN 29 -5.149 -2.806 14.343 232 HE21 GLN 29 HE21 GLN 29 -5.668 -4.068 17.543 233 HE22 GLN 29 HE22 GLN 29 -6.465 -2.672 18.183 234 H ILE 30 HN ILE 30 -7.866 -4.621 11.497 235 HA ILE 30 HA ILE 30 -9.390 -7.014 11.770 236 HB ILE 30 HB ILE 30 -9.390 -4.957 9.552 237 HG12 ILE 30 HG12 ILE 30 -11.183 -5.262 11.972 238 HG13 ILE 30 HG11 ILE 30 -9.951 -4.023 11.760 239 HG21 ILE 30 HG21 ILE 30 -11.612 -5.853 9.006 240 HG22 ILE 30 HG22 ILE 30 -11.385 -7.118 10.214 241 HG23 ILE 30 HG23 ILE 30 -10.338 -7.055 8.795 242 HD11 ILE 30 HD11 ILE 30 -11.192 -3.125 9.858 243 HD12 ILE 30 HD12 ILE 30 -12.158 -3.136 11.332 244 HD13 ILE 30 HD13 ILE 30 -12.432 -4.359 10.090 245 H LEU 31 HN LEU 31 -7.180 -5.770 9.275 246 HA LEU 31 HA LEU 31 -7.180 -8.025 7.623 247 HB2 LEU 31 HB2 LEU 31 -5.113 -5.890 8.096 248 HB3 LEU 31 HB1 LEU 31 -4.915 -7.144 6.887 249 HG LEU 31 HG LEU 31 -7.218 -5.189 6.928 250 HD11 LEU 31 HD11 LEU 31 -4.697 -5.159 5.273 251 HD12 LEU 31 HD12 LEU 31 -5.110 -4.020 6.555 252 HD13 LEU 31 HD13 LEU 31 -6.076 -4.075 5.081 253 HD21 LEU 31 HD21 LEU 31 -6.246 -7.115 4.818 254 HD22 LEU 31 HD22 LEU 31 -7.593 -5.987 4.652 255 HD23 LEU 31 HD23 LEU 31 -7.691 -7.315 5.808 256 H ASP 32 HN ASP 32 -5.168 -7.155 10.378 257 HA ASP 32 HA ASP 32 -3.331 -9.264 10.309 258 HB2 ASP 32 HB2 ASP 32 -3.028 -7.310 11.726 259 HB3 ASP 32 HB1 ASP 32 -4.456 -7.731 12.662 260 H LEU 33 HN LEU 33 -6.526 -9.031 11.792 261 HA LEU 33 HA LEU 33 -6.457 -11.611 12.981 262 HB2 LEU 33 HB2 LEU 33 -7.976 -9.781 13.703 263 HB3 LEU 33 HB1 LEU 33 -8.861 -9.958 12.199 264 HG LEU 33 HG LEU 33 -9.406 -12.304 12.858 265 HD11 LEU 33 HD11 LEU 33 -9.107 -12.951 15.199 266 HD12 LEU 33 HD12 LEU 33 -8.189 -11.473 15.487 267 HD13 LEU 33 HD13 LEU 33 -7.561 -12.698 14.387 268 HD21 LEU 33 HD21 LEU 33 -10.991 -10.475 13.218 269 HD22 LEU 33 HD22 LEU 33 -10.280 -10.173 14.803 270 HD23 LEU 33 HD23 LEU 33 -11.110 -11.695 14.486 271 H LEU 34 HN LEU 34 -7.702 -10.348 9.920 272 HA LEU 34 HA LEU 34 -8.905 -12.768 9.068 273 HB2 LEU 34 HB2 LEU 34 -7.935 -10.394 7.479 274 HB3 LEU 34 HB1 LEU 34 -8.886 -11.709 6.814 275 HG LEU 34 HG LEU 34 -9.790 -9.812 8.983 276 HD11 LEU 34 HD11 LEU 34 -11.345 -8.994 7.273 277 HD12 LEU 34 HD12 LEU 34 -10.571 -10.038 6.082 278 HD13 LEU 34 HD13 LEU 34 -9.662 -8.723 6.825 279 HD21 LEU 34 HD21 LEU 34 -11.276 -12.018 7.560 280 HD22 LEU 34 HD22 LEU 34 -11.972 -10.874 8.708 281 HD23 LEU 34 HD23 LEU 34 -10.758 -12.036 9.244 282 H ALA 35 HN ALA 35 -5.668 -11.464 8.781 283 HA ALA 35 HA ALA 35 -4.666 -13.329 6.908 284 HB1 ALA 35 HB1 ALA 35 -3.498 -11.249 7.499 285 HB2 ALA 35 HB2 ALA 35 -2.458 -12.662 7.687 286 HB3 ALA 35 HB3 ALA 35 -3.174 -11.897 9.107 287 H GLN 36 HN GLN 36 -5.478 -13.571 10.228 288 HA GLN 36 HA GLN 36 -4.036 -16.090 10.557 289 HB2 GLN 36 HB2 GLN 36 -5.657 -14.421 12.488 290 HB3 GLN 36 HB1 GLN 36 -4.905 -15.954 12.903 291 HG2 GLN 36 HG2 GLN 36 -2.717 -15.057 12.528 292 HG3 GLN 36 HG1 GLN 36 -3.393 -13.554 11.903 293 HE21 GLN 36 HE21 GLN 36 -4.206 -12.038 13.315 294 HE22 GLN 36 HE22 GLN 36 -3.953 -12.125 15.028 295 H GLY 37 HN GLY 37 -6.866 -15.141 9.231 296 HA2 GLY 37 HA2 GLY 37 -8.052 -17.355 8.535 297 HA3 GLY 37 HA1 GLY 37 -8.442 -17.396 10.248 298 H GLU 38 HN GLU 38 -10.001 -17.010 7.629 299 HA GLU 38 HA GLU 38 -11.164 -14.399 7.848 300 HB2 GLU 38 HB2 GLU 38 -12.825 -15.296 6.211 301 HB3 GLU 38 HB1 GLU 38 -11.157 -15.452 5.693 302 HG2 GLU 38 HG2 GLU 38 -11.195 -17.817 6.414 303 HG3 GLU 38 HG1 GLU 38 -12.901 -17.633 6.814 304 H ARG 39 HN ARG 39 -13.216 -13.840 8.694 305 HA ARG 39 HA ARG 39 -14.639 -15.797 10.279 306 HB2 ARG 39 HB2 ARG 39 -12.653 -13.956 11.478 307 HB3 ARG 39 HB1 ARG 39 -14.189 -14.103 12.322 308 HG2 ARG 39 HG2 ARG 39 -13.894 -16.403 12.690 309 HG3 ARG 39 HG1 ARG 39 -12.582 -16.502 11.514 310 HD2 ARG 39 HD2 ARG 39 -12.407 -14.851 14.021 311 HD3 ARG 39 HD1 ARG 39 -11.920 -16.544 13.956 312 HE ARG 39 HE ARG 39 -10.719 -14.742 12.006 313 HH11 ARG 39 HH11 ARG 39 -10.418 -16.492 15.018 314 HH12 ARG 39 HH12 ARG 39 -8.676 -16.435 15.021 315 HH21 ARG 39 HH21 ARG 39 -8.428 -14.643 12.018 316 HH22 ARG 39 HH22 ARG 39 -7.559 -15.388 13.326 317 H ALA 40 HN ALA 40 -16.303 -14.676 11.712 318 HA ALA 40 HA ALA 40 -17.847 -12.951 10.026 319 HB1 ALA 40 HB1 ALA 40 -19.549 -13.128 11.759 320 HB2 ALA 40 HB2 ALA 40 -18.383 -13.893 12.839 321 HB3 ALA 40 HB3 ALA 40 -18.888 -14.714 11.363 322 H VAL 41 HN VAL 41 -18.898 -10.988 10.885 323 HA VAL 41 HA VAL 41 -16.977 -9.025 11.410 324 HB VAL 41 HB VAL 41 -19.958 -8.801 11.863 325 HG11 VAL 41 HG11 VAL 41 -19.612 -6.414 11.419 326 HG12 VAL 41 HG12 VAL 41 -17.873 -6.693 11.312 327 HG13 VAL 41 HG13 VAL 41 -18.717 -6.956 12.840 328 HG21 VAL 41 HG21 VAL 41 -18.347 -8.320 9.361 329 HG22 VAL 41 HG22 VAL 41 -20.055 -7.941 9.566 330 HG23 VAL 41 HG23 VAL 41 -19.512 -9.616 9.624 331 H GLU 42 HN GLU 42 -19.262 -10.657 13.566 332 HA GLU 42 HA GLU 42 -18.915 -9.066 15.831 333 HB2 GLU 42 HB2 GLU 42 -19.335 -12.052 15.922 334 HB3 GLU 42 HB1 GLU 42 -19.833 -10.861 17.115 335 HG2 GLU 42 HG2 GLU 42 -21.822 -11.235 16.088 336 HG3 GLU 42 HG1 GLU 42 -21.221 -9.912 15.088 337 H ALA 43 HN ALA 43 -17.116 -11.930 14.796 338 HA ALA 43 HA ALA 43 -15.400 -12.087 17.019 339 HB1 ALA 43 HB1 ALA 43 -15.682 -13.923 15.427 340 HB2 ALA 43 HB2 ALA 43 -13.984 -13.479 15.600 341 HB3 ALA 43 HB3 ALA 43 -14.890 -12.962 14.176 342 H ILE 44 HN ILE 44 -15.081 -10.475 13.886 343 HA ILE 44 HA ILE 44 -12.490 -9.459 14.250 344 HB ILE 44 HB ILE 44 -14.757 -8.317 12.611 345 HG12 ILE 44 HG12 ILE 44 -12.472 -10.129 11.801 346 HG13 ILE 44 HG11 ILE 44 -14.136 -10.651 12.043 347 HG21 ILE 44 HG21 ILE 44 -11.795 -7.777 12.470 348 HG22 ILE 44 HG22 ILE 44 -13.044 -6.646 12.993 349 HG23 ILE 44 HG23 ILE 44 -12.996 -7.195 11.318 350 HD11 ILE 44 HD11 ILE 44 -13.164 -8.710 9.959 351 HD12 ILE 44 HD12 ILE 44 -14.844 -9.187 10.210 352 HD13 ILE 44 HD13 ILE 44 -13.655 -10.383 9.691 353 H ALA 45 HN ALA 45 -15.670 -7.984 14.871 354 HA ALA 45 HA ALA 45 -14.735 -5.480 15.721 355 HB1 ALA 45 HB1 ALA 45 -16.946 -5.186 16.716 356 HB2 ALA 45 HB2 ALA 45 -17.266 -6.908 16.521 357 HB3 ALA 45 HB3 ALA 45 -17.057 -5.884 15.100 358 H THR 46 HN THR 46 -15.306 -8.470 17.504 359 HA THR 46 HA THR 46 -14.930 -7.346 20.082 360 HB THR 46 HB THR 46 -14.442 -10.223 19.279 361 HG1 THR 46 HG1 THR 46 -16.553 -9.558 18.656 362 HG21 THR 46 HG21 THR 46 -13.638 -9.608 21.523 363 HG22 THR 46 HG22 THR 46 -15.016 -10.707 21.608 364 HG23 THR 46 HG23 THR 46 -15.239 -8.986 21.919 365 H ALA 47 HN ALA 47 -12.751 -9.161 17.922 366 HA ALA 47 HA ALA 47 -10.522 -9.164 19.624 367 HB1 ALA 47 HB1 ALA 47 -10.749 -10.654 17.693 368 HB2 ALA 47 HB2 ALA 47 -9.225 -9.764 17.654 369 HB3 ALA 47 HB3 ALA 47 -10.560 -9.275 16.609 370 H THR 48 HN THR 48 -11.679 -6.768 17.336 371 HA THR 48 HA THR 48 -9.271 -5.187 17.550 372 HB THR 48 HB THR 48 -10.625 -3.507 16.211 373 HG1 THR 48 HG1 THR 48 -12.402 -5.665 15.741 374 HG21 THR 48 HG21 THR 48 -9.036 -5.022 15.155 375 HG22 THR 48 HG22 THR 48 -10.459 -4.812 14.135 376 HG23 THR 48 HG23 THR 48 -10.264 -6.287 15.082 377 H GLY 49 HN GLY 49 -12.357 -5.374 19.118 378 HA2 GLY 49 HA2 GLY 49 -12.916 -4.374 21.147 379 HA3 GLY 49 HA1 GLY 49 -11.526 -3.313 20.986 380 H MET 50 HN MET 50 -13.949 -3.725 18.477 381 HA MET 50 HA MET 50 -14.964 -1.037 19.113 382 HB2 MET 50 HB2 MET 50 -14.186 -2.136 16.419 383 HB3 MET 50 HB1 MET 50 -15.295 -0.783 16.584 384 HG2 MET 50 HG2 MET 50 -13.452 0.459 16.440 385 HG3 MET 50 HG1 MET 50 -13.246 0.047 18.140 386 HE1 MET 50 HE1 MET 50 -12.795 -2.143 14.889 387 HE2 MET 50 HE2 MET 50 -11.057 -1.997 14.633 388 HE3 MET 50 HE3 MET 50 -12.095 -0.582 14.467 389 H ASN 51 HN ASN 51 -17.011 -0.609 17.729 390 HA ASN 51 HA ASN 51 -18.974 -2.557 18.513 391 HB2 ASN 51 HB2 ASN 51 -19.197 0.013 18.450 392 HB3 ASN 51 HB1 ASN 51 -19.429 -0.168 16.718 393 HD21 ASN 51 HD21 ASN 51 -21.209 0.879 18.750 394 HD22 ASN 51 HD22 ASN 51 -22.661 -0.066 18.655 395 H LEU 52 HN LEU 52 -20.449 -3.632 17.053 396 HA LEU 52 HA LEU 52 -19.261 -5.016 14.956 397 HB2 LEU 52 HB2 LEU 52 -22.188 -4.467 15.441 398 HB3 LEU 52 HB1 LEU 52 -21.577 -5.650 14.301 399 HG LEU 52 HG LEU 52 -21.267 -5.721 17.301 400 HD11 LEU 52 HD11 LEU 52 -22.649 -7.722 17.134 401 HD12 LEU 52 HD12 LEU 52 -22.773 -7.498 15.391 402 HD13 LEU 52 HD13 LEU 52 -23.492 -6.316 16.484 403 HD21 LEU 52 HD21 LEU 52 -19.259 -6.573 16.234 404 HD22 LEU 52 HD22 LEU 52 -20.233 -7.614 15.196 405 HD23 LEU 52 HD23 LEU 52 -20.193 -7.894 16.937 406 H THR 53 HN THR 53 -21.525 -2.279 14.780 407 HA THR 53 HA THR 53 -21.546 -2.107 11.967 408 HB THR 53 HB THR 53 -22.062 0.141 13.919 409 HG1 THR 53 HG1 THR 53 -24.123 -0.655 14.102 410 HG21 THR 53 HG21 THR 53 -21.935 0.869 11.595 411 HG22 THR 53 HG22 THR 53 -23.603 0.938 12.168 412 HG23 THR 53 HG23 THR 53 -23.083 -0.385 11.123 413 H THR 54 HN THR 54 -19.457 -0.723 14.422 414 HA THR 54 HA THR 54 -18.056 1.092 12.779 415 HB THR 54 HB THR 54 -17.094 -0.368 15.249 416 HG1 THR 54 HG1 THR 54 -18.251 2.228 14.984 417 HG21 THR 54 HG21 THR 54 -15.252 0.634 13.978 418 HG22 THR 54 HG22 THR 54 -15.523 1.492 15.493 419 HG23 THR 54 HG23 THR 54 -16.096 2.184 13.976 420 H ALA 55 HN ALA 55 -17.370 -2.265 13.748 421 HA ALA 55 HA ALA 55 -15.047 -2.596 12.202 422 HB1 ALA 55 HB1 ALA 55 -15.432 -4.996 12.443 423 HB2 ALA 55 HB2 ALA 55 -17.075 -4.681 13.006 424 HB3 ALA 55 HB3 ALA 55 -15.696 -4.154 13.971 425 H SER 56 HN SER 56 -18.459 -3.119 11.455 426 HA SER 56 HA SER 56 -18.162 -4.235 8.908 427 HB2 SER 56 HB2 SER 56 -20.395 -2.452 9.915 428 HB3 SER 56 HB1 SER 56 -20.483 -3.538 8.529 429 HG SER 56 HG SER 56 -20.016 -4.326 11.226 430 H ALA 57 HN ALA 57 -18.370 -0.844 9.931 431 HA ALA 57 HA ALA 57 -18.433 0.327 7.381 432 HB1 ALA 57 HB1 ALA 57 -17.705 2.372 8.498 433 HB2 ALA 57 HB2 ALA 57 -17.260 1.439 9.927 434 HB3 ALA 57 HB3 ALA 57 -18.951 1.548 9.438 435 H ASN 58 HN ASN 58 -15.703 -0.479 9.498 436 HA ASN 58 HA ASN 58 -13.673 0.467 7.781 437 HB2 ASN 58 HB2 ASN 58 -13.713 -1.528 10.033 438 HB3 ASN 58 HB1 ASN 58 -12.247 -1.252 9.099 439 HD21 ASN 58 HD21 ASN 58 -14.518 0.138 11.354 440 HD22 ASN 58 HD22 ASN 58 -13.525 1.477 11.823 441 H LEU 59 HN LEU 59 -15.314 -2.627 8.068 442 HA LEU 59 HA LEU 59 -13.722 -4.060 6.233 443 HB2 LEU 59 HB2 LEU 59 -16.566 -4.413 7.157 444 HB3 LEU 59 HB1 LEU 59 -15.785 -5.527 6.051 445 HG LEU 59 HG LEU 59 -14.725 -4.904 8.803 446 HD11 LEU 59 HD11 LEU 59 -15.647 -7.042 9.498 447 HD12 LEU 59 HD12 LEU 59 -16.380 -7.259 7.909 448 HD13 LEU 59 HD13 LEU 59 -16.931 -5.957 8.962 449 HD21 LEU 59 HD21 LEU 59 -14.086 -7.076 6.813 450 HD22 LEU 59 HD22 LEU 59 -13.425 -6.950 8.444 451 HD23 LEU 59 HD23 LEU 59 -13.054 -5.711 7.244 452 H GLN 60 HN GLN 60 -16.486 -1.922 5.820 453 HA GLN 60 HA GLN 60 -17.011 -2.502 3.106 454 HB2 GLN 60 HB2 GLN 60 -17.389 0.106 4.599 455 HB3 GLN 60 HB1 GLN 60 -18.080 -0.270 3.030 456 HG2 GLN 60 HG2 GLN 60 -18.698 -1.654 5.629 457 HG3 GLN 60 HG1 GLN 60 -19.730 -0.505 4.780 458 HE21 GLN 60 HE21 GLN 60 -18.526 -3.743 4.888 459 HE22 GLN 60 HE22 GLN 60 -19.591 -4.403 3.694 460 H ALA 61 HN ALA 61 -14.855 -0.175 4.677 461 HA ALA 61 HA ALA 61 -13.872 1.043 2.332 462 HB1 ALA 61 HB1 ALA 61 -12.482 0.675 4.987 463 HB2 ALA 61 HB2 ALA 61 -13.558 2.007 4.565 464 HB3 ALA 61 HB3 ALA 61 -12.019 1.815 3.726 465 H LEU 62 HN LEU 62 -12.649 -1.662 4.277 466 HA LEU 62 HA LEU 62 -10.418 -2.343 2.763 467 HB2 LEU 62 HB2 LEU 62 -12.185 -3.703 4.681 468 HB3 LEU 62 HB1 LEU 62 -11.365 -4.780 3.573 469 HG LEU 62 HG LEU 62 -9.192 -3.906 4.318 470 HD11 LEU 62 HD11 LEU 62 -10.827 -2.268 6.244 471 HD12 LEU 62 HD12 LEU 62 -9.815 -1.651 4.935 472 HD13 LEU 62 HD13 LEU 62 -9.078 -2.479 6.309 473 HD21 LEU 62 HD21 LEU 62 -10.152 -5.857 5.417 474 HD22 LEU 62 HD22 LEU 62 -10.987 -4.809 6.565 475 HD23 LEU 62 HD23 LEU 62 -9.225 -4.880 6.556 476 H LYS 63 HN LYS 63 -13.799 -3.336 2.362 477 HA LYS 63 HA LYS 63 -13.290 -5.114 0.203 478 HB2 LYS 63 HB2 LYS 63 -15.325 -5.054 1.758 479 HB3 LYS 63 HB1 LYS 63 -15.924 -3.758 0.732 480 HG2 LYS 63 HG2 LYS 63 -15.707 -5.309 -1.211 481 HG3 LYS 63 HG1 LYS 63 -15.336 -6.595 -0.064 482 HD2 LYS 63 HD2 LYS 63 -17.522 -6.081 1.058 483 HD3 LYS 63 HD1 LYS 63 -17.887 -5.010 -0.295 484 HE2 LYS 63 HE2 LYS 63 -17.492 -7.991 -0.324 485 HE3 LYS 63 HE1 LYS 63 -18.925 -7.077 -0.787 486 HZ1 LYS 63 HZ1 LYS 63 -17.959 -7.677 -2.796 487 HZ2 LYS 63 HZ2 LYS 63 -16.380 -7.396 -2.256 488 HZ3 LYS 63 HZ3 LYS 63 -17.411 -6.083 -2.585 489 H SER 64 HN SER 64 -14.158 -1.709 0.405 490 HA SER 64 HA SER 64 -14.700 -1.349 -2.356 491 HB2 SER 64 HB2 SER 64 -13.817 0.696 -0.304 492 HB3 SER 64 HB1 SER 64 -14.545 1.054 -1.870 493 HG SER 64 HG SER 64 -15.724 -0.211 0.380 494 H GLY 65 HN GLY 65 -11.779 -1.408 -0.466 495 HA2 GLY 65 HA2 GLY 65 -10.129 -0.353 -2.606 496 HA3 GLY 65 HA1 GLY 65 -9.565 -1.010 -1.076 497 H GLY 66 HN GLY 66 -11.479 -3.360 -1.762 498 HA2 GLY 66 HA2 GLY 66 -11.443 -5.248 -3.157 499 HA3 GLY 66 HA1 GLY 66 -9.988 -4.629 -3.922 500 H LEU 67 HN LEU 67 -10.003 -4.587 -0.500 501 HA LEU 67 HA LEU 67 -7.829 -6.480 -0.467 502 HB2 LEU 67 HB2 LEU 67 -9.118 -4.797 1.671 503 HB3 LEU 67 HB1 LEU 67 -7.879 -5.977 2.039 504 HG LEU 67 HG LEU 67 -6.847 -3.830 1.947 505 HD11 LEU 67 HD11 LEU 67 -5.534 -5.630 1.005 506 HD12 LEU 67 HD12 LEU 67 -5.206 -4.116 0.162 507 HD13 LEU 67 HD13 LEU 67 -6.237 -5.338 -0.586 508 HD21 LEU 67 HD21 LEU 67 -8.514 -2.628 0.662 509 HD22 LEU 67 HD22 LEU 67 -8.057 -3.512 -0.792 510 HD23 LEU 67 HD23 LEU 67 -6.912 -2.404 -0.038 511 H VAL 68 HN VAL 68 -11.186 -6.393 0.637 512 HA VAL 68 HA VAL 68 -10.949 -9.243 1.295 513 HB VAL 68 HB VAL 68 -12.304 -9.003 3.285 514 HG11 VAL 68 HG11 VAL 68 -9.909 -8.858 3.585 515 HG12 VAL 68 HG12 VAL 68 -10.728 -7.803 4.737 516 HG13 VAL 68 HG13 VAL 68 -9.954 -7.118 3.308 517 HG21 VAL 68 HG21 VAL 68 -13.693 -7.132 2.712 518 HG22 VAL 68 HG22 VAL 68 -12.298 -6.052 2.670 519 HG23 VAL 68 HG23 VAL 68 -12.825 -6.753 4.201 520 H GLU 69 HN GLU 69 -13.016 -10.355 1.416 521 HA GLU 69 HA GLU 69 -15.170 -9.064 -0.128 522 HB2 GLU 69 HB2 GLU 69 -14.022 -11.834 -0.373 523 HB3 GLU 69 HB1 GLU 69 -15.672 -11.492 -0.876 524 HG2 GLU 69 HG2 GLU 69 -13.289 -9.984 -1.918 525 HG3 GLU 69 HG1 GLU 69 -13.939 -11.430 -2.691 526 H ALA 70 HN ALA 70 -17.327 -10.292 0.261 527 HA ALA 70 HA ALA 70 -17.467 -10.920 3.142 528 HB1 ALA 70 HB1 ALA 70 -19.485 -9.592 3.335 529 HB2 ALA 70 HB2 ALA 70 -19.402 -9.178 1.623 530 HB3 ALA 70 HB3 ALA 70 -18.159 -8.599 2.732 531 H ARG 71 HN ARG 71 -19.063 -12.341 3.805 532 HA ARG 71 HA ARG 71 -20.759 -13.525 1.708 533 HB2 ARG 71 HB2 ARG 71 -19.359 -15.006 3.941 534 HB3 ARG 71 HB1 ARG 71 -20.567 -15.707 2.878 535 HG2 ARG 71 HG2 ARG 71 -19.058 -15.180 0.960 536 HG3 ARG 71 HG1 ARG 71 -17.827 -14.731 2.143 537 HD2 ARG 71 HD2 ARG 71 -19.156 -17.423 1.840 538 HD3 ARG 71 HD1 ARG 71 -17.490 -17.020 1.431 539 HE ARG 71 HE ARG 71 -18.600 -17.194 4.166 540 HH11 ARG 71 HH11 ARG 71 -15.869 -17.113 1.965 541 HH12 ARG 71 HH12 ARG 71 -14.716 -17.594 3.185 542 HH21 ARG 71 HH21 ARG 71 -17.062 -17.830 5.763 543 HH22 ARG 71 HH22 ARG 71 -15.388 -17.997 5.309 544 H ARG 72 HN ARG 72 -22.777 -12.962 2.174 545 HA ARG 72 HA ARG 72 -23.705 -12.620 4.880 546 HB2 ARG 72 HB2 ARG 72 -25.109 -12.679 2.213 547 HB3 ARG 72 HB1 ARG 72 -25.973 -12.512 3.733 548 HG2 ARG 72 HG2 ARG 72 -24.853 -10.430 4.191 549 HG3 ARG 72 HG1 ARG 72 -23.851 -10.619 2.749 550 HD2 ARG 72 HD2 ARG 72 -25.707 -10.384 1.309 551 HD3 ARG 72 HD1 ARG 72 -26.850 -10.564 2.636 552 HE ARG 72 HE ARG 72 -25.334 -8.308 3.196 553 HH11 ARG 72 HH11 ARG 72 -27.488 -9.398 0.670 554 HH12 ARG 72 HH12 ARG 72 -28.129 -7.814 0.340 555 HH21 ARG 72 HH21 ARG 72 -26.218 -6.229 2.823 556 HH22 ARG 72 HH22 ARG 72 -27.412 -6.013 1.581 557 H GLU 73 HN GLU 73 -23.551 -14.508 6.015 558 HA GLU 73 HA GLU 73 -24.851 -16.853 4.829 559 HB2 GLU 73 HB2 GLU 73 -22.685 -16.714 6.928 560 HB3 GLU 73 HB1 GLU 73 -23.471 -18.198 6.401 561 HG2 GLU 73 HG2 GLU 73 -22.667 -17.781 4.113 562 HG3 GLU 73 HG1 GLU 73 -21.826 -16.343 4.688 563 H GLY 74 HN GLY 74 -26.900 -16.337 5.442 564 HA2 GLY 74 HA2 GLY 74 -28.737 -16.479 6.810 565 HA3 GLY 74 HA1 GLY 74 -27.684 -17.129 8.060 566 H THR 75 HN THR 75 -27.691 -15.978 9.827 567 HA THR 75 HA THR 75 -28.516 -13.187 9.731 568 HB THR 75 HB THR 75 -29.599 -14.687 11.349 569 HG1 THR 75 HG1 THR 75 -28.035 -12.950 12.935 570 HG21 THR 75 HG21 THR 75 -27.765 -16.216 11.792 571 HG22 THR 75 HG22 THR 75 -28.337 -15.508 13.302 572 HG23 THR 75 HG23 THR 75 -26.845 -14.924 12.566 573 H ARG 76 HN ARG 76 -25.618 -14.806 9.567 574 HA ARG 76 HA ARG 76 -24.215 -12.565 10.855 575 HB2 ARG 76 HB2 ARG 76 -22.380 -14.168 11.432 576 HB3 ARG 76 HB1 ARG 76 -23.881 -14.427 12.310 577 HG2 ARG 76 HG2 ARG 76 -24.438 -16.282 10.839 578 HG3 ARG 76 HG1 ARG 76 -22.950 -16.011 9.925 579 HD2 ARG 76 HD2 ARG 76 -22.637 -17.826 11.502 580 HD3 ARG 76 HD1 ARG 76 -21.640 -16.446 11.955 581 HE ARG 76 HE ARG 76 -24.192 -17.138 13.284 582 HH11 ARG 76 HH11 ARG 76 -20.902 -15.951 13.370 583 HH12 ARG 76 HH12 ARG 76 -20.896 -15.674 15.080 584 HH21 ARG 76 HH21 ARG 76 -24.179 -16.822 15.561 585 HH22 ARG 76 HH22 ARG 76 -22.765 -16.162 16.332 586 H GLN 77 HN GLN 77 -22.266 -11.902 9.906 587 HA GLN 77 HA GLN 77 -22.050 -12.688 7.078 588 HB2 GLN 77 HB2 GLN 77 -21.665 -9.997 8.390 589 HB3 GLN 77 HB1 GLN 77 -21.172 -10.343 6.739 590 HG2 GLN 77 HG2 GLN 77 -23.444 -10.792 6.104 591 HG3 GLN 77 HG1 GLN 77 -23.983 -10.615 7.772 592 HE21 GLN 77 HE21 GLN 77 -21.551 -8.541 6.421 593 HE22 GLN 77 HE22 GLN 77 -22.519 -7.115 6.348 594 H TYR 78 HN TYR 78 -20.205 -13.564 6.498 595 HA TYR 78 HA TYR 78 -17.886 -13.310 8.274 596 HB2 TYR 78 HB2 TYR 78 -18.520 -15.254 6.051 597 HB3 TYR 78 HB1 TYR 78 -16.959 -15.189 6.859 598 HD1 TYR 78 HD2 TYR 78 -20.572 -15.808 7.425 599 HD2 TYR 78 HD1 TYR 78 -16.613 -16.288 8.905 600 HE1 TYR 78 HE2 TYR 78 -21.410 -17.340 9.153 601 HE2 TYR 78 HE1 TYR 78 -17.441 -17.822 10.636 602 HH TYR 78 HH TYR 78 -20.548 -19.174 10.555 603 H TYR 79 HN TYR 79 -15.997 -12.429 7.621 604 HA TYR 79 HA TYR 79 -15.876 -11.449 4.848 605 HB2 TYR 79 HB2 TYR 79 -15.029 -10.113 7.406 606 HB3 TYR 79 HB1 TYR 79 -14.288 -9.671 5.871 607 HD1 TYR 79 HD1 TYR 79 -17.601 -9.968 7.548 608 HD2 TYR 79 HD2 TYR 79 -15.316 -8.098 4.487 609 HE1 TYR 79 HE1 TYR 79 -19.476 -8.449 7.085 610 HE2 TYR 79 HE2 TYR 79 -17.187 -6.572 4.013 611 HH TYR 79 HH TYR 79 -19.621 -6.481 4.310 612 H ARG 80 HN ARG 80 -14.062 -11.815 3.719 613 HA ARG 80 HA ARG 80 -11.848 -13.192 5.076 614 HB2 ARG 80 HB2 ARG 80 -11.740 -14.891 3.404 615 HB3 ARG 80 HB1 ARG 80 -13.411 -14.831 3.944 616 HG2 ARG 80 HG2 ARG 80 -14.057 -13.617 1.967 617 HG3 ARG 80 HG1 ARG 80 -12.375 -13.504 1.449 618 HD2 ARG 80 HD2 ARG 80 -14.050 -16.000 1.688 619 HD3 ARG 80 HD1 ARG 80 -13.451 -15.256 0.205 620 HE ARG 80 HE ARG 80 -11.766 -16.596 2.234 621 HH11 ARG 80 HH11 ARG 80 -12.336 -15.519 -1.064 622 HH12 ARG 80 HH12 ARG 80 -10.957 -16.363 -1.708 623 HH21 ARG 80 HH21 ARG 80 -9.925 -17.670 1.376 624 HH22 ARG 80 HH22 ARG 80 -9.576 -17.553 -0.324 625 H ILE 81 HN ILE 81 -9.840 -13.093 3.875 626 HA ILE 81 HA ILE 81 -9.370 -10.665 2.497 627 HB ILE 81 HB ILE 81 -7.678 -13.179 2.438 628 HG12 ILE 81 HG12 ILE 81 -7.575 -10.838 4.358 629 HG13 ILE 81 HG11 ILE 81 -8.174 -12.446 4.748 630 HG21 ILE 81 HG21 ILE 81 -7.068 -11.542 0.739 631 HG22 ILE 81 HG22 ILE 81 -5.828 -11.639 1.989 632 HG23 ILE 81 HG23 ILE 81 -6.959 -10.286 1.974 633 HD11 ILE 81 HD11 ILE 81 -5.354 -11.729 3.986 634 HD12 ILE 81 HD12 ILE 81 -5.941 -13.359 4.315 635 HD13 ILE 81 HD13 ILE 81 -5.940 -12.147 5.596 636 H ALA 82 HN ALA 82 -9.157 -10.274 0.280 637 HA ALA 82 HA ALA 82 -10.975 -11.551 -1.390 638 HB1 ALA 82 HB1 ALA 82 -8.587 -9.901 -2.195 639 HB2 ALA 82 HB2 ALA 82 -10.180 -9.281 -1.762 640 HB3 ALA 82 HB3 ALA 82 -9.984 -10.268 -3.210 641 H GLY 83 HN GLY 83 -7.661 -12.375 -0.740 642 HA2 GLY 83 HA2 GLY 83 -7.881 -14.963 -1.651 643 HA3 GLY 83 HA1 GLY 83 -7.271 -14.038 -3.015 644 H GLU 84 HN GLU 84 -5.523 -15.691 -2.594 645 HA GLU 84 HA GLU 84 -3.783 -15.324 -0.362 646 HB2 GLU 84 HB2 GLU 84 -2.219 -16.763 -1.649 647 HB3 GLU 84 HB1 GLU 84 -3.821 -17.462 -1.488 648 HG2 GLU 84 HG2 GLU 84 -2.984 -15.944 -3.939 649 HG3 GLU 84 HG1 GLU 84 -2.671 -17.667 -3.746 650 H ASP 85 HN ASP 85 -4.190 -13.832 -3.421 651 HA ASP 85 HA ASP 85 -1.615 -12.709 -3.731 652 HB2 ASP 85 HB2 ASP 85 -2.830 -11.037 -5.220 653 HB3 ASP 85 HB1 ASP 85 -2.964 -12.727 -5.677 654 H VAL 86 HN VAL 86 -4.629 -11.373 -2.410 655 HA VAL 86 HA VAL 86 -3.425 -8.969 -1.480 656 HB VAL 86 HB VAL 86 -5.988 -10.288 -0.563 657 HG11 VAL 86 HG11 VAL 86 -5.194 -8.622 1.020 658 HG12 VAL 86 HG12 VAL 86 -6.629 -8.045 0.172 659 HG13 VAL 86 HG13 VAL 86 -5.036 -7.442 -0.281 660 HG21 VAL 86 HG21 VAL 86 -7.091 -8.755 -2.132 661 HG22 VAL 86 HG22 VAL 86 -6.006 -9.872 -2.959 662 HG23 VAL 86 HG23 VAL 86 -5.513 -8.200 -2.689 663 H ALA 87 HN ALA 87 -4.074 -12.114 -0.025 664 HA ALA 87 HA ALA 87 -3.489 -11.474 2.642 665 HB1 ALA 87 HB1 ALA 87 -4.570 -13.567 1.947 666 HB2 ALA 87 HB2 ALA 87 -3.173 -13.856 2.983 667 HB3 ALA 87 HB3 ALA 87 -3.048 -14.111 1.242 668 H ARG 88 HN ARG 88 -1.387 -12.696 0.055 669 HA ARG 88 HA ARG 88 0.935 -12.636 1.746 670 HB2 ARG 88 HB2 ARG 88 0.652 -13.066 -1.231 671 HB3 ARG 88 HB1 ARG 88 2.165 -13.222 -0.344 672 HG2 ARG 88 HG2 ARG 88 1.242 -15.031 0.978 673 HG3 ARG 88 HG1 ARG 88 -0.319 -14.847 0.179 674 HD2 ARG 88 HD2 ARG 88 0.798 -15.395 -1.980 675 HD3 ARG 88 HD1 ARG 88 2.277 -15.726 -1.076 676 HE ARG 88 HE ARG 88 0.104 -17.194 0.003 677 HH11 ARG 88 HH11 ARG 88 2.327 -17.149 -2.715 678 HH12 ARG 88 HH12 ARG 88 2.203 -18.859 -2.999 679 HH21 ARG 88 HH21 ARG 88 -0.066 -19.438 -0.384 680 HH22 ARG 88 HH22 ARG 88 0.826 -20.159 -1.692 681 H LEU 89 HN LEU 89 -0.720 -10.337 -0.155 682 HA LEU 89 HA LEU 89 1.442 -8.551 -0.635 683 HB2 LEU 89 HB2 LEU 89 -0.846 -8.490 -1.714 684 HB3 LEU 89 HB1 LEU 89 -1.468 -7.842 -0.211 685 HG LEU 89 HG LEU 89 0.742 -6.431 -1.685 686 HD11 LEU 89 HD11 LEU 89 -1.060 -6.797 -3.294 687 HD12 LEU 89 HD12 LEU 89 -0.959 -5.101 -2.823 688 HD13 LEU 89 HD13 LEU 89 -2.223 -6.129 -2.149 689 HD21 LEU 89 HD21 LEU 89 -1.452 -5.491 0.162 690 HD22 LEU 89 HD22 LEU 89 -0.212 -4.473 -0.574 691 HD23 LEU 89 HD23 LEU 89 0.242 -5.713 0.596 692 H PHE 90 HN PHE 90 -0.987 -8.793 1.957 693 HA PHE 90 HA PHE 90 0.104 -6.733 3.566 694 HB2 PHE 90 HB2 PHE 90 -2.179 -7.506 3.916 695 HB3 PHE 90 HB1 PHE 90 -1.605 -9.120 4.312 696 HD1 PHE 90 HD1 PHE 90 -1.422 -5.579 5.470 697 HD2 PHE 90 HD2 PHE 90 -1.203 -9.702 6.518 698 HE1 PHE 90 HE1 PHE 90 -1.342 -4.968 7.850 699 HE2 PHE 90 HE2 PHE 90 -1.119 -9.095 8.898 700 HZ PHE 90 HZ PHE 90 -1.188 -6.726 9.569 701 H ALA 91 HN ALA 91 0.704 -10.190 3.322 702 HA ALA 91 HA ALA 91 2.436 -10.407 5.548 703 HB1 ALA 91 HB1 ALA 91 2.372 -12.068 3.030 704 HB2 ALA 91 HB2 ALA 91 1.416 -12.359 4.482 705 HB3 ALA 91 HB3 ALA 91 3.173 -12.507 4.538 706 H LEU 92 HN LEU 92 2.952 -9.579 2.166 707 HA LEU 92 HA LEU 92 5.756 -9.620 2.157 708 HB2 LEU 92 HB2 LEU 92 4.268 -9.495 0.150 709 HB3 LEU 92 HB1 LEU 92 3.935 -7.823 0.549 710 HG LEU 92 HG LEU 92 6.773 -8.683 0.106 711 HD11 LEU 92 HD11 LEU 92 5.507 -9.575 -1.795 712 HD12 LEU 92 HD12 LEU 92 6.544 -8.233 -2.272 713 HD13 LEU 92 HD13 LEU 92 4.808 -7.981 -2.073 714 HD21 LEU 92 HD21 LEU 92 6.357 -6.433 0.931 715 HD22 LEU 92 HD22 LEU 92 5.247 -6.130 -0.406 716 HD23 LEU 92 HD23 LEU 92 6.965 -6.379 -0.724 717 H VAL 93 HN VAL 93 3.503 -6.894 2.677 718 HA VAL 93 HA VAL 93 5.577 -5.038 3.220 719 HB VAL 93 HB VAL 93 3.259 -4.412 2.501 720 HG11 VAL 93 HG11 VAL 93 1.941 -5.813 3.940 721 HG12 VAL 93 HG12 VAL 93 1.545 -4.122 4.247 722 HG13 VAL 93 HG13 VAL 93 2.580 -5.003 5.373 723 HG21 VAL 93 HG21 VAL 93 3.154 -2.364 3.840 724 HG22 VAL 93 HG22 VAL 93 4.799 -2.729 3.323 725 HG23 VAL 93 HG23 VAL 93 4.302 -3.057 4.984 726 H GLN 94 HN GLN 94 3.904 -7.372 5.160 727 HA GLN 94 HA GLN 94 4.587 -6.364 7.713 728 HB2 GLN 94 HB2 GLN 94 2.867 -8.096 7.363 729 HB3 GLN 94 HB1 GLN 94 4.111 -9.224 6.841 730 HG2 GLN 94 HG2 GLN 94 5.116 -9.177 9.042 731 HG3 GLN 94 HG1 GLN 94 3.934 -7.983 9.578 732 HE21 GLN 94 HE21 GLN 94 1.807 -8.628 9.943 733 HE22 GLN 94 HE22 GLN 94 1.366 -10.288 10.114 734 H VAL 95 HN VAL 95 6.183 -8.639 5.503 735 HA VAL 95 HA VAL 95 8.453 -9.143 7.113 736 HB VAL 95 HB VAL 95 8.225 -9.187 4.094 737 HG11 VAL 95 HG11 VAL 95 10.551 -9.028 4.817 738 HG12 VAL 95 HG12 VAL 95 10.206 -10.621 4.144 739 HG13 VAL 95 HG13 VAL 95 10.322 -10.408 5.891 740 HG21 VAL 95 HG21 VAL 95 7.941 -11.380 6.143 741 HG22 VAL 95 HG22 VAL 95 7.990 -11.626 4.396 742 HG23 VAL 95 HG23 VAL 95 6.664 -10.718 5.124 743 H VAL 96 HN VAL 96 7.764 -6.743 4.617 744 HA VAL 96 HA VAL 96 10.189 -5.412 4.501 745 HB VAL 96 HB VAL 96 7.408 -4.221 4.346 746 HG11 VAL 96 HG11 VAL 96 10.020 -3.070 3.368 747 HG12 VAL 96 HG12 VAL 96 9.103 -2.497 4.762 748 HG13 VAL 96 HG13 VAL 96 8.418 -2.367 3.142 749 HG21 VAL 96 HG21 VAL 96 9.273 -5.178 2.176 750 HG22 VAL 96 HG22 VAL 96 7.708 -4.402 1.926 751 HG23 VAL 96 HG23 VAL 96 7.794 -5.981 2.706 752 H ALA 97 HN ALA 97 7.563 -5.086 6.847 753 HA ALA 97 HA ALA 97 8.816 -2.951 8.267 754 HB1 ALA 97 HB1 ALA 97 6.391 -3.337 8.308 755 HB2 ALA 97 HB2 ALA 97 7.095 -3.258 9.923 756 HB3 ALA 97 HB3 ALA 97 6.659 -4.820 9.222 757 H ASP 98 HN ASP 98 8.291 -6.379 9.108 758 HA ASP 98 HA ASP 98 9.566 -6.307 11.571 759 HB2 ASP 98 HB2 ASP 98 8.131 -8.152 10.915 760 HB3 ASP 98 HB1 ASP 98 9.278 -8.640 9.673 761 H GLU 99 HN GLU 99 10.971 -7.161 8.410 762 HA GLU 99 HA GLU 99 13.507 -7.847 9.537 763 HB2 GLU 99 HB2 GLU 99 12.535 -8.719 7.363 764 HB3 GLU 99 HB1 GLU 99 12.933 -7.164 6.653 765 HG2 GLU 99 HG2 GLU 99 14.979 -8.938 7.950 766 HG3 GLU 99 HG1 GLU 99 14.558 -9.049 6.246 767 H HIS 100 HN HIS 100 12.282 -4.999 7.769 768 HA HIS 100 HA HIS 100 14.834 -3.703 7.756 769 HB2 HIS 100 HB2 HIS 100 12.085 -2.541 7.266 770 HB3 HIS 100 HB1 HIS 100 13.598 -1.695 6.988 771 HD1 HIS 100 HD1 HIS 100 14.298 -4.977 5.824 772 HD2 HIS 100 HD2 HIS 100 12.033 -1.809 4.354 773 HE1 HIS 100 HE1 HIS 100 14.003 -5.427 3.374 774 HE2 HIS 100 HE2 HIS 100 12.417 -3.645 2.567 775 H LEU 101 HN LEU 101 12.458 -4.093 10.135 776 HA LEU 101 HA LEU 101 13.050 -1.626 11.539 777 HB2 LEU 101 HB2 LEU 101 10.774 -2.614 11.532 778 HB3 LEU 101 HB1 LEU 101 11.396 -4.006 12.394 779 HG LEU 101 HG LEU 101 11.989 -2.515 14.295 780 HD11 LEU 101 HD11 LEU 101 11.021 -0.264 14.363 781 HD12 LEU 101 HD12 LEU 101 10.506 -0.440 12.686 782 HD13 LEU 101 HD13 LEU 101 12.225 -0.424 13.082 783 HD21 LEU 101 HD21 LEU 101 9.099 -2.446 13.441 784 HD22 LEU 101 HD22 LEU 101 9.699 -2.220 15.083 785 HD23 LEU 101 HD23 LEU 101 9.900 -3.775 14.277 786 H GLU 102 HN GLU 102 14.525 -4.590 11.215 787 HA GLU 102 HA GLU 102 15.298 -5.154 13.866 788 HB2 GLU 102 HB2 GLU 102 15.784 -6.257 11.293 789 HB3 GLU 102 HB1 GLU 102 17.340 -6.013 12.074 790 HG2 GLU 102 HG2 GLU 102 15.008 -7.598 13.120 791 HG3 GLU 102 HG1 GLU 102 16.565 -8.218 12.575 792 H HIS 103 HN HIS 103 17.765 -5.245 14.376 793 HA HIS 103 HA HIS 103 18.357 -2.509 14.911 794 HB2 HIS 103 HB2 HIS 103 19.966 -4.997 15.516 795 HB3 HIS 103 HB1 HIS 103 20.235 -3.403 16.217 796 HD1 HIS 103 HD1 HIS 103 17.841 -6.309 16.311 797 HD2 HIS 103 HD2 HIS 103 18.513 -2.705 18.282 798 HE1 HIS 103 HE1 HIS 103 16.355 -6.354 18.342 799 HE2 HIS 103 HE2 HIS 103 16.613 -4.074 19.386 800 H HIS 104 HN HIS 104 18.978 -1.356 13.186 801 HA HIS 104 HA HIS 104 21.487 -2.169 11.882 802 HB2 HIS 104 HB2 HIS 104 20.676 -1.372 9.731 803 HB3 HIS 104 HB1 HIS 104 19.590 -2.609 10.351 804 HD1 HIS 104 HD1 HIS 104 17.236 -1.762 11.241 805 HD2 HIS 104 HD2 HIS 104 19.531 1.088 9.259 806 HE1 HIS 104 HE1 HIS 104 15.656 0.112 10.680 807 HE2 HIS 104 HE2 HIS 104 17.076 1.855 9.542 808 H HIS 105 HN HIS 105 20.075 -0.040 13.846 809 HA HIS 105 HA HIS 105 20.895 2.483 12.884 810 HB2 HIS 105 HB2 HIS 105 19.298 2.250 14.723 811 HB3 HIS 105 HB1 HIS 105 20.529 1.493 15.725 812 HD1 HIS 105 HD1 HIS 105 21.837 3.009 17.201 813 HD2 HIS 105 HD2 HIS 105 19.926 5.060 14.123 814 HE1 HIS 105 HE1 HIS 105 22.232 5.453 17.659 815 HE2 HIS 105 HE2 HIS 105 21.166 6.668 15.722 816 H HIS 106 HN HIS 106 22.366 0.470 15.413 817 HA HIS 106 HA HIS 106 24.975 0.559 14.334 818 HB2 HIS 106 HB2 HIS 106 24.617 2.956 15.295 819 HB3 HIS 106 HB1 HIS 106 24.750 2.179 16.866 820 HD1 HIS 106 HD1 HIS 106 26.740 3.631 14.203 821 HD2 HIS 106 HD2 HIS 106 27.346 0.837 17.226 822 HE1 HIS 106 HE1 HIS 106 29.233 3.427 14.452 823 HE2 HIS 106 HE2 HIS 106 29.562 1.913 16.436 824 H HIS 107 HN HIS 107 25.330 -1.520 14.830 825 HA HIS 107 HA HIS 107 24.233 -2.535 17.356 826 HB2 HIS 107 HB2 HIS 107 24.374 -4.772 16.319 827 HB3 HIS 107 HB1 HIS 107 23.388 -3.662 15.381 828 HD1 HIS 107 HD1 HIS 107 26.249 -5.924 15.139 829 HD2 HIS 107 HD2 HIS 107 24.726 -2.726 12.960 830 HE1 HIS 107 HE1 HIS 107 27.342 -6.059 12.882 831 HE2 HIS 107 HE2 HIS 107 26.582 -3.988 11.668 832 H HIS 108 HN HIS 108 26.474 -1.154 17.793 833 HA HIS 108 HA HIS 108 28.166 -3.155 18.937 834 HB2 HIS 108 HB2 HIS 108 28.942 -2.761 16.467 835 HB3 HIS 108 HB1 HIS 108 29.606 -1.261 17.104 836 HD1 HIS 108 HD1 HIS 108 31.740 -2.892 16.081 837 HD2 HIS 108 HD2 HIS 108 30.182 -3.641 19.864 838 HE1 HIS 108 HE1 HIS 108 33.489 -4.241 17.278 839 HE2 HIS 108 HE2 HIS 108 32.465 -4.807 19.512 840 H1 MET 1 HT1 MET 1 7.715 -1.172 30.986 841 H2 MET 1 HT2 MET 1 7.537 -2.820 30.628 842 H3 MET 1 HT3 MET 1 7.047 -1.652 29.502 843 HA MET 1 HA MET 1 9.269 -0.962 29.114 844 HB2 MET 1 HB2 MET 1 9.908 -2.912 31.329 845 HB3 MET 1 HB1 MET 1 11.125 -2.319 30.208 846 HG2 MET 1 HG2 MET 1 10.616 -0.018 30.929 847 HG3 MET 1 HG1 MET 1 9.482 -0.670 32.110 848 HE1 MET 1 HE1 MET 1 12.498 0.568 34.304 849 HE2 MET 1 HE2 MET 1 10.775 0.735 33.968 850 HE3 MET 1 HE3 MET 1 11.960 1.303 32.794 851 H ALA 2 HN ALA 2 11.146 -2.583 28.287 852 HA ALA 2 HA ALA 2 11.786 -4.235 26.882 853 HB1 ALA 2 HB1 ALA 2 9.408 -5.729 27.976 854 HB2 ALA 2 HB2 ALA 2 11.040 -5.741 28.643 855 HB3 ALA 2 HB3 ALA 2 10.736 -6.427 27.048 856 H GLY 3 HN GLY 3 9.414 -2.277 26.236 857 HA2 GLY 3 HA2 GLY 3 8.135 -1.793 24.392 858 HA3 GLY 3 HA1 GLY 3 9.158 -2.921 23.515 859 H GLN 4 HN GLN 4 7.108 -3.652 26.268 860 HA GLN 4 HA GLN 4 6.022 -5.971 25.154 861 HB2 GLN 4 HB2 GLN 4 6.081 -5.544 27.562 862 HB3 GLN 4 HB1 GLN 4 4.936 -4.226 27.372 863 HG2 GLN 4 HG2 GLN 4 3.226 -5.788 26.643 864 HG3 GLN 4 HG1 GLN 4 4.373 -7.120 26.772 865 HE21 GLN 4 HE21 GLN 4 4.259 -4.482 29.045 866 HE22 GLN 4 HE22 GLN 4 3.679 -5.406 30.391 867 H SER 5 HN SER 5 4.750 -6.141 23.490 868 HA SER 5 HA SER 5 2.932 -5.971 22.143 869 HB2 SER 5 HB2 SER 5 1.615 -5.488 24.215 870 HB3 SER 5 HB1 SER 5 1.925 -3.772 23.965 871 HG SER 5 HG SER 5 -0.118 -4.865 23.099 872 H ASP 6 HN ASP 6 5.004 -3.395 22.891 873 HA ASP 6 HA ASP 6 4.061 -1.494 20.980 874 HB2 ASP 6 HB2 ASP 6 6.765 -1.737 22.312 875 HB3 ASP 6 HB1 ASP 6 6.228 -0.358 21.359 876 H ARG 7 HN ARG 7 6.216 -4.228 20.874 877 HA ARG 7 HA ARG 7 7.673 -3.489 18.588 878 HB2 ARG 7 HB2 ARG 7 8.278 -5.855 18.388 879 HB3 ARG 7 HB1 ARG 7 8.452 -5.265 20.033 880 HG2 ARG 7 HG2 ARG 7 6.429 -6.382 20.702 881 HG3 ARG 7 HG1 ARG 7 6.106 -6.869 19.035 882 HD2 ARG 7 HD2 ARG 7 8.491 -7.702 20.689 883 HD3 ARG 7 HD1 ARG 7 7.080 -8.703 20.341 884 HE ARG 7 HE ARG 7 7.733 -8.552 17.959 885 HH11 ARG 7 HH11 ARG 7 10.153 -7.939 20.429 886 HH12 ARG 7 HH12 ARG 7 11.491 -8.391 19.409 887 HH21 ARG 7 HH21 ARG 7 9.508 -9.082 16.603 888 HH22 ARG 7 HH22 ARG 7 11.121 -9.035 17.247 889 H LYS 8 HN LYS 8 4.518 -5.029 18.922 890 HA LYS 8 HA LYS 8 4.328 -5.547 16.089 891 HB2 LYS 8 HB2 LYS 8 3.103 -6.918 17.805 892 HB3 LYS 8 HB1 LYS 8 2.078 -5.519 18.114 893 HG2 LYS 8 HG2 LYS 8 1.372 -5.553 15.752 894 HG3 LYS 8 HG1 LYS 8 2.340 -7.005 15.504 895 HD2 LYS 8 HD2 LYS 8 0.975 -8.167 17.204 896 HD3 LYS 8 HD1 LYS 8 -0.015 -6.716 17.373 897 HE2 LYS 8 HE2 LYS 8 -0.563 -6.877 14.953 898 HE3 LYS 8 HE1 LYS 8 0.319 -8.401 14.889 899 HZ1 LYS 8 HZ1 LYS 8 -1.235 -9.303 16.530 900 HZ2 LYS 8 HZ2 LYS 8 -2.041 -8.794 15.128 901 HZ3 LYS 8 HZ3 LYS 8 -2.092 -7.840 16.532 902 H ALA 9 HN ALA 9 3.217 -3.121 18.377 903 HA ALA 9 HA ALA 9 1.547 -1.649 16.670 904 HB1 ALA 9 HB1 ALA 9 1.592 -1.328 19.099 905 HB2 ALA 9 HB2 ALA 9 1.846 0.194 18.244 906 HB3 ALA 9 HB3 ALA 9 3.212 -0.643 18.980 907 H ALA 10 HN ALA 10 5.020 -1.449 17.303 908 HA ALA 10 HA ALA 10 5.548 0.760 15.626 909 HB1 ALA 10 HB1 ALA 10 7.400 -1.484 16.420 910 HB2 ALA 10 HB2 ALA 10 7.116 -0.009 17.344 911 HB3 ALA 10 HB3 ALA 10 7.884 0.077 15.758 912 H LEU 11 HN LEU 11 5.187 -2.665 15.022 913 HA LEU 11 HA LEU 11 6.303 -2.667 12.408 914 HB2 LEU 11 HB2 LEU 11 5.912 -4.694 13.847 915 HB3 LEU 11 HB1 LEU 11 4.199 -4.525 13.534 916 HG LEU 11 HG LEU 11 6.127 -4.861 11.255 917 HD11 LEU 11 HD11 LEU 11 6.594 -6.675 12.821 918 HD12 LEU 11 HD12 LEU 11 5.776 -7.273 11.378 919 HD13 LEU 11 HD13 LEU 11 4.876 -7.072 12.882 920 HD21 LEU 11 HD21 LEU 11 3.232 -5.621 11.647 921 HD22 LEU 11 HD22 LEU 11 4.175 -5.858 10.175 922 HD23 LEU 11 HD23 LEU 11 3.820 -4.226 10.742 923 H LEU 12 HN LEU 12 3.006 -2.375 13.672 924 HA LEU 12 HA LEU 12 1.791 -1.997 11.128 925 HB2 LEU 12 HB2 LEU 12 0.817 -1.307 13.899 926 HB3 LEU 12 HB1 LEU 12 -0.164 -1.185 12.453 927 HG LEU 12 HG LEU 12 0.964 -3.713 13.652 928 HD11 LEU 12 HD11 LEU 12 -1.387 -4.293 13.976 929 HD12 LEU 12 HD12 LEU 12 -1.858 -2.712 13.353 930 HD13 LEU 12 HD13 LEU 12 -0.941 -2.830 14.855 931 HD21 LEU 12 HD21 LEU 12 1.007 -3.833 11.209 932 HD22 LEU 12 HD22 LEU 12 -0.693 -3.361 11.152 933 HD23 LEU 12 HD23 LEU 12 -0.227 -4.899 11.882 934 H ASP 13 HN ASP 13 3.495 0.080 13.272 935 HA ASP 13 HA ASP 13 2.380 2.530 12.241 936 HB2 ASP 13 HB2 ASP 13 3.240 2.353 14.563 937 HB3 ASP 13 HB1 ASP 13 4.860 2.105 13.923 938 H GLN 14 HN GLN 14 5.328 0.625 11.758 939 HA GLN 14 HA GLN 14 6.541 2.486 9.991 940 HB2 GLN 14 HB2 GLN 14 7.779 0.659 11.158 941 HB3 GLN 14 HB1 GLN 14 6.994 -0.501 10.094 942 HG2 GLN 14 HG2 GLN 14 8.075 0.411 8.177 943 HG3 GLN 14 HG1 GLN 14 8.693 1.772 9.108 944 HE21 GLN 14 HE21 GLN 14 9.066 -1.579 8.353 945 HE22 GLN 14 HE22 GLN 14 10.599 -1.794 9.117 946 H VAL 15 HN VAL 15 4.544 -0.423 9.451 947 HA VAL 15 HA VAL 15 4.498 -0.140 6.632 948 HB VAL 15 HB VAL 15 2.562 -1.630 6.609 949 HG11 VAL 15 HG11 VAL 15 4.770 -2.609 6.796 950 HG12 VAL 15 HG12 VAL 15 3.587 -3.574 7.680 951 HG13 VAL 15 HG13 VAL 15 4.685 -2.506 8.555 952 HG21 VAL 15 HG21 VAL 15 1.582 -2.504 8.652 953 HG22 VAL 15 HG22 VAL 15 1.384 -0.753 8.565 954 HG23 VAL 15 HG23 VAL 15 2.615 -1.451 9.617 955 H ALA 16 HN ALA 16 2.753 1.384 9.215 956 HA ALA 16 HA ALA 16 0.587 2.455 7.837 957 HB1 ALA 16 HB1 ALA 16 0.834 2.622 10.266 958 HB2 ALA 16 HB2 ALA 16 0.537 4.200 9.539 959 HB3 ALA 16 HB3 ALA 16 2.166 3.758 10.054 960 H ARG 17 HN ARG 17 3.863 3.763 8.259 961 HA ARG 17 HA ARG 17 3.519 6.059 6.665 962 HB2 ARG 17 HB2 ARG 17 6.067 4.440 6.904 963 HB3 ARG 17 HB1 ARG 17 5.929 6.142 6.493 964 HG2 ARG 17 HG2 ARG 17 5.131 6.641 8.731 965 HG3 ARG 17 HG1 ARG 17 5.208 4.929 9.152 966 HD2 ARG 17 HD2 ARG 17 7.177 5.886 10.021 967 HD3 ARG 17 HD1 ARG 17 7.669 5.042 8.555 968 HE ARG 17 HE ARG 17 7.078 7.878 8.287 969 HH11 ARG 17 HH11 ARG 17 9.512 5.382 8.634 970 HH12 ARG 17 HH12 ARG 17 10.822 6.407 8.132 971 HH21 ARG 17 HH21 ARG 17 8.794 9.241 7.676 972 HH22 ARG 17 HH22 ARG 17 10.412 8.605 7.567 973 H VAL 18 HN VAL 18 4.520 2.764 5.833 974 HA VAL 18 HA VAL 18 5.141 3.257 3.128 975 HB VAL 18 HB VAL 18 4.198 0.667 4.366 976 HG11 VAL 18 HG11 VAL 18 5.427 -0.405 2.535 977 HG12 VAL 18 HG12 VAL 18 5.780 1.181 1.850 978 HG13 VAL 18 HG13 VAL 18 4.115 0.609 1.938 979 HG21 VAL 18 HG21 VAL 18 6.999 1.744 4.047 980 HG22 VAL 18 HG22 VAL 18 6.574 0.134 4.632 981 HG23 VAL 18 HG23 VAL 18 6.119 1.561 5.566 982 H GLY 19 HN GLY 19 2.210 1.766 4.535 983 HA2 GLY 19 HA2 GLY 19 0.840 1.497 2.091 984 HA3 GLY 19 HA1 GLY 19 0.094 1.493 3.681 985 H LYS 20 HN LYS 20 0.681 4.047 4.549 986 HA LYS 20 HA LYS 20 -1.255 5.612 3.233 987 HB2 LYS 20 HB2 LYS 20 -0.781 5.950 5.576 988 HB3 LYS 20 HB1 LYS 20 0.893 6.354 5.225 989 HG2 LYS 20 HG2 LYS 20 0.252 8.394 4.183 990 HG3 LYS 20 HG1 LYS 20 -1.458 7.971 4.281 991 HD2 LYS 20 HD2 LYS 20 -1.354 8.068 6.711 992 HD3 LYS 20 HD1 LYS 20 0.373 8.427 6.637 993 HE2 LYS 20 HE2 LYS 20 -1.800 10.138 5.440 994 HE3 LYS 20 HE1 LYS 20 -1.034 10.434 7.000 995 HZ1 LYS 20 HZ1 LYS 20 -0.101 11.746 5.126 996 HZ2 LYS 20 HZ2 LYS 20 0.459 10.306 4.433 997 HZ3 LYS 20 HZ3 LYS 20 1.047 10.807 5.944 998 H ALA 21 HN ALA 21 2.185 5.258 2.777 999 HA ALA 21 HA ALA 21 2.510 7.593 1.158 1000 HB1 ALA 21 HB1 ALA 21 4.218 5.110 1.300 1001 HB2 ALA 21 HB2 ALA 21 4.422 6.564 2.278 1002 HB3 ALA 21 HB3 ALA 21 4.669 6.632 0.533 1003 H LEU 22 HN LEU 22 1.502 4.301 0.608 1004 HA LEU 22 HA LEU 22 1.775 4.284 -2.217 1005 HB2 LEU 22 HB2 LEU 22 -0.073 2.697 -0.431 1006 HB3 LEU 22 HB1 LEU 22 0.203 2.369 -2.131 1007 HG LEU 22 HG LEU 22 2.296 2.204 0.042 1008 HD11 LEU 22 HD11 LEU 22 0.631 0.431 0.213 1009 HD12 LEU 22 HD12 LEU 22 2.182 -0.206 -0.337 1010 HD13 LEU 22 HD13 LEU 22 0.868 0.033 -1.489 1011 HD21 LEU 22 HD21 LEU 22 3.701 1.205 -1.687 1012 HD22 LEU 22 HD22 LEU 22 3.232 2.851 -2.121 1013 HD23 LEU 22 HD23 LEU 22 2.431 1.476 -2.882 1014 H ALA 23 HN ALA 23 -0.755 5.317 -0.023 1015 HA ALA 23 HA ALA 23 -2.682 5.831 -2.098 1016 HB1 ALA 23 HB1 ALA 23 -2.645 6.744 0.779 1017 HB2 ALA 23 HB2 ALA 23 -3.395 5.264 0.175 1018 HB3 ALA 23 HB3 ALA 23 -4.019 6.839 -0.321 1019 H ASN 24 HN ASN 24 -0.490 7.022 -2.976 1020 HA ASN 24 HA ASN 24 -0.546 9.850 -2.202 1021 HB2 ASN 24 HB2 ASN 24 1.526 10.040 -3.539 1022 HB3 ASN 24 HB1 ASN 24 1.663 8.809 -2.285 1023 HD21 ASN 24 HD21 ASN 24 2.041 6.731 -2.854 1024 HD22 ASN 24 HD22 ASN 24 2.225 6.197 -4.495 1025 H GLY 25 HN GLY 25 -1.203 7.707 -4.887 1026 HA2 GLY 25 HA2 GLY 25 -2.621 8.114 -6.681 1027 HA3 GLY 25 HA1 GLY 25 -2.682 9.808 -6.220 1028 H ARG 26 HN ARG 26 -1.272 11.248 -7.123 1029 HA ARG 26 HA ARG 26 -0.396 10.515 -9.726 1030 HB2 ARG 26 HB2 ARG 26 0.151 12.827 -10.024 1031 HB3 ARG 26 HB1 ARG 26 -1.363 12.718 -9.138 1032 HG2 ARG 26 HG2 ARG 26 -0.188 13.184 -7.054 1033 HG3 ARG 26 HG1 ARG 26 1.340 13.275 -7.933 1034 HD2 ARG 26 HD2 ARG 26 -1.043 15.100 -8.181 1035 HD3 ARG 26 HD1 ARG 26 0.564 15.506 -7.582 1036 HE ARG 26 HE ARG 26 0.995 14.625 -10.130 1037 HH11 ARG 26 HH11 ARG 26 -0.928 17.158 -8.673 1038 HH12 ARG 26 HH12 ARG 26 -0.946 18.138 -10.114 1039 HH21 ARG 26 HH21 ARG 26 0.987 15.919 -12.015 1040 HH22 ARG 26 HH22 ARG 26 0.141 17.438 -11.999 1041 H ARG 27 HN ARG 27 1.221 10.288 -6.761 1042 HA ARG 27 HA ARG 27 3.849 10.898 -7.810 1043 HB2 ARG 27 HB2 ARG 27 3.039 9.627 -5.189 1044 HB3 ARG 27 HB1 ARG 27 4.680 10.083 -5.619 1045 HG2 ARG 27 HG2 ARG 27 4.013 12.420 -5.736 1046 HG3 ARG 27 HG1 ARG 27 2.351 11.973 -5.342 1047 HD2 ARG 27 HD2 ARG 27 3.131 11.046 -3.197 1048 HD3 ARG 27 HD1 ARG 27 4.774 11.544 -3.593 1049 HE ARG 27 HE ARG 27 3.514 13.872 -3.760 1050 HH11 ARG 27 HH11 ARG 27 3.281 11.370 -1.320 1051 HH12 ARG 27 HH12 ARG 27 2.874 12.476 -0.040 1052 HH21 ARG 27 HH21 ARG 27 2.995 15.331 -2.072 1053 HH22 ARG 27 HH22 ARG 27 2.710 14.714 -0.471 1054 H LEU 28 HN LEU 28 1.739 8.282 -7.928 1055 HA LEU 28 HA LEU 28 3.586 6.133 -7.927 1056 HB2 LEU 28 HB2 LEU 28 0.867 6.397 -9.209 1057 HB3 LEU 28 HB1 LEU 28 1.780 4.903 -9.145 1058 HG LEU 28 HG LEU 28 0.799 6.433 -6.732 1059 HD11 LEU 28 HD11 LEU 28 -0.195 3.856 -7.936 1060 HD12 LEU 28 HD12 LEU 28 -1.021 5.413 -8.025 1061 HD13 LEU 28 HD13 LEU 28 -0.793 4.623 -6.464 1062 HD21 LEU 28 HD21 LEU 28 2.846 5.203 -6.275 1063 HD22 LEU 28 HD22 LEU 28 2.153 3.747 -6.986 1064 HD23 LEU 28 HD23 LEU 28 1.474 4.411 -5.501 1065 H GLN 29 HN GLN 29 2.844 8.587 -10.182 1066 HA GLN 29 HA GLN 29 3.739 7.397 -12.569 1067 HB2 GLN 29 HB2 GLN 29 3.876 10.277 -11.650 1068 HB3 GLN 29 HB1 GLN 29 4.197 9.743 -13.295 1069 HG2 GLN 29 HG2 GLN 29 1.923 8.953 -13.523 1070 HG3 GLN 29 HG1 GLN 29 1.583 9.367 -11.845 1071 HE21 GLN 29 HE21 GLN 29 3.081 11.856 -11.953 1072 HE22 GLN 29 HE22 GLN 29 2.124 12.967 -12.871 1073 H ILE 30 HN ILE 30 5.402 8.708 -9.808 1074 HA ILE 30 HA ILE 30 7.999 8.832 -10.965 1075 HB ILE 30 HB ILE 30 7.206 8.561 -8.056 1076 HG12 ILE 30 HG12 ILE 30 7.927 11.026 -9.657 1077 HG13 ILE 30 HG11 ILE 30 6.290 10.573 -9.196 1078 HG21 ILE 30 HG21 ILE 30 9.444 9.460 -7.577 1079 HG22 ILE 30 HG22 ILE 30 9.828 9.390 -9.298 1080 HG23 ILE 30 HG23 ILE 30 9.514 7.903 -8.403 1081 HD11 ILE 30 HD11 ILE 30 6.913 10.790 -6.835 1082 HD12 ILE 30 HD12 ILE 30 7.155 12.290 -7.732 1083 HD13 ILE 30 HD13 ILE 30 8.539 11.275 -7.322 1084 H LEU 31 HN LEU 31 6.338 6.459 -8.906 1085 HA LEU 31 HA LEU 31 8.412 4.569 -8.813 1086 HB2 LEU 31 HB2 LEU 31 5.426 4.198 -8.599 1087 HB3 LEU 31 HB1 LEU 31 6.593 2.927 -8.283 1088 HG LEU 31 HG LEU 31 6.357 5.514 -6.742 1089 HD11 LEU 31 HD11 LEU 31 5.632 2.690 -5.972 1090 HD12 LEU 31 HD12 LEU 31 4.493 3.982 -6.348 1091 HD13 LEU 31 HD13 LEU 31 5.536 4.110 -4.932 1092 HD21 LEU 31 HD21 LEU 31 8.113 3.101 -6.272 1093 HD22 LEU 31 HD22 LEU 31 7.981 4.512 -5.222 1094 HD23 LEU 31 HD23 LEU 31 8.658 4.679 -6.841 1095 H ASP 32 HN ASP 32 5.798 5.068 -11.111 1096 HA ASP 32 HA ASP 32 6.108 2.754 -12.655 1097 HB2 ASP 32 HB2 ASP 32 4.201 4.265 -12.908 1098 HB3 ASP 32 HB1 ASP 32 5.264 5.533 -13.512 1099 H LEU 33 HN LEU 33 7.593 5.960 -13.022 1100 HA LEU 33 HA LEU 33 9.205 5.292 -15.243 1101 HB2 LEU 33 HB2 LEU 33 8.672 7.602 -14.609 1102 HB3 LEU 33 HB1 LEU 33 9.610 7.420 -13.140 1103 HG LEU 33 HG LEU 33 11.643 7.074 -14.540 1104 HD11 LEU 33 HD11 LEU 33 11.572 7.669 -16.897 1105 HD12 LEU 33 HD12 LEU 33 9.827 7.898 -16.801 1106 HD13 LEU 33 HD13 LEU 33 10.518 6.291 -16.573 1107 HD21 LEU 33 HD21 LEU 33 11.874 9.429 -15.167 1108 HD22 LEU 33 HD22 LEU 33 11.133 9.249 -13.579 1109 HD23 LEU 33 HD23 LEU 33 10.135 9.646 -14.976 1110 H LEU 34 HN LEU 34 9.781 5.239 -11.757 1111 HA LEU 34 HA LEU 34 12.533 4.616 -11.902 1112 HB2 LEU 34 HB2 LEU 34 10.467 4.712 -9.809 1113 HB3 LEU 34 HB1 LEU 34 11.803 3.620 -9.487 1114 HG LEU 34 HG LEU 34 12.242 5.781 -8.483 1115 HD11 LEU 34 HD11 LEU 34 13.951 5.293 -10.917 1116 HD12 LEU 34 HD12 LEU 34 14.124 4.506 -9.348 1117 HD13 LEU 34 HD13 LEU 34 14.414 6.239 -9.500 1118 HD21 LEU 34 HD21 LEU 34 10.875 7.176 -9.951 1119 HD22 LEU 34 HD22 LEU 34 12.004 6.900 -11.276 1120 HD23 LEU 34 HD23 LEU 34 12.524 7.794 -9.847 1121 H ALA 35 HN ALA 35 9.655 2.623 -11.944 1122 HA ALA 35 HA ALA 35 10.949 0.131 -11.553 1123 HB1 ALA 35 HB1 ALA 35 8.912 -0.851 -12.481 1124 HB2 ALA 35 HB2 ALA 35 8.391 0.741 -13.027 1125 HB3 ALA 35 HB3 ALA 35 8.533 0.406 -11.304 1126 H GLN 36 HN GLN 36 10.871 2.326 -14.149 1127 HA GLN 36 HA GLN 36 11.678 0.308 -16.108 1128 HB2 GLN 36 HB2 GLN 36 10.980 3.235 -16.390 1129 HB3 GLN 36 HB1 GLN 36 11.502 2.211 -17.724 1130 HG2 GLN 36 HG2 GLN 36 9.567 0.856 -17.557 1131 HG3 GLN 36 HG1 GLN 36 9.109 1.589 -16.019 1132 HE21 GLN 36 HE21 GLN 36 8.109 3.557 -15.991 1133 HE22 GLN 36 HE22 GLN 36 7.480 4.311 -17.412 1134 H GLY 37 HN GLY 37 12.976 2.739 -14.049 1135 HA2 GLY 37 HA2 GLY 37 15.590 1.951 -14.241 1136 HA3 GLY 37 HA1 GLY 37 15.411 3.155 -15.508 1137 H GLU 38 HN GLU 38 17.079 3.295 -13.145 1138 HA GLU 38 HA GLU 38 15.830 5.168 -11.352 1139 HB2 GLU 38 HB2 GLU 38 18.077 5.378 -10.350 1140 HB3 GLU 38 HB1 GLU 38 17.556 3.705 -10.483 1141 HG2 GLU 38 HG2 GLU 38 18.984 3.349 -12.372 1142 HG3 GLU 38 HG1 GLU 38 19.404 5.060 -12.430 1143 H ARG 39 HN ARG 39 16.209 7.366 -11.202 1144 HA ARG 39 HA ARG 39 17.613 8.642 -13.439 1145 HB2 ARG 39 HB2 ARG 39 14.696 8.705 -12.941 1146 HB3 ARG 39 HB1 ARG 39 15.439 10.269 -13.237 1147 HG2 ARG 39 HG2 ARG 39 14.641 9.455 -15.312 1148 HG3 ARG 39 HG1 ARG 39 16.397 9.326 -15.341 1149 HD2 ARG 39 HD2 ARG 39 16.165 6.930 -14.712 1150 HD3 ARG 39 HD1 ARG 39 14.419 7.104 -14.872 1151 HE ARG 39 HE ARG 39 14.749 7.543 -17.231 1152 HH11 ARG 39 HH11 ARG 39 17.492 6.219 -15.484 1153 HH12 ARG 39 HH12 ARG 39 18.269 5.622 -16.920 1154 HH21 ARG 39 HH21 ARG 39 15.753 6.742 -19.102 1155 HH22 ARG 39 HH22 ARG 39 17.279 5.913 -18.983 1156 H ALA 40 HN ALA 40 17.926 10.983 -13.080 1157 HA ALA 40 HA ALA 40 18.345 11.557 -10.257 1158 HB1 ALA 40 HB1 ALA 40 19.516 13.556 -11.038 1159 HB2 ALA 40 HB2 ALA 40 19.032 13.200 -12.696 1160 HB3 ALA 40 HB3 ALA 40 20.125 12.112 -11.844 1161 H VAL 41 HN VAL 41 17.709 13.742 -9.457 1162 HA VAL 41 HA VAL 41 15.004 14.044 -9.299 1163 HB VAL 41 HB VAL 41 16.980 16.319 -9.102 1164 HG11 VAL 41 HG11 VAL 41 15.349 17.306 -7.556 1165 HG12 VAL 41 HG12 VAL 41 14.236 15.983 -7.894 1166 HG13 VAL 41 HG13 VAL 41 14.680 17.108 -9.176 1167 HG21 VAL 41 HG21 VAL 41 17.055 15.768 -6.712 1168 HG22 VAL 41 HG22 VAL 41 17.655 14.446 -7.712 1169 HG23 VAL 41 HG23 VAL 41 16.039 14.358 -7.013 1170 H GLU 42 HN GLU 42 17.094 15.763 -11.613 1171 HA GLU 42 HA GLU 42 15.163 17.495 -12.652 1172 HB2 GLU 42 HB2 GLU 42 17.605 16.320 -13.980 1173 HB3 GLU 42 HB1 GLU 42 16.661 17.654 -14.631 1174 HG2 GLU 42 HG2 GLU 42 17.207 19.006 -12.687 1175 HG3 GLU 42 HG1 GLU 42 18.125 17.667 -11.999 1176 H ALA 43 HN ALA 43 16.228 14.334 -13.923 1177 HA ALA 43 HA ALA 43 14.525 14.324 -16.156 1178 HB1 ALA 43 HB1 ALA 43 14.993 11.950 -16.310 1179 HB2 ALA 43 HB2 ALA 43 15.627 11.947 -14.666 1180 HB3 ALA 43 HB3 ALA 43 16.467 12.841 -15.933 1181 H ILE 44 HN ILE 44 14.093 13.069 -12.878 1182 HA ILE 44 HA ILE 44 11.641 11.766 -13.278 1183 HB ILE 44 HB ILE 44 12.663 13.099 -10.760 1184 HG12 ILE 44 HG12 ILE 44 12.838 10.213 -11.670 1185 HG13 ILE 44 HG11 ILE 44 14.171 11.362 -11.702 1186 HG21 ILE 44 HG21 ILE 44 11.119 11.603 -9.581 1187 HG22 ILE 44 HG22 ILE 44 10.513 11.011 -11.127 1188 HG23 ILE 44 HG23 ILE 44 10.258 12.694 -10.666 1189 HD11 ILE 44 HD11 ILE 44 14.035 11.554 -9.261 1190 HD12 ILE 44 HD12 ILE 44 14.354 9.903 -9.789 1191 HD13 ILE 44 HD13 ILE 44 12.737 10.360 -9.253 1192 H ALA 45 HN ALA 45 12.350 15.077 -12.212 1193 HA ALA 45 HA ALA 45 9.715 15.963 -11.882 1194 HB1 ALA 45 HB1 ALA 45 12.114 17.581 -12.740 1195 HB2 ALA 45 HB2 ALA 45 11.694 17.178 -11.074 1196 HB3 ALA 45 HB3 ALA 45 10.627 18.209 -12.030 1197 H THR 46 HN THR 46 11.809 15.940 -14.718 1198 HA THR 46 HA THR 46 10.136 17.461 -16.401 1199 HB THR 46 HB THR 46 12.127 15.352 -17.263 1200 HG1 THR 46 HG1 THR 46 13.143 16.801 -15.839 1201 HG21 THR 46 HG21 THR 46 11.110 17.858 -18.619 1202 HG22 THR 46 HG22 THR 46 10.737 16.196 -19.077 1203 HG23 THR 46 HG23 THR 46 12.384 16.804 -19.240 1204 H ALA 47 HN ALA 47 10.533 13.943 -16.021 1205 HA ALA 47 HA ALA 47 8.754 13.269 -18.122 1206 HB1 ALA 47 HB1 ALA 47 10.522 11.774 -17.341 1207 HB2 ALA 47 HB2 ALA 47 8.941 10.993 -17.307 1208 HB3 ALA 47 HB3 ALA 47 9.670 11.573 -15.808 1209 H THR 48 HN THR 48 8.239 14.055 -14.783 1210 HA THR 48 HA THR 48 5.579 12.868 -14.798 1211 HB THR 48 HB THR 48 5.507 13.750 -12.420 1212 HG1 THR 48 HG1 THR 48 8.314 13.981 -12.610 1213 HG21 THR 48 HG21 THR 48 6.006 11.418 -12.902 1214 HG22 THR 48 HG22 THR 48 7.007 11.989 -11.568 1215 HG23 THR 48 HG23 THR 48 7.701 11.817 -13.179 1216 H GLY 49 HN GLY 49 6.997 15.822 -15.599 1217 HA2 GLY 49 HA2 GLY 49 5.925 17.687 -16.468 1218 HA3 GLY 49 HA1 GLY 49 4.391 17.007 -15.953 1219 H MET 50 HN MET 50 7.177 17.547 -13.873 1220 HA MET 50 HA MET 50 5.764 19.810 -12.634 1221 HB2 MET 50 HB2 MET 50 6.419 18.999 -10.404 1222 HB3 MET 50 HB1 MET 50 5.356 17.865 -11.222 1223 HG2 MET 50 HG2 MET 50 7.334 16.518 -11.835 1224 HG3 MET 50 HG1 MET 50 8.338 17.627 -10.903 1225 HE1 MET 50 HE1 MET 50 5.569 14.881 -10.819 1226 HE2 MET 50 HE2 MET 50 4.701 16.241 -10.106 1227 HE3 MET 50 HE3 MET 50 5.114 14.841 -9.116 1228 H ASN 51 HN ASN 51 7.461 20.731 -10.853 1229 HA ASN 51 HA ASN 51 9.869 21.301 -12.430 1230 HB2 ASN 51 HB2 ASN 51 8.401 23.204 -11.702 1231 HB3 ASN 51 HB1 ASN 51 8.792 22.805 -10.033 1232 HD21 ASN 51 HD21 ASN 51 9.714 24.836 -9.712 1233 HD22 ASN 51 HD22 ASN 51 11.260 25.259 -10.375 1234 H LEU 52 HN LEU 52 11.905 21.638 -11.131 1235 HA LEU 52 HA LEU 52 12.622 19.314 -9.781 1236 HB2 LEU 52 HB2 LEU 52 13.865 22.045 -9.883 1237 HB3 LEU 52 HB1 LEU 52 14.569 20.772 -8.905 1238 HG LEU 52 HG LEU 52 14.724 19.385 -11.011 1239 HD11 LEU 52 HD11 LEU 52 14.652 20.539 -13.145 1240 HD12 LEU 52 HD12 LEU 52 14.139 22.023 -12.344 1241 HD13 LEU 52 HD13 LEU 52 13.082 20.614 -12.348 1242 HD21 LEU 52 HD21 LEU 52 16.648 20.512 -10.040 1243 HD22 LEU 52 HD22 LEU 52 16.244 21.982 -10.923 1244 HD23 LEU 52 HD23 LEU 52 16.729 20.532 -11.801 1245 H THR 53 HN THR 53 11.594 22.440 -8.495 1246 HA THR 53 HA THR 53 11.966 21.914 -5.768 1247 HB THR 53 HB THR 53 10.074 23.634 -5.511 1248 HG1 THR 53 HG1 THR 53 9.537 24.705 -7.484 1249 HG21 THR 53 HG21 THR 53 12.480 24.344 -7.197 1250 HG22 THR 53 HG22 THR 53 12.440 24.255 -5.436 1251 HG23 THR 53 HG23 THR 53 11.494 25.481 -6.279 1252 H THR 54 HN THR 54 9.154 21.475 -7.866 1253 HA THR 54 HA THR 54 7.383 20.437 -5.962 1254 HB THR 54 HB THR 54 7.376 19.590 -8.852 1255 HG1 THR 54 HG1 THR 54 6.872 22.157 -7.739 1256 HG21 THR 54 HG21 THR 54 5.171 20.311 -6.917 1257 HG22 THR 54 HG22 THR 54 5.643 18.675 -7.382 1258 HG23 THR 54 HG23 THR 54 4.952 19.768 -8.581 1259 H ALA 55 HN ALA 55 9.561 18.815 -8.254 1260 HA ALA 55 HA ALA 55 8.860 16.178 -7.591 1261 HB1 ALA 55 HB1 ALA 55 10.874 15.519 -8.761 1262 HB2 ALA 55 HB2 ALA 55 11.492 17.169 -8.677 1263 HB3 ALA 55 HB3 ALA 55 10.059 16.813 -9.643 1264 H SER 56 HN SER 56 11.459 18.277 -6.368 1265 HA SER 56 HA SER 56 12.797 16.446 -4.778 1266 HB2 SER 56 HB2 SER 56 13.525 18.793 -5.243 1267 HB3 SER 56 HB1 SER 56 12.309 19.357 -4.100 1268 HG SER 56 HG SER 56 13.500 18.688 -2.465 1269 H ALA 57 HN ALA 57 10.018 18.503 -3.902 1270 HA ALA 57 HA ALA 57 9.807 17.615 -1.233 1271 HB1 ALA 57 HB1 ALA 57 7.641 18.721 -3.018 1272 HB2 ALA 57 HB2 ALA 57 8.753 19.670 -2.030 1273 HB3 ALA 57 HB3 ALA 57 7.580 18.604 -1.257 1274 H ASN 58 HN ASN 58 8.214 16.519 -4.205 1275 HA ASN 58 HA ASN 58 6.539 14.609 -2.953 1276 HB2 ASN 58 HB2 ASN 58 7.466 14.983 -5.791 1277 HB3 ASN 58 HB1 ASN 58 6.504 13.581 -5.330 1278 HD21 ASN 58 HD21 ASN 58 6.519 17.014 -5.807 1279 HD22 ASN 58 HD22 ASN 58 4.804 17.234 -5.713 1280 H LEU 59 HN LEU 59 9.723 14.360 -4.480 1281 HA LEU 59 HA LEU 59 10.017 11.585 -4.342 1282 HB2 LEU 59 HB2 LEU 59 12.054 13.803 -4.314 1283 HB3 LEU 59 HB1 LEU 59 12.500 12.108 -4.364 1284 HG LEU 59 HG LEU 59 10.817 13.496 -6.454 1285 HD11 LEU 59 HD11 LEU 59 13.725 12.697 -6.510 1286 HD12 LEU 59 HD12 LEU 59 13.103 14.349 -6.446 1287 HD13 LEU 59 HD13 LEU 59 12.804 13.347 -7.867 1288 HD21 LEU 59 HD21 LEU 59 10.343 11.118 -6.277 1289 HD22 LEU 59 HD22 LEU 59 12.065 10.752 -6.361 1290 HD23 LEU 59 HD23 LEU 59 11.246 11.455 -7.755 1291 H GLN 60 HN GLN 60 11.055 14.081 -2.022 1292 HA GLN 60 HA GLN 60 12.224 12.246 -0.214 1293 HB2 GLN 60 HB2 GLN 60 11.167 15.033 0.290 1294 HB3 GLN 60 HB1 GLN 60 12.197 14.124 1.389 1295 HG2 GLN 60 HG2 GLN 60 13.976 14.104 -0.262 1296 HG3 GLN 60 HG1 GLN 60 12.946 14.969 -1.400 1297 HE21 GLN 60 HE21 GLN 60 15.522 15.727 -0.343 1298 HE22 GLN 60 HE22 GLN 60 15.299 17.247 0.455 1299 H ALA 61 HN ALA 61 8.963 13.334 -0.705 1300 HA ALA 61 HA ALA 61 7.857 12.592 1.768 1301 HB1 ALA 61 HB1 ALA 61 6.554 12.614 -0.949 1302 HB2 ALA 61 HB2 ALA 61 6.650 13.971 0.169 1303 HB3 ALA 61 HB3 ALA 61 5.711 12.543 0.598 1304 H LEU 62 HN LEU 62 7.815 10.723 -1.324 1305 HA LEU 62 HA LEU 62 6.884 8.409 0.118 1306 HB2 LEU 62 HB2 LEU 62 6.666 7.283 -1.908 1307 HB3 LEU 62 HB1 LEU 62 6.284 8.944 -2.300 1308 HG LEU 62 HG LEU 62 9.024 7.808 -2.798 1309 HD11 LEU 62 HD11 LEU 62 6.645 7.785 -4.649 1310 HD12 LEU 62 HD12 LEU 62 7.409 6.372 -3.928 1311 HD13 LEU 62 HD13 LEU 62 8.296 7.356 -5.091 1312 HD21 LEU 62 HD21 LEU 62 8.781 10.238 -2.869 1313 HD22 LEU 62 HD22 LEU 62 7.474 10.074 -4.042 1314 HD23 LEU 62 HD23 LEU 62 9.113 9.577 -4.470 1315 H LYS 63 HN LYS 63 9.911 9.782 -0.516 1316 HA LYS 63 HA LYS 63 11.515 7.449 -0.308 1317 HB2 LYS 63 HB2 LYS 63 12.377 9.684 -1.041 1318 HB3 LYS 63 HB1 LYS 63 12.203 10.248 0.617 1319 HG2 LYS 63 HG2 LYS 63 13.740 8.342 1.271 1320 HG3 LYS 63 HG1 LYS 63 14.079 8.168 -0.451 1321 HD2 LYS 63 HD2 LYS 63 14.875 10.467 -0.541 1322 HD3 LYS 63 HD1 LYS 63 14.486 10.679 1.169 1323 HE2 LYS 63 HE2 LYS 63 16.554 8.848 -0.031 1324 HE3 LYS 63 HE1 LYS 63 16.832 10.257 0.990 1325 HZ1 LYS 63 HZ1 LYS 63 15.573 7.691 1.795 1326 HZ2 LYS 63 HZ2 LYS 63 15.632 9.064 2.785 1327 HZ3 LYS 63 HZ3 LYS 63 17.070 8.298 2.312 1328 H SER 64 HN SER 64 10.064 9.659 2.016 1329 HA SER 64 HA SER 64 11.135 8.407 4.339 1330 HB2 SER 64 HB2 SER 64 8.655 10.122 4.034 1331 HB3 SER 64 HB1 SER 64 9.437 9.705 5.561 1332 HG SER 64 HG SER 64 10.408 11.343 3.457 1333 H GLY 65 HN GLY 65 8.305 7.924 2.339 1334 HA2 GLY 65 HA2 GLY 65 6.975 6.074 4.028 1335 HA3 GLY 65 HA1 GLY 65 6.748 6.234 2.292 1336 H GLY 66 HN GLY 66 9.821 5.821 2.164 1337 HA2 GLY 66 HA2 GLY 66 11.335 4.040 2.351 1338 HA3 GLY 66 HA1 GLY 66 10.022 3.008 2.895 1339 H LEU 67 HN LEU 67 9.380 4.891 0.111 1340 HA LEU 67 HA LEU 67 9.227 2.455 -1.451 1341 HB2 LEU 67 HB2 LEU 67 8.164 5.217 -1.710 1342 HB3 LEU 67 HB1 LEU 67 8.380 4.293 -3.183 1343 HG LEU 67 HG LEU 67 6.822 2.622 -2.469 1344 HD11 LEU 67 HD11 LEU 67 6.689 4.066 0.176 1345 HD12 LEU 67 HD12 LEU 67 7.440 2.494 -0.111 1346 HD13 LEU 67 HD13 LEU 67 5.697 2.689 -0.306 1347 HD21 LEU 67 HD21 LEU 67 4.782 3.954 -2.186 1348 HD22 LEU 67 HD22 LEU 67 5.846 4.627 -3.422 1349 HD23 LEU 67 HD23 LEU 67 5.768 5.372 -1.825 1350 H VAL 68 HN VAL 68 10.864 5.606 -1.703 1351 HA VAL 68 HA VAL 68 12.648 4.364 -3.689 1352 HB VAL 68 HB VAL 68 13.104 6.628 -4.569 1353 HG11 VAL 68 HG11 VAL 68 10.994 6.892 -5.781 1354 HG12 VAL 68 HG12 VAL 68 10.200 5.817 -4.626 1355 HG13 VAL 68 HG13 VAL 68 11.480 5.199 -5.673 1356 HG21 VAL 68 HG21 VAL 68 10.878 7.458 -2.714 1357 HG22 VAL 68 HG22 VAL 68 11.547 8.461 -4.001 1358 HG23 VAL 68 HG23 VAL 68 12.564 7.973 -2.646 1359 H GLU 69 HN GLU 69 14.838 5.124 -3.730 1360 HA GLU 69 HA GLU 69 15.794 6.221 -1.173 1361 HB2 GLU 69 HB2 GLU 69 16.352 3.640 -2.330 1362 HB3 GLU 69 HB1 GLU 69 17.833 4.584 -2.223 1363 HG2 GLU 69 HG2 GLU 69 15.948 4.156 0.082 1364 HG3 GLU 69 HG1 GLU 69 17.355 3.145 -0.247 1365 H ALA 70 HN ALA 70 17.874 7.315 -1.336 1366 HA ALA 70 HA ALA 70 18.332 8.379 -4.048 1367 HB1 ALA 70 HB1 ALA 70 18.194 10.022 -1.525 1368 HB2 ALA 70 HB2 ALA 70 16.948 9.945 -2.771 1369 HB3 ALA 70 HB3 ALA 70 18.532 10.623 -3.148 1370 H ARG 71 HN ARG 71 20.381 8.734 -4.629 1371 HA ARG 71 HA ARG 71 22.485 8.763 -2.581 1372 HB2 ARG 71 HB2 ARG 71 22.254 6.906 -4.895 1373 HB3 ARG 71 HB1 ARG 71 23.845 7.568 -4.553 1374 HG2 ARG 71 HG2 ARG 71 23.622 6.734 -2.226 1375 HG3 ARG 71 HG1 ARG 71 22.114 5.954 -2.706 1376 HD2 ARG 71 HD2 ARG 71 24.121 4.458 -2.720 1377 HD3 ARG 71 HD1 ARG 71 23.244 4.537 -4.248 1378 HE ARG 71 HE ARG 71 25.024 5.758 -5.188 1379 HH11 ARG 71 HH11 ARG 71 25.651 4.845 -1.855 1380 HH12 ARG 71 HH12 ARG 71 27.372 5.069 -1.997 1381 HH21 ARG 71 HH21 ARG 71 27.300 6.036 -5.351 1382 HH22 ARG 71 HH22 ARG 71 28.295 5.757 -3.953 1383 H ARG 72 HN ARG 72 23.849 10.423 -2.844 1384 HA ARG 72 HA ARG 72 23.638 12.039 -5.246 1385 HB2 ARG 72 HB2 ARG 72 23.839 13.018 -2.909 1386 HB3 ARG 72 HB1 ARG 72 25.514 12.478 -2.922 1387 HG2 ARG 72 HG2 ARG 72 25.838 13.826 -5.008 1388 HG3 ARG 72 HG1 ARG 72 24.224 14.488 -4.748 1389 HD2 ARG 72 HD2 ARG 72 25.670 16.062 -3.807 1390 HD3 ARG 72 HD1 ARG 72 25.051 15.145 -2.435 1391 HE ARG 72 HE ARG 72 27.272 13.814 -2.815 1392 HH11 ARG 72 HH11 ARG 72 26.775 17.276 -3.082 1393 HH12 ARG 72 HH12 ARG 72 28.426 17.665 -2.671 1394 HH21 ARG 72 HH21 ARG 72 29.424 14.331 -2.244 1395 HH22 ARG 72 HH22 ARG 72 29.918 15.995 -2.180 1396 H GLU 73 HN GLU 73 24.690 11.269 -6.955 1397 HA GLU 73 HA GLU 73 27.421 10.258 -6.551 1398 HB2 GLU 73 HB2 GLU 73 25.369 9.309 -8.569 1399 HB3 GLU 73 HB1 GLU 73 27.038 8.755 -8.484 1400 HG2 GLU 73 HG2 GLU 73 26.626 7.876 -6.234 1401 HG3 GLU 73 HG1 GLU 73 24.953 8.411 -6.337 1402 H GLY 74 HN GLY 74 28.961 11.231 -7.675 1403 HA2 GLY 74 HA2 GLY 74 29.974 12.659 -9.174 1404 HA3 GLY 74 HA1 GLY 74 28.482 12.669 -10.108 1405 H THR 75 HN THR 75 27.298 14.465 -10.085 1406 HA THR 75 HA THR 75 27.656 16.334 -7.839 1407 HB THR 75 HB THR 75 27.112 18.129 -9.650 1408 HG1 THR 75 HG1 THR 75 28.306 16.105 -11.277 1409 HG21 THR 75 HG21 THR 75 29.485 18.442 -10.101 1410 HG22 THR 75 HG22 THR 75 29.820 16.785 -9.601 1411 HG23 THR 75 HG23 THR 75 29.241 17.963 -8.421 1412 H ARG 76 HN ARG 76 25.571 14.234 -8.954 1413 HA ARG 76 HA ARG 76 23.243 15.977 -8.540 1414 HB2 ARG 76 HB2 ARG 76 22.039 14.698 -10.306 1415 HB3 ARG 76 HB1 ARG 76 23.377 15.664 -10.916 1416 HG2 ARG 76 HG2 ARG 76 24.779 13.660 -11.004 1417 HG3 ARG 76 HG1 ARG 76 23.423 12.692 -10.415 1418 HD2 ARG 76 HD2 ARG 76 23.605 12.503 -12.825 1419 HD3 ARG 76 HD1 ARG 76 22.122 13.351 -12.388 1420 HE ARG 76 HE ARG 76 24.513 14.891 -13.132 1421 HH11 ARG 76 HH11 ARG 76 21.247 13.849 -13.846 1422 HH12 ARG 76 HH12 ARG 76 20.974 15.092 -15.029 1423 HH21 ARG 76 HH21 ARG 76 24.165 16.507 -14.700 1424 HH22 ARG 76 HH22 ARG 76 22.645 16.587 -15.535 1425 H GLN 77 HN GLN 77 21.338 14.894 -7.798 1426 HA GLN 77 HA GLN 77 21.976 12.512 -6.236 1427 HB2 GLN 77 HB2 GLN 77 19.663 14.445 -6.057 1428 HB3 GLN 77 HB1 GLN 77 19.816 12.997 -5.068 1429 HG2 GLN 77 HG2 GLN 77 21.935 13.867 -4.168 1430 HG3 GLN 77 HG1 GLN 77 21.711 15.337 -5.113 1431 HE21 GLN 77 HE21 GLN 77 19.068 13.655 -3.553 1432 HE22 GLN 77 HE22 GLN 77 18.760 14.854 -2.346 1433 H TYR 78 HN TYR 78 21.423 10.622 -6.922 1434 HA TYR 78 HA TYR 78 19.417 10.316 -9.026 1435 HB2 TYR 78 HB2 TYR 78 21.477 8.426 -7.875 1436 HB3 TYR 78 HB1 TYR 78 20.271 7.937 -9.061 1437 HD1 TYR 78 HD2 TYR 78 20.233 9.294 -11.279 1438 HD2 TYR 78 HD1 TYR 78 23.531 9.226 -8.594 1439 HE1 TYR 78 HE2 TYR 78 21.723 9.999 -13.102 1440 HE2 TYR 78 HE1 TYR 78 25.030 9.931 -10.410 1441 HH TYR 78 HH TYR 78 25.063 9.802 -12.919 1442 H TYR 79 HN TYR 79 17.556 9.201 -8.754 1443 HA TYR 79 HA TYR 79 17.056 8.076 -6.085 1444 HB2 TYR 79 HB2 TYR 79 15.262 9.534 -7.990 1445 HB3 TYR 79 HB1 TYR 79 14.572 8.346 -6.889 1446 HD1 TYR 79 HD2 TYR 79 16.587 11.468 -6.992 1447 HD2 TYR 79 HD1 TYR 79 14.140 8.890 -4.656 1448 HE1 TYR 79 HE2 TYR 79 16.542 13.146 -5.196 1449 HE2 TYR 79 HE1 TYR 79 14.089 10.558 -2.855 1450 HH TYR 79 HH TYR 79 15.112 13.753 -3.276 1451 H ARG 80 HN ARG 80 16.418 6.040 -5.920 1452 HA ARG 80 HA ARG 80 15.612 4.536 -8.283 1453 HB2 ARG 80 HB2 ARG 80 17.191 2.689 -7.687 1454 HB3 ARG 80 HB1 ARG 80 17.992 4.146 -8.254 1455 HG2 ARG 80 HG2 ARG 80 18.467 4.761 -5.913 1456 HG3 ARG 80 HG1 ARG 80 17.730 3.246 -5.393 1457 HD2 ARG 80 HD2 ARG 80 20.160 3.052 -5.479 1458 HD3 ARG 80 HD1 ARG 80 19.397 1.988 -6.660 1459 HE ARG 80 HE ARG 80 20.080 3.516 -8.399 1460 HH11 ARG 80 HH11 ARG 80 21.525 4.028 -5.246 1461 HH12 ARG 80 HH12 ARG 80 22.844 4.972 -5.880 1462 HH21 ARG 80 HH21 ARG 80 21.823 4.760 -9.219 1463 HH22 ARG 80 HH22 ARG 80 23.024 5.379 -8.104 1464 H ILE 81 HN ILE 81 15.104 2.145 -7.427 1465 HA ILE 81 HA ILE 81 13.046 2.470 -5.493 1466 HB ILE 81 HB ILE 81 14.245 -0.104 -6.542 1467 HG12 ILE 81 HG12 ILE 81 13.385 1.320 -8.347 1468 HG13 ILE 81 HG11 ILE 81 12.373 -0.103 -8.131 1469 HG21 ILE 81 HG21 ILE 81 11.624 0.440 -5.152 1470 HG22 ILE 81 HG22 ILE 81 12.988 -0.476 -4.509 1471 HG23 ILE 81 HG23 ILE 81 12.082 -1.095 -5.889 1472 HD11 ILE 81 HD11 ILE 81 11.756 2.649 -7.081 1473 HD12 ILE 81 HD12 ILE 81 10.728 1.222 -6.947 1474 HD13 ILE 81 HD13 ILE 81 11.065 1.920 -8.531 1475 H ALA 82 HN ALA 82 13.006 2.021 -3.332 1476 HA ALA 82 HA ALA 82 15.380 2.280 -1.887 1477 HB1 ALA 82 HB1 ALA 82 14.053 1.885 0.095 1478 HB2 ALA 82 HB2 ALA 82 12.758 1.188 -0.879 1479 HB3 ALA 82 HB3 ALA 82 13.157 2.899 -1.036 1480 H GLY 83 HN GLY 83 13.402 -0.639 -2.410 1481 HA2 GLY 83 HA2 GLY 83 15.785 -2.265 -2.079 1482 HA3 GLY 83 HA1 GLY 83 14.539 -2.495 -0.859 1483 H GLU 84 HN GLU 84 15.286 -4.610 -2.343 1484 HA GLU 84 HA GLU 84 13.891 -5.039 -4.745 1485 HB2 GLU 84 HB2 GLU 84 15.777 -6.420 -3.978 1486 HB3 GLU 84 HB1 GLU 84 14.790 -7.042 -2.667 1487 HG2 GLU 84 HG2 GLU 84 13.329 -8.150 -4.223 1488 HG3 GLU 84 HG1 GLU 84 14.178 -7.423 -5.587 1489 H ASP 85 HN ASP 85 13.011 -5.500 -1.386 1490 HA ASP 85 HA ASP 85 10.583 -6.875 -1.791 1491 HB2 ASP 85 HB2 ASP 85 10.050 -5.967 0.535 1492 HB3 ASP 85 HB1 ASP 85 11.507 -6.943 0.389 1493 H VAL 86 HN VAL 86 11.370 -3.445 -1.532 1494 HA VAL 86 HA VAL 86 8.727 -2.462 -1.714 1495 HB VAL 86 HB VAL 86 11.262 -1.091 -2.629 1496 HG11 VAL 86 HG11 VAL 86 10.032 0.971 -2.198 1497 HG12 VAL 86 HG12 VAL 86 8.606 0.035 -1.751 1498 HG13 VAL 86 HG13 VAL 86 9.210 -0.015 -3.407 1499 HG21 VAL 86 HG21 VAL 86 11.475 -1.869 -0.322 1500 HG22 VAL 86 HG22 VAL 86 9.950 -1.085 0.090 1501 HG23 VAL 86 HG23 VAL 86 11.341 -0.113 -0.386 1502 H ALA 87 HN ALA 87 11.195 -3.205 -4.132 1503 HA ALA 87 HA ALA 87 9.827 -2.256 -6.399 1504 HB1 ALA 87 HB1 ALA 87 11.794 -4.536 -6.225 1505 HB2 ALA 87 HB2 ALA 87 12.215 -2.835 -6.400 1506 HB3 ALA 87 HB3 ALA 87 11.341 -3.664 -7.688 1507 H ARG 88 HN ARG 88 9.891 -5.449 -4.863 1508 HA ARG 88 HA ARG 88 8.143 -6.656 -6.747 1509 HB2 ARG 88 HB2 ARG 88 9.070 -7.452 -4.001 1510 HB3 ARG 88 HB1 ARG 88 7.890 -8.410 -4.888 1511 HG2 ARG 88 HG2 ARG 88 9.527 -8.601 -6.744 1512 HG3 ARG 88 HG1 ARG 88 10.707 -7.770 -5.731 1513 HD2 ARG 88 HD2 ARG 88 10.706 -9.538 -4.139 1514 HD3 ARG 88 HD1 ARG 88 9.310 -10.303 -4.903 1515 HE ARG 88 HE ARG 88 11.598 -10.025 -6.634 1516 HH11 ARG 88 HH11 ARG 88 10.052 -12.054 -4.229 1517 HH12 ARG 88 HH12 ARG 88 10.764 -13.523 -4.829 1518 HH21 ARG 88 HH21 ARG 88 12.548 -11.926 -7.404 1519 HH22 ARG 88 HH22 ARG 88 12.204 -13.452 -6.633 1520 H LEU 89 HN LEU 89 7.610 -4.699 -3.939 1521 HA LEU 89 HA LEU 89 4.907 -5.441 -3.489 1522 HB2 LEU 89 HB2 LEU 89 6.331 -4.191 -1.866 1523 HB3 LEU 89 HB1 LEU 89 6.250 -2.795 -2.916 1524 HG LEU 89 HG LEU 89 4.717 -2.894 -0.841 1525 HD11 LEU 89 HD11 LEU 89 4.551 -1.173 -2.551 1526 HD12 LEU 89 HD12 LEU 89 2.954 -1.663 -1.990 1527 HD13 LEU 89 HD13 LEU 89 3.557 -2.239 -3.545 1528 HD21 LEU 89 HD21 LEU 89 3.851 -5.136 -1.182 1529 HD22 LEU 89 HD22 LEU 89 3.150 -4.649 -2.727 1530 HD23 LEU 89 HD23 LEU 89 2.544 -3.954 -1.224 1531 H PHE 90 HN PHE 90 6.394 -2.773 -5.332 1532 HA PHE 90 HA PHE 90 3.954 -1.765 -6.346 1533 HB2 PHE 90 HB2 PHE 90 6.035 -0.448 -6.334 1534 HB3 PHE 90 HB1 PHE 90 6.732 -1.536 -7.530 1535 HD1 PHE 90 HD2 PHE 90 3.696 0.598 -7.061 1536 HD2 PHE 90 HD1 PHE 90 6.660 -0.892 -9.730 1537 HE1 PHE 90 HE2 PHE 90 2.774 1.995 -8.862 1538 HE2 PHE 90 HE1 PHE 90 5.742 0.504 -11.535 1539 HZ PHE 90 HZ PHE 90 3.796 1.951 -11.102 1540 H ALA 91 HN ALA 91 6.186 -4.233 -7.491 1541 HA ALA 91 HA ALA 91 4.940 -4.686 -9.993 1542 HB1 ALA 91 HB1 ALA 91 6.124 -6.829 -9.982 1543 HB2 ALA 91 HB2 ALA 91 6.528 -6.600 -8.280 1544 HB3 ALA 91 HB3 ALA 91 7.186 -5.507 -9.500 1545 H LEU 92 HN LEU 92 4.490 -6.102 -6.782 1546 HA LEU 92 HA LEU 92 2.644 -8.088 -7.507 1547 HB2 LEU 92 HB2 LEU 92 3.847 -8.049 -5.364 1548 HB3 LEU 92 HB1 LEU 92 2.930 -6.639 -4.876 1549 HG LEU 92 HG LEU 92 0.857 -7.977 -4.931 1550 HD11 LEU 92 HD11 LEU 92 1.524 -9.617 -6.609 1551 HD12 LEU 92 HD12 LEU 92 0.990 -10.408 -5.125 1552 HD13 LEU 92 HD13 LEU 92 2.712 -10.287 -5.490 1553 HD21 LEU 92 HD21 LEU 92 1.314 -9.294 -2.934 1554 HD22 LEU 92 HD22 LEU 92 2.115 -7.724 -2.848 1555 HD23 LEU 92 HD23 LEU 92 3.049 -9.170 -3.235 1556 H VAL 93 HN VAL 93 2.125 -4.762 -6.310 1557 HA VAL 93 HA VAL 93 -0.700 -4.957 -6.320 1558 HB VAL 93 HB VAL 93 -0.775 -2.545 -6.103 1559 HG11 VAL 93 HG11 VAL 93 -0.234 -3.827 -4.122 1560 HG12 VAL 93 HG12 VAL 93 0.601 -2.272 -4.100 1561 HG13 VAL 93 HG13 VAL 93 1.485 -3.741 -4.514 1562 HG21 VAL 93 HG21 VAL 93 0.897 -1.899 -7.735 1563 HG22 VAL 93 HG22 VAL 93 2.173 -2.579 -6.725 1564 HG23 VAL 93 HG23 VAL 93 1.262 -1.175 -6.169 1565 H GLN 94 HN GLN 94 1.626 -4.208 -8.803 1566 HA GLN 94 HA GLN 94 -0.203 -3.177 -10.720 1567 HB2 GLN 94 HB2 GLN 94 2.285 -2.917 -10.809 1568 HB3 GLN 94 HB1 GLN 94 2.410 -4.624 -11.205 1569 HG2 GLN 94 HG2 GLN 94 0.974 -4.148 -13.216 1570 HG3 GLN 94 HG1 GLN 94 1.181 -2.434 -12.853 1571 HE21 GLN 94 HE21 GLN 94 3.250 -1.517 -13.024 1572 HE22 GLN 94 HE22 GLN 94 4.503 -2.269 -13.950 1573 H VAL 95 HN VAL 95 1.215 -6.383 -10.174 1574 HA VAL 95 HA VAL 95 -0.117 -7.706 -12.269 1575 HB VAL 95 HB VAL 95 0.978 -8.833 -9.685 1576 HG11 VAL 95 HG11 VAL 95 0.206 -10.282 -12.218 1577 HG12 VAL 95 HG12 VAL 95 -0.658 -10.357 -10.681 1578 HG13 VAL 95 HG13 VAL 95 0.979 -10.999 -10.806 1579 HG21 VAL 95 HG21 VAL 95 2.171 -8.649 -12.449 1580 HG22 VAL 95 HG22 VAL 95 2.894 -9.491 -11.079 1581 HG23 VAL 95 HG23 VAL 95 2.677 -7.742 -11.025 1582 H VAL 96 HN VAL 96 -0.941 -7.419 -8.805 1583 HA VAL 96 HA VAL 96 -3.173 -9.128 -8.918 1584 HB VAL 96 HB VAL 96 -2.062 -8.475 -6.802 1585 HG11 VAL 96 HG11 VAL 96 -1.747 -6.105 -7.208 1586 HG12 VAL 96 HG12 VAL 96 -2.646 -6.365 -5.712 1587 HG13 VAL 96 HG13 VAL 96 -3.491 -5.851 -7.172 1588 HG21 VAL 96 HG21 VAL 96 -4.093 -8.314 -5.451 1589 HG22 VAL 96 HG22 VAL 96 -4.272 -9.488 -6.754 1590 HG23 VAL 96 HG23 VAL 96 -5.018 -7.897 -6.891 1591 H ALA 97 HN ALA 97 -2.864 -5.658 -9.461 1592 HA ALA 97 HA ALA 97 -5.619 -5.077 -9.610 1593 HB1 ALA 97 HB1 ALA 97 -3.353 -3.691 -11.037 1594 HB2 ALA 97 HB2 ALA 97 -3.867 -3.360 -9.383 1595 HB3 ALA 97 HB3 ALA 97 -4.959 -3.034 -10.729 1596 H ASP 98 HN ASP 98 -3.236 -5.778 -12.151 1597 HA ASP 98 HA ASP 98 -5.050 -5.641 -14.310 1598 HB2 ASP 98 HB2 ASP 98 -2.587 -5.460 -14.521 1599 HB3 ASP 98 HB1 ASP 98 -2.444 -7.167 -14.121 1600 H GLU 99 HN GLU 99 -4.051 -8.268 -12.207 1601 HA GLU 99 HA GLU 99 -5.149 -10.415 -13.666 1602 HB2 GLU 99 HB2 GLU 99 -3.501 -10.513 -11.737 1603 HB3 GLU 99 HB1 GLU 99 -4.859 -10.239 -10.661 1604 HG2 GLU 99 HG2 GLU 99 -4.736 -12.559 -12.569 1605 HG3 GLU 99 HG1 GLU 99 -4.085 -12.622 -10.935 1606 H HIS 100 HN HIS 100 -6.474 -8.401 -11.050 1607 HA HIS 100 HA HIS 100 -8.979 -9.790 -11.019 1608 HB2 HIS 100 HB2 HIS 100 -8.035 -7.237 -9.734 1609 HB3 HIS 100 HB1 HIS 100 -9.707 -7.770 -9.613 1610 HD1 HIS 100 HD1 HIS 100 -10.223 -9.286 -7.689 1611 HD2 HIS 100 HD2 HIS 100 -6.170 -9.265 -8.644 1612 HE1 HIS 100 HE1 HIS 100 -9.087 -10.644 -5.900 1613 HE2 HIS 100 HE2 HIS 100 -6.656 -10.732 -6.571 1614 H LEU 101 HN LEU 101 -7.689 -7.105 -12.797 1615 HA LEU 101 HA LEU 101 -10.069 -5.966 -13.741 1616 HB2 LEU 101 HB2 LEU 101 -7.368 -6.277 -15.048 1617 HB3 LEU 101 HB1 LEU 101 -8.689 -5.409 -15.803 1618 HG LEU 101 HG LEU 101 -7.404 -4.678 -13.170 1619 HD11 LEU 101 HD11 LEU 101 -5.911 -4.302 -15.057 1620 HD12 LEU 101 HD12 LEU 101 -6.496 -2.771 -14.402 1621 HD13 LEU 101 HD13 LEU 101 -7.180 -3.410 -15.898 1622 HD21 LEU 101 HD21 LEU 101 -8.716 -2.617 -13.386 1623 HD22 LEU 101 HD22 LEU 101 -9.747 -4.042 -13.250 1624 HD23 LEU 101 HD23 LEU 101 -9.503 -3.277 -14.820 1625 H GLU 102 HN GLU 102 -7.985 -8.227 -15.500 1626 HA GLU 102 HA GLU 102 -8.384 -9.683 -17.190 1627 HB2 GLU 102 HB2 GLU 102 -8.901 -11.008 -15.214 1628 HB3 GLU 102 HB1 GLU 102 -10.575 -10.480 -15.274 1629 HG2 GLU 102 HG2 GLU 102 -10.174 -12.773 -16.136 1630 HG3 GLU 102 HG1 GLU 102 -10.971 -11.691 -17.278 1631 H HIS 103 HN HIS 103 -11.818 -9.673 -16.433 1632 HA HIS 103 HA HIS 103 -12.361 -8.160 -18.872 1633 HB2 HIS 103 HB2 HIS 103 -12.268 -10.586 -19.470 1634 HB3 HIS 103 HB1 HIS 103 -13.569 -10.883 -18.328 1635 HD1 HIS 103 HD1 HIS 103 -12.866 -9.325 -21.678 1636 HD2 HIS 103 HD2 HIS 103 -16.109 -10.239 -19.233 1637 HE1 HIS 103 HE1 HIS 103 -14.914 -9.002 -23.107 1638 HE2 HIS 103 HE2 HIS 103 -16.852 -9.714 -21.655 1639 H HIS 104 HN HIS 104 -12.892 -6.642 -17.124 1640 HA HIS 104 HA HIS 104 -15.115 -7.127 -15.416 1641 HB2 HIS 104 HB2 HIS 104 -13.586 -4.661 -16.179 1642 HB3 HIS 104 HB1 HIS 104 -15.085 -4.524 -15.271 1643 HD1 HIS 104 HD1 HIS 104 -12.460 -3.589 -14.029 1644 HD2 HIS 104 HD2 HIS 104 -14.045 -7.405 -13.509 1645 HE1 HIS 104 HE1 HIS 104 -11.477 -4.450 -11.880 1646 HE2 HIS 104 HE2 HIS 104 -12.424 -6.766 -11.587 1647 H HIS 105 HN HIS 105 -16.720 -7.901 -16.734 1648 HA HIS 105 HA HIS 105 -18.526 -5.926 -17.743 1649 HB2 HIS 105 HB2 HIS 105 -16.965 -7.601 -19.662 1650 HB3 HIS 105 HB1 HIS 105 -18.685 -7.426 -19.974 1651 HD1 HIS 105 HD1 HIS 105 -19.485 -4.787 -20.093 1652 HD2 HIS 105 HD2 HIS 105 -15.468 -5.636 -20.759 1653 HE1 HIS 105 HE1 HIS 105 -18.564 -2.793 -21.320 1654 HE2 HIS 105 HE2 HIS 105 -16.205 -3.443 -21.911 1655 H HIS 106 HN HIS 106 -18.181 -9.188 -18.893 1656 HA HIS 106 HA HIS 106 -19.733 -10.513 -16.927 1657 HB2 HIS 106 HB2 HIS 106 -21.451 -9.106 -18.293 1658 HB3 HIS 106 HB1 HIS 106 -21.104 -10.219 -19.609 1659 HD1 HIS 106 HD1 HIS 106 -23.001 -11.810 -19.782 1660 HD2 HIS 106 HD2 HIS 106 -22.001 -10.978 -15.823 1661 HE1 HIS 106 HE1 HIS 106 -24.567 -13.187 -18.372 1662 HE2 HIS 106 HE2 HIS 106 -24.054 -12.541 -15.987 1663 H HIS 107 HN HIS 107 -20.125 -12.868 -17.842 1664 HA HIS 107 HA HIS 107 -17.797 -13.568 -19.391 1665 HB2 HIS 107 HB2 HIS 107 -20.062 -15.300 -18.377 1666 HB3 HIS 107 HB1 HIS 107 -18.621 -15.906 -19.186 1667 HD1 HIS 107 HD1 HIS 107 -16.349 -15.744 -17.843 1668 HD2 HIS 107 HD2 HIS 107 -19.752 -14.641 -15.714 1669 HE1 HIS 107 HE1 HIS 107 -15.641 -15.633 -15.432 1670 HE2 HIS 107 HE2 HIS 107 -17.712 -14.961 -14.161 1671 H HIS 108 HN HIS 108 -21.264 -14.270 -19.874 1672 HA HIS 108 HA HIS 108 -21.107 -13.093 -22.521 1673 HB2 HIS 108 HB2 HIS 108 -21.723 -16.001 -22.049 1674 HB3 HIS 108 HB1 HIS 108 -22.435 -15.145 -23.413 1675 HD1 HIS 108 HD1 HIS 108 -19.679 -17.216 -22.677 1676 HD2 HIS 108 HD2 HIS 108 -20.172 -13.759 -24.930 1677 HE1 HIS 108 HE1 HIS 108 -17.732 -17.163 -24.272 1678 HE2 HIS 108 HE2 HIS 108 -18.105 -15.111 -25.691 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 9.498 4.448 -28.102 2 H2 MET 1 HT2 MET 1 8.387 4.880 -26.901 3 H3 MET 1 HT3 MET 1 7.953 5.004 -28.533 4 HA MET 1 HA MET 1 8.100 2.618 -28.786 5 HB2 MET 1 HB2 MET 1 9.810 2.188 -27.103 6 HB3 MET 1 HB1 MET 1 8.723 2.711 -25.826 7 HG2 MET 1 HG2 MET 1 7.243 0.818 -26.354 8 HG3 MET 1 HG1 MET 1 8.405 0.278 -27.565 9 HE1 MET 1 HE1 MET 1 8.372 -2.095 -26.366 10 HE2 MET 1 HE2 MET 1 7.303 -1.522 -25.086 11 HE3 MET 1 HE3 MET 1 8.802 -2.352 -24.675 12 H ALA 2 HN ALA 2 6.008 3.196 -29.376 13 HA ALA 2 HA ALA 2 3.747 3.064 -29.293 14 HB1 ALA 2 HB1 ALA 2 4.031 1.015 -28.003 15 HB2 ALA 2 HB2 ALA 2 2.622 1.923 -27.452 16 HB3 ALA 2 HB3 ALA 2 4.114 1.954 -26.513 17 H GLY 3 HN GLY 3 5.070 4.304 -26.237 18 HA2 GLY 3 HA2 GLY 3 4.789 6.691 -25.781 19 HA3 GLY 3 HA1 GLY 3 3.167 6.554 -26.453 20 H GLN 4 HN GLN 4 4.294 7.333 -23.731 21 HA GLN 4 HA GLN 4 3.495 5.373 -21.865 22 HB2 GLN 4 HB2 GLN 4 3.770 8.371 -21.621 23 HB3 GLN 4 HB1 GLN 4 3.377 7.328 -20.261 24 HG2 GLN 4 HG2 GLN 4 5.491 6.112 -20.624 25 HG3 GLN 4 HG1 GLN 4 5.887 7.239 -21.921 26 HE21 GLN 4 HE21 GLN 4 7.263 6.678 -19.389 27 HE22 GLN 4 HE22 GLN 4 7.378 8.197 -18.571 28 H SER 5 HN SER 5 1.529 4.539 -21.936 29 HA SER 5 HA SER 5 -0.744 5.960 -22.872 30 HB2 SER 5 HB2 SER 5 -0.633 3.357 -21.331 31 HB3 SER 5 HB1 SER 5 -1.975 3.932 -22.325 32 HG SER 5 HG SER 5 0.474 3.821 -23.604 33 H ASP 6 HN ASP 6 -2.012 7.307 -21.799 34 HA ASP 6 HA ASP 6 -1.560 7.960 -19.073 35 HB2 ASP 6 HB2 ASP 6 -3.967 8.685 -20.758 36 HB3 ASP 6 HB1 ASP 6 -3.416 9.506 -19.303 37 H ARG 7 HN ARG 7 -3.279 5.500 -20.536 38 HA ARG 7 HA ARG 7 -5.450 5.122 -18.782 39 HB2 ARG 7 HB2 ARG 7 -5.182 4.072 -21.028 40 HB3 ARG 7 HB1 ARG 7 -3.917 3.052 -20.367 41 HG2 ARG 7 HG2 ARG 7 -5.468 1.916 -18.956 42 HG3 ARG 7 HG1 ARG 7 -6.753 3.060 -19.360 43 HD2 ARG 7 HD2 ARG 7 -6.730 2.319 -21.663 44 HD3 ARG 7 HD1 ARG 7 -5.374 1.245 -21.333 45 HE ARG 7 HE ARG 7 -6.993 0.086 -19.768 46 HH11 ARG 7 HH11 ARG 7 -8.084 1.862 -22.584 47 HH12 ARG 7 HH12 ARG 7 -9.439 0.817 -22.872 48 HH21 ARG 7 HH21 ARG 7 -8.778 -1.300 -20.153 49 HH22 ARG 7 HH22 ARG 7 -9.846 -0.971 -21.492 50 H LYS 8 HN LYS 8 -2.053 4.465 -18.503 51 HA LYS 8 HA LYS 8 -2.111 2.581 -16.413 52 HB2 LYS 8 HB2 LYS 8 -0.040 2.953 -17.540 53 HB3 LYS 8 HB1 LYS 8 -0.075 4.672 -17.178 54 HG2 LYS 8 HG2 LYS 8 0.351 4.268 -14.864 55 HG3 LYS 8 HG1 LYS 8 0.154 2.529 -15.079 56 HD2 LYS 8 HD2 LYS 8 2.286 4.139 -16.468 57 HD3 LYS 8 HD1 LYS 8 2.531 3.335 -14.914 58 HE2 LYS 8 HE2 LYS 8 1.924 1.193 -15.958 59 HE3 LYS 8 HE1 LYS 8 1.759 2.010 -17.509 60 HZ1 LYS 8 HZ1 LYS 8 4.248 1.749 -15.901 61 HZ2 LYS 8 HZ2 LYS 8 4.117 2.642 -17.334 62 HZ3 LYS 8 HZ3 LYS 8 3.905 0.962 -17.367 63 H ALA 9 HN ALA 9 -2.565 6.037 -16.470 64 HA ALA 9 HA ALA 9 -2.146 6.560 -13.736 65 HB1 ALA 9 HB1 ALA 9 -3.373 8.638 -14.128 66 HB2 ALA 9 HB2 ALA 9 -3.911 8.027 -15.694 67 HB3 ALA 9 HB3 ALA 9 -2.198 8.332 -15.406 68 H ALA 10 HN ALA 10 -4.874 5.276 -15.499 69 HA ALA 10 HA ALA 10 -6.816 5.581 -13.452 70 HB1 ALA 10 HB1 ALA 10 -8.105 3.908 -14.694 71 HB2 ALA 10 HB2 ALA 10 -6.693 3.556 -15.689 72 HB3 ALA 10 HB3 ALA 10 -7.453 5.147 -15.767 73 H LEU 11 HN LEU 11 -4.424 3.128 -14.219 74 HA LEU 11 HA LEU 11 -5.219 1.243 -12.248 75 HB2 LEU 11 HB2 LEU 11 -2.477 1.742 -13.422 76 HB3 LEU 11 HB1 LEU 11 -2.954 0.321 -12.516 77 HG LEU 11 HG LEU 11 -4.150 1.115 -15.171 78 HD11 LEU 11 HD11 LEU 11 -2.801 -0.707 -16.099 79 HD12 LEU 11 HD12 LEU 11 -2.037 -0.937 -14.527 80 HD13 LEU 11 HD13 LEU 11 -1.790 0.566 -15.415 81 HD21 LEU 11 HD21 LEU 11 -5.644 -0.232 -13.806 82 HD22 LEU 11 HD22 LEU 11 -4.357 -1.407 -13.528 83 HD23 LEU 11 HD23 LEU 11 -5.015 -1.187 -15.150 84 H LEU 12 HN LEU 12 -2.940 3.922 -12.328 85 HA LEU 12 HA LEU 12 -1.915 3.623 -9.729 86 HB2 LEU 12 HB2 LEU 12 -2.150 6.092 -11.451 87 HB3 LEU 12 HB1 LEU 12 -1.159 5.962 -10.008 88 HG LEU 12 HG LEU 12 -0.792 4.233 -12.455 89 HD11 LEU 12 HD11 LEU 12 0.778 6.668 -11.626 90 HD12 LEU 12 HD12 LEU 12 -0.351 6.585 -12.978 91 HD13 LEU 12 HD13 LEU 12 1.120 5.612 -12.999 92 HD21 LEU 12 HD21 LEU 12 0.012 3.259 -10.361 93 HD22 LEU 12 HD22 LEU 12 0.975 4.705 -10.057 94 HD23 LEU 12 HD23 LEU 12 1.344 3.674 -11.438 95 H ASP 13 HN ASP 13 -4.837 5.104 -10.944 96 HA ASP 13 HA ASP 13 -5.600 6.492 -8.602 97 HB2 ASP 13 HB2 ASP 13 -7.071 5.428 -10.976 98 HB3 ASP 13 HB1 ASP 13 -8.002 5.901 -9.562 99 H GLN 14 HN GLN 14 -6.378 3.211 -9.747 100 HA GLN 14 HA GLN 14 -7.974 2.669 -7.438 101 HB2 GLN 14 HB2 GLN 14 -8.130 0.374 -8.332 102 HB3 GLN 14 HB1 GLN 14 -8.552 1.609 -9.506 103 HG2 GLN 14 HG2 GLN 14 -6.282 1.384 -10.476 104 HG3 GLN 14 HG1 GLN 14 -5.981 0.052 -9.364 105 HE21 GLN 14 HE21 GLN 14 -9.080 0.638 -10.869 106 HE22 GLN 14 HE22 GLN 14 -9.064 -0.753 -11.887 107 H VAL 15 HN VAL 15 -4.614 2.024 -8.288 108 HA VAL 15 HA VAL 15 -4.181 0.273 -6.075 109 HB VAL 15 HB VAL 15 -1.797 0.571 -6.436 110 HG11 VAL 15 HG11 VAL 15 -2.943 -0.993 -7.871 111 HG12 VAL 15 HG12 VAL 15 -1.664 -0.185 -8.775 112 HG13 VAL 15 HG13 VAL 15 -3.346 0.294 -9.007 113 HG21 VAL 15 HG21 VAL 15 -2.558 2.708 -8.423 114 HG22 VAL 15 HG22 VAL 15 -0.937 2.058 -8.181 115 HG23 VAL 15 HG23 VAL 15 -1.727 2.955 -6.885 116 H ALA 16 HN ALA 16 -4.176 3.732 -6.525 117 HA ALA 16 HA ALA 16 -3.050 4.449 -4.031 118 HB1 ALA 16 HB1 ALA 16 -5.097 5.941 -5.669 119 HB2 ALA 16 HB2 ALA 16 -3.346 6.054 -5.863 120 HB3 ALA 16 HB3 ALA 16 -4.110 6.615 -4.375 121 H ARG 17 HN ARG 17 -6.292 3.589 -5.078 122 HA ARG 17 HA ARG 17 -7.711 4.230 -2.752 123 HB2 ARG 17 HB2 ARG 17 -8.759 3.603 -4.900 124 HB3 ARG 17 HB1 ARG 17 -8.199 1.952 -4.681 125 HG2 ARG 17 HG2 ARG 17 -9.600 1.728 -2.701 126 HG3 ARG 17 HG1 ARG 17 -10.143 3.395 -2.889 127 HD2 ARG 17 HD2 ARG 17 -10.576 1.144 -4.852 128 HD3 ARG 17 HD1 ARG 17 -11.793 1.848 -3.788 129 HE ARG 17 HE ARG 17 -10.457 3.619 -5.702 130 HH11 ARG 17 HH11 ARG 17 -13.304 1.777 -4.824 131 HH12 ARG 17 HH12 ARG 17 -14.371 2.686 -5.852 132 HH21 ARG 17 HH21 ARG 17 -11.845 4.785 -7.099 133 HH22 ARG 17 HH22 ARG 17 -13.537 4.372 -7.173 134 H VAL 18 HN VAL 18 -6.015 1.270 -3.697 135 HA VAL 18 HA VAL 18 -6.525 -0.256 -1.402 136 HB VAL 18 HB VAL 18 -3.998 -0.272 -3.072 137 HG11 VAL 18 HG11 VAL 18 -5.226 -2.393 -1.314 138 HG12 VAL 18 HG12 VAL 18 -3.752 -1.482 -0.978 139 HG13 VAL 18 HG13 VAL 18 -3.803 -2.606 -2.336 140 HG21 VAL 18 HG21 VAL 18 -6.573 -1.805 -3.440 141 HG22 VAL 18 HG22 VAL 18 -5.086 -2.078 -4.350 142 HG23 VAL 18 HG23 VAL 18 -5.943 -0.542 -4.497 143 H GLY 19 HN GLY 19 -3.914 2.032 -2.147 144 HA2 GLY 19 HA2 GLY 19 -2.510 1.820 0.275 145 HA3 GLY 19 HA1 GLY 19 -2.493 3.218 -0.791 146 H LYS 20 HN LYS 20 -5.284 3.820 -0.618 147 HA LYS 20 HA LYS 20 -5.328 5.427 1.701 148 HB2 LYS 20 HB2 LYS 20 -7.644 4.559 -0.038 149 HB3 LYS 20 HB1 LYS 20 -7.688 5.866 1.136 150 HG2 LYS 20 HG2 LYS 20 -6.029 7.098 -0.150 151 HG3 LYS 20 HG1 LYS 20 -5.942 5.777 -1.318 152 HD2 LYS 20 HD2 LYS 20 -8.401 6.105 -1.720 153 HD3 LYS 20 HD1 LYS 20 -8.300 7.558 -0.728 154 HE2 LYS 20 HE2 LYS 20 -6.700 7.049 -3.231 155 HE3 LYS 20 HE1 LYS 20 -8.161 8.030 -3.150 156 HZ1 LYS 20 HZ1 LYS 20 -6.282 9.463 -3.078 157 HZ2 LYS 20 HZ2 LYS 20 -5.558 8.575 -1.828 158 HZ3 LYS 20 HZ3 LYS 20 -6.972 9.467 -1.528 159 H ALA 21 HN ALA 21 -6.487 2.205 1.048 160 HA ALA 21 HA ALA 21 -7.975 1.967 3.497 161 HB1 ALA 21 HB1 ALA 21 -8.583 0.656 1.528 162 HB2 ALA 21 HB2 ALA 21 -8.188 -0.392 2.890 163 HB3 ALA 21 HB3 ALA 21 -7.023 -0.163 1.585 164 H LEU 22 HN LEU 22 -4.700 1.503 2.491 165 HA LEU 22 HA LEU 22 -4.026 0.000 4.907 166 HB2 LEU 22 HB2 LEU 22 -2.265 0.779 2.582 167 HB3 LEU 22 HB1 LEU 22 -1.842 -0.322 3.877 168 HG LEU 22 HG LEU 22 -3.987 -0.804 1.809 169 HD11 LEU 22 HD11 LEU 22 -2.449 -2.489 0.929 170 HD12 LEU 22 HD12 LEU 22 -1.230 -1.989 2.102 171 HD13 LEU 22 HD13 LEU 22 -1.757 -0.870 0.844 172 HD21 LEU 22 HD21 LEU 22 -4.010 -3.086 2.711 173 HD22 LEU 22 HD22 LEU 22 -4.514 -1.893 3.909 174 HD23 LEU 22 HD23 LEU 22 -2.893 -2.584 3.981 175 H ALA 23 HN ALA 23 -4.641 3.035 4.555 176 HA ALA 23 HA ALA 23 -2.120 4.288 5.179 177 HB1 ALA 23 HB1 ALA 23 -3.754 5.402 3.744 178 HB2 ALA 23 HB2 ALA 23 -3.364 6.369 5.167 179 HB3 ALA 23 HB3 ALA 23 -4.885 5.479 5.096 180 H ASN 24 HN ASN 24 -4.353 2.658 7.044 181 HA ASN 24 HA ASN 24 -3.332 3.971 9.452 182 HB2 ASN 24 HB2 ASN 24 -5.468 4.079 10.523 183 HB3 ASN 24 HB1 ASN 24 -5.656 4.830 8.945 184 HD21 ASN 24 HD21 ASN 24 -6.869 3.778 7.368 185 HD22 ASN 24 HD22 ASN 24 -7.934 2.467 7.736 186 H GLY 25 HN GLY 25 -2.954 2.596 11.172 187 HA2 GLY 25 HA2 GLY 25 -2.581 -0.141 10.298 188 HA3 GLY 25 HA1 GLY 25 -1.942 0.586 11.762 189 H ARG 26 HN ARG 26 -4.826 1.520 12.359 190 HA ARG 26 HA ARG 26 -5.313 -0.740 14.042 191 HB2 ARG 26 HB2 ARG 26 -6.763 1.873 13.706 192 HB3 ARG 26 HB1 ARG 26 -7.297 0.622 14.824 193 HG2 ARG 26 HG2 ARG 26 -5.078 0.706 15.914 194 HG3 ARG 26 HG1 ARG 26 -4.647 2.050 14.855 195 HD2 ARG 26 HD2 ARG 26 -6.390 3.410 15.799 196 HD3 ARG 26 HD1 ARG 26 -6.988 2.049 16.749 197 HE ARG 26 HE ARG 26 -4.266 2.536 17.348 198 HH11 ARG 26 HH11 ARG 26 -7.437 3.925 17.876 199 HH12 ARG 26 HH12 ARG 26 -7.026 4.598 19.418 200 HH21 ARG 26 HH21 ARG 26 -3.713 3.445 19.357 201 HH22 ARG 26 HH22 ARG 26 -4.904 4.333 20.266 202 H ARG 27 HN ARG 27 -6.653 0.316 10.999 203 HA ARG 27 HA ARG 27 -8.776 -1.659 11.155 204 HB2 ARG 27 HB2 ARG 27 -7.840 0.200 8.982 205 HB3 ARG 27 HB1 ARG 27 -8.996 -1.085 8.653 206 HG2 ARG 27 HG2 ARG 27 -10.521 -0.150 10.310 207 HG3 ARG 27 HG1 ARG 27 -9.364 1.140 10.651 208 HD2 ARG 27 HD2 ARG 27 -9.564 1.971 8.401 209 HD3 ARG 27 HD1 ARG 27 -10.586 0.608 7.951 210 HE ARG 27 HE ARG 27 -11.893 1.830 10.032 211 HH11 ARG 27 HH11 ARG 27 -10.723 2.837 6.890 212 HH12 ARG 27 HH12 ARG 27 -12.005 3.979 6.632 213 HH21 ARG 27 HH21 ARG 27 -13.586 3.325 9.700 214 HH22 ARG 27 HH22 ARG 27 -13.642 4.256 8.234 215 H LEU 28 HN LEU 28 -5.494 -1.459 10.150 216 HA LEU 28 HA LEU 28 -5.437 -3.740 8.462 217 HB2 LEU 28 HB2 LEU 28 -3.218 -2.528 10.115 218 HB3 LEU 28 HB1 LEU 28 -3.006 -3.701 8.830 219 HG LEU 28 HG LEU 28 -4.017 -0.874 8.518 220 HD11 LEU 28 HD11 LEU 28 -1.961 -0.551 7.234 221 HD12 LEU 28 HD12 LEU 28 -1.461 -2.195 7.630 222 HD13 LEU 28 HD13 LEU 28 -1.630 -0.993 8.908 223 HD21 LEU 28 HD21 LEU 28 -3.598 -3.021 6.446 224 HD22 LEU 28 HD22 LEU 28 -3.990 -1.334 6.113 225 HD23 LEU 28 HD23 LEU 28 -5.147 -2.357 6.963 226 H GLN 29 HN GLN 29 -5.557 -3.270 11.860 227 HA GLN 29 HA GLN 29 -4.630 -5.693 12.860 228 HB2 GLN 29 HB2 GLN 29 -6.997 -4.034 13.764 229 HB3 GLN 29 HB1 GLN 29 -6.295 -5.350 14.696 230 HG2 GLN 29 HG2 GLN 29 -4.180 -4.131 14.823 231 HG3 GLN 29 HG1 GLN 29 -4.880 -2.817 13.882 232 HE21 GLN 29 HE21 GLN 29 -7.462 -2.995 15.196 233 HE22 GLN 29 HE22 GLN 29 -7.253 -2.336 16.779 234 H ILE 30 HN ILE 30 -7.628 -4.882 11.255 235 HA ILE 30 HA ILE 30 -8.950 -7.347 11.784 236 HB ILE 30 HB ILE 30 -9.489 -5.330 9.598 237 HG12 ILE 30 HG12 ILE 30 -10.710 -5.591 12.360 238 HG13 ILE 30 HG11 ILE 30 -9.582 -4.337 11.858 239 HG21 ILE 30 HG21 ILE 30 -11.752 -6.295 9.595 240 HG22 ILE 30 HG22 ILE 30 -11.220 -7.514 10.754 241 HG23 ILE 30 HG23 ILE 30 -10.524 -7.474 9.133 242 HD11 ILE 30 HD11 ILE 30 -12.343 -4.770 10.739 243 HD12 ILE 30 HD12 ILE 30 -11.214 -3.506 10.252 244 HD13 ILE 30 HD13 ILE 30 -11.867 -3.521 11.889 245 H LEU 31 HN LEU 31 -7.082 -6.053 9.066 246 HA LEU 31 HA LEU 31 -7.403 -8.227 7.318 247 HB2 LEU 31 HB2 LEU 31 -5.203 -6.194 7.604 248 HB3 LEU 31 HB1 LEU 31 -5.202 -7.412 6.345 249 HG LEU 31 HG LEU 31 -7.350 -5.324 6.718 250 HD11 LEU 31 HD11 LEU 31 -5.085 -5.494 4.737 251 HD12 LEU 31 HD12 LEU 31 -5.268 -4.301 6.023 252 HD13 LEU 31 HD13 LEU 31 -6.408 -4.328 4.678 253 HD21 LEU 31 HD21 LEU 31 -8.181 -7.375 5.704 254 HD22 LEU 31 HD22 LEU 31 -6.868 -7.340 4.527 255 HD23 LEU 31 HD23 LEU 31 -8.101 -6.079 4.509 256 H ASP 32 HN ASP 32 -4.965 -7.540 9.773 257 HA ASP 32 HA ASP 32 -3.301 -9.753 9.286 258 HB2 ASP 32 HB2 ASP 32 -2.760 -7.713 10.670 259 HB3 ASP 32 HB1 ASP 32 -3.759 -8.393 11.948 260 H LEU 33 HN LEU 33 -6.190 -9.351 11.238 261 HA LEU 33 HA LEU 33 -6.057 -11.953 12.427 262 HB2 LEU 33 HB2 LEU 33 -7.202 -10.152 13.571 263 HB3 LEU 33 HB1 LEU 33 -8.296 -9.941 12.219 264 HG LEU 33 HG LEU 33 -8.304 -12.620 13.501 265 HD11 LEU 33 HD11 LEU 33 -9.772 -11.841 15.303 266 HD12 LEU 33 HD12 LEU 33 -9.475 -10.170 14.820 267 HD13 LEU 33 HD13 LEU 33 -8.154 -11.155 15.447 268 HD21 LEU 33 HD21 LEU 33 -10.460 -10.735 12.547 269 HD22 LEU 33 HD22 LEU 33 -10.710 -12.390 13.109 270 HD23 LEU 33 HD23 LEU 33 -9.787 -12.087 11.639 271 H LEU 34 HN LEU 34 -7.709 -10.530 9.646 272 HA LEU 34 HA LEU 34 -9.217 -12.897 9.072 273 HB2 LEU 34 HB2 LEU 34 -8.642 -10.442 7.426 274 HB3 LEU 34 HB1 LEU 34 -9.680 -11.748 6.890 275 HG LEU 34 HG LEU 34 -10.156 -9.969 9.286 276 HD11 LEU 34 HD11 LEU 34 -12.068 -9.162 8.014 277 HD12 LEU 34 HD12 LEU 34 -11.614 -10.195 6.660 278 HD13 LEU 34 HD13 LEU 34 -10.562 -8.867 7.146 279 HD21 LEU 34 HD21 LEU 34 -10.950 -12.230 9.710 280 HD22 LEU 34 HD22 LEU 34 -11.825 -12.223 8.179 281 HD23 LEU 34 HD23 LEU 34 -12.303 -11.125 9.474 282 H ALA 35 HN ALA 35 -5.989 -12.152 8.694 283 HA ALA 35 HA ALA 35 -5.378 -13.545 6.318 284 HB1 ALA 35 HB1 ALA 35 -3.681 -13.175 8.787 285 HB2 ALA 35 HB2 ALA 35 -3.771 -12.074 7.413 286 HB3 ALA 35 HB3 ALA 35 -3.103 -13.693 7.202 287 H GLN 36 HN GLN 36 -6.608 -14.634 9.264 288 HA GLN 36 HA GLN 36 -5.543 -17.312 9.119 289 HB2 GLN 36 HB2 GLN 36 -7.844 -16.202 10.733 290 HB3 GLN 36 HB1 GLN 36 -7.146 -17.801 10.928 291 HG2 GLN 36 HG2 GLN 36 -5.003 -16.751 11.551 292 HG3 GLN 36 HG1 GLN 36 -5.784 -15.171 11.448 293 HE21 GLN 36 HE21 GLN 36 -7.338 -14.605 12.994 294 HE22 GLN 36 HE22 GLN 36 -7.490 -15.455 14.499 295 H GLY 37 HN GLY 37 -8.135 -15.558 7.707 296 HA2 GLY 37 HA2 GLY 37 -9.054 -17.034 5.782 297 HA3 GLY 37 HA1 GLY 37 -9.645 -18.014 7.119 298 H GLU 38 HN GLU 38 -11.712 -17.666 7.588 299 HA GLU 38 HA GLU 38 -12.775 -14.960 7.133 300 HB2 GLU 38 HB2 GLU 38 -15.039 -16.240 7.009 301 HB3 GLU 38 HB1 GLU 38 -13.982 -16.187 5.611 302 HG2 GLU 38 HG2 GLU 38 -14.828 -18.390 5.802 303 HG3 GLU 38 HG1 GLU 38 -13.126 -18.429 6.249 304 H ARG 39 HN ARG 39 -14.072 -14.016 8.617 305 HA ARG 39 HA ARG 39 -14.793 -15.450 11.053 306 HB2 ARG 39 HB2 ARG 39 -13.092 -12.946 11.025 307 HB3 ARG 39 HB1 ARG 39 -13.945 -13.520 12.452 308 HG2 ARG 39 HG2 ARG 39 -11.865 -15.096 10.954 309 HG3 ARG 39 HG1 ARG 39 -11.556 -14.140 12.404 310 HD2 ARG 39 HD2 ARG 39 -12.663 -15.606 13.773 311 HD3 ARG 39 HD1 ARG 39 -13.736 -16.164 12.488 312 HE ARG 39 HE ARG 39 -11.687 -17.323 11.587 313 HH11 ARG 39 HH11 ARG 39 -12.069 -16.668 15.013 314 HH12 ARG 39 HH12 ARG 39 -11.089 -18.023 15.499 315 HH21 ARG 39 HH21 ARG 39 -10.436 -19.099 12.226 316 HH22 ARG 39 HH22 ARG 39 -10.135 -19.383 13.915 317 H ALA 40 HN ALA 40 -16.547 -14.515 12.154 318 HA ALA 40 HA ALA 40 -18.249 -12.905 10.475 319 HB1 ALA 40 HB1 ALA 40 -19.928 -13.217 12.200 320 HB2 ALA 40 HB2 ALA 40 -18.713 -13.880 13.292 321 HB3 ALA 40 HB3 ALA 40 -19.149 -14.755 11.824 322 H VAL 41 HN VAL 41 -19.183 -10.890 11.074 323 HA VAL 41 HA VAL 41 -17.446 -8.918 11.938 324 HB VAL 41 HB VAL 41 -20.460 -8.817 12.166 325 HG11 VAL 41 HG11 VAL 41 -19.378 -6.979 13.321 326 HG12 VAL 41 HG12 VAL 41 -20.167 -6.398 11.855 327 HG13 VAL 41 HG13 VAL 41 -18.417 -6.616 11.888 328 HG21 VAL 41 HG21 VAL 41 -19.827 -9.503 9.931 329 HG22 VAL 41 HG22 VAL 41 -18.682 -8.166 9.818 330 HG23 VAL 41 HG23 VAL 41 -20.413 -7.840 9.907 331 H GLU 42 HN GLU 42 -19.733 -10.836 13.780 332 HA GLU 42 HA GLU 42 -19.686 -9.508 16.226 333 HB2 GLU 42 HB2 GLU 42 -19.948 -12.467 15.647 334 HB3 GLU 42 HB1 GLU 42 -20.303 -11.714 17.197 335 HG2 GLU 42 HG2 GLU 42 -22.144 -10.550 16.342 336 HG3 GLU 42 HG1 GLU 42 -21.667 -10.847 14.672 337 H ALA 43 HN ALA 43 -17.593 -12.153 15.080 338 HA ALA 43 HA ALA 43 -16.017 -12.249 17.436 339 HB1 ALA 43 HB1 ALA 43 -16.209 -14.137 15.875 340 HB2 ALA 43 HB2 ALA 43 -14.530 -13.686 16.168 341 HB3 ALA 43 HB3 ALA 43 -15.319 -13.213 14.663 342 H ILE 44 HN ILE 44 -15.536 -10.756 14.253 343 HA ILE 44 HA ILE 44 -12.955 -9.775 14.611 344 HB ILE 44 HB ILE 44 -15.215 -8.552 13.021 345 HG12 ILE 44 HG12 ILE 44 -12.970 -10.389 12.163 346 HG13 ILE 44 HG11 ILE 44 -14.641 -10.883 12.412 347 HG21 ILE 44 HG21 ILE 44 -12.244 -8.067 12.830 348 HG22 ILE 44 HG22 ILE 44 -13.450 -6.923 13.423 349 HG23 ILE 44 HG23 ILE 44 -13.467 -7.423 11.732 350 HD11 ILE 44 HD11 ILE 44 -13.670 -8.911 10.356 351 HD12 ILE 44 HD12 ILE 44 -15.346 -9.401 10.609 352 HD13 ILE 44 HD13 ILE 44 -14.156 -10.581 10.059 353 H ALA 45 HN ALA 45 -16.062 -8.212 15.305 354 HA ALA 45 HA ALA 45 -15.042 -5.767 16.234 355 HB1 ALA 45 HB1 ALA 45 -17.612 -7.156 16.993 356 HB2 ALA 45 HB2 ALA 45 -17.382 -6.072 15.619 357 HB3 ALA 45 HB3 ALA 45 -17.240 -5.454 17.266 358 H THR 46 HN THR 46 -15.929 -8.721 17.983 359 HA THR 46 HA THR 46 -15.459 -7.733 20.569 360 HB THR 46 HB THR 46 -15.259 -10.596 19.606 361 HG1 THR 46 HG1 THR 46 -17.300 -9.922 19.106 362 HG21 THR 46 HG21 THR 46 -15.813 -9.462 22.350 363 HG22 THR 46 HG22 THR 46 -14.331 -10.275 21.850 364 HG23 THR 46 HG23 THR 46 -15.850 -11.170 21.915 365 H ALA 47 HN ALA 47 -13.330 -9.399 18.274 366 HA ALA 47 HA ALA 47 -11.192 -9.776 20.101 367 HB1 ALA 47 HB1 ALA 47 -9.884 -10.423 18.171 368 HB2 ALA 47 HB2 ALA 47 -11.097 -9.738 17.090 369 HB3 ALA 47 HB3 ALA 47 -11.492 -11.140 18.083 370 H THR 48 HN THR 48 -12.104 -7.119 18.030 371 HA THR 48 HA THR 48 -9.528 -5.816 18.499 372 HB THR 48 HB THR 48 -10.519 -4.025 16.966 373 HG1 THR 48 HG1 THR 48 -12.303 -6.120 16.228 374 HG21 THR 48 HG21 THR 48 -8.829 -5.568 16.180 375 HG22 THR 48 HG22 THR 48 -10.057 -5.361 14.932 376 HG23 THR 48 HG23 THR 48 -10.046 -6.819 15.923 377 H GLY 49 HN GLY 49 -12.421 -6.060 20.048 378 HA2 GLY 49 HA2 GLY 49 -13.276 -4.911 21.845 379 HA3 GLY 49 HA1 GLY 49 -11.868 -3.864 21.775 380 H MET 50 HN MET 50 -14.151 -4.381 19.150 381 HA MET 50 HA MET 50 -15.136 -1.626 19.526 382 HB2 MET 50 HB2 MET 50 -14.378 -3.017 16.949 383 HB3 MET 50 HB1 MET 50 -15.332 -1.542 16.997 384 HG2 MET 50 HG2 MET 50 -13.473 -0.413 18.161 385 HG3 MET 50 HG1 MET 50 -12.517 -1.884 18.003 386 HE1 MET 50 HE1 MET 50 -13.129 -2.957 15.107 387 HE2 MET 50 HE2 MET 50 -11.511 -2.783 15.786 388 HE3 MET 50 HE3 MET 50 -11.869 -2.132 14.186 389 H ASN 51 HN ASN 51 -17.212 -1.355 18.041 390 HA ASN 51 HA ASN 51 -19.000 -3.531 18.806 391 HB2 ASN 51 HB2 ASN 51 -19.457 -0.695 17.897 392 HB3 ASN 51 HB1 ASN 51 -20.769 -1.869 17.891 393 HD21 ASN 51 HD21 ASN 51 -18.701 0.091 19.830 394 HD22 ASN 51 HD22 ASN 51 -19.471 -0.220 21.344 395 H LEU 52 HN LEU 52 -20.707 -4.186 17.227 396 HA LEU 52 HA LEU 52 -19.511 -5.239 14.908 397 HB2 LEU 52 HB2 LEU 52 -22.314 -5.062 15.916 398 HB3 LEU 52 HB1 LEU 52 -22.052 -5.540 14.252 399 HG LEU 52 HG LEU 52 -20.627 -7.414 15.053 400 HD11 LEU 52 HD11 LEU 52 -20.725 -8.052 17.408 401 HD12 LEU 52 HD12 LEU 52 -21.596 -6.563 17.775 402 HD13 LEU 52 HD13 LEU 52 -19.934 -6.492 17.192 403 HD21 LEU 52 HD21 LEU 52 -22.494 -8.772 15.911 404 HD22 LEU 52 HD22 LEU 52 -22.937 -7.813 14.500 405 HD23 LEU 52 HD23 LEU 52 -23.446 -7.300 16.109 406 H THR 53 HN THR 53 -21.559 -2.416 15.406 407 HA THR 53 HA THR 53 -21.889 -1.698 12.714 408 HB THR 53 HB THR 53 -22.182 0.651 13.704 409 HG1 THR 53 HG1 THR 53 -22.453 0.550 16.057 410 HG21 THR 53 HG21 THR 53 -23.832 -1.625 14.809 411 HG22 THR 53 HG22 THR 53 -24.068 -0.838 13.247 412 HG23 THR 53 HG23 THR 53 -24.331 0.066 14.739 413 H THR 54 HN THR 54 -19.493 -0.727 15.126 414 HA THR 54 HA THR 54 -17.957 0.978 13.529 415 HB THR 54 HB THR 54 -16.801 -0.778 15.692 416 HG1 THR 54 HG1 THR 54 -18.561 1.450 15.909 417 HG21 THR 54 HG21 THR 54 -15.239 0.667 14.505 418 HG22 THR 54 HG22 THR 54 -15.460 1.227 16.163 419 HG23 THR 54 HG23 THR 54 -16.261 2.065 14.834 420 H ALA 55 HN ALA 55 -17.621 -2.496 14.209 421 HA ALA 55 HA ALA 55 -15.305 -2.929 12.694 422 HB1 ALA 55 HB1 ALA 55 -15.865 -5.285 12.787 423 HB2 ALA 55 HB2 ALA 55 -17.514 -4.893 13.279 424 HB3 ALA 55 HB3 ALA 55 -16.162 -4.522 14.349 425 H SER 56 HN SER 56 -18.735 -3.239 11.805 426 HA SER 56 HA SER 56 -18.305 -4.267 9.228 427 HB2 SER 56 HB2 SER 56 -20.487 -4.308 10.440 428 HB3 SER 56 HB1 SER 56 -20.643 -2.576 10.149 429 HG SER 56 HG SER 56 -20.627 -3.023 7.910 430 H ALA 57 HN ALA 57 -18.439 -0.951 10.425 431 HA ALA 57 HA ALA 57 -18.462 0.318 7.893 432 HB1 ALA 57 HB1 ALA 57 -19.062 1.501 9.941 433 HB2 ALA 57 HB2 ALA 57 -17.746 2.322 9.099 434 HB3 ALA 57 HB3 ALA 57 -17.406 1.341 10.526 435 H ASN 58 HN ASN 58 -15.864 -0.640 10.083 436 HA ASN 58 HA ASN 58 -13.718 0.338 8.514 437 HB2 ASN 58 HB2 ASN 58 -13.785 -1.908 10.545 438 HB3 ASN 58 HB1 ASN 58 -12.319 -1.200 9.882 439 HD21 ASN 58 HD21 ASN 58 -13.236 -1.337 12.632 440 HD22 ASN 58 HD22 ASN 58 -13.318 0.291 13.198 441 H LEU 59 HN LEU 59 -15.350 -2.778 8.710 442 HA LEU 59 HA LEU 59 -13.726 -4.192 6.905 443 HB2 LEU 59 HB2 LEU 59 -16.615 -4.528 7.697 444 HB3 LEU 59 HB1 LEU 59 -15.764 -5.663 6.666 445 HG LEU 59 HG LEU 59 -14.869 -4.983 9.465 446 HD11 LEU 59 HD11 LEU 59 -16.509 -7.330 8.517 447 HD12 LEU 59 HD12 LEU 59 -17.089 -6.008 9.530 448 HD13 LEU 59 HD13 LEU 59 -15.853 -7.109 10.139 449 HD21 LEU 59 HD21 LEU 59 -13.560 -7.030 9.226 450 HD22 LEU 59 HD22 LEU 59 -13.135 -5.848 7.987 451 HD23 LEU 59 HD23 LEU 59 -14.161 -7.226 7.579 452 H GLN 60 HN GLN 60 -16.530 -2.117 6.433 453 HA GLN 60 HA GLN 60 -16.967 -2.656 3.708 454 HB2 GLN 60 HB2 GLN 60 -18.557 -1.450 5.176 455 HB3 GLN 60 HB1 GLN 60 -17.459 -0.079 5.212 456 HG2 GLN 60 HG2 GLN 60 -17.724 0.196 2.799 457 HG3 GLN 60 HG1 GLN 60 -18.830 -1.178 2.769 458 HE21 GLN 60 HE21 GLN 60 -19.296 1.569 1.985 459 HE22 GLN 60 HE22 GLN 60 -20.611 2.141 2.960 460 H ALA 61 HN ALA 61 -14.850 -0.362 5.356 461 HA ALA 61 HA ALA 61 -13.916 1.001 3.076 462 HB1 ALA 61 HB1 ALA 61 -13.568 1.774 5.394 463 HB2 ALA 61 HB2 ALA 61 -12.073 1.733 4.463 464 HB3 ALA 61 HB3 ALA 61 -12.415 0.463 5.637 465 H LEU 62 HN LEU 62 -12.690 -1.855 4.773 466 HA LEU 62 HA LEU 62 -10.458 -2.287 3.094 467 HB2 LEU 62 HB2 LEU 62 -12.015 -4.292 4.732 468 HB3 LEU 62 HB1 LEU 62 -10.412 -4.539 4.065 469 HG LEU 62 HG LEU 62 -11.121 -2.487 6.165 470 HD11 LEU 62 HD11 LEU 62 -9.682 -5.128 6.381 471 HD12 LEU 62 HD12 LEU 62 -11.269 -4.739 7.049 472 HD13 LEU 62 HD13 LEU 62 -9.827 -3.935 7.672 473 HD21 LEU 62 HD21 LEU 62 -8.451 -3.320 5.039 474 HD22 LEU 62 HD22 LEU 62 -8.709 -2.182 6.362 475 HD23 LEU 62 HD23 LEU 62 -9.268 -1.786 4.737 476 H LYS 63 HN LYS 63 -13.818 -3.261 2.916 477 HA LYS 63 HA LYS 63 -13.538 -5.111 0.785 478 HB2 LYS 63 HB2 LYS 63 -15.533 -4.928 2.296 479 HB3 LYS 63 HB1 LYS 63 -15.963 -3.438 1.470 480 HG2 LYS 63 HG2 LYS 63 -16.074 -4.740 -0.656 481 HG3 LYS 63 HG1 LYS 63 -15.848 -6.205 0.300 482 HD2 LYS 63 HD2 LYS 63 -18.127 -4.239 0.508 483 HD3 LYS 63 HD1 LYS 63 -18.201 -5.885 -0.123 484 HE2 LYS 63 HE2 LYS 63 -17.557 -6.727 2.109 485 HE3 LYS 63 HE1 LYS 63 -17.590 -5.072 2.718 486 HZ1 LYS 63 HZ1 LYS 63 -19.964 -4.998 1.989 487 HZ2 LYS 63 HZ2 LYS 63 -19.649 -6.073 3.259 488 HZ3 LYS 63 HZ3 LYS 63 -19.869 -6.665 1.681 489 H SER 64 HN SER 64 -14.228 -1.645 0.929 490 HA SER 64 HA SER 64 -14.643 -1.309 -1.857 491 HB2 SER 64 HB2 SER 64 -15.424 0.282 -0.092 492 HB3 SER 64 HB1 SER 64 -13.748 0.775 0.151 493 HG SER 64 HG SER 64 -15.037 0.893 -2.377 494 H GLY 65 HN GLY 65 -11.804 -1.235 0.200 495 HA2 GLY 65 HA2 GLY 65 -10.032 -0.192 -1.785 496 HA3 GLY 65 HA1 GLY 65 -9.567 -0.988 -0.289 497 H GLY 66 HN GLY 66 -11.431 -3.265 -1.272 498 HA2 GLY 66 HA2 GLY 66 -11.292 -5.062 -2.773 499 HA3 GLY 66 HA1 GLY 66 -9.829 -4.356 -3.445 500 H LEU 67 HN LEU 67 -10.242 -4.748 -0.014 501 HA LEU 67 HA LEU 67 -7.986 -6.596 0.007 502 HB2 LEU 67 HB2 LEU 67 -9.382 -5.090 2.220 503 HB3 LEU 67 HB1 LEU 67 -8.117 -6.262 2.511 504 HG LEU 67 HG LEU 67 -7.107 -4.134 2.653 505 HD11 LEU 67 HD11 LEU 67 -6.501 -5.272 -0.065 506 HD12 LEU 67 HD12 LEU 67 -5.762 -5.748 1.464 507 HD13 LEU 67 HD13 LEU 67 -5.490 -4.128 0.818 508 HD21 LEU 67 HD21 LEU 67 -7.245 -2.432 0.923 509 HD22 LEU 67 HD22 LEU 67 -8.841 -2.822 1.562 510 HD23 LEU 67 HD23 LEU 67 -8.339 -3.452 -0.009 511 H VAL 68 HN VAL 68 -11.277 -6.388 1.364 512 HA VAL 68 HA VAL 68 -11.235 -9.319 1.624 513 HB VAL 68 HB VAL 68 -12.556 -9.147 3.687 514 HG11 VAL 68 HG11 VAL 68 -9.967 -7.608 3.798 515 HG12 VAL 68 HG12 VAL 68 -10.131 -9.363 3.835 516 HG13 VAL 68 HG13 VAL 68 -10.760 -8.389 5.164 517 HG21 VAL 68 HG21 VAL 68 -12.073 -6.177 3.440 518 HG22 VAL 68 HG22 VAL 68 -12.762 -6.986 4.848 519 HG23 VAL 68 HG23 VAL 68 -13.630 -6.997 3.312 520 H GLU 69 HN GLU 69 -13.270 -10.362 1.610 521 HA GLU 69 HA GLU 69 -15.434 -8.833 0.319 522 HB2 GLU 69 HB2 GLU 69 -16.134 -11.134 -0.562 523 HB3 GLU 69 HB1 GLU 69 -14.712 -10.405 -1.292 524 HG2 GLU 69 HG2 GLU 69 -13.253 -11.829 -0.099 525 HG3 GLU 69 HG1 GLU 69 -14.548 -12.399 0.944 526 H ALA 70 HN ALA 70 -17.622 -10.080 0.703 527 HA ALA 70 HA ALA 70 -17.710 -10.973 3.508 528 HB1 ALA 70 HB1 ALA 70 -19.708 -9.637 3.890 529 HB2 ALA 70 HB2 ALA 70 -19.605 -8.999 2.250 530 HB3 ALA 70 HB3 ALA 70 -18.346 -8.617 3.424 531 H ARG 71 HN ARG 71 -18.920 -12.698 3.875 532 HA ARG 71 HA ARG 71 -20.829 -13.559 1.797 533 HB2 ARG 71 HB2 ARG 71 -18.915 -15.036 1.751 534 HB3 ARG 71 HB1 ARG 71 -18.971 -15.235 3.498 535 HG2 ARG 71 HG2 ARG 71 -21.108 -16.395 3.303 536 HG3 ARG 71 HG1 ARG 71 -21.066 -16.181 1.554 537 HD2 ARG 71 HD2 ARG 71 -19.000 -17.680 3.157 538 HD3 ARG 71 HD1 ARG 71 -20.333 -18.430 2.281 539 HE ARG 71 HE ARG 71 -19.003 -16.874 0.427 540 HH11 ARG 71 HH11 ARG 71 -18.186 -19.534 2.562 541 HH12 ARG 71 HH12 ARG 71 -17.006 -20.216 1.475 542 HH21 ARG 71 HH21 ARG 71 -17.440 -17.755 -1.008 543 HH22 ARG 71 HH22 ARG 71 -16.561 -19.180 -0.545 544 H ARG 72 HN ARG 72 -22.875 -13.827 2.505 545 HA ARG 72 HA ARG 72 -23.380 -13.617 5.358 546 HB2 ARG 72 HB2 ARG 72 -24.726 -12.323 3.697 547 HB3 ARG 72 HB1 ARG 72 -25.383 -13.845 3.112 548 HG2 ARG 72 HG2 ARG 72 -26.388 -14.286 5.263 549 HG3 ARG 72 HG1 ARG 72 -25.649 -12.831 5.933 550 HD2 ARG 72 HD2 ARG 72 -27.690 -12.940 3.718 551 HD3 ARG 72 HD1 ARG 72 -27.984 -12.439 5.384 552 HE ARG 72 HE ARG 72 -26.106 -10.705 4.706 553 HH11 ARG 72 HH11 ARG 72 -28.897 -11.791 2.891 554 HH12 ARG 72 HH12 ARG 72 -29.054 -10.303 2.002 555 HH21 ARG 72 HH21 ARG 72 -26.305 -8.752 3.546 556 HH22 ARG 72 HH22 ARG 72 -27.584 -8.570 2.383 557 H GLU 73 HN GLU 73 -23.019 -15.453 6.397 558 HA GLU 73 HA GLU 73 -24.068 -17.938 5.240 559 HB2 GLU 73 HB2 GLU 73 -21.574 -17.678 5.781 560 HB3 GLU 73 HB1 GLU 73 -22.048 -17.716 7.470 561 HG2 GLU 73 HG2 GLU 73 -22.811 -19.912 5.581 562 HG3 GLU 73 HG1 GLU 73 -21.243 -19.881 6.382 563 H GLY 74 HN GLY 74 -25.934 -18.534 6.055 564 HA2 GLY 74 HA2 GLY 74 -27.618 -18.948 7.571 565 HA3 GLY 74 HA1 GLY 74 -26.469 -18.601 8.858 566 H THR 75 HN THR 75 -26.613 -16.727 9.917 567 HA THR 75 HA THR 75 -28.415 -14.672 8.807 568 HB THR 75 HB THR 75 -27.884 -15.201 11.739 569 HG1 THR 75 HG1 THR 75 -30.074 -15.953 10.058 570 HG21 THR 75 HG21 THR 75 -28.560 -12.896 11.228 571 HG22 THR 75 HG22 THR 75 -29.830 -13.759 12.098 572 HG23 THR 75 HG23 THR 75 -29.968 -13.503 10.358 573 H ARG 76 HN ARG 76 -25.240 -15.391 9.775 574 HA ARG 76 HA ARG 76 -24.697 -12.573 10.406 575 HB2 ARG 76 HB2 ARG 76 -22.504 -13.513 11.322 576 HB3 ARG 76 HB1 ARG 76 -23.975 -13.824 12.233 577 HG2 ARG 76 HG2 ARG 76 -24.084 -16.074 11.322 578 HG3 ARG 76 HG1 ARG 76 -22.643 -15.762 10.351 579 HD2 ARG 76 HD2 ARG 76 -22.231 -17.029 12.471 580 HD3 ARG 76 HD1 ARG 76 -21.284 -15.553 12.289 581 HE ARG 76 HE ARG 76 -22.828 -14.476 13.850 582 HH11 ARG 76 HH11 ARG 76 -22.872 -17.975 13.718 583 HH12 ARG 76 HH12 ARG 76 -23.478 -18.157 15.337 584 HH21 ARG 76 HH21 ARG 76 -23.600 -14.697 15.969 585 HH22 ARG 76 HH22 ARG 76 -23.896 -16.284 16.624 586 H GLN 77 HN GLN 77 -22.825 -11.579 9.627 587 HA GLN 77 HA GLN 77 -22.180 -12.414 6.902 588 HB2 GLN 77 HB2 GLN 77 -21.809 -9.775 8.341 589 HB3 GLN 77 HB1 GLN 77 -21.317 -10.076 6.680 590 HG2 GLN 77 HG2 GLN 77 -24.141 -10.603 7.453 591 HG3 GLN 77 HG1 GLN 77 -23.614 -8.935 7.244 592 HE21 GLN 77 HE21 GLN 77 -22.138 -11.429 5.362 593 HE22 GLN 77 HE22 GLN 77 -22.892 -11.031 3.854 594 H TYR 78 HN TYR 78 -20.369 -13.493 6.611 595 HA TYR 78 HA TYR 78 -18.157 -13.185 8.502 596 HB2 TYR 78 HB2 TYR 78 -18.742 -15.200 6.336 597 HB3 TYR 78 HB1 TYR 78 -17.175 -15.107 7.130 598 HD1 TYR 78 HD1 TYR 78 -20.709 -15.989 7.540 599 HD2 TYR 78 HD2 TYR 78 -16.897 -15.827 9.417 600 HE1 TYR 78 HE1 TYR 78 -21.537 -17.452 9.333 601 HE2 TYR 78 HE2 TYR 78 -17.714 -17.289 11.216 602 HH TYR 78 HH TYR 78 -20.510 -19.075 11.001 603 H TYR 79 HN TYR 79 -16.321 -12.177 8.006 604 HA TYR 79 HA TYR 79 -16.025 -11.232 5.242 605 HB2 TYR 79 HB2 TYR 79 -15.287 -10.026 7.872 606 HB3 TYR 79 HB1 TYR 79 -14.321 -9.627 6.455 607 HD1 TYR 79 HD1 TYR 79 -17.803 -9.593 7.767 608 HD2 TYR 79 HD2 TYR 79 -15.062 -8.039 4.907 609 HE1 TYR 79 HE1 TYR 79 -19.476 -7.925 7.081 610 HE2 TYR 79 HE2 TYR 79 -16.725 -6.366 4.216 611 HH TYR 79 HH TYR 79 -19.535 -5.704 5.987 612 H ARG 80 HN ARG 80 -14.171 -11.557 4.152 613 HA ARG 80 HA ARG 80 -11.982 -13.028 5.392 614 HB2 ARG 80 HB2 ARG 80 -13.511 -14.804 4.725 615 HB3 ARG 80 HB1 ARG 80 -13.666 -14.106 3.119 616 HG2 ARG 80 HG2 ARG 80 -11.240 -14.541 2.768 617 HG3 ARG 80 HG1 ARG 80 -11.224 -15.391 4.315 618 HD2 ARG 80 HD2 ARG 80 -11.464 -16.952 2.456 619 HD3 ARG 80 HD1 ARG 80 -12.894 -16.959 3.485 620 HE ARG 80 HE ARG 80 -13.402 -15.149 1.453 621 HH11 ARG 80 HH11 ARG 80 -12.681 -18.569 1.706 622 HH12 ARG 80 HH12 ARG 80 -13.622 -18.994 0.303 623 HH21 ARG 80 HH21 ARG 80 -14.638 -15.700 -0.399 624 HH22 ARG 80 HH22 ARG 80 -14.714 -17.369 -0.895 625 H ILE 81 HN ILE 81 -10.040 -12.749 4.267 626 HA ILE 81 HA ILE 81 -9.820 -10.635 2.418 627 HB ILE 81 HB ILE 81 -7.886 -12.924 2.854 628 HG12 ILE 81 HG12 ILE 81 -8.059 -10.197 4.158 629 HG13 ILE 81 HG11 ILE 81 -8.390 -11.740 4.938 630 HG21 ILE 81 HG21 ILE 81 -6.196 -11.363 1.992 631 HG22 ILE 81 HG22 ILE 81 -7.466 -10.188 1.655 632 HG23 ILE 81 HG23 ILE 81 -7.435 -11.724 0.789 633 HD11 ILE 81 HD11 ILE 81 -6.207 -10.891 5.560 634 HD12 ILE 81 HD12 ILE 81 -5.730 -10.832 3.863 635 HD13 ILE 81 HD13 ILE 81 -6.055 -12.385 4.634 636 H ALA 82 HN ALA 82 -9.970 -10.580 0.232 637 HA ALA 82 HA ALA 82 -11.574 -12.635 -0.909 638 HB1 ALA 82 HB1 ALA 82 -11.637 -11.195 -2.884 639 HB2 ALA 82 HB2 ALA 82 -10.384 -10.177 -2.171 640 HB3 ALA 82 HB3 ALA 82 -11.966 -10.303 -1.399 641 H GLY 83 HN GLY 83 -8.233 -12.337 -0.710 642 HA2 GLY 83 HA2 GLY 83 -7.826 -14.640 -2.330 643 HA3 GLY 83 HA1 GLY 83 -7.263 -13.190 -3.150 644 H GLU 84 HN GLU 84 -5.718 -15.489 -2.159 645 HA GLU 84 HA GLU 84 -4.405 -14.737 0.242 646 HB2 GLU 84 HB2 GLU 84 -4.436 -17.066 -0.663 647 HB3 GLU 84 HB1 GLU 84 -3.334 -16.544 -1.932 648 HG2 GLU 84 HG2 GLU 84 -1.691 -15.916 -0.217 649 HG3 GLU 84 HG1 GLU 84 -2.785 -16.517 1.028 650 H ASP 85 HN ASP 85 -3.866 -14.027 -3.154 651 HA ASP 85 HA ASP 85 -1.363 -12.840 -3.077 652 HB2 ASP 85 HB2 ASP 85 -3.842 -12.050 -4.611 653 HB3 ASP 85 HB1 ASP 85 -2.300 -11.232 -4.829 654 H VAL 86 HN VAL 86 -4.484 -11.480 -2.164 655 HA VAL 86 HA VAL 86 -3.569 -8.878 -1.571 656 HB VAL 86 HB VAL 86 -5.979 -10.331 -0.453 657 HG11 VAL 86 HG11 VAL 86 -6.882 -8.052 -0.122 658 HG12 VAL 86 HG12 VAL 86 -5.311 -7.394 -0.588 659 HG13 VAL 86 HG13 VAL 86 -5.459 -8.382 0.865 660 HG21 VAL 86 HG21 VAL 86 -7.227 -9.191 -2.240 661 HG22 VAL 86 HG22 VAL 86 -6.021 -10.308 -2.876 662 HG23 VAL 86 HG23 VAL 86 -5.709 -8.573 -2.891 663 H ALA 87 HN ALA 87 -4.089 -11.749 0.449 664 HA ALA 87 HA ALA 87 -3.326 -10.586 2.901 665 HB1 ALA 87 HB1 ALA 87 -3.120 -13.477 2.059 666 HB2 ALA 87 HB2 ALA 87 -4.554 -12.703 2.733 667 HB3 ALA 87 HB3 ALA 87 -3.099 -12.865 3.715 668 H ARG 88 HN ARG 88 -1.494 -12.308 0.425 669 HA ARG 88 HA ARG 88 0.973 -12.376 1.789 670 HB2 ARG 88 HB2 ARG 88 0.268 -12.511 -1.135 671 HB3 ARG 88 HB1 ARG 88 1.919 -12.656 -0.552 672 HG2 ARG 88 HG2 ARG 88 1.478 -14.674 0.545 673 HG3 ARG 88 HG1 ARG 88 -0.268 -14.437 0.465 674 HD2 ARG 88 HD2 ARG 88 0.532 -16.127 -1.135 675 HD3 ARG 88 HD1 ARG 88 -0.245 -14.757 -1.925 676 HE ARG 88 HE ARG 88 2.692 -15.012 -1.741 677 HH11 ARG 88 HH11 ARG 88 -0.241 -14.427 -3.553 678 HH12 ARG 88 HH12 ARG 88 0.582 -14.045 -5.031 679 HH21 ARG 88 HH21 ARG 88 3.798 -14.520 -3.698 680 HH22 ARG 88 HH22 ARG 88 2.879 -14.090 -5.110 681 H LEU 89 HN LEU 89 -0.521 -9.969 -0.300 682 HA LEU 89 HA LEU 89 1.704 -8.285 -0.626 683 HB2 LEU 89 HB2 LEU 89 -0.515 -8.189 -1.838 684 HB3 LEU 89 HB1 LEU 89 -1.187 -7.429 -0.410 685 HG LEU 89 HG LEU 89 1.173 -6.205 -1.813 686 HD11 LEU 89 HD11 LEU 89 -0.509 -6.573 -3.535 687 HD12 LEU 89 HD12 LEU 89 -0.392 -4.860 -3.135 688 HD13 LEU 89 HD13 LEU 89 -1.736 -5.819 -2.517 689 HD21 LEU 89 HD21 LEU 89 -1.089 -5.065 -0.169 690 HD22 LEU 89 HD22 LEU 89 0.227 -4.139 -0.888 691 HD23 LEU 89 HD23 LEU 89 0.569 -5.317 0.378 692 H PHE 90 HN PHE 90 -0.845 -8.348 1.830 693 HA PHE 90 HA PHE 90 0.132 -6.152 3.330 694 HB2 PHE 90 HB2 PHE 90 -2.193 -6.934 3.484 695 HB3 PHE 90 HB1 PHE 90 -1.645 -8.455 4.178 696 HD1 PHE 90 HD2 PHE 90 -0.967 -4.843 4.851 697 HD2 PHE 90 HD1 PHE 90 -2.126 -8.633 6.403 698 HE1 PHE 90 HE2 PHE 90 -1.119 -3.873 7.103 699 HE2 PHE 90 HE1 PHE 90 -2.279 -7.666 8.659 700 HZ PHE 90 HZ PHE 90 -1.773 -5.281 9.012 701 H ALA 91 HN ALA 91 0.643 -9.647 3.531 702 HA ALA 91 HA ALA 91 2.183 -9.600 5.910 703 HB1 ALA 91 HB1 ALA 91 2.851 -11.857 5.300 704 HB2 ALA 91 HB2 ALA 91 2.239 -11.611 3.664 705 HB3 ALA 91 HB3 ALA 91 1.122 -11.631 5.028 706 H LEU 92 HN LEU 92 3.024 -9.439 2.489 707 HA LEU 92 HA LEU 92 5.795 -9.652 2.686 708 HB2 LEU 92 HB2 LEU 92 4.402 -9.728 0.594 709 HB3 LEU 92 HB1 LEU 92 4.254 -7.987 0.690 710 HG LEU 92 HG LEU 92 6.973 -9.258 0.539 711 HD11 LEU 92 HD11 LEU 92 5.674 -10.213 -1.297 712 HD12 LEU 92 HD12 LEU 92 6.877 -9.069 -1.894 713 HD13 LEU 92 HD13 LEU 92 5.181 -8.596 -1.796 714 HD21 LEU 92 HD21 LEU 92 5.875 -6.617 -0.428 715 HD22 LEU 92 HD22 LEU 92 7.560 -7.139 -0.503 716 HD23 LEU 92 HD23 LEU 92 6.788 -6.860 1.059 717 H VAL 93 HN VAL 93 3.778 -6.702 2.608 718 HA VAL 93 HA VAL 93 5.960 -4.939 2.885 719 HB VAL 93 HB VAL 93 3.794 -4.189 2.023 720 HG11 VAL 93 HG11 VAL 93 1.942 -3.696 3.572 721 HG12 VAL 93 HG12 VAL 93 2.818 -4.537 4.852 722 HG13 VAL 93 HG13 VAL 93 2.277 -5.421 3.425 723 HG21 VAL 93 HG21 VAL 93 4.682 -2.719 4.500 724 HG22 VAL 93 HG22 VAL 93 3.676 -2.045 3.217 725 HG23 VAL 93 HG23 VAL 93 5.337 -2.530 2.873 726 H GLN 94 HN GLN 94 3.989 -6.640 5.253 727 HA GLN 94 HA GLN 94 4.850 -5.142 7.504 728 HB2 GLN 94 HB2 GLN 94 2.845 -6.718 7.360 729 HB3 GLN 94 HB1 GLN 94 3.992 -8.036 7.568 730 HG2 GLN 94 HG2 GLN 94 4.683 -7.114 9.713 731 HG3 GLN 94 HG1 GLN 94 3.568 -5.768 9.503 732 HE21 GLN 94 HE21 GLN 94 1.524 -7.548 8.306 733 HE22 GLN 94 HE22 GLN 94 0.834 -8.410 9.637 734 H VAL 95 HN VAL 95 6.025 -8.117 5.987 735 HA VAL 95 HA VAL 95 8.046 -8.642 7.910 736 HB VAL 95 HB VAL 95 7.822 -9.564 5.041 737 HG11 VAL 95 HG11 VAL 95 9.603 -10.571 7.258 738 HG12 VAL 95 HG12 VAL 95 10.123 -9.743 5.791 739 HG13 VAL 95 HG13 VAL 95 9.393 -11.345 5.687 740 HG21 VAL 95 HG21 VAL 95 6.984 -11.645 6.017 741 HG22 VAL 95 HG22 VAL 95 5.955 -10.275 6.436 742 HG23 VAL 95 HG23 VAL 95 7.081 -10.930 7.626 743 H VAL 96 HN VAL 96 8.162 -7.118 4.683 744 HA VAL 96 HA VAL 96 10.925 -6.675 4.619 745 HB VAL 96 HB VAL 96 8.723 -5.071 3.302 746 HG11 VAL 96 HG11 VAL 96 11.679 -5.104 2.701 747 HG12 VAL 96 HG12 VAL 96 10.787 -3.767 3.424 748 HG13 VAL 96 HG13 VAL 96 10.442 -4.263 1.768 749 HG21 VAL 96 HG21 VAL 96 9.303 -6.387 1.315 750 HG22 VAL 96 HG22 VAL 96 8.747 -7.412 2.639 751 HG23 VAL 96 HG23 VAL 96 10.469 -7.304 2.268 752 H ALA 97 HN ALA 97 8.310 -4.710 5.953 753 HA ALA 97 HA ALA 97 9.881 -2.461 6.631 754 HB1 ALA 97 HB1 ALA 97 7.448 -2.364 6.537 755 HB2 ALA 97 HB2 ALA 97 8.031 -1.868 8.126 756 HB3 ALA 97 HB3 ALA 97 7.339 -3.474 7.903 757 H ASP 98 HN ASP 98 8.903 -5.330 8.469 758 HA ASP 98 HA ASP 98 9.947 -4.695 10.958 759 HB2 ASP 98 HB2 ASP 98 8.508 -6.655 10.487 760 HB3 ASP 98 HB1 ASP 98 9.854 -7.427 9.659 761 H GLU 99 HN GLU 99 11.545 -6.395 8.272 762 HA GLU 99 HA GLU 99 13.984 -6.689 9.766 763 HB2 GLU 99 HB2 GLU 99 13.485 -7.186 6.831 764 HB3 GLU 99 HB1 GLU 99 14.860 -7.759 7.769 765 HG2 GLU 99 HG2 GLU 99 13.189 -8.990 9.211 766 HG3 GLU 99 HG1 GLU 99 11.989 -8.608 7.978 767 H HIS 100 HN HIS 100 12.665 -4.153 7.992 768 HA HIS 100 HA HIS 100 15.239 -3.144 7.065 769 HB2 HIS 100 HB2 HIS 100 12.604 -2.855 6.162 770 HB3 HIS 100 HB1 HIS 100 13.047 -1.272 6.792 771 HD1 HIS 100 HD1 HIS 100 14.703 0.114 5.436 772 HD2 HIS 100 HD2 HIS 100 14.202 -3.757 3.986 773 HE1 HIS 100 HE1 HIS 100 15.828 0.076 3.182 774 HE2 HIS 100 HE2 HIS 100 15.374 -2.231 2.259 775 H LEU 101 HN LEU 101 13.069 -2.768 9.721 776 HA LEU 101 HA LEU 101 14.365 -0.276 10.508 777 HB2 LEU 101 HB2 LEU 101 12.640 -0.208 12.311 778 HB3 LEU 101 HB1 LEU 101 12.037 -0.097 10.672 779 HG LEU 101 HG LEU 101 11.617 -2.658 10.934 780 HD11 LEU 101 HD11 LEU 101 11.701 -1.766 13.810 781 HD12 LEU 101 HD12 LEU 101 12.760 -2.955 13.051 782 HD13 LEU 101 HD13 LEU 101 11.038 -3.293 13.230 783 HD21 LEU 101 HD21 LEU 101 9.896 -0.974 10.622 784 HD22 LEU 101 HD22 LEU 101 9.944 -0.589 12.340 785 HD23 LEU 101 HD23 LEU 101 9.388 -2.177 11.810 786 H GLU 102 HN GLU 102 14.922 -3.467 10.902 787 HA GLU 102 HA GLU 102 15.624 -3.880 13.545 788 HB2 GLU 102 HB2 GLU 102 15.744 -5.672 11.913 789 HB3 GLU 102 HB1 GLU 102 16.993 -4.827 11.012 790 HG2 GLU 102 HG2 GLU 102 18.530 -5.098 12.900 791 HG3 GLU 102 HG1 GLU 102 17.277 -5.958 13.791 792 H HIS 103 HN HIS 103 16.700 -2.442 14.768 793 HA HIS 103 HA HIS 103 19.321 -1.530 13.823 794 HB2 HIS 103 HB2 HIS 103 17.365 0.184 13.466 795 HB3 HIS 103 HB1 HIS 103 17.531 0.449 15.195 796 HD1 HIS 103 HD1 HIS 103 18.430 2.129 12.363 797 HD2 HIS 103 HD2 HIS 103 20.709 0.710 15.542 798 HE1 HIS 103 HE1 HIS 103 20.544 3.492 12.349 799 HE2 HIS 103 HE2 HIS 103 21.988 2.463 14.141 800 H HIS 104 HN HIS 104 18.452 -3.516 15.779 801 HA HIS 104 HA HIS 104 19.993 -2.393 18.027 802 HB2 HIS 104 HB2 HIS 104 17.613 -4.226 18.111 803 HB3 HIS 104 HB1 HIS 104 18.814 -4.264 19.398 804 HD1 HIS 104 HD1 HIS 104 19.109 -2.013 20.774 805 HD2 HIS 104 HD2 HIS 104 15.797 -2.168 18.261 806 HE1 HIS 104 HE1 HIS 104 17.579 -0.167 21.547 807 HE2 HIS 104 HE2 HIS 104 15.508 -0.399 20.131 808 H HIS 105 HN HIS 105 19.025 -5.353 16.374 809 HA HIS 105 HA HIS 105 21.461 -6.720 17.070 810 HB2 HIS 105 HB2 HIS 105 19.512 -8.073 16.840 811 HB3 HIS 105 HB1 HIS 105 19.125 -7.372 15.275 812 HD1 HIS 105 HD1 HIS 105 19.464 -9.006 13.502 813 HD2 HIS 105 HD2 HIS 105 22.303 -9.425 16.516 814 HE1 HIS 105 HE1 HIS 105 20.955 -10.900 12.775 815 HE2 HIS 105 HE2 HIS 105 22.789 -10.983 14.503 816 H HIS 106 HN HIS 106 23.205 -5.697 16.249 817 HA HIS 106 HA HIS 106 23.310 -5.381 13.327 818 HB2 HIS 106 HB2 HIS 106 23.050 -3.157 14.326 819 HB3 HIS 106 HB1 HIS 106 24.429 -3.455 15.377 820 HD1 HIS 106 HD1 HIS 106 26.518 -2.415 14.567 821 HD2 HIS 106 HD2 HIS 106 23.960 -3.387 11.432 822 HE1 HIS 106 HE1 HIS 106 27.661 -1.600 12.480 823 HE2 HIS 106 HE2 HIS 106 26.211 -2.420 10.591 824 H HIS 107 HN HIS 107 24.534 -7.108 12.837 825 HA HIS 107 HA HIS 107 27.288 -7.028 13.807 826 HB2 HIS 107 HB2 HIS 107 25.991 -8.732 15.162 827 HB3 HIS 107 HB1 HIS 107 25.767 -9.640 13.671 828 HD1 HIS 107 HD1 HIS 107 27.822 -9.657 16.527 829 HD2 HIS 107 HD2 HIS 107 28.574 -10.086 12.455 830 HE1 HIS 107 HE1 HIS 107 30.042 -10.821 16.362 831 HE2 HIS 107 HE2 HIS 107 30.560 -10.908 13.897 832 H HIS 108 HN HIS 108 27.691 -6.134 11.765 833 HA HIS 108 HA HIS 108 28.199 -8.172 9.762 834 HB2 HIS 108 HB2 HIS 108 26.465 -5.759 9.245 835 HB3 HIS 108 HB1 HIS 108 27.402 -6.500 7.954 836 HD1 HIS 108 HD1 HIS 108 26.924 -9.391 8.175 837 HD2 HIS 108 HD2 HIS 108 23.935 -6.634 9.034 838 HE1 HIS 108 HE1 HIS 108 24.752 -10.630 7.886 839 HE2 HIS 108 HE2 HIS 108 22.959 -8.892 8.233 840 H1 MET 1 HT1 MET 1 -0.117 -18.323 23.411 841 H2 MET 1 HT2 MET 1 0.380 -16.854 22.726 842 H3 MET 1 HT3 MET 1 -0.452 -16.864 24.204 843 HA MET 1 HA MET 1 1.353 -17.988 25.280 844 HB2 MET 1 HB2 MET 1 2.690 -17.764 22.575 845 HB3 MET 1 HB1 MET 1 3.520 -18.198 24.060 846 HG2 MET 1 HG2 MET 1 3.080 -20.192 22.853 847 HG3 MET 1 HG1 MET 1 2.015 -20.164 24.257 848 HE1 MET 1 HE1 MET 1 0.528 -22.086 23.188 849 HE2 MET 1 HE2 MET 1 1.591 -22.126 21.783 850 HE3 MET 1 HE3 MET 1 -0.154 -22.007 21.564 851 H ALA 2 HN ALA 2 1.957 -16.490 26.628 852 HA ALA 2 HA ALA 2 2.746 -14.580 27.549 853 HB1 ALA 2 HB1 ALA 2 3.940 -14.008 24.840 854 HB2 ALA 2 HB2 ALA 2 4.717 -14.918 26.135 855 HB3 ALA 2 HB3 ALA 2 4.354 -13.204 26.354 856 H GLY 3 HN GLY 3 2.243 -13.261 24.287 857 HA2 GLY 3 HA2 GLY 3 -0.230 -11.991 25.031 858 HA3 GLY 3 HA1 GLY 3 1.131 -10.878 24.981 859 H GLN 4 HN GLN 4 -0.071 -9.806 23.281 860 HA GLN 4 HA GLN 4 -0.178 -11.258 20.734 861 HB2 GLN 4 HB2 GLN 4 -1.586 -9.431 19.944 862 HB3 GLN 4 HB1 GLN 4 -2.225 -10.085 21.446 863 HG2 GLN 4 HG2 GLN 4 -1.292 -8.221 22.682 864 HG3 GLN 4 HG1 GLN 4 -0.570 -7.580 21.207 865 HE21 GLN 4 HE21 GLN 4 -2.921 -8.323 19.611 866 HE22 GLN 4 HE22 GLN 4 -4.143 -7.159 19.991 867 H SER 5 HN SER 5 1.881 -9.380 22.438 868 HA SER 5 HA SER 5 3.811 -8.302 21.975 869 HB2 SER 5 HB2 SER 5 4.206 -10.001 20.221 870 HB3 SER 5 HB1 SER 5 3.292 -9.023 19.076 871 HG SER 5 HG SER 5 5.527 -7.972 20.456 872 H ASP 6 HN ASP 6 3.235 -6.313 22.595 873 HA ASP 6 HA ASP 6 1.524 -4.595 21.128 874 HB2 ASP 6 HB2 ASP 6 3.531 -3.908 23.287 875 HB3 ASP 6 HB1 ASP 6 2.235 -2.862 22.718 876 H ARG 7 HN ARG 7 4.818 -5.401 20.867 877 HA ARG 7 HA ARG 7 5.759 -3.060 19.553 878 HB2 ARG 7 HB2 ARG 7 7.315 -4.632 20.569 879 HB3 ARG 7 HB1 ARG 7 6.759 -5.916 19.506 880 HG2 ARG 7 HG2 ARG 7 8.885 -5.083 18.748 881 HG3 ARG 7 HG1 ARG 7 7.631 -4.667 17.577 882 HD2 ARG 7 HD2 ARG 7 7.502 -2.411 18.623 883 HD3 ARG 7 HD1 ARG 7 8.879 -2.850 19.633 884 HE ARG 7 HE ARG 7 9.302 -3.157 16.784 885 HH11 ARG 7 HH11 ARG 7 9.639 -1.068 19.582 886 HH12 ARG 7 HH12 ARG 7 10.821 -0.040 18.823 887 HH21 ARG 7 HH21 ARG 7 10.828 -1.816 15.794 888 HH22 ARG 7 HH22 ARG 7 11.480 -0.449 16.648 889 H LYS 8 HN LYS 8 4.068 -5.939 18.536 890 HA LYS 8 HA LYS 8 4.589 -5.740 15.760 891 HB2 LYS 8 HB2 LYS 8 3.761 -7.790 16.901 892 HB3 LYS 8 HB1 LYS 8 2.210 -6.996 17.141 893 HG2 LYS 8 HG2 LYS 8 1.880 -6.860 14.738 894 HG3 LYS 8 HG1 LYS 8 3.459 -7.603 14.468 895 HD2 LYS 8 HD2 LYS 8 2.697 -9.622 15.636 896 HD3 LYS 8 HD1 LYS 8 1.116 -8.877 15.879 897 HE2 LYS 8 HE2 LYS 8 2.385 -9.478 13.211 898 HE3 LYS 8 HE1 LYS 8 1.116 -10.428 13.980 899 HZ1 LYS 8 HZ1 LYS 8 0.889 -7.613 13.080 900 HZ2 LYS 8 HZ2 LYS 8 -0.327 -8.480 13.880 901 HZ3 LYS 8 HZ3 LYS 8 0.185 -8.962 12.335 902 H ALA 9 HN ALA 9 2.307 -4.206 17.889 903 HA ALA 9 HA ALA 9 0.485 -3.239 15.979 904 HB1 ALA 9 HB1 ALA 9 0.066 -3.211 18.405 905 HB2 ALA 9 HB2 ALA 9 -0.189 -1.633 17.659 906 HB3 ALA 9 HB3 ALA 9 1.281 -1.945 18.584 907 H ALA 10 HN ALA 10 3.650 -2.137 16.994 908 HA ALA 10 HA ALA 10 3.530 0.412 15.731 909 HB1 ALA 10 HB1 ALA 10 5.937 0.484 16.049 910 HB2 ALA 10 HB2 ALA 10 5.956 -1.238 16.435 911 HB3 ALA 10 HB3 ALA 10 5.140 -0.101 17.510 912 H LEU 11 HN LEU 11 4.332 -2.816 14.687 913 HA LEU 11 HA LEU 11 5.570 -2.121 12.225 914 HB2 LEU 11 HB2 LEU 11 4.104 -4.652 12.990 915 HB3 LEU 11 HB1 LEU 11 5.162 -4.462 11.604 916 HG LEU 11 HG LEU 11 6.057 -4.201 14.473 917 HD11 LEU 11 HD11 LEU 11 7.121 -6.379 14.132 918 HD12 LEU 11 HD12 LEU 11 6.372 -6.494 12.539 919 HD13 LEU 11 HD13 LEU 11 5.366 -6.484 13.989 920 HD21 LEU 11 HD21 LEU 11 8.300 -4.302 13.522 921 HD22 LEU 11 HD22 LEU 11 7.405 -2.919 12.889 922 HD23 LEU 11 HD23 LEU 11 7.617 -4.362 11.897 923 H LEU 12 HN LEU 12 2.271 -2.722 13.245 924 HA LEU 12 HA LEU 12 1.116 -2.730 10.660 925 HB2 LEU 12 HB2 LEU 12 -0.126 -2.082 13.335 926 HB3 LEU 12 HB1 LEU 12 -1.017 -2.394 11.856 927 HG LEU 12 HG LEU 12 0.764 -4.389 13.264 928 HD11 LEU 12 HD11 LEU 12 -2.242 -4.230 13.099 929 HD12 LEU 12 HD12 LEU 12 -1.262 -3.936 14.536 930 HD13 LEU 12 HD13 LEU 12 -1.314 -5.547 13.818 931 HD21 LEU 12 HD21 LEU 12 -0.190 -6.004 11.688 932 HD22 LEU 12 HD22 LEU 12 0.712 -4.736 10.858 933 HD23 LEU 12 HD23 LEU 12 -1.050 -4.696 10.875 934 H ASP 13 HN ASP 13 1.940 -0.196 12.932 935 HA ASP 13 HA ASP 13 0.642 1.880 11.427 936 HB2 ASP 13 HB2 ASP 13 1.100 2.078 13.869 937 HB3 ASP 13 HB1 ASP 13 2.822 2.133 13.512 938 H GLN 14 HN GLN 14 3.807 0.413 11.552 939 HA GLN 14 HA GLN 14 5.211 2.263 9.951 940 HB2 GLN 14 HB2 GLN 14 6.424 0.649 11.249 941 HB3 GLN 14 HB1 GLN 14 5.611 -0.691 10.455 942 HG2 GLN 14 HG2 GLN 14 7.935 -0.375 9.717 943 HG3 GLN 14 HG1 GLN 14 6.765 -0.252 8.403 944 HE21 GLN 14 HE21 GLN 14 8.125 0.920 7.105 945 HE22 GLN 14 HE22 GLN 14 8.552 2.561 7.427 946 H VAL 15 HN VAL 15 3.497 -0.749 9.097 947 HA VAL 15 HA VAL 15 3.927 -0.416 6.305 948 HB VAL 15 HB VAL 15 2.244 -2.154 5.972 949 HG11 VAL 15 HG11 VAL 15 4.090 -2.746 8.279 950 HG12 VAL 15 HG12 VAL 15 4.511 -2.805 6.566 951 HG13 VAL 15 HG13 VAL 15 3.334 -3.943 7.226 952 HG21 VAL 15 HG21 VAL 15 1.101 -3.189 7.881 953 HG22 VAL 15 HG22 VAL 15 0.616 -1.509 7.650 954 HG23 VAL 15 HG23 VAL 15 1.747 -1.932 8.935 955 H ALA 16 HN ALA 16 1.553 0.788 8.548 956 HA ALA 16 HA ALA 16 -0.332 1.729 6.678 957 HB1 ALA 16 HB1 ALA 16 -0.820 1.601 9.064 958 HB2 ALA 16 HB2 ALA 16 -1.083 3.233 8.446 959 HB3 ALA 16 HB3 ALA 16 0.368 2.866 9.381 960 H ARG 17 HN ARG 17 2.710 3.032 7.858 961 HA ARG 17 HA ARG 17 2.460 5.593 6.654 962 HB2 ARG 17 HB2 ARG 17 4.080 5.246 8.416 963 HB3 ARG 17 HB1 ARG 17 4.900 4.008 7.476 964 HG2 ARG 17 HG2 ARG 17 5.776 5.567 5.972 965 HG3 ARG 17 HG1 ARG 17 4.659 6.826 6.491 966 HD2 ARG 17 HD2 ARG 17 6.899 7.245 7.336 967 HD3 ARG 17 HD1 ARG 17 5.773 6.938 8.654 968 HE ARG 17 HE ARG 17 6.742 4.655 8.739 969 HH11 ARG 17 HH11 ARG 17 8.573 7.202 7.185 970 HH12 ARG 17 HH12 ARG 17 10.121 6.548 7.636 971 HH21 ARG 17 HH21 ARG 17 8.775 3.790 9.339 972 HH22 ARG 17 HH22 ARG 17 10.237 4.616 8.868 973 H VAL 18 HN VAL 18 3.727 2.491 5.572 974 HA VAL 18 HA VAL 18 4.682 3.355 3.056 975 HB VAL 18 HB VAL 18 3.563 0.635 3.773 976 HG11 VAL 18 HG11 VAL 18 5.400 1.503 1.541 977 HG12 VAL 18 HG12 VAL 18 3.742 0.924 1.374 978 HG13 VAL 18 HG13 VAL 18 5.005 -0.170 1.936 979 HG21 VAL 18 HG21 VAL 18 5.922 0.013 4.170 980 HG22 VAL 18 HG22 VAL 18 5.336 1.233 5.302 981 HG23 VAL 18 HG23 VAL 18 6.378 1.704 3.958 982 H GLY 19 HN GLY 19 1.567 1.938 4.041 983 HA2 GLY 19 HA2 GLY 19 0.291 2.110 1.544 984 HA3 GLY 19 HA1 GLY 19 -0.522 2.063 3.103 985 H LYS 20 HN LYS 20 0.563 4.436 4.173 986 HA LYS 20 HA LYS 20 -1.187 6.403 3.238 987 HB2 LYS 20 HB2 LYS 20 -0.098 6.329 5.484 988 HB3 LYS 20 HB1 LYS 20 1.412 6.809 4.726 989 HG2 LYS 20 HG2 LYS 20 0.324 8.907 3.990 990 HG3 LYS 20 HG1 LYS 20 -1.119 8.427 4.890 991 HD2 LYS 20 HD2 LYS 20 0.270 8.296 6.944 992 HD3 LYS 20 HD1 LYS 20 1.637 8.918 6.020 993 HE2 LYS 20 HE2 LYS 20 0.610 10.725 7.243 994 HE3 LYS 20 HE1 LYS 20 0.330 10.952 5.517 995 HZ1 LYS 20 HZ1 LYS 20 -1.664 9.645 7.273 996 HZ2 LYS 20 HZ2 LYS 20 -1.899 10.309 5.728 997 HZ3 LYS 20 HZ3 LYS 20 -1.622 11.326 7.056 998 H ALA 21 HN ALA 21 2.186 5.748 2.466 999 HA ALA 21 HA ALA 21 2.571 8.073 0.862 1000 HB1 ALA 21 HB1 ALA 21 4.121 5.480 0.902 1001 HB2 ALA 21 HB2 ALA 21 4.451 6.899 1.900 1002 HB3 ALA 21 HB3 ALA 21 4.645 6.986 0.150 1003 H LEU 22 HN LEU 22 1.292 4.890 0.301 1004 HA LEU 22 HA LEU 22 1.414 5.091 -2.587 1005 HB2 LEU 22 HB2 LEU 22 -0.037 3.097 -0.843 1006 HB3 LEU 22 HB1 LEU 22 0.223 2.954 -2.570 1007 HG LEU 22 HG LEU 22 2.403 2.942 -0.480 1008 HD11 LEU 22 HD11 LEU 22 1.016 0.941 -0.372 1009 HD12 LEU 22 HD12 LEU 22 2.614 0.570 -1.021 1010 HD13 LEU 22 HD13 LEU 22 1.227 0.691 -2.106 1011 HD21 LEU 22 HD21 LEU 22 3.868 2.295 -2.302 1012 HD22 LEU 22 HD22 LEU 22 3.115 3.853 -2.646 1013 HD23 LEU 22 HD23 LEU 22 2.526 2.395 -3.442 1014 H ALA 23 HN ALA 23 -0.678 6.140 -0.131 1015 HA ALA 23 HA ALA 23 -3.183 5.780 -1.420 1016 HB1 ALA 23 HB1 ALA 23 -2.463 7.685 0.798 1017 HB2 ALA 23 HB2 ALA 23 -2.937 6.000 1.008 1018 HB3 ALA 23 HB3 ALA 23 -4.085 7.164 0.348 1019 H ASN 24 HN ASN 24 -0.720 7.826 -2.257 1020 HA ASN 24 HA ASN 24 -2.380 10.106 -2.963 1021 HB2 ASN 24 HB2 ASN 24 -0.111 10.525 -2.167 1022 HB3 ASN 24 HB1 ASN 24 0.549 9.557 -3.483 1023 HD21 ASN 24 HD21 ASN 24 -0.897 12.579 -2.589 1024 HD22 ASN 24 HD22 ASN 24 -0.582 13.400 -4.078 1025 H GLY 25 HN GLY 25 -0.699 7.449 -4.572 1026 HA2 GLY 25 HA2 GLY 25 -1.302 6.412 -6.556 1027 HA3 GLY 25 HA1 GLY 25 -2.538 7.638 -6.787 1028 H ARG 26 HN ARG 26 -1.335 9.945 -7.057 1029 HA ARG 26 HA ARG 26 -0.361 9.815 -9.690 1030 HB2 ARG 26 HB2 ARG 26 -0.148 12.114 -7.737 1031 HB3 ARG 26 HB1 ARG 26 0.034 12.225 -9.480 1032 HG2 ARG 26 HG2 ARG 26 -2.473 11.452 -8.001 1033 HG3 ARG 26 HG1 ARG 26 -2.155 12.998 -8.787 1034 HD2 ARG 26 HD2 ARG 26 -2.335 10.315 -10.157 1035 HD3 ARG 26 HD1 ARG 26 -3.574 11.570 -10.171 1036 HE ARG 26 HE ARG 26 -1.010 12.455 -11.153 1037 HH11 ARG 26 HH11 ARG 26 -4.094 10.995 -11.994 1038 HH12 ARG 26 HH12 ARG 26 -3.949 11.376 -13.687 1039 HH21 ARG 26 HH21 ARG 26 -0.829 12.960 -13.365 1040 HH22 ARG 26 HH22 ARG 26 -2.080 12.472 -14.473 1041 H ARG 27 HN ARG 27 1.336 10.320 -6.621 1042 HA ARG 27 HA ARG 27 3.891 10.781 -7.776 1043 HB2 ARG 27 HB2 ARG 27 4.742 10.276 -5.459 1044 HB3 ARG 27 HB1 ARG 27 3.531 11.549 -5.550 1045 HG2 ARG 27 HG2 ARG 27 1.820 10.017 -4.790 1046 HG3 ARG 27 HG1 ARG 27 2.981 8.690 -4.779 1047 HD2 ARG 27 HD2 ARG 27 3.508 11.163 -3.180 1048 HD3 ARG 27 HD1 ARG 27 2.409 9.932 -2.562 1049 HE ARG 27 HE ARG 27 4.900 8.829 -3.419 1050 HH11 ARG 27 HH11 ARG 27 3.344 10.540 -0.792 1051 HH12 ARG 27 HH12 ARG 27 4.383 9.863 0.435 1052 HH21 ARG 27 HH21 ARG 27 6.254 7.919 -1.799 1053 HH22 ARG 27 HH22 ARG 27 6.038 8.393 -0.145 1054 H LEU 28 HN LEU 28 2.086 7.945 -7.584 1055 HA LEU 28 HA LEU 28 4.281 6.137 -7.126 1056 HB2 LEU 28 HB2 LEU 28 1.524 5.524 -8.190 1057 HB3 LEU 28 HB1 LEU 28 2.680 4.366 -7.562 1058 HG LEU 28 HG LEU 28 1.240 6.500 -5.988 1059 HD11 LEU 28 HD11 LEU 28 -0.128 4.561 -6.561 1060 HD12 LEU 28 HD12 LEU 28 0.221 4.615 -4.833 1061 HD13 LEU 28 HD13 LEU 28 1.096 3.492 -5.874 1062 HD21 LEU 28 HD21 LEU 28 3.260 4.478 -5.029 1063 HD22 LEU 28 HD22 LEU 28 2.368 5.627 -4.031 1064 HD23 LEU 28 HD23 LEU 28 3.548 6.210 -5.205 1065 H GLN 29 HN GLN 29 3.003 7.823 -9.789 1066 HA GLN 29 HA GLN 29 3.709 6.138 -11.922 1067 HB2 GLN 29 HB2 GLN 29 2.340 8.172 -12.188 1068 HB3 GLN 29 HB1 GLN 29 3.743 9.163 -11.807 1069 HG2 GLN 29 HG2 GLN 29 4.875 8.332 -13.805 1070 HG3 GLN 29 HG1 GLN 29 3.470 7.334 -14.182 1071 HE21 GLN 29 HE21 GLN 29 4.742 9.507 -15.695 1072 HE22 GLN 29 HE22 GLN 29 3.489 10.660 -15.982 1073 H ILE 30 HN ILE 30 5.568 8.307 -9.912 1074 HA ILE 30 HA ILE 30 7.940 8.307 -11.450 1075 HB ILE 30 HB ILE 30 7.627 8.702 -8.467 1076 HG12 ILE 30 HG12 ILE 30 7.702 10.692 -10.748 1077 HG13 ILE 30 HG11 ILE 30 6.295 10.288 -9.769 1078 HG21 ILE 30 HG21 ILE 30 9.898 9.414 -10.322 1079 HG22 ILE 30 HG22 ILE 30 9.926 8.191 -9.050 1080 HG23 ILE 30 HG23 ILE 30 9.776 9.899 -8.630 1081 HD11 ILE 30 HD11 ILE 30 7.356 11.238 -7.812 1082 HD12 ILE 30 HD12 ILE 30 7.302 12.417 -9.121 1083 HD13 ILE 30 HD13 ILE 30 8.812 11.585 -8.747 1084 H LEU 31 HN LEU 31 6.646 6.133 -9.006 1085 HA LEU 31 HA LEU 31 8.973 4.578 -8.624 1086 HB2 LEU 31 HB2 LEU 31 6.056 3.856 -8.336 1087 HB3 LEU 31 HB1 LEU 31 7.376 2.816 -7.836 1088 HG LEU 31 HG LEU 31 6.764 5.550 -6.701 1089 HD11 LEU 31 HD11 LEU 31 5.128 3.880 -6.035 1090 HD12 LEU 31 HD12 LEU 31 6.168 4.304 -4.675 1091 HD13 LEU 31 HD13 LEU 31 6.420 2.787 -5.539 1092 HD21 LEU 31 HD21 LEU 31 9.168 5.019 -6.715 1093 HD22 LEU 31 HD22 LEU 31 8.824 3.514 -5.860 1094 HD23 LEU 31 HD23 LEU 31 8.501 5.065 -5.083 1095 H ASP 32 HN ASP 32 6.321 4.417 -10.932 1096 HA ASP 32 HA ASP 32 7.055 2.028 -12.227 1097 HB2 ASP 32 HB2 ASP 32 4.887 3.107 -12.587 1098 HB3 ASP 32 HB1 ASP 32 5.677 4.481 -13.348 1099 H LEU 33 HN LEU 33 8.139 5.343 -12.603 1100 HA LEU 33 HA LEU 33 9.778 4.840 -14.901 1101 HB2 LEU 33 HB2 LEU 33 8.848 7.061 -14.370 1102 HB3 LEU 33 HB1 LEU 33 9.827 7.118 -12.917 1103 HG LEU 33 HG LEU 33 11.868 7.041 -14.356 1104 HD11 LEU 33 HD11 LEU 33 9.883 7.415 -16.591 1105 HD12 LEU 33 HD12 LEU 33 10.891 5.994 -16.322 1106 HD13 LEU 33 HD13 LEU 33 11.636 7.539 -16.735 1107 HD21 LEU 33 HD21 LEU 33 11.715 9.371 -15.072 1108 HD22 LEU 33 HD22 LEU 33 11.004 9.148 -13.473 1109 HD23 LEU 33 HD23 LEU 33 9.963 9.317 -14.885 1110 H LEU 34 HN LEU 34 10.184 4.675 -11.455 1111 HA LEU 34 HA LEU 34 13.065 4.568 -11.554 1112 HB2 LEU 34 HB2 LEU 34 11.000 4.638 -9.460 1113 HB3 LEU 34 HB1 LEU 34 12.431 3.708 -9.054 1114 HG LEU 34 HG LEU 34 12.602 6.017 -8.258 1115 HD11 LEU 34 HD11 LEU 34 14.482 5.372 -10.521 1116 HD12 LEU 34 HD12 LEU 34 14.623 4.805 -8.857 1117 HD13 LEU 34 HD13 LEU 34 14.788 6.523 -9.220 1118 HD21 LEU 34 HD21 LEU 34 12.832 7.857 -9.853 1119 HD22 LEU 34 HD22 LEU 34 11.238 7.111 -9.960 1120 HD23 LEU 34 HD23 LEU 34 12.460 6.754 -11.179 1121 H ALA 35 HN ALA 35 10.500 2.321 -11.821 1122 HA ALA 35 HA ALA 35 11.978 -0.002 -11.055 1123 HB1 ALA 35 HB1 ALA 35 10.179 -1.255 -12.135 1124 HB2 ALA 35 HB2 ALA 35 9.561 0.234 -12.852 1125 HB3 ALA 35 HB3 ALA 35 9.526 0.017 -11.102 1126 H GLN 36 HN GLN 36 12.483 2.134 -13.438 1127 HA GLN 36 HA GLN 36 13.413 0.179 -15.422 1128 HB2 GLN 36 HB2 GLN 36 13.149 3.179 -15.692 1129 HB3 GLN 36 HB1 GLN 36 13.435 2.022 -16.987 1130 HG2 GLN 36 HG2 GLN 36 11.247 1.137 -16.797 1131 HG3 GLN 36 HG1 GLN 36 10.956 2.007 -15.292 1132 HE21 GLN 36 HE21 GLN 36 9.144 3.038 -16.058 1133 HE22 GLN 36 HE22 GLN 36 9.213 4.295 -17.248 1134 H GLY 37 HN GLY 37 14.522 1.820 -12.802 1135 HA2 GLY 37 HA2 GLY 37 16.980 1.325 -12.448 1136 HA3 GLY 37 HA1 GLY 37 17.212 2.207 -13.953 1137 H GLU 38 HN GLU 38 18.646 3.310 -12.155 1138 HA GLU 38 HA GLU 38 17.275 5.055 -10.358 1139 HB2 GLU 38 HB2 GLU 38 19.522 6.078 -10.004 1140 HB3 GLU 38 HB1 GLU 38 19.485 4.337 -9.758 1141 HG2 GLU 38 HG2 GLU 38 20.483 3.990 -11.945 1142 HG3 GLU 38 HG1 GLU 38 20.477 5.729 -12.237 1143 H ARG 39 HN ARG 39 16.721 7.134 -10.567 1144 HA ARG 39 HA ARG 39 17.213 8.420 -13.173 1145 HB2 ARG 39 HB2 ARG 39 14.663 8.501 -11.549 1146 HB3 ARG 39 HB1 ARG 39 14.948 9.375 -13.045 1147 HG2 ARG 39 HG2 ARG 39 14.885 6.376 -12.766 1148 HG3 ARG 39 HG1 ARG 39 13.567 7.381 -13.371 1149 HD2 ARG 39 HD2 ARG 39 15.185 8.212 -15.124 1150 HD3 ARG 39 HD1 ARG 39 16.266 6.918 -14.610 1151 HE ARG 39 HE ARG 39 13.863 5.692 -15.114 1152 HH11 ARG 39 HH11 ARG 39 16.143 7.622 -16.919 1153 HH12 ARG 39 HH12 ARG 39 15.726 6.938 -18.462 1154 HH21 ARG 39 HH21 ARG 39 13.277 4.786 -17.158 1155 HH22 ARG 39 HH22 ARG 39 14.085 5.336 -18.594 1156 H ALA 40 HN ALA 40 17.787 10.535 -13.123 1157 HA ALA 40 HA ALA 40 18.429 11.719 -10.565 1158 HB1 ALA 40 HB1 ALA 40 19.958 11.943 -12.464 1159 HB2 ALA 40 HB2 ALA 40 19.427 13.516 -11.871 1160 HB3 ALA 40 HB3 ALA 40 18.727 12.847 -13.345 1161 H VAL 41 HN VAL 41 17.722 13.846 -9.907 1162 HA VAL 41 HA VAL 41 14.980 14.128 -9.764 1163 HB VAL 41 HB VAL 41 17.034 16.329 -9.482 1164 HG11 VAL 41 HG11 VAL 41 14.801 17.248 -9.734 1165 HG12 VAL 41 HG12 VAL 41 15.351 17.432 -8.070 1166 HG13 VAL 41 HG13 VAL 41 14.193 16.167 -8.481 1167 HG21 VAL 41 HG21 VAL 41 15.836 14.474 -7.427 1168 HG22 VAL 41 HG22 VAL 41 16.897 15.839 -7.076 1169 HG23 VAL 41 HG23 VAL 41 17.503 14.464 -8.000 1170 H GLU 42 HN GLU 42 17.190 16.081 -11.804 1171 HA GLU 42 HA GLU 42 15.127 17.561 -13.033 1172 HB2 GLU 42 HB2 GLU 42 17.858 16.939 -14.174 1173 HB3 GLU 42 HB1 GLU 42 16.796 18.250 -14.668 1174 HG2 GLU 42 HG2 GLU 42 18.085 19.456 -13.289 1175 HG3 GLU 42 HG1 GLU 42 17.025 18.795 -12.044 1176 H ALA 43 HN ALA 43 16.632 14.503 -13.846 1177 HA ALA 43 HA ALA 43 15.573 14.239 -16.452 1178 HB1 ALA 43 HB1 ALA 43 16.172 11.894 -16.271 1179 HB2 ALA 43 HB2 ALA 43 16.368 12.059 -14.526 1180 HB3 ALA 43 HB3 ALA 43 17.462 12.905 -15.621 1181 H ILE 44 HN ILE 44 14.452 13.084 -13.290 1182 HA ILE 44 HA ILE 44 12.158 11.735 -14.175 1183 HB ILE 44 HB ILE 44 12.647 13.132 -11.539 1184 HG12 ILE 44 HG12 ILE 44 12.877 10.214 -12.304 1185 HG13 ILE 44 HG11 ILE 44 14.236 11.316 -12.119 1186 HG21 ILE 44 HG21 ILE 44 10.845 11.710 -10.655 1187 HG22 ILE 44 HG22 ILE 44 10.520 11.122 -12.285 1188 HG23 ILE 44 HG23 ILE 44 10.262 12.822 -11.892 1189 HD11 ILE 44 HD11 ILE 44 13.977 9.925 -10.160 1190 HD12 ILE 44 HD12 ILE 44 12.317 10.485 -9.960 1191 HD13 ILE 44 HD13 ILE 44 13.658 11.614 -9.762 1192 H ALA 45 HN ALA 45 12.628 15.079 -13.126 1193 HA ALA 45 HA ALA 45 10.004 15.966 -13.195 1194 HB1 ALA 45 HB1 ALA 45 12.474 17.530 -13.941 1195 HB2 ALA 45 HB2 ALA 45 11.876 17.276 -12.302 1196 HB3 ALA 45 HB3 ALA 45 10.920 18.206 -13.456 1197 H THR 46 HN THR 46 12.412 16.137 -15.825 1198 HA THR 46 HA THR 46 10.615 17.230 -17.710 1199 HB THR 46 HB THR 46 13.104 15.634 -18.339 1200 HG1 THR 46 HG1 THR 46 14.197 17.209 -17.439 1201 HG21 THR 46 HG21 THR 46 11.744 16.184 -20.283 1202 HG22 THR 46 HG22 THR 46 13.220 17.150 -20.285 1203 HG23 THR 46 HG23 THR 46 11.691 17.878 -19.792 1204 H ALA 47 HN ALA 47 11.583 13.898 -16.988 1205 HA ALA 47 HA ALA 47 10.376 12.720 -19.262 1206 HB1 ALA 47 HB1 ALA 47 10.729 10.603 -18.146 1207 HB2 ALA 47 HB2 ALA 47 11.025 11.432 -16.617 1208 HB3 ALA 47 HB3 ALA 47 12.149 11.634 -17.962 1209 H THR 48 HN THR 48 9.105 13.639 -16.143 1210 HA THR 48 HA THR 48 6.613 12.193 -16.702 1211 HB THR 48 HB THR 48 5.993 12.880 -14.355 1212 HG1 THR 48 HG1 THR 48 8.757 13.515 -14.097 1213 HG21 THR 48 HG21 THR 48 7.447 11.227 -13.277 1214 HG22 THR 48 HG22 THR 48 8.529 11.268 -14.668 1215 HG23 THR 48 HG23 THR 48 6.885 10.652 -14.848 1216 H GLY 49 HN GLY 49 7.949 15.184 -17.223 1217 HA2 GLY 49 HA2 GLY 49 7.011 17.120 -18.044 1218 HA3 GLY 49 HA1 GLY 49 5.442 16.333 -17.979 1219 H MET 50 HN MET 50 7.625 16.773 -15.244 1220 HA MET 50 HA MET 50 5.720 18.737 -14.152 1221 HB2 MET 50 HB2 MET 50 6.115 17.856 -11.907 1222 HB3 MET 50 HB1 MET 50 5.481 16.600 -12.957 1223 HG2 MET 50 HG2 MET 50 7.704 15.656 -13.196 1224 HG3 MET 50 HG1 MET 50 8.371 16.945 -12.194 1225 HE1 MET 50 HE1 MET 50 6.069 13.771 -12.303 1226 HE2 MET 50 HE2 MET 50 4.949 14.983 -11.680 1227 HE3 MET 50 HE3 MET 50 5.495 13.667 -10.637 1228 H ASN 51 HN ASN 51 6.783 20.013 -12.309 1229 HA ASN 51 HA ASN 51 9.253 21.100 -13.378 1230 HB2 ASN 51 HB2 ASN 51 7.397 22.594 -12.699 1231 HB3 ASN 51 HB1 ASN 51 7.546 22.011 -11.046 1232 HD21 ASN 51 HD21 ASN 51 8.024 23.974 -10.166 1233 HD22 ASN 51 HD22 ASN 51 9.504 24.820 -10.476 1234 H LEU 52 HN LEU 52 11.049 21.630 -11.897 1235 HA LEU 52 HA LEU 52 12.089 19.404 -10.592 1236 HB2 LEU 52 HB2 LEU 52 12.775 22.318 -10.206 1237 HB3 LEU 52 HB1 LEU 52 13.741 20.981 -9.615 1238 HG LEU 52 HG LEU 52 13.182 21.588 -12.522 1239 HD11 LEU 52 HD11 LEU 52 15.537 22.191 -12.629 1240 HD12 LEU 52 HD12 LEU 52 15.706 21.893 -10.898 1241 HD13 LEU 52 HD13 LEU 52 14.682 23.212 -11.470 1242 HD21 LEU 52 HD21 LEU 52 14.917 19.486 -11.230 1243 HD22 LEU 52 HD22 LEU 52 14.857 19.845 -12.955 1244 HD23 LEU 52 HD23 LEU 52 13.433 19.204 -12.140 1245 H THR 53 HN THR 53 10.462 22.249 -9.243 1246 HA THR 53 HA THR 53 10.742 21.673 -6.533 1247 HB THR 53 HB THR 53 8.299 22.965 -7.747 1248 HG1 THR 53 HG1 THR 53 10.807 24.219 -7.189 1249 HG21 THR 53 HG21 THR 53 9.807 23.450 -5.171 1250 HG22 THR 53 HG22 THR 53 8.252 22.631 -5.324 1251 HG23 THR 53 HG23 THR 53 8.388 24.345 -5.717 1252 H THR 54 HN THR 54 8.295 20.660 -8.862 1253 HA THR 54 HA THR 54 6.612 19.292 -7.056 1254 HB THR 54 HB THR 54 6.953 18.655 -9.987 1255 HG1 THR 54 HG1 THR 54 5.065 20.297 -9.990 1256 HG21 THR 54 HG21 THR 54 5.513 17.132 -8.731 1257 HG22 THR 54 HG22 THR 54 4.562 18.109 -9.849 1258 HG23 THR 54 HG23 THR 54 4.577 18.500 -8.129 1259 H ALA 55 HN ALA 55 9.112 18.144 -9.315 1260 HA ALA 55 HA ALA 55 8.885 15.419 -8.700 1261 HB1 ALA 55 HB1 ALA 55 9.999 16.297 -10.711 1262 HB2 ALA 55 HB2 ALA 55 11.008 15.147 -9.832 1263 HB3 ALA 55 HB3 ALA 55 11.326 16.877 -9.703 1264 H SER 56 HN SER 56 11.001 17.925 -7.362 1265 HA SER 56 HA SER 56 12.564 16.262 -5.739 1266 HB2 SER 56 HB2 SER 56 13.081 18.644 -6.286 1267 HB3 SER 56 HB1 SER 56 11.790 19.137 -5.190 1268 HG SER 56 HG SER 56 13.118 17.656 -3.667 1269 H ALA 57 HN ALA 57 9.492 17.912 -5.088 1270 HA ALA 57 HA ALA 57 9.339 17.209 -2.349 1271 HB1 ALA 57 HB1 ALA 57 7.098 17.853 -4.264 1272 HB2 ALA 57 HB2 ALA 57 8.031 19.033 -3.341 1273 HB3 ALA 57 HB3 ALA 57 7.002 17.871 -2.502 1274 H ASN 58 HN ASN 58 8.085 15.719 -5.300 1275 HA ASN 58 HA ASN 58 6.646 13.644 -4.047 1276 HB2 ASN 58 HB2 ASN 58 7.832 13.882 -6.815 1277 HB3 ASN 58 HB1 ASN 58 6.863 12.503 -6.308 1278 HD21 ASN 58 HD21 ASN 58 6.381 14.525 -8.383 1279 HD22 ASN 58 HD22 ASN 58 4.849 15.227 -8.000 1280 H LEU 59 HN LEU 59 9.959 13.826 -5.274 1281 HA LEU 59 HA LEU 59 10.648 11.140 -4.772 1282 HB2 LEU 59 HB2 LEU 59 12.350 13.622 -4.934 1283 HB3 LEU 59 HB1 LEU 59 13.010 12.001 -4.810 1284 HG LEU 59 HG LEU 59 11.253 12.974 -7.064 1285 HD11 LEU 59 HD11 LEU 59 13.300 12.910 -8.405 1286 HD12 LEU 59 HD12 LEU 59 14.232 12.530 -6.956 1287 HD13 LEU 59 HD13 LEU 59 13.412 14.086 -7.096 1288 HD21 LEU 59 HD21 LEU 59 11.060 10.579 -6.624 1289 HD22 LEU 59 HD22 LEU 59 12.814 10.419 -6.714 1290 HD23 LEU 59 HD23 LEU 59 11.896 10.888 -8.146 1291 H GLN 60 HN GLN 60 10.950 14.057 -2.783 1292 HA GLN 60 HA GLN 60 12.280 12.867 -0.610 1293 HB2 GLN 60 HB2 GLN 60 11.983 15.325 -0.964 1294 HB3 GLN 60 HB1 GLN 60 10.294 15.151 -0.509 1295 HG2 GLN 60 HG2 GLN 60 11.056 14.264 1.692 1296 HG3 GLN 60 HG1 GLN 60 12.706 14.668 1.220 1297 HE21 GLN 60 HE21 GLN 60 13.005 16.177 2.819 1298 HE22 GLN 60 HE22 GLN 60 12.175 17.702 2.847 1299 H ALA 61 HN ALA 61 8.848 13.216 -1.370 1300 HA ALA 61 HA ALA 61 7.838 12.106 1.013 1301 HB1 ALA 61 HB1 ALA 61 6.611 12.122 -1.740 1302 HB2 ALA 61 HB2 ALA 61 6.463 13.397 -0.531 1303 HB3 ALA 61 HB3 ALA 61 5.758 11.806 -0.231 1304 H LEU 62 HN LEU 62 8.872 10.653 -2.033 1305 HA LEU 62 HA LEU 62 7.962 8.034 -1.511 1306 HB2 LEU 62 HB2 LEU 62 10.246 9.024 -3.214 1307 HB3 LEU 62 HB1 LEU 62 9.705 7.358 -3.186 1308 HG LEU 62 HG LEU 62 7.990 9.697 -4.029 1309 HD11 LEU 62 HD11 LEU 62 9.412 7.626 -5.699 1310 HD12 LEU 62 HD12 LEU 62 9.828 9.336 -5.593 1311 HD13 LEU 62 HD13 LEU 62 8.288 8.845 -6.300 1312 HD21 LEU 62 HD21 LEU 62 6.478 7.971 -4.862 1313 HD22 LEU 62 HD22 LEU 62 6.721 7.811 -3.123 1314 HD23 LEU 62 HD23 LEU 62 7.548 6.719 -4.235 1315 H LYS 63 HN LYS 63 10.952 9.715 -0.710 1316 HA LYS 63 HA LYS 63 12.234 7.367 0.311 1317 HB2 LYS 63 HB2 LYS 63 13.559 9.187 -0.609 1318 HB3 LYS 63 HB1 LYS 63 12.934 10.290 0.610 1319 HG2 LYS 63 HG2 LYS 63 14.097 9.188 2.340 1320 HG3 LYS 63 HG1 LYS 63 14.494 7.821 1.299 1321 HD2 LYS 63 HD2 LYS 63 15.933 9.235 -0.049 1322 HD3 LYS 63 HD1 LYS 63 15.485 10.644 0.914 1323 HE2 LYS 63 HE2 LYS 63 17.675 9.718 1.553 1324 HE3 LYS 63 HE1 LYS 63 16.508 9.677 2.875 1325 HZ1 LYS 63 HZ1 LYS 63 17.745 7.621 2.756 1326 HZ2 LYS 63 HZ2 LYS 63 17.269 7.378 1.152 1327 HZ3 LYS 63 HZ3 LYS 63 16.115 7.329 2.392 1328 H SER 64 HN SER 64 10.367 10.004 1.712 1329 HA SER 64 HA SER 64 10.988 9.320 4.408 1330 HB2 SER 64 HB2 SER 64 8.891 10.794 4.849 1331 HB3 SER 64 HB1 SER 64 10.342 11.543 4.184 1332 HG SER 64 HG SER 64 9.408 11.611 2.193 1333 H GLY 65 HN GLY 65 8.421 8.368 2.169 1334 HA2 GLY 65 HA2 GLY 65 6.985 6.825 4.098 1335 HA3 GLY 65 HA1 GLY 65 6.890 6.655 2.348 1336 H GLY 66 HN GLY 66 9.928 6.351 2.374 1337 HA2 GLY 66 HA2 GLY 66 11.519 4.726 2.990 1338 HA3 GLY 66 HA1 GLY 66 10.228 3.751 3.671 1339 H LEU 67 HN LEU 67 10.041 5.123 0.448 1340 HA LEU 67 HA LEU 67 9.916 2.389 -0.589 1341 HB2 LEU 67 HB2 LEU 67 9.015 5.028 -1.727 1342 HB3 LEU 67 HB1 LEU 67 9.056 3.564 -2.683 1343 HG LEU 67 HG LEU 67 6.819 3.840 -1.990 1344 HD11 LEU 67 HD11 LEU 67 7.600 1.558 -1.818 1345 HD12 LEU 67 HD12 LEU 67 6.397 1.894 -0.573 1346 HD13 LEU 67 HD13 LEU 67 8.108 1.836 -0.153 1347 HD21 LEU 67 HD21 LEU 67 6.138 4.146 0.342 1348 HD22 LEU 67 HD22 LEU 67 7.157 5.470 -0.223 1349 HD23 LEU 67 HD23 LEU 67 7.834 4.222 0.822 1350 H VAL 68 HN VAL 68 11.807 5.343 -0.929 1351 HA VAL 68 HA VAL 68 13.516 3.921 -2.850 1352 HB VAL 68 HB VAL 68 13.871 5.942 -4.150 1353 HG11 VAL 68 HG11 VAL 68 12.082 4.449 -4.842 1354 HG12 VAL 68 HG12 VAL 68 11.684 6.126 -5.215 1355 HG13 VAL 68 HG13 VAL 68 10.938 5.331 -3.827 1356 HG21 VAL 68 HG21 VAL 68 11.842 7.224 -2.326 1357 HG22 VAL 68 HG22 VAL 68 12.501 7.947 -3.794 1358 HG23 VAL 68 HG23 VAL 68 13.560 7.615 -2.423 1359 H GLU 69 HN GLU 69 15.669 4.595 -2.983 1360 HA GLU 69 HA GLU 69 16.662 6.200 -0.721 1361 HB2 GLU 69 HB2 GLU 69 17.917 3.791 -2.053 1362 HB3 GLU 69 HB1 GLU 69 18.803 4.871 -0.987 1363 HG2 GLU 69 HG2 GLU 69 16.402 3.216 -0.249 1364 HG3 GLU 69 HG1 GLU 69 18.075 2.896 0.205 1365 H ALA 70 HN ALA 70 19.106 6.906 -1.399 1366 HA ALA 70 HA ALA 70 18.664 8.301 -3.954 1367 HB1 ALA 70 HB1 ALA 70 19.965 10.141 -3.070 1368 HB2 ALA 70 HB2 ALA 70 20.278 9.234 -1.590 1369 HB3 ALA 70 HB3 ALA 70 18.635 9.748 -1.978 1370 H ARG 71 HN ARG 71 20.291 8.602 -5.389 1371 HA ARG 71 HA ARG 71 22.878 7.274 -4.900 1372 HB2 ARG 71 HB2 ARG 71 21.087 7.247 -7.303 1373 HB3 ARG 71 HB1 ARG 71 22.824 7.187 -7.545 1374 HG2 ARG 71 HG2 ARG 71 21.339 5.244 -5.799 1375 HG3 ARG 71 HG1 ARG 71 21.647 4.978 -7.517 1376 HD2 ARG 71 HD2 ARG 71 23.720 5.381 -5.363 1377 HD3 ARG 71 HD1 ARG 71 23.339 3.864 -6.176 1378 HE ARG 71 HE ARG 71 24.025 5.746 -8.125 1379 HH11 ARG 71 HH11 ARG 71 25.510 3.947 -5.518 1380 HH12 ARG 71 HH12 ARG 71 27.104 4.002 -6.216 1381 HH21 ARG 71 HH21 ARG 71 26.104 5.838 -9.039 1382 HH22 ARG 71 HH22 ARG 71 27.448 5.110 -8.209 1383 H ARG 72 HN ARG 72 24.031 9.105 -4.326 1384 HA ARG 72 HA ARG 72 23.629 11.544 -5.859 1385 HB2 ARG 72 HB2 ARG 72 23.860 11.726 -3.429 1386 HB3 ARG 72 HB1 ARG 72 25.466 11.008 -3.516 1387 HG2 ARG 72 HG2 ARG 72 26.264 12.896 -4.814 1388 HG3 ARG 72 HG1 ARG 72 24.650 13.604 -4.809 1389 HD2 ARG 72 HD2 ARG 72 24.736 13.853 -2.401 1390 HD3 ARG 72 HD1 ARG 72 26.314 13.062 -2.356 1391 HE ARG 72 HE ARG 72 26.572 15.205 -4.087 1392 HH11 ARG 72 HH11 ARG 72 25.779 14.736 -0.694 1393 HH12 ARG 72 HH12 ARG 72 26.454 16.268 -0.209 1394 HH21 ARG 72 HH21 ARG 72 27.468 17.206 -3.426 1395 HH22 ARG 72 HH22 ARG 72 27.422 17.648 -1.748 1396 H GLU 73 HN GLU 73 24.904 12.331 -7.351 1397 HA GLU 73 HA GLU 73 27.590 11.207 -7.722 1398 HB2 GLU 73 HB2 GLU 73 26.209 10.106 -9.377 1399 HB3 GLU 73 HB1 GLU 73 25.498 11.637 -9.858 1400 HG2 GLU 73 HG2 GLU 73 27.578 12.372 -10.799 1401 HG3 GLU 73 HG1 GLU 73 28.400 10.932 -10.198 1402 H GLY 74 HN GLY 74 28.678 12.967 -6.998 1403 HA2 GLY 74 HA2 GLY 74 29.459 15.120 -6.883 1404 HA3 GLY 74 HA1 GLY 74 28.872 15.313 -8.531 1405 H THR 75 HN THR 75 27.415 16.853 -8.791 1406 HA THR 75 HA THR 75 25.909 17.790 -6.469 1407 HB THR 75 HB THR 75 25.253 19.680 -7.949 1408 HG1 THR 75 HG1 THR 75 25.658 19.583 -10.012 1409 HG21 THR 75 HG21 THR 75 27.476 20.740 -8.046 1410 HG22 THR 75 HG22 THR 75 28.222 19.173 -7.730 1411 HG23 THR 75 HG23 THR 75 27.194 19.925 -6.509 1412 H ARG 76 HN ARG 76 25.521 15.452 -8.645 1413 HA ARG 76 HA ARG 76 22.727 15.983 -9.304 1414 HB2 ARG 76 HB2 ARG 76 24.494 13.634 -10.010 1415 HB3 ARG 76 HB1 ARG 76 22.857 13.889 -10.591 1416 HG2 ARG 76 HG2 ARG 76 23.587 15.904 -11.759 1417 HG3 ARG 76 HG1 ARG 76 25.236 15.633 -11.180 1418 HD2 ARG 76 HD2 ARG 76 25.291 13.481 -12.328 1419 HD3 ARG 76 HD1 ARG 76 23.638 13.727 -12.884 1420 HE ARG 76 HE ARG 76 25.446 15.820 -13.663 1421 HH11 ARG 76 HH11 ARG 76 24.180 12.653 -14.500 1422 HH12 ARG 76 HH12 ARG 76 24.517 12.834 -16.196 1423 HH21 ARG 76 HH21 ARG 76 25.883 16.045 -15.899 1424 HH22 ARG 76 HH22 ARG 76 25.493 14.740 -16.984 1425 H GLN 77 HN GLN 77 21.041 14.805 -8.538 1426 HA GLN 77 HA GLN 77 21.675 12.754 -6.526 1427 HB2 GLN 77 HB2 GLN 77 19.471 14.822 -6.401 1428 HB3 GLN 77 HB1 GLN 77 19.592 13.440 -5.318 1429 HG2 GLN 77 HG2 GLN 77 21.785 14.269 -4.557 1430 HG3 GLN 77 HG1 GLN 77 21.582 15.684 -5.589 1431 HE21 GLN 77 HE21 GLN 77 20.548 14.060 -2.704 1432 HE22 GLN 77 HE22 GLN 77 19.691 15.394 -2.016 1433 H TYR 78 HN TYR 78 21.301 10.957 -7.623 1434 HA TYR 78 HA TYR 78 18.866 10.661 -9.193 1435 HB2 TYR 78 HB2 TYR 78 21.047 8.640 -8.586 1436 HB3 TYR 78 HB1 TYR 78 19.727 8.418 -9.725 1437 HD1 TYR 78 HD1 TYR 78 22.667 10.617 -9.063 1438 HD2 TYR 78 HD2 TYR 78 20.056 8.929 -11.970 1439 HE1 TYR 78 HE1 TYR 78 24.087 11.507 -10.853 1440 HE2 TYR 78 HE2 TYR 78 21.480 9.823 -13.771 1441 HH TYR 78 HH TYR 78 24.617 11.071 -13.167 1442 H TYR 79 HN TYR 79 17.336 8.976 -8.671 1443 HA TYR 79 HA TYR 79 17.506 8.069 -5.880 1444 HB2 TYR 79 HB2 TYR 79 15.158 9.125 -7.415 1445 HB3 TYR 79 HB1 TYR 79 14.902 7.968 -6.109 1446 HD1 TYR 79 HD1 TYR 79 16.244 11.327 -6.914 1447 HD2 TYR 79 HD2 TYR 79 15.073 8.629 -3.838 1448 HE1 TYR 79 HE1 TYR 79 16.404 13.146 -5.264 1449 HE2 TYR 79 HE2 TYR 79 15.225 10.439 -2.181 1450 HH TYR 79 HH TYR 79 15.474 13.694 -3.039 1451 H ARG 80 HN ARG 80 16.308 6.046 -5.472 1452 HA ARG 80 HA ARG 80 15.948 4.271 -7.739 1453 HB2 ARG 80 HB2 ARG 80 17.604 2.643 -6.965 1454 HB3 ARG 80 HB1 ARG 80 18.388 4.176 -7.328 1455 HG2 ARG 80 HG2 ARG 80 18.287 4.717 -4.895 1456 HG3 ARG 80 HG1 ARG 80 17.699 3.078 -4.615 1457 HD2 ARG 80 HD2 ARG 80 20.321 3.790 -5.916 1458 HD3 ARG 80 HD1 ARG 80 20.121 3.312 -4.235 1459 HE ARG 80 HE ARG 80 19.037 1.341 -5.963 1460 HH11 ARG 80 HH11 ARG 80 22.057 2.616 -4.730 1461 HH12 ARG 80 HH12 ARG 80 22.943 1.144 -5.025 1462 HH21 ARG 80 HH21 ARG 80 20.187 -0.593 -6.336 1463 HH22 ARG 80 HH22 ARG 80 21.868 -0.691 -5.901 1464 H ILE 81 HN ILE 81 14.895 2.295 -7.095 1465 HA ILE 81 HA ILE 81 13.185 2.502 -4.856 1466 HB ILE 81 HB ILE 81 13.939 0.010 -6.403 1467 HG12 ILE 81 HG12 ILE 81 11.646 1.947 -6.818 1468 HG13 ILE 81 HG11 ILE 81 13.074 1.830 -7.843 1469 HG21 ILE 81 HG21 ILE 81 11.785 -0.859 -5.624 1470 HG22 ILE 81 HG22 ILE 81 11.537 0.609 -4.678 1471 HG23 ILE 81 HG23 ILE 81 12.859 -0.487 -4.275 1472 HD11 ILE 81 HD11 ILE 81 12.443 -0.404 -8.513 1473 HD12 ILE 81 HD12 ILE 81 11.117 0.721 -8.812 1474 HD13 ILE 81 HD13 ILE 81 11.058 -0.364 -7.422 1475 H ALA 82 HN ALA 82 13.383 1.748 -2.782 1476 HA ALA 82 HA ALA 82 15.896 1.689 -1.636 1477 HB1 ALA 82 HB1 ALA 82 13.837 2.173 -0.410 1478 HB2 ALA 82 HB2 ALA 82 14.808 0.945 0.405 1479 HB3 ALA 82 HB3 ALA 82 13.380 0.473 -0.515 1480 H GLY 83 HN GLY 83 13.887 -1.070 -2.599 1481 HA2 GLY 83 HA2 GLY 83 16.245 -2.746 -2.672 1482 HA3 GLY 83 HA1 GLY 83 15.063 -3.202 -1.453 1483 H GLU 84 HN GLU 84 15.687 -5.000 -3.343 1484 HA GLU 84 HA GLU 84 14.233 -4.906 -5.740 1485 HB2 GLU 84 HB2 GLU 84 16.120 -6.467 -5.194 1486 HB3 GLU 84 HB1 GLU 84 15.004 -7.385 -4.194 1487 HG2 GLU 84 HG2 GLU 84 15.252 -8.448 -6.339 1488 HG3 GLU 84 HG1 GLU 84 13.613 -7.822 -6.167 1489 H ASP 85 HN ASP 85 13.372 -6.143 -2.539 1490 HA ASP 85 HA ASP 85 10.910 -7.300 -3.385 1491 HB2 ASP 85 HB2 ASP 85 11.957 -6.573 -0.652 1492 HB3 ASP 85 HB1 ASP 85 10.388 -7.332 -0.911 1493 H VAL 86 HN VAL 86 11.868 -4.129 -2.349 1494 HA VAL 86 HA VAL 86 9.279 -3.101 -1.828 1495 HB VAL 86 HB VAL 86 11.714 -1.594 -2.815 1496 HG11 VAL 86 HG11 VAL 86 9.245 -0.624 -1.376 1497 HG12 VAL 86 HG12 VAL 86 9.646 -0.327 -3.068 1498 HG13 VAL 86 HG13 VAL 86 10.649 0.362 -1.790 1499 HG21 VAL 86 HG21 VAL 86 10.788 -2.190 -0.009 1500 HG22 VAL 86 HG22 VAL 86 12.081 -1.067 -0.427 1501 HG23 VAL 86 HG23 VAL 86 12.253 -2.785 -0.786 1502 H ALA 87 HN ALA 87 11.260 -3.405 -4.719 1503 HA ALA 87 HA ALA 87 9.477 -2.081 -6.489 1504 HB1 ALA 87 HB1 ALA 87 11.820 -2.448 -7.057 1505 HB2 ALA 87 HB2 ALA 87 10.761 -3.175 -8.267 1506 HB3 ALA 87 HB3 ALA 87 11.556 -4.193 -7.066 1507 H ARG 88 HN ARG 88 9.951 -5.463 -5.560 1508 HA ARG 88 HA ARG 88 8.011 -6.629 -7.209 1509 HB2 ARG 88 HB2 ARG 88 8.923 -7.471 -4.452 1510 HB3 ARG 88 HB1 ARG 88 7.954 -8.464 -5.530 1511 HG2 ARG 88 HG2 ARG 88 9.764 -8.503 -7.152 1512 HG3 ARG 88 HG1 ARG 88 10.738 -7.473 -6.102 1513 HD2 ARG 88 HD2 ARG 88 11.381 -9.811 -5.872 1514 HD3 ARG 88 HD1 ARG 88 10.695 -9.194 -4.369 1515 HE ARG 88 HE ARG 88 9.202 -10.882 -6.279 1516 HH11 ARG 88 HH11 ARG 88 10.073 -9.976 -3.004 1517 HH12 ARG 88 HH12 ARG 88 8.973 -11.104 -2.273 1518 HH21 ARG 88 HH21 ARG 88 7.769 -12.383 -5.301 1519 HH22 ARG 88 HH22 ARG 88 7.671 -12.456 -3.562 1520 H LEU 89 HN LEU 89 7.774 -5.074 -4.082 1521 HA LEU 89 HA LEU 89 5.130 -5.710 -3.436 1522 HB2 LEU 89 HB2 LEU 89 6.869 -4.609 -1.969 1523 HB3 LEU 89 HB1 LEU 89 6.553 -3.116 -2.825 1524 HG LEU 89 HG LEU 89 4.326 -4.553 -1.407 1525 HD11 LEU 89 HD11 LEU 89 4.791 -3.189 0.568 1526 HD12 LEU 89 HD12 LEU 89 6.261 -2.582 -0.196 1527 HD13 LEU 89 HD13 LEU 89 6.125 -4.290 0.221 1528 HD21 LEU 89 HD21 LEU 89 4.838 -1.652 -2.068 1529 HD22 LEU 89 HD22 LEU 89 3.420 -2.282 -1.230 1530 HD23 LEU 89 HD23 LEU 89 3.722 -2.727 -2.910 1531 H PHE 90 HN PHE 90 6.394 -2.769 -5.016 1532 HA PHE 90 HA PHE 90 3.914 -1.625 -5.630 1533 HB2 PHE 90 HB2 PHE 90 6.009 -0.368 -5.743 1534 HB3 PHE 90 HB1 PHE 90 6.559 -1.361 -7.088 1535 HD1 PHE 90 HD2 PHE 90 3.919 1.047 -6.080 1536 HD2 PHE 90 HD1 PHE 90 6.067 -0.750 -9.284 1537 HE1 PHE 90 HE2 PHE 90 2.882 2.627 -7.657 1538 HE2 PHE 90 HE1 PHE 90 5.038 0.829 -10.868 1539 HZ PHE 90 HZ PHE 90 3.441 2.518 -10.053 1540 H ALA 91 HN ALA 91 5.940 -3.866 -7.461 1541 HA ALA 91 HA ALA 91 4.417 -3.977 -9.803 1542 HB1 ALA 91 HB1 ALA 91 6.016 -6.194 -8.529 1543 HB2 ALA 91 HB2 ALA 91 6.650 -4.961 -9.618 1544 HB3 ALA 91 HB3 ALA 91 5.474 -6.138 -10.205 1545 H LEU 92 HN LEU 92 4.275 -6.054 -6.910 1546 HA LEU 92 HA LEU 92 2.157 -7.683 -7.711 1547 HB2 LEU 92 HB2 LEU 92 3.604 -8.127 -5.772 1548 HB3 LEU 92 HB1 LEU 92 2.886 -6.772 -4.924 1549 HG LEU 92 HG LEU 92 0.701 -7.942 -4.950 1550 HD11 LEU 92 HD11 LEU 92 1.061 -9.314 -6.945 1551 HD12 LEU 92 HD12 LEU 92 0.594 -10.294 -5.555 1552 HD13 LEU 92 HD13 LEU 92 2.278 -10.251 -6.078 1553 HD21 LEU 92 HD21 LEU 92 2.980 -9.503 -3.744 1554 HD22 LEU 92 HD22 LEU 92 1.283 -9.638 -3.283 1555 HD23 LEU 92 HD23 LEU 92 2.155 -8.128 -3.014 1556 H VAL 93 HN VAL 93 2.151 -4.523 -6.166 1557 HA VAL 93 HA VAL 93 -0.542 -4.314 -5.503 1558 HB VAL 93 HB VAL 93 1.419 -2.176 -6.351 1559 HG11 VAL 93 HG11 VAL 93 -0.868 -1.387 -6.696 1560 HG12 VAL 93 HG12 VAL 93 -0.092 -0.559 -5.346 1561 HG13 VAL 93 HG13 VAL 93 -1.271 -1.835 -5.038 1562 HG21 VAL 93 HG21 VAL 93 2.040 -3.364 -4.324 1563 HG22 VAL 93 HG22 VAL 93 0.442 -3.063 -3.640 1564 HG23 VAL 93 HG23 VAL 93 1.538 -1.716 -3.946 1565 H GLN 94 HN GLN 94 1.068 -3.219 -8.522 1566 HA GLN 94 HA GLN 94 -1.466 -2.575 -9.701 1567 HB2 GLN 94 HB2 GLN 94 -0.209 -2.099 -11.750 1568 HB3 GLN 94 HB1 GLN 94 0.503 -1.308 -10.352 1569 HG2 GLN 94 HG2 GLN 94 2.258 -2.952 -10.261 1570 HG3 GLN 94 HG1 GLN 94 1.512 -3.863 -11.576 1571 HE21 GLN 94 HE21 GLN 94 3.304 -3.688 -12.897 1572 HE22 GLN 94 HE22 GLN 94 3.767 -2.193 -13.638 1573 H VAL 95 HN VAL 95 0.496 -5.411 -9.514 1574 HA VAL 95 HA VAL 95 -0.614 -6.776 -11.746 1575 HB VAL 95 HB VAL 95 0.789 -7.771 -9.265 1576 HG11 VAL 95 HG11 VAL 95 0.813 -10.011 -10.259 1577 HG12 VAL 95 HG12 VAL 95 -0.245 -9.447 -11.554 1578 HG13 VAL 95 HG13 VAL 95 -0.831 -9.489 -9.891 1579 HG21 VAL 95 HG21 VAL 95 2.170 -6.671 -10.937 1580 HG22 VAL 95 HG22 VAL 95 1.532 -7.737 -12.189 1581 HG23 VAL 95 HG23 VAL 95 2.524 -8.397 -10.889 1582 H VAL 96 HN VAL 96 -1.486 -6.761 -8.273 1583 HA VAL 96 HA VAL 96 -3.662 -8.558 -8.645 1584 HB VAL 96 HB VAL 96 -4.429 -7.914 -6.416 1585 HG11 VAL 96 HG11 VAL 96 -1.444 -8.308 -6.568 1586 HG12 VAL 96 HG12 VAL 96 -2.671 -9.576 -6.620 1587 HG13 VAL 96 HG13 VAL 96 -2.456 -8.617 -5.157 1588 HG21 VAL 96 HG21 VAL 96 -3.207 -6.277 -5.073 1589 HG22 VAL 96 HG22 VAL 96 -3.952 -5.523 -6.483 1590 HG23 VAL 96 HG23 VAL 96 -2.220 -5.858 -6.475 1591 H ALA 97 HN ALA 97 -3.273 -5.130 -9.006 1592 HA ALA 97 HA ALA 97 -6.068 -4.537 -9.156 1593 HB1 ALA 97 HB1 ALA 97 -5.360 -2.363 -9.971 1594 HB2 ALA 97 HB2 ALA 97 -3.719 -2.966 -10.204 1595 HB3 ALA 97 HB3 ALA 97 -4.391 -2.845 -8.578 1596 H ASP 98 HN ASP 98 -3.557 -4.485 -11.698 1597 HA ASP 98 HA ASP 98 -5.420 -4.100 -13.783 1598 HB2 ASP 98 HB2 ASP 98 -3.138 -3.335 -13.993 1599 HB3 ASP 98 HB1 ASP 98 -2.533 -4.980 -13.858 1600 H GLU 99 HN GLU 99 -3.746 -7.030 -12.669 1601 HA GLU 99 HA GLU 99 -4.612 -8.602 -14.882 1602 HB2 GLU 99 HB2 GLU 99 -2.598 -9.185 -13.635 1603 HB3 GLU 99 HB1 GLU 99 -3.549 -9.455 -12.183 1604 HG2 GLU 99 HG2 GLU 99 -4.613 -11.361 -13.155 1605 HG3 GLU 99 HG1 GLU 99 -3.885 -11.027 -14.726 1606 H HIS 100 HN HIS 100 -6.068 -7.723 -11.869 1607 HA HIS 100 HA HIS 100 -8.032 -9.860 -12.007 1608 HB2 HIS 100 HB2 HIS 100 -7.548 -7.596 -10.098 1609 HB3 HIS 100 HB1 HIS 100 -9.075 -8.470 -10.073 1610 HD1 HIS 100 HD1 HIS 100 -8.980 -9.959 -8.109 1611 HD2 HIS 100 HD2 HIS 100 -5.395 -9.951 -10.220 1612 HE1 HIS 100 HE1 HIS 100 -7.522 -11.676 -6.979 1613 HE2 HIS 100 HE2 HIS 100 -5.413 -11.761 -8.365 1614 H LEU 101 HN LEU 101 -7.576 -6.963 -13.533 1615 HA LEU 101 HA LEU 101 -10.334 -6.131 -13.652 1616 HB2 LEU 101 HB2 LEU 101 -7.925 -5.229 -15.224 1617 HB3 LEU 101 HB1 LEU 101 -9.517 -4.511 -15.348 1618 HG LEU 101 HG LEU 101 -7.773 -4.519 -12.887 1619 HD11 LEU 101 HD11 LEU 101 -8.552 -2.281 -14.751 1620 HD12 LEU 101 HD12 LEU 101 -6.966 -3.047 -14.668 1621 HD13 LEU 101 HD13 LEU 101 -7.575 -2.132 -13.289 1622 HD21 LEU 101 HD21 LEU 101 -9.462 -3.028 -11.942 1623 HD22 LEU 101 HD22 LEU 101 -10.145 -4.610 -12.321 1624 HD23 LEU 101 HD23 LEU 101 -10.458 -3.236 -13.383 1625 H GLU 102 HN GLU 102 -11.335 -8.001 -14.443 1626 HA GLU 102 HA GLU 102 -11.317 -7.994 -17.348 1627 HB2 GLU 102 HB2 GLU 102 -11.581 -10.484 -17.402 1628 HB3 GLU 102 HB1 GLU 102 -9.988 -9.926 -16.927 1629 HG2 GLU 102 HG2 GLU 102 -10.285 -11.575 -15.408 1630 HG3 GLU 102 HG1 GLU 102 -10.965 -10.226 -14.506 1631 H HIS 103 HN HIS 103 -13.252 -7.938 -18.198 1632 HA HIS 103 HA HIS 103 -15.634 -8.968 -17.147 1633 HB2 HIS 103 HB2 HIS 103 -15.255 -7.243 -15.379 1634 HB3 HIS 103 HB1 HIS 103 -15.297 -5.999 -16.622 1635 HD1 HIS 103 HD1 HIS 103 -17.579 -8.635 -15.083 1636 HD2 HIS 103 HD2 HIS 103 -17.790 -5.045 -17.180 1637 HE1 HIS 103 HE1 HIS 103 -20.002 -7.982 -15.075 1638 HE2 HIS 103 HE2 HIS 103 -20.097 -5.749 -16.237 1639 H HIS 104 HN HIS 104 -13.821 -7.019 -19.269 1640 HA HIS 104 HA HIS 104 -15.974 -6.150 -20.942 1641 HB2 HIS 104 HB2 HIS 104 -13.038 -6.470 -21.623 1642 HB3 HIS 104 HB1 HIS 104 -14.229 -5.608 -22.590 1643 HD1 HIS 104 HD1 HIS 104 -15.574 -3.830 -20.528 1644 HD2 HIS 104 HD2 HIS 104 -11.469 -4.528 -20.597 1645 HE1 HIS 104 HE1 HIS 104 -14.527 -1.877 -19.335 1646 HE2 HIS 104 HE2 HIS 104 -12.052 -2.366 -19.296 1647 H HIS 105 HN HIS 105 -14.137 -9.038 -20.563 1648 HA HIS 105 HA HIS 105 -15.685 -10.222 -22.760 1649 HB2 HIS 105 HB2 HIS 105 -13.877 -12.015 -22.833 1650 HB3 HIS 105 HB1 HIS 105 -13.440 -10.438 -23.467 1651 HD1 HIS 105 HD1 HIS 105 -13.067 -12.288 -20.141 1652 HD2 HIS 105 HD2 HIS 105 -11.034 -9.623 -22.590 1653 HE1 HIS 105 HE1 HIS 105 -10.822 -11.955 -19.058 1654 HE2 HIS 105 HE2 HIS 105 -9.540 -10.521 -20.682 1655 H HIS 106 HN HIS 106 -17.429 -10.794 -21.565 1656 HA HIS 106 HA HIS 106 -17.242 -12.047 -19.015 1657 HB2 HIS 106 HB2 HIS 106 -19.225 -10.762 -19.716 1658 HB3 HIS 106 HB1 HIS 106 -19.564 -11.964 -20.956 1659 HD1 HIS 106 HD1 HIS 106 -21.128 -13.759 -20.309 1660 HD2 HIS 106 HD2 HIS 106 -19.375 -11.955 -16.993 1661 HE1 HIS 106 HE1 HIS 106 -22.246 -14.786 -18.305 1662 HE2 HIS 106 HE2 HIS 106 -21.294 -13.560 -16.320 1663 H HIS 107 HN HIS 107 -17.297 -13.177 -22.305 1664 HA HIS 107 HA HIS 107 -17.419 -15.963 -21.374 1665 HB2 HIS 107 HB2 HIS 107 -18.932 -15.265 -23.239 1666 HB3 HIS 107 HB1 HIS 107 -17.510 -14.921 -24.216 1667 HD1 HIS 107 HD1 HIS 107 -19.439 -17.767 -22.710 1668 HD2 HIS 107 HD2 HIS 107 -16.302 -17.154 -25.369 1669 HE1 HIS 107 HE1 HIS 107 -19.031 -19.993 -23.798 1670 HE2 HIS 107 HE2 HIS 107 -17.292 -19.542 -25.563 1671 H HIS 108 HN HIS 108 -15.646 -17.199 -21.335 1672 HA HIS 108 HA HIS 108 -13.411 -16.617 -23.076 1673 HB2 HIS 108 HB2 HIS 108 -11.756 -16.606 -21.185 1674 HB3 HIS 108 HB1 HIS 108 -12.760 -15.169 -21.291 1675 HD1 HIS 108 HD1 HIS 108 -11.971 -18.069 -19.095 1676 HD2 HIS 108 HD2 HIS 108 -14.582 -14.833 -19.159 1677 HE1 HIS 108 HE1 HIS 108 -12.878 -17.880 -16.757 1678 HE2 HIS 108 HE2 HIS 108 -14.234 -15.755 -16.770 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -1.515 5.558 -35.058 2 H2 MET 1 HT2 MET 1 -0.108 4.690 -35.429 3 H3 MET 1 HT3 MET 1 0.003 6.270 -34.817 4 HA MET 1 HA MET 1 -1.093 3.938 -33.359 5 HB2 MET 1 HB2 MET 1 1.533 5.414 -33.074 6 HB3 MET 1 HB1 MET 1 0.921 4.260 -31.899 7 HG2 MET 1 HG2 MET 1 0.965 2.511 -33.622 8 HG3 MET 1 HG1 MET 1 1.632 3.677 -34.764 9 HE1 MET 1 HE1 MET 1 4.665 1.305 -33.965 10 HE2 MET 1 HE2 MET 1 3.648 1.980 -35.238 11 HE3 MET 1 HE3 MET 1 2.966 0.850 -34.069 12 H ALA 2 HN ALA 2 -0.886 4.610 -30.886 13 HA ALA 2 HA ALA 2 -1.802 7.371 -30.555 14 HB1 ALA 2 HB1 ALA 2 -3.280 4.953 -29.507 15 HB2 ALA 2 HB2 ALA 2 -3.820 6.009 -30.813 16 HB3 ALA 2 HB3 ALA 2 -3.685 6.637 -29.170 17 H GLY 3 HN GLY 3 -1.781 8.069 -28.300 18 HA2 GLY 3 HA2 GLY 3 0.076 6.471 -26.641 19 HA3 GLY 3 HA1 GLY 3 0.158 8.227 -26.737 20 H GLN 4 HN GLN 4 -0.763 9.280 -25.133 21 HA GLN 4 HA GLN 4 -2.082 9.843 -23.388 22 HB2 GLN 4 HB2 GLN 4 -4.082 7.992 -24.699 23 HB3 GLN 4 HB1 GLN 4 -4.446 9.166 -23.442 24 HG2 GLN 4 HG2 GLN 4 -3.339 9.857 -26.153 25 HG3 GLN 4 HG1 GLN 4 -5.044 9.920 -25.715 26 HE21 GLN 4 HE21 GLN 4 -1.907 11.373 -25.243 27 HE22 GLN 4 HE22 GLN 4 -2.489 12.843 -24.536 28 H SER 5 HN SER 5 -0.672 8.853 -21.921 29 HA SER 5 HA SER 5 -1.051 6.109 -21.145 30 HB2 SER 5 HB2 SER 5 0.687 6.835 -19.366 31 HB3 SER 5 HB1 SER 5 1.184 6.812 -21.058 32 HG SER 5 HG SER 5 1.834 8.756 -20.231 33 H ASP 6 HN ASP 6 -2.930 8.625 -20.615 34 HA ASP 6 HA ASP 6 -3.259 8.884 -17.848 35 HB2 ASP 6 HB2 ASP 6 -5.351 9.175 -20.011 36 HB3 ASP 6 HB1 ASP 6 -5.462 9.822 -18.378 37 H ARG 7 HN ARG 7 -4.316 6.405 -20.046 38 HA ARG 7 HA ARG 7 -6.388 5.351 -18.407 39 HB2 ARG 7 HB2 ARG 7 -4.765 3.889 -20.496 40 HB3 ARG 7 HB1 ARG 7 -6.317 3.389 -19.837 41 HG2 ARG 7 HG2 ARG 7 -7.193 5.624 -20.750 42 HG3 ARG 7 HG1 ARG 7 -5.704 5.653 -21.697 43 HD2 ARG 7 HD2 ARG 7 -7.868 3.558 -21.757 44 HD3 ARG 7 HD1 ARG 7 -7.451 4.697 -23.034 45 HE ARG 7 HE ARG 7 -5.914 2.323 -22.236 46 HH11 ARG 7 HH11 ARG 7 -6.326 5.069 -24.379 47 HH12 ARG 7 HH12 ARG 7 -5.352 4.390 -25.649 48 HH21 ARG 7 HH21 ARG 7 -4.648 1.411 -23.937 49 HH22 ARG 7 HH22 ARG 7 -4.409 2.323 -25.404 50 H LYS 8 HN LYS 8 -2.932 4.970 -18.495 51 HA LYS 8 HA LYS 8 -2.845 2.626 -16.838 52 HB2 LYS 8 HB2 LYS 8 -1.020 3.306 -18.421 53 HB3 LYS 8 HB1 LYS 8 -0.661 4.654 -17.354 54 HG2 LYS 8 HG2 LYS 8 -0.124 3.074 -15.555 55 HG3 LYS 8 HG1 LYS 8 -0.457 1.732 -16.650 56 HD2 LYS 8 HD2 LYS 8 1.317 2.569 -18.155 57 HD3 LYS 8 HD1 LYS 8 1.683 3.833 -16.983 58 HE2 LYS 8 HE2 LYS 8 1.889 0.861 -16.515 59 HE3 LYS 8 HE1 LYS 8 3.237 1.959 -16.797 60 HZ1 LYS 8 HZ1 LYS 8 2.446 3.170 -14.755 61 HZ2 LYS 8 HZ2 LYS 8 3.130 1.644 -14.495 62 HZ3 LYS 8 HZ3 LYS 8 1.446 1.837 -14.443 63 H ALA 9 HN ALA 9 -3.072 6.030 -16.377 64 HA ALA 9 HA ALA 9 -2.214 6.134 -13.670 65 HB1 ALA 9 HB1 ALA 9 -3.172 8.351 -13.624 66 HB2 ALA 9 HB2 ALA 9 -4.060 8.030 -15.112 67 HB3 ALA 9 HB3 ALA 9 -2.299 8.117 -15.138 68 H ALA 10 HN ALA 10 -5.053 4.991 -15.174 69 HA ALA 10 HA ALA 10 -6.856 5.350 -12.986 70 HB1 ALA 10 HB1 ALA 10 -8.305 3.790 -14.180 71 HB2 ALA 10 HB2 ALA 10 -6.983 3.385 -15.277 72 HB3 ALA 10 HB3 ALA 10 -7.665 5.014 -15.275 73 H LEU 11 HN LEU 11 -4.507 2.932 -13.923 74 HA LEU 11 HA LEU 11 -5.329 1.036 -11.925 75 HB2 LEU 11 HB2 LEU 11 -2.763 1.227 -13.509 76 HB3 LEU 11 HB1 LEU 11 -3.183 -0.104 -12.451 77 HG LEU 11 HG LEU 11 -3.687 -0.932 -14.556 78 HD11 LEU 11 HD11 LEU 11 -6.127 -1.043 -14.720 79 HD12 LEU 11 HD12 LEU 11 -6.259 0.278 -13.559 80 HD13 LEU 11 HD13 LEU 11 -5.561 -1.265 -13.065 81 HD21 LEU 11 HD21 LEU 11 -4.937 1.717 -15.256 82 HD22 LEU 11 HD22 LEU 11 -4.857 0.303 -16.306 83 HD23 LEU 11 HD23 LEU 11 -3.375 1.121 -15.814 84 H LEU 12 HN LEU 12 -3.031 3.630 -12.219 85 HA LEU 12 HA LEU 12 -1.729 3.223 -9.725 86 HB2 LEU 12 HB2 LEU 12 -2.020 5.723 -11.401 87 HB3 LEU 12 HB1 LEU 12 -0.923 5.539 -10.044 88 HG LEU 12 HG LEU 12 -0.802 3.887 -12.569 89 HD11 LEU 12 HD11 LEU 12 1.196 5.195 -13.102 90 HD12 LEU 12 HD12 LEU 12 0.892 6.220 -11.696 91 HD13 LEU 12 HD13 LEU 12 -0.250 6.205 -13.041 92 HD21 LEU 12 HD21 LEU 12 0.075 2.755 -10.582 93 HD22 LEU 12 HD22 LEU 12 1.125 4.138 -10.262 94 HD23 LEU 12 HD23 LEU 12 1.361 3.167 -11.717 95 H ASP 13 HN ASP 13 -4.535 5.048 -10.788 96 HA ASP 13 HA ASP 13 -5.224 6.254 -8.340 97 HB2 ASP 13 HB2 ASP 13 -6.360 6.963 -10.319 98 HB3 ASP 13 HB1 ASP 13 -6.871 5.323 -10.696 99 H GLN 14 HN GLN 14 -5.761 3.075 -9.670 100 HA GLN 14 HA GLN 14 -7.611 2.155 -7.747 101 HB2 GLN 14 HB2 GLN 14 -7.059 1.189 -10.064 102 HB3 GLN 14 HB1 GLN 14 -5.705 0.399 -9.270 103 HG2 GLN 14 HG2 GLN 14 -7.560 -1.119 -9.430 104 HG3 GLN 14 HG1 GLN 14 -7.262 -0.710 -7.741 105 HE21 GLN 14 HE21 GLN 14 -8.828 1.453 -9.998 106 HE22 GLN 14 HE22 GLN 14 -10.395 1.377 -9.276 107 H VAL 15 HN VAL 15 -4.088 1.686 -8.073 108 HA VAL 15 HA VAL 15 -3.853 0.179 -5.680 109 HB VAL 15 HB VAL 15 -1.447 0.476 -5.877 110 HG11 VAL 15 HG11 VAL 15 -2.507 -1.194 -7.280 111 HG12 VAL 15 HG12 VAL 15 -1.134 -0.469 -8.118 112 HG13 VAL 15 HG13 VAL 15 -2.777 0.011 -8.539 113 HG21 VAL 15 HG21 VAL 15 -1.393 2.834 -6.522 114 HG22 VAL 15 HG22 VAL 15 -2.058 2.418 -8.101 115 HG23 VAL 15 HG23 VAL 15 -0.457 1.840 -7.639 116 H ALA 16 HN ALA 16 -3.934 3.574 -6.364 117 HA ALA 16 HA ALA 16 -2.901 4.509 -3.904 118 HB1 ALA 16 HB1 ALA 16 -4.910 5.817 -5.737 119 HB2 ALA 16 HB2 ALA 16 -3.156 5.964 -5.851 120 HB3 ALA 16 HB3 ALA 16 -4.007 6.617 -4.451 121 H ARG 17 HN ARG 17 -6.104 3.474 -4.953 122 HA ARG 17 HA ARG 17 -7.506 4.225 -2.619 123 HB2 ARG 17 HB2 ARG 17 -8.676 3.634 -4.690 124 HB3 ARG 17 HB1 ARG 17 -8.072 1.985 -4.577 125 HG2 ARG 17 HG2 ARG 17 -9.371 1.585 -2.598 126 HG3 ARG 17 HG1 ARG 17 -9.870 3.274 -2.535 127 HD2 ARG 17 HD2 ARG 17 -11.677 1.982 -3.430 128 HD3 ARG 17 HD1 ARG 17 -11.002 2.964 -4.724 129 HE ARG 17 HE ARG 17 -9.869 0.910 -5.500 130 HH11 ARG 17 HH11 ARG 17 -12.621 0.601 -3.356 131 HH12 ARG 17 HH12 ARG 17 -13.074 -0.970 -3.952 132 HH21 ARG 17 HH21 ARG 17 -10.486 -1.151 -6.313 133 HH22 ARG 17 HH22 ARG 17 -11.865 -1.955 -5.628 134 H VAL 18 HN VAL 18 -5.784 1.294 -3.554 135 HA VAL 18 HA VAL 18 -6.351 -0.231 -1.254 136 HB VAL 18 HB VAL 18 -3.874 -0.330 -2.987 137 HG11 VAL 18 HG11 VAL 18 -3.527 -1.503 -0.903 138 HG12 VAL 18 HG12 VAL 18 -3.704 -2.664 -2.220 139 HG13 VAL 18 HG13 VAL 18 -5.044 -2.379 -1.109 140 HG21 VAL 18 HG21 VAL 18 -5.866 -0.604 -4.331 141 HG22 VAL 18 HG22 VAL 18 -6.481 -1.829 -3.222 142 HG23 VAL 18 HG23 VAL 18 -5.033 -2.151 -4.176 143 H GLY 19 HN GLY 19 -3.598 1.883 -2.052 144 HA2 GLY 19 HA2 GLY 19 -2.233 1.597 0.396 145 HA3 GLY 19 HA1 GLY 19 -2.060 2.948 -0.715 146 H LYS 20 HN LYS 20 -4.791 3.781 -0.608 147 HA LYS 20 HA LYS 20 -4.756 5.547 1.556 148 HB2 LYS 20 HB2 LYS 20 -6.040 5.986 -0.456 149 HB3 LYS 20 HB1 LYS 20 -7.058 4.589 -0.151 150 HG2 LYS 20 HG2 LYS 20 -7.895 5.693 1.894 151 HG3 LYS 20 HG1 LYS 20 -6.933 7.115 1.481 152 HD2 LYS 20 HD2 LYS 20 -8.161 7.429 -0.557 153 HD3 LYS 20 HD1 LYS 20 -9.023 5.908 -0.325 154 HE2 LYS 20 HE2 LYS 20 -10.081 6.821 1.684 155 HE3 LYS 20 HE1 LYS 20 -9.219 8.342 1.445 156 HZ1 LYS 20 HZ1 LYS 20 -11.132 7.171 -0.507 157 HZ2 LYS 20 HZ2 LYS 20 -10.386 8.692 -0.603 158 HZ3 LYS 20 HZ3 LYS 20 -11.525 8.383 0.612 159 H ALA 21 HN ALA 21 -6.326 2.406 1.156 160 HA ALA 21 HA ALA 21 -7.681 2.496 3.672 161 HB1 ALA 21 HB1 ALA 21 -8.495 1.123 1.812 162 HB2 ALA 21 HB2 ALA 21 -8.207 0.155 3.254 163 HB3 ALA 21 HB3 ALA 21 -7.052 0.117 1.924 164 H LEU 22 HN LEU 22 -4.584 1.295 2.547 165 HA LEU 22 HA LEU 22 -3.887 -0.094 4.927 166 HB2 LEU 22 HB2 LEU 22 -2.125 1.124 2.799 167 HB3 LEU 22 HB1 LEU 22 -1.562 0.056 4.068 168 HG LEU 22 HG LEU 22 -3.503 -0.692 1.878 169 HD11 LEU 22 HD11 LEU 22 -1.668 -2.096 1.057 170 HD12 LEU 22 HD12 LEU 22 -0.612 -1.437 2.306 171 HD13 LEU 22 HD13 LEU 22 -1.244 -0.386 1.040 172 HD21 LEU 22 HD21 LEU 22 -3.222 -2.977 2.732 173 HD22 LEU 22 HD22 LEU 22 -3.965 -1.909 3.924 174 HD23 LEU 22 HD23 LEU 22 -2.263 -2.348 4.073 175 H ALA 23 HN ALA 23 -3.593 3.226 3.859 176 HA ALA 23 HA ALA 23 -1.876 4.030 6.025 177 HB1 ALA 23 HB1 ALA 23 -3.428 5.720 4.066 178 HB2 ALA 23 HB2 ALA 23 -1.784 5.123 3.829 179 HB3 ALA 23 HB3 ALA 23 -2.127 6.275 5.123 180 H ASN 24 HN ASN 24 -4.751 2.913 6.390 181 HA ASN 24 HA ASN 24 -6.062 5.094 7.777 182 HB2 ASN 24 HB2 ASN 24 -7.187 3.134 6.490 183 HB3 ASN 24 HB1 ASN 24 -6.884 2.204 7.949 184 HD21 ASN 24 HD21 ASN 24 -7.342 4.467 9.751 185 HD22 ASN 24 HD22 ASN 24 -9.049 4.744 9.736 186 H GLY 25 HN GLY 25 -4.059 2.329 8.517 187 HA2 GLY 25 HA2 GLY 25 -2.683 2.106 10.370 188 HA3 GLY 25 HA1 GLY 25 -3.494 3.476 11.107 189 H ARG 26 HN ARG 26 -5.613 3.081 12.097 190 HA ARG 26 HA ARG 26 -5.282 0.908 13.887 191 HB2 ARG 26 HB2 ARG 26 -7.568 2.856 13.582 192 HB3 ARG 26 HB1 ARG 26 -7.396 1.718 14.913 193 HG2 ARG 26 HG2 ARG 26 -5.266 2.770 15.518 194 HG3 ARG 26 HG1 ARG 26 -5.479 3.931 14.211 195 HD2 ARG 26 HD2 ARG 26 -6.141 4.954 16.279 196 HD3 ARG 26 HD1 ARG 26 -7.576 4.687 15.292 197 HE ARG 26 HE ARG 26 -8.359 3.201 16.857 198 HH11 ARG 26 HH11 ARG 26 -4.991 3.910 17.536 199 HH12 ARG 26 HH12 ARG 26 -5.031 3.196 19.124 200 HH21 ARG 26 HH21 ARG 26 -8.421 2.284 18.944 201 HH22 ARG 26 HH22 ARG 26 -6.979 2.274 19.928 202 H ARG 27 HN ARG 27 -7.032 1.176 10.945 203 HA ARG 27 HA ARG 27 -8.843 -0.982 11.589 204 HB2 ARG 27 HB2 ARG 27 -8.381 0.653 9.116 205 HB3 ARG 27 HB1 ARG 27 -9.390 -0.790 9.080 206 HG2 ARG 27 HG2 ARG 27 -10.777 0.173 10.875 207 HG3 ARG 27 HG1 ARG 27 -9.805 1.641 10.808 208 HD2 ARG 27 HD2 ARG 27 -10.511 2.062 8.544 209 HD3 ARG 27 HD1 ARG 27 -11.359 0.515 8.482 210 HE ARG 27 HE ARG 27 -12.879 1.405 10.181 211 HH11 ARG 27 HH11 ARG 27 -10.962 3.681 8.342 212 HH12 ARG 27 HH12 ARG 27 -12.000 5.033 8.700 213 HH21 ARG 27 HH21 ARG 27 -14.240 3.152 10.648 214 HH22 ARG 27 HH22 ARG 27 -13.855 4.732 10.036 215 H LEU 28 HN LEU 28 -5.641 -0.813 10.670 216 HA LEU 28 HA LEU 28 -5.494 -3.087 8.961 217 HB2 LEU 28 HB2 LEU 28 -3.376 -1.842 10.717 218 HB3 LEU 28 HB1 LEU 28 -3.080 -3.051 9.482 219 HG LEU 28 HG LEU 28 -4.129 -0.262 8.992 220 HD11 LEU 28 HD11 LEU 28 -1.784 -0.294 9.666 221 HD12 LEU 28 HD12 LEU 28 -1.958 0.139 7.964 222 HD13 LEU 28 HD13 LEU 28 -1.435 -1.485 8.412 223 HD21 LEU 28 HD21 LEU 28 -4.994 -1.901 7.386 224 HD22 LEU 28 HD22 LEU 28 -3.345 -2.422 7.034 225 HD23 LEU 28 HD23 LEU 28 -3.858 -0.784 6.632 226 H GLN 29 HN GLN 29 -5.982 -2.689 12.310 227 HA GLN 29 HA GLN 29 -4.923 -5.054 13.369 228 HB2 GLN 29 HB2 GLN 29 -7.439 -3.561 14.140 229 HB3 GLN 29 HB1 GLN 29 -6.717 -4.847 15.095 230 HG2 GLN 29 HG2 GLN 29 -4.705 -3.512 15.387 231 HG3 GLN 29 HG1 GLN 29 -5.412 -2.227 14.411 232 HE21 GLN 29 HE21 GLN 29 -5.292 -0.735 16.084 233 HE22 GLN 29 HE22 GLN 29 -6.341 -0.800 17.456 234 H ILE 30 HN ILE 30 -7.859 -4.413 11.582 235 HA ILE 30 HA ILE 30 -9.088 -6.930 12.031 236 HB ILE 30 HB ILE 30 -9.529 -4.988 9.756 237 HG12 ILE 30 HG12 ILE 30 -10.985 -5.295 12.395 238 HG13 ILE 30 HG11 ILE 30 -9.904 -3.973 11.970 239 HG21 ILE 30 HG21 ILE 30 -11.267 -7.232 10.778 240 HG22 ILE 30 HG22 ILE 30 -10.369 -7.224 9.258 241 HG23 ILE 30 HG23 ILE 30 -11.696 -6.088 9.506 242 HD11 ILE 30 HD11 ILE 30 -12.242 -3.322 11.782 243 HD12 ILE 30 HD12 ILE 30 -12.512 -4.611 10.608 244 HD13 ILE 30 HD13 ILE 30 -11.436 -3.270 10.215 245 H LEU 31 HN LEU 31 -7.112 -5.623 9.383 246 HA LEU 31 HA LEU 31 -7.176 -7.896 7.736 247 HB2 LEU 31 HB2 LEU 31 -5.029 -5.795 8.041 248 HB3 LEU 31 HB1 LEU 31 -5.077 -6.987 6.757 249 HG LEU 31 HG LEU 31 -7.175 -4.864 7.225 250 HD11 LEU 31 HD11 LEU 31 -5.002 -5.066 5.143 251 HD12 LEU 31 HD12 LEU 31 -5.064 -3.909 6.473 252 HD13 LEU 31 HD13 LEU 31 -6.274 -3.844 5.191 253 HD21 LEU 31 HD21 LEU 31 -8.066 -6.906 6.215 254 HD22 LEU 31 HD22 LEU 31 -6.817 -6.836 4.971 255 HD23 LEU 31 HD23 LEU 31 -8.045 -5.573 5.061 256 H ASP 32 HN ASP 32 -5.081 -6.979 10.400 257 HA ASP 32 HA ASP 32 -3.237 -9.092 10.221 258 HB2 ASP 32 HB2 ASP 32 -2.817 -7.129 11.597 259 HB3 ASP 32 HB1 ASP 32 -4.188 -7.522 12.627 260 H LEU 33 HN LEU 33 -6.417 -8.846 11.675 261 HA LEU 33 HA LEU 33 -6.301 -11.435 12.935 262 HB2 LEU 33 HB2 LEU 33 -7.667 -9.590 13.838 263 HB3 LEU 33 HB1 LEU 33 -8.642 -9.607 12.383 264 HG LEU 33 HG LEU 33 -9.363 -11.922 12.944 265 HD11 LEU 33 HD11 LEU 33 -7.477 -12.580 14.332 266 HD12 LEU 33 HD12 LEU 33 -8.991 -12.736 15.225 267 HD13 LEU 33 HD13 LEU 33 -7.923 -11.370 15.534 268 HD21 LEU 33 HD21 LEU 33 -9.908 -9.832 15.049 269 HD22 LEU 33 HD22 LEU 33 -10.901 -11.250 14.710 270 HD23 LEU 33 HD23 LEU 33 -10.737 -9.979 13.498 271 H LEU 34 HN LEU 34 -7.195 -10.150 9.862 272 HA LEU 34 HA LEU 34 -8.683 -12.477 9.013 273 HB2 LEU 34 HB2 LEU 34 -7.988 -9.837 7.907 274 HB3 LEU 34 HB1 LEU 34 -8.104 -11.123 6.722 275 HG LEU 34 HG LEU 34 -10.210 -9.863 6.966 276 HD11 LEU 34 HD11 LEU 34 -10.334 -12.727 7.887 277 HD12 LEU 34 HD12 LEU 34 -10.277 -12.165 6.215 278 HD13 LEU 34 HD13 LEU 34 -11.682 -11.805 7.221 279 HD21 LEU 34 HD21 LEU 34 -10.069 -9.278 9.324 280 HD22 LEU 34 HD22 LEU 34 -10.213 -10.979 9.771 281 HD23 LEU 34 HD23 LEU 34 -11.565 -10.153 8.993 282 H ALA 35 HN ALA 35 -5.447 -11.644 9.308 283 HA ALA 35 HA ALA 35 -4.234 -12.890 7.123 284 HB1 ALA 35 HB1 ALA 35 -3.221 -12.631 9.948 285 HB2 ALA 35 HB2 ALA 35 -3.045 -11.429 8.667 286 HB3 ALA 35 HB3 ALA 35 -2.236 -12.991 8.530 287 H GLN 36 HN GLN 36 -5.746 -14.240 9.921 288 HA GLN 36 HA GLN 36 -4.460 -16.832 9.568 289 HB2 GLN 36 HB2 GLN 36 -5.661 -17.449 11.632 290 HB3 GLN 36 HB1 GLN 36 -4.682 -16.004 11.842 291 HG2 GLN 36 HG2 GLN 36 -6.704 -14.630 11.535 292 HG3 GLN 36 HG1 GLN 36 -7.660 -16.104 11.428 293 HE21 GLN 36 HE21 GLN 36 -8.882 -15.561 13.186 294 HE22 GLN 36 HE22 GLN 36 -8.286 -15.624 14.805 295 H GLY 37 HN GLY 37 -7.041 -15.266 8.228 296 HA2 GLY 37 HA2 GLY 37 -8.143 -16.894 6.578 297 HA3 GLY 37 HA1 GLY 37 -8.671 -17.716 8.041 298 H GLU 38 HN GLU 38 -10.760 -17.202 6.757 299 HA GLU 38 HA GLU 38 -11.702 -14.509 6.795 300 HB2 GLU 38 HB2 GLU 38 -13.895 -15.518 6.189 301 HB3 GLU 38 HB1 GLU 38 -12.579 -16.014 5.136 302 HG2 GLU 38 HG2 GLU 38 -12.415 -18.133 6.352 303 HG3 GLU 38 HG1 GLU 38 -13.764 -17.639 7.375 304 H ARG 39 HN ARG 39 -13.139 -13.524 8.157 305 HA ARG 39 HA ARG 39 -13.628 -14.894 10.721 306 HB2 ARG 39 HB2 ARG 39 -11.651 -13.237 10.651 307 HB3 ARG 39 HB1 ARG 39 -12.874 -11.987 10.503 308 HG2 ARG 39 HG2 ARG 39 -12.636 -11.941 12.743 309 HG3 ARG 39 HG1 ARG 39 -13.825 -13.241 12.654 310 HD2 ARG 39 HD2 ARG 39 -10.847 -13.691 12.689 311 HD3 ARG 39 HD1 ARG 39 -11.851 -13.690 14.136 312 HE ARG 39 HE ARG 39 -12.990 -15.640 13.263 313 HH11 ARG 39 HH11 ARG 39 -10.059 -14.733 11.561 314 HH12 ARG 39 HH12 ARG 39 -9.735 -16.353 11.012 315 HH21 ARG 39 HH21 ARG 39 -12.546 -17.754 12.545 316 HH22 ARG 39 HH22 ARG 39 -11.140 -18.057 11.574 317 H ALA 40 HN ALA 40 -15.627 -14.562 11.577 318 HA ALA 40 HA ALA 40 -17.624 -13.250 10.012 319 HB1 ALA 40 HB1 ALA 40 -17.785 -14.343 12.820 320 HB2 ALA 40 HB2 ALA 40 -18.146 -15.235 11.343 321 HB3 ALA 40 HB3 ALA 40 -19.154 -13.868 11.816 322 H VAL 41 HN VAL 41 -18.911 -11.440 10.676 323 HA VAL 41 HA VAL 41 -17.440 -9.202 11.446 324 HB VAL 41 HB VAL 41 -20.439 -9.553 11.629 325 HG11 VAL 41 HG11 VAL 41 -20.539 -7.125 11.383 326 HG12 VAL 41 HG12 VAL 41 -18.777 -7.047 11.390 327 HG13 VAL 41 HG13 VAL 41 -19.642 -7.581 12.832 328 HG21 VAL 41 HG21 VAL 41 -18.758 -8.538 9.338 329 HG22 VAL 41 HG22 VAL 41 -20.520 -8.598 9.384 330 HG23 VAL 41 HG23 VAL 41 -19.585 -10.094 9.399 331 H GLU 42 HN GLU 42 -19.643 -11.224 13.334 332 HA GLU 42 HA GLU 42 -19.573 -9.755 15.727 333 HB2 GLU 42 HB2 GLU 42 -19.748 -12.750 15.753 334 HB3 GLU 42 HB1 GLU 42 -20.601 -11.584 16.753 335 HG2 GLU 42 HG2 GLU 42 -22.270 -12.357 15.384 336 HG3 GLU 42 HG1 GLU 42 -21.749 -10.906 14.527 337 H ALA 43 HN ALA 43 -17.512 -12.338 14.506 338 HA ALA 43 HA ALA 43 -15.971 -12.686 16.857 339 HB1 ALA 43 HB1 ALA 43 -14.387 -13.872 15.383 340 HB2 ALA 43 HB2 ALA 43 -15.307 -13.324 13.983 341 HB3 ALA 43 HB3 ALA 43 -16.053 -14.408 15.158 342 H ILE 44 HN ILE 44 -15.474 -10.776 13.906 343 HA ILE 44 HA ILE 44 -12.957 -9.714 14.532 344 HB ILE 44 HB ILE 44 -15.197 -8.441 12.946 345 HG12 ILE 44 HG12 ILE 44 -12.802 -10.044 12.024 346 HG13 ILE 44 HG11 ILE 44 -14.449 -10.658 12.121 347 HG21 ILE 44 HG21 ILE 44 -13.550 -6.787 13.638 348 HG22 ILE 44 HG22 ILE 44 -13.437 -7.090 11.903 349 HG23 ILE 44 HG23 ILE 44 -12.250 -7.798 12.999 350 HD11 ILE 44 HD11 ILE 44 -15.139 -8.991 10.458 351 HD12 ILE 44 HD12 ILE 44 -13.897 -10.086 9.854 352 HD13 ILE 44 HD13 ILE 44 -13.465 -8.447 10.339 353 H ALA 45 HN ALA 45 -16.209 -8.437 15.136 354 HA ALA 45 HA ALA 45 -15.489 -6.081 16.453 355 HB1 ALA 45 HB1 ALA 45 -17.935 -7.791 16.916 356 HB2 ALA 45 HB2 ALA 45 -17.763 -6.556 15.667 357 HB3 ALA 45 HB3 ALA 45 -17.749 -6.096 17.370 358 H THR 46 HN THR 46 -16.307 -9.261 17.822 359 HA THR 46 HA THR 46 -15.986 -8.612 20.510 360 HB THR 46 HB THR 46 -15.477 -11.281 19.180 361 HG1 THR 46 HG1 THR 46 -17.560 -10.645 18.721 362 HG21 THR 46 HG21 THR 46 -14.619 -11.238 21.461 363 HG22 THR 46 HG22 THR 46 -16.079 -12.227 21.375 364 HG23 THR 46 HG23 THR 46 -16.157 -10.596 22.043 365 H ALA 47 HN ALA 47 -13.609 -9.929 18.212 366 HA ALA 47 HA ALA 47 -11.515 -10.322 20.022 367 HB1 ALA 47 HB1 ALA 47 -11.335 -9.694 17.081 368 HB2 ALA 47 HB2 ALA 47 -11.558 -11.295 17.783 369 HB3 ALA 47 HB3 ALA 47 -10.062 -10.407 18.071 370 H THR 48 HN THR 48 -12.304 -7.481 18.036 371 HA THR 48 HA THR 48 -9.952 -6.081 19.002 372 HB THR 48 HB THR 48 -10.894 -4.188 17.574 373 HG1 THR 48 HG1 THR 48 -12.532 -6.236 16.469 374 HG21 THR 48 HG21 THR 48 -10.197 -5.253 15.470 375 HG22 THR 48 HG22 THR 48 -10.272 -6.832 16.250 376 HG23 THR 48 HG23 THR 48 -9.093 -5.637 16.789 377 H GLY 49 HN GLY 49 -13.004 -6.604 20.193 378 HA2 GLY 49 HA2 GLY 49 -14.010 -5.711 22.078 379 HA3 GLY 49 HA1 GLY 49 -12.702 -4.540 22.174 380 H MET 50 HN MET 50 -14.615 -4.982 19.297 381 HA MET 50 HA MET 50 -15.731 -2.283 19.690 382 HB2 MET 50 HB2 MET 50 -15.326 -3.824 17.119 383 HB3 MET 50 HB1 MET 50 -15.968 -2.194 17.247 384 HG2 MET 50 HG2 MET 50 -13.816 -1.442 18.157 385 HG3 MET 50 HG1 MET 50 -13.183 -3.077 17.959 386 HE1 MET 50 HE1 MET 50 -11.332 -1.176 15.108 387 HE2 MET 50 HE2 MET 50 -11.167 -2.244 16.502 388 HE3 MET 50 HE3 MET 50 -11.713 -0.580 16.723 389 H ASN 51 HN ASN 51 -17.905 -1.937 18.770 390 HA ASN 51 HA ASN 51 -19.689 -4.152 19.285 391 HB2 ASN 51 HB2 ASN 51 -20.099 -1.605 19.711 392 HB3 ASN 51 HB1 ASN 51 -20.504 -1.550 18.001 393 HD21 ASN 51 HD21 ASN 51 -22.183 -1.015 20.282 394 HD22 ASN 51 HD22 ASN 51 -23.506 -2.118 20.200 395 H LEU 52 HN LEU 52 -21.301 -4.820 17.595 396 HA LEU 52 HA LEU 52 -20.012 -5.714 15.268 397 HB2 LEU 52 HB2 LEU 52 -22.896 -5.560 16.075 398 HB3 LEU 52 HB1 LEU 52 -22.453 -6.084 14.463 399 HG LEU 52 HG LEU 52 -21.062 -7.893 15.521 400 HD11 LEU 52 HD11 LEU 52 -21.575 -8.507 17.835 401 HD12 LEU 52 HD12 LEU 52 -22.511 -7.021 18.015 402 HD13 LEU 52 HD13 LEU 52 -20.771 -6.942 17.727 403 HD21 LEU 52 HD21 LEU 52 -24.015 -7.905 16.122 404 HD22 LEU 52 HD22 LEU 52 -22.973 -9.325 16.011 405 HD23 LEU 52 HD23 LEU 52 -23.265 -8.333 14.582 406 H THR 53 HN THR 53 -22.104 -2.951 15.855 407 HA THR 53 HA THR 53 -22.385 -2.029 13.231 408 HB THR 53 HB THR 53 -22.117 -0.218 15.631 409 HG1 THR 53 HG1 THR 53 -24.561 -1.449 14.893 410 HG21 THR 53 HG21 THR 53 -23.846 -0.106 13.153 411 HG22 THR 53 HG22 THR 53 -22.419 0.882 13.468 412 HG23 THR 53 HG23 THR 53 -23.860 1.071 14.467 413 H THR 54 HN THR 54 -19.920 -1.348 15.682 414 HA THR 54 HA THR 54 -18.453 0.566 14.252 415 HB THR 54 HB THR 54 -17.110 -1.315 16.155 416 HG1 THR 54 HG1 THR 54 -18.769 0.786 17.111 417 HG21 THR 54 HG21 THR 54 -16.090 0.770 16.968 418 HG22 THR 54 HG22 THR 54 -17.065 1.692 15.824 419 HG23 THR 54 HG23 THR 54 -15.843 0.566 15.234 420 H ALA 55 HN ALA 55 -17.835 -2.909 14.737 421 HA ALA 55 HA ALA 55 -15.598 -3.111 13.082 422 HB1 ALA 55 HB1 ALA 55 -16.189 -4.848 14.663 423 HB2 ALA 55 HB2 ALA 55 -16.058 -5.525 13.039 424 HB3 ALA 55 HB3 ALA 55 -17.647 -5.223 13.744 425 H SER 56 HN SER 56 -19.039 -3.486 12.323 426 HA SER 56 HA SER 56 -18.761 -4.436 9.712 427 HB2 SER 56 HB2 SER 56 -20.892 -4.429 10.979 428 HB3 SER 56 HB1 SER 56 -20.975 -2.679 10.799 429 HG SER 56 HG SER 56 -22.013 -3.166 9.035 430 H ALA 57 HN ALA 57 -19.077 -1.087 10.884 431 HA ALA 57 HA ALA 57 -19.006 0.133 8.346 432 HB1 ALA 57 HB1 ALA 57 -18.458 2.193 9.557 433 HB2 ALA 57 HB2 ALA 57 -18.154 1.246 11.014 434 HB3 ALA 57 HB3 ALA 57 -19.775 1.310 10.329 435 H ASN 58 HN ASN 58 -16.479 -0.911 10.535 436 HA ASN 58 HA ASN 58 -14.324 0.318 9.135 437 HB2 ASN 58 HB2 ASN 58 -14.354 -2.030 11.044 438 HB3 ASN 58 HB1 ASN 58 -12.893 -1.265 10.432 439 HD21 ASN 58 HD21 ASN 58 -13.824 -1.530 13.164 440 HD22 ASN 58 HD22 ASN 58 -13.957 0.075 13.785 441 H LEU 59 HN LEU 59 -15.868 -2.844 9.004 442 HA LEU 59 HA LEU 59 -14.074 -4.039 7.174 443 HB2 LEU 59 HB2 LEU 59 -16.978 -4.604 7.772 444 HB3 LEU 59 HB1 LEU 59 -15.975 -5.613 6.746 445 HG LEU 59 HG LEU 59 -15.407 -5.050 9.657 446 HD11 LEU 59 HD11 LEU 59 -16.599 -7.498 8.355 447 HD12 LEU 59 HD12 LEU 59 -17.456 -6.353 9.389 448 HD13 LEU 59 HD13 LEU 59 -16.153 -7.339 10.055 449 HD21 LEU 59 HD21 LEU 59 -13.423 -5.544 8.330 450 HD22 LEU 59 HD22 LEU 59 -14.191 -7.005 7.709 451 HD23 LEU 59 HD23 LEU 59 -13.800 -6.873 9.424 452 H GLN 60 HN GLN 60 -17.054 -2.188 6.761 453 HA GLN 60 HA GLN 60 -17.273 -2.460 3.972 454 HB2 GLN 60 HB2 GLN 60 -18.128 -0.163 5.738 455 HB3 GLN 60 HB1 GLN 60 -18.659 -0.420 4.082 456 HG2 GLN 60 HG2 GLN 60 -19.754 -2.472 4.705 457 HG3 GLN 60 HG1 GLN 60 -19.136 -2.338 6.350 458 HE21 GLN 60 HE21 GLN 60 -21.878 -2.521 5.440 459 HE22 GLN 60 HE22 GLN 60 -22.680 -1.095 6.019 460 H ALA 61 HN ALA 61 -15.411 -0.265 5.986 461 HA ALA 61 HA ALA 61 -14.516 1.431 3.898 462 HB1 ALA 61 HB1 ALA 61 -13.199 0.813 6.544 463 HB2 ALA 61 HB2 ALA 61 -14.397 2.075 6.254 464 HB3 ALA 61 HB3 ALA 61 -12.813 2.170 5.485 465 H LEU 62 HN LEU 62 -13.161 -1.486 5.396 466 HA LEU 62 HA LEU 62 -10.792 -1.545 3.843 467 HB2 LEU 62 HB2 LEU 62 -12.254 -3.797 5.229 468 HB3 LEU 62 HB1 LEU 62 -10.635 -3.912 4.565 469 HG LEU 62 HG LEU 62 -11.486 -2.126 6.847 470 HD11 LEU 62 HD11 LEU 62 -11.414 -4.470 7.466 471 HD12 LEU 62 HD12 LEU 62 -10.070 -3.593 8.199 472 HD13 LEU 62 HD13 LEU 62 -9.791 -4.618 6.790 473 HD21 LEU 62 HD21 LEU 62 -8.767 -2.570 5.612 474 HD22 LEU 62 HD22 LEU 62 -9.096 -1.641 7.078 475 HD23 LEU 62 HD23 LEU 62 -9.727 -1.090 5.524 476 H LYS 63 HN LYS 63 -14.029 -2.810 3.364 477 HA LYS 63 HA LYS 63 -13.417 -4.281 0.998 478 HB2 LYS 63 HB2 LYS 63 -15.447 -4.645 2.426 479 HB3 LYS 63 HB1 LYS 63 -16.086 -3.121 1.826 480 HG2 LYS 63 HG2 LYS 63 -15.974 -4.056 -0.478 481 HG3 LYS 63 HG1 LYS 63 -15.510 -5.605 0.228 482 HD2 LYS 63 HD2 LYS 63 -17.618 -5.611 1.513 483 HD3 LYS 63 HD1 LYS 63 -18.081 -4.102 0.726 484 HE2 LYS 63 HE2 LYS 63 -17.892 -5.264 -1.466 485 HE3 LYS 63 HE1 LYS 63 -17.600 -6.767 -0.593 486 HZ1 LYS 63 HZ1 LYS 63 -19.774 -6.489 0.476 487 HZ2 LYS 63 HZ2 LYS 63 -19.907 -6.601 -1.213 488 HZ3 LYS 63 HZ3 LYS 63 -20.051 -5.092 -0.447 489 H SER 64 HN SER 64 -14.439 -0.988 1.688 490 HA SER 64 HA SER 64 -14.838 -0.207 -1.012 491 HB2 SER 64 HB2 SER 64 -15.776 1.008 0.967 492 HB3 SER 64 HB1 SER 64 -14.145 1.558 1.351 493 HG SER 64 HG SER 64 -15.169 1.991 -1.229 494 H GLY 65 HN GLY 65 -12.033 -0.640 0.960 495 HA2 GLY 65 HA2 GLY 65 -10.291 0.763 -0.879 496 HA3 GLY 65 HA1 GLY 65 -9.791 -0.219 0.494 497 H GLY 66 HN GLY 66 -11.574 -2.424 -0.472 498 HA2 GLY 66 HA2 GLY 66 -11.672 -3.946 -2.299 499 HA3 GLY 66 HA1 GLY 66 -10.188 -3.244 -2.925 500 H LEU 67 HN LEU 67 -10.088 -3.796 0.415 501 HA LEU 67 HA LEU 67 -8.014 -5.748 0.007 502 HB2 LEU 67 HB2 LEU 67 -9.097 -4.366 2.446 503 HB3 LEU 67 HB1 LEU 67 -7.926 -5.660 2.571 504 HG LEU 67 HG LEU 67 -6.753 -3.594 2.734 505 HD11 LEU 67 HD11 LEU 67 -5.205 -3.734 0.863 506 HD12 LEU 67 HD12 LEU 67 -6.361 -4.719 -0.033 507 HD13 LEU 67 HD13 LEU 67 -5.638 -5.338 1.453 508 HD21 LEU 67 HD21 LEU 67 -8.365 -2.097 1.755 509 HD22 LEU 67 HD22 LEU 67 -8.100 -2.800 0.159 510 HD23 LEU 67 HD23 LEU 67 -6.808 -1.898 0.952 511 H VAL 68 HN VAL 68 -11.306 -5.773 1.270 512 HA VAL 68 HA VAL 68 -11.015 -8.668 1.714 513 HB VAL 68 HB VAL 68 -12.620 -8.507 3.584 514 HG11 VAL 68 HG11 VAL 68 -11.076 -7.537 5.218 515 HG12 VAL 68 HG12 VAL 68 -10.154 -6.805 3.905 516 HG13 VAL 68 HG13 VAL 68 -10.240 -8.562 4.050 517 HG21 VAL 68 HG21 VAL 68 -12.297 -5.528 3.224 518 HG22 VAL 68 HG22 VAL 68 -13.093 -6.311 4.589 519 HG23 VAL 68 HG23 VAL 68 -13.773 -6.461 2.969 520 H GLU 69 HN GLU 69 -12.961 -9.906 1.599 521 HA GLU 69 HA GLU 69 -15.142 -8.684 0.033 522 HB2 GLU 69 HB2 GLU 69 -14.216 -11.566 -0.094 523 HB3 GLU 69 HB1 GLU 69 -15.508 -10.846 -1.042 524 HG2 GLU 69 HG2 GLU 69 -13.814 -9.346 -2.077 525 HG3 GLU 69 HG1 GLU 69 -12.569 -10.264 -1.234 526 H ALA 70 HN ALA 70 -17.236 -9.958 0.350 527 HA ALA 70 HA ALA 70 -17.393 -11.005 3.102 528 HB1 ALA 70 HB1 ALA 70 -18.270 -8.729 3.043 529 HB2 ALA 70 HB2 ALA 70 -19.549 -9.896 3.375 530 HB3 ALA 70 HB3 ALA 70 -19.397 -9.187 1.766 531 H ARG 71 HN ARG 71 -18.448 -12.857 3.351 532 HA ARG 71 HA ARG 71 -20.426 -13.714 1.370 533 HB2 ARG 71 HB2 ARG 71 -18.266 -14.749 0.697 534 HB3 ARG 71 HB1 ARG 71 -18.144 -15.484 2.290 535 HG2 ARG 71 HG2 ARG 71 -20.333 -16.626 1.805 536 HG3 ARG 71 HG1 ARG 71 -20.170 -16.053 0.144 537 HD2 ARG 71 HD2 ARG 71 -17.991 -17.219 -0.000 538 HD3 ARG 71 HD1 ARG 71 -18.250 -17.845 1.629 539 HE ARG 71 HE ARG 71 -19.744 -18.597 -0.786 540 HH11 ARG 71 HH11 ARG 71 -18.965 -19.129 2.592 541 HH12 ARG 71 HH12 ARG 71 -19.828 -20.639 2.683 542 HH21 ARG 71 HH21 ARG 71 -20.844 -20.594 -0.670 543 HH22 ARG 71 HH22 ARG 71 -20.884 -21.476 0.828 544 H ARG 72 HN ARG 72 -22.150 -14.728 2.335 545 HA ARG 72 HA ARG 72 -21.990 -15.009 5.237 546 HB2 ARG 72 HB2 ARG 72 -24.355 -15.135 3.365 547 HB3 ARG 72 HB1 ARG 72 -24.454 -15.346 5.109 548 HG2 ARG 72 HG2 ARG 72 -23.418 -13.055 5.321 549 HG3 ARG 72 HG1 ARG 72 -23.685 -12.875 3.585 550 HD2 ARG 72 HD2 ARG 72 -25.518 -11.874 4.799 551 HD3 ARG 72 HD1 ARG 72 -26.084 -13.303 3.935 552 HE ARG 72 HE ARG 72 -25.332 -13.622 6.736 553 HH11 ARG 72 HH11 ARG 72 -27.882 -13.326 4.347 554 HH12 ARG 72 HH12 ARG 72 -29.102 -13.986 5.395 555 HH21 ARG 72 HH21 ARG 72 -26.942 -14.466 8.116 556 HH22 ARG 72 HH22 ARG 72 -28.572 -14.642 7.535 557 H GLU 73 HN GLU 73 -22.271 -16.869 6.336 558 HA GLU 73 HA GLU 73 -22.867 -19.330 4.871 559 HB2 GLU 73 HB2 GLU 73 -20.365 -19.091 5.080 560 HB3 GLU 73 HB1 GLU 73 -20.566 -19.102 6.827 561 HG2 GLU 73 HG2 GLU 73 -19.928 -21.286 6.139 562 HG3 GLU 73 HG1 GLU 73 -21.621 -21.342 6.631 563 H GLY 74 HN GLY 74 -24.175 -20.680 6.053 564 HA2 GLY 74 HA2 GLY 74 -25.683 -21.234 7.704 565 HA3 GLY 74 HA1 GLY 74 -24.562 -20.520 8.859 566 H THR 75 HN THR 75 -25.285 -18.799 9.916 567 HA THR 75 HA THR 75 -27.196 -17.034 8.523 568 HB THR 75 HB THR 75 -28.101 -18.180 10.580 569 HG1 THR 75 HG1 THR 75 -27.957 -15.382 11.042 570 HG21 THR 75 HG21 THR 75 -27.385 -17.343 12.771 571 HG22 THR 75 HG22 THR 75 -26.111 -16.402 11.997 572 HG23 THR 75 HG23 THR 75 -26.066 -18.163 11.936 573 H ARG 76 HN ARG 76 -24.034 -17.291 9.405 574 HA ARG 76 HA ARG 76 -23.746 -14.561 10.422 575 HB2 ARG 76 HB2 ARG 76 -21.657 -16.723 10.106 576 HB3 ARG 76 HB1 ARG 76 -21.436 -15.181 10.916 577 HG2 ARG 76 HG2 ARG 76 -23.163 -15.858 12.565 578 HG3 ARG 76 HG1 ARG 76 -23.214 -17.446 11.793 579 HD2 ARG 76 HD2 ARG 76 -20.778 -17.670 12.229 580 HD3 ARG 76 HD1 ARG 76 -20.835 -16.148 13.114 581 HE ARG 76 HE ARG 76 -22.072 -18.686 13.938 582 HH11 ARG 76 HH11 ARG 76 -21.262 -15.344 14.625 583 HH12 ARG 76 HH12 ARG 76 -21.383 -15.541 16.356 584 HH21 ARG 76 HH21 ARG 76 -22.246 -18.950 16.204 585 HH22 ARG 76 HH22 ARG 76 -21.966 -17.591 17.247 586 H GLN 77 HN GLN 77 -22.468 -13.013 9.447 587 HA GLN 77 HA GLN 77 -21.878 -13.482 6.606 588 HB2 GLN 77 HB2 GLN 77 -23.354 -11.573 7.172 589 HB3 GLN 77 HB1 GLN 77 -22.069 -10.883 8.153 590 HG2 GLN 77 HG2 GLN 77 -20.715 -10.486 6.242 591 HG3 GLN 77 HG1 GLN 77 -21.802 -11.410 5.206 592 HE21 GLN 77 HE21 GLN 77 -20.898 -8.622 5.002 593 HE22 GLN 77 HE22 GLN 77 -22.331 -7.660 4.987 594 H TYR 78 HN TYR 78 -19.871 -14.064 6.197 595 HA TYR 78 HA TYR 78 -17.762 -13.376 8.102 596 HB2 TYR 78 HB2 TYR 78 -17.858 -15.415 5.871 597 HB3 TYR 78 HB1 TYR 78 -16.450 -15.122 6.883 598 HD1 TYR 78 HD2 TYR 78 -19.943 -16.353 6.902 599 HD2 TYR 78 HD1 TYR 78 -16.275 -16.080 9.040 600 HE1 TYR 78 HE2 TYR 78 -20.779 -17.990 8.532 601 HE2 TYR 78 HE1 TYR 78 -17.102 -17.721 10.677 602 HH TYR 78 HH TYR 78 -19.930 -19.570 10.157 603 H TYR 79 HN TYR 79 -15.994 -12.216 7.562 604 HA TYR 79 HA TYR 79 -15.832 -11.226 4.798 605 HB2 TYR 79 HB2 TYR 79 -15.147 -9.971 7.428 606 HB3 TYR 79 HB1 TYR 79 -14.230 -9.502 5.998 607 HD1 TYR 79 HD2 TYR 79 -17.687 -9.709 7.357 608 HD2 TYR 79 HD1 TYR 79 -15.100 -7.956 4.471 609 HE1 TYR 79 HE2 TYR 79 -19.477 -8.157 6.700 610 HE2 TYR 79 HE1 TYR 79 -16.885 -6.402 3.803 611 HH TYR 79 HH TYR 79 -19.702 -5.936 5.633 612 H ARG 80 HN ARG 80 -13.881 -11.329 3.722 613 HA ARG 80 HA ARG 80 -11.695 -12.784 5.018 614 HB2 ARG 80 HB2 ARG 80 -11.528 -14.346 3.117 615 HB3 ARG 80 HB1 ARG 80 -13.055 -14.524 3.970 616 HG2 ARG 80 HG2 ARG 80 -14.243 -13.388 2.260 617 HG3 ARG 80 HG1 ARG 80 -12.749 -12.875 1.477 618 HD2 ARG 80 HD2 ARG 80 -13.756 -14.711 0.259 619 HD3 ARG 80 HD1 ARG 80 -12.223 -15.212 0.967 620 HE ARG 80 HE ARG 80 -13.671 -16.237 2.778 621 HH11 ARG 80 HH11 ARG 80 -14.811 -15.791 -0.500 622 HH12 ARG 80 HH12 ARG 80 -15.853 -17.177 -0.471 623 HH21 ARG 80 HH21 ARG 80 -15.024 -18.058 2.844 624 HH22 ARG 80 HH22 ARG 80 -15.978 -18.471 1.446 625 H ILE 81 HN ILE 81 -9.692 -12.661 3.789 626 HA ILE 81 HA ILE 81 -9.244 -10.185 2.501 627 HB ILE 81 HB ILE 81 -7.533 -12.683 2.414 628 HG12 ILE 81 HG12 ILE 81 -7.440 -10.310 4.291 629 HG13 ILE 81 HG11 ILE 81 -8.013 -11.919 4.713 630 HG21 ILE 81 HG21 ILE 81 -6.911 -11.112 0.679 631 HG22 ILE 81 HG22 ILE 81 -5.689 -11.117 1.952 632 HG23 ILE 81 HG23 ILE 81 -6.856 -9.798 1.854 633 HD11 ILE 81 HD11 ILE 81 -5.773 -12.807 4.267 634 HD12 ILE 81 HD12 ILE 81 -5.777 -11.579 5.535 635 HD13 ILE 81 HD13 ILE 81 -5.213 -11.172 3.914 636 H ALA 82 HN ALA 82 -9.110 -9.665 0.341 637 HA ALA 82 HA ALA 82 -10.907 -10.839 -1.388 638 HB1 ALA 82 HB1 ALA 82 -9.912 -9.475 -3.149 639 HB2 ALA 82 HB2 ALA 82 -8.506 -9.180 -2.125 640 HB3 ALA 82 HB3 ALA 82 -10.088 -8.565 -1.649 641 H GLY 83 HN GLY 83 -7.407 -11.398 -1.238 642 HA2 GLY 83 HA2 GLY 83 -7.727 -14.001 -2.379 643 HA3 GLY 83 HA1 GLY 83 -6.997 -12.868 -3.507 644 H GLU 84 HN GLU 84 -5.500 -14.949 -2.927 645 HA GLU 84 HA GLU 84 -3.906 -14.806 -0.607 646 HB2 GLU 84 HB2 GLU 84 -4.075 -16.767 -2.167 647 HB3 GLU 84 HB1 GLU 84 -3.094 -15.875 -3.320 648 HG2 GLU 84 HG2 GLU 84 -1.658 -17.372 -2.196 649 HG3 GLU 84 HG1 GLU 84 -1.306 -15.757 -1.585 650 H ASP 85 HN ASP 85 -3.598 -13.374 -3.808 651 HA ASP 85 HA ASP 85 -1.063 -12.230 -3.561 652 HB2 ASP 85 HB2 ASP 85 -3.472 -11.224 -5.090 653 HB3 ASP 85 HB1 ASP 85 -1.828 -10.630 -5.303 654 H VAL 86 HN VAL 86 -4.197 -11.120 -2.443 655 HA VAL 86 HA VAL 86 -3.302 -8.504 -1.718 656 HB VAL 86 HB VAL 86 -5.745 -9.994 -0.741 657 HG11 VAL 86 HG11 VAL 86 -6.650 -7.774 -0.273 658 HG12 VAL 86 HG12 VAL 86 -5.131 -7.042 -0.792 659 HG13 VAL 86 HG13 VAL 86 -5.171 -8.069 0.642 660 HG21 VAL 86 HG21 VAL 86 -5.733 -9.870 -3.166 661 HG22 VAL 86 HG22 VAL 86 -5.434 -8.134 -3.095 662 HG23 VAL 86 HG23 VAL 86 -6.959 -8.791 -2.499 663 H ALA 87 HN ALA 87 -3.750 -11.575 -0.035 664 HA ALA 87 HA ALA 87 -3.113 -10.640 2.558 665 HB1 ALA 87 HB1 ALA 87 -2.749 -13.003 3.112 666 HB2 ALA 87 HB2 ALA 87 -2.797 -13.411 1.396 667 HB3 ALA 87 HB3 ALA 87 -4.238 -12.777 2.192 668 H ARG 88 HN ARG 88 -1.188 -12.035 -0.053 669 HA ARG 88 HA ARG 88 1.285 -12.003 1.327 670 HB2 ARG 88 HB2 ARG 88 0.530 -12.167 -1.583 671 HB3 ARG 88 HB1 ARG 88 2.212 -12.135 -1.066 672 HG2 ARG 88 HG2 ARG 88 2.109 -14.214 -0.121 673 HG3 ARG 88 HG1 ARG 88 0.380 -14.099 0.203 674 HD2 ARG 88 HD2 ARG 88 0.844 -15.736 -1.542 675 HD3 ARG 88 HD1 ARG 88 -0.095 -14.383 -2.166 676 HE ARG 88 HE ARG 88 2.517 -13.738 -2.707 677 HH11 ARG 88 HH11 ARG 88 0.419 -16.447 -3.433 678 HH12 ARG 88 HH12 ARG 88 1.149 -16.769 -4.975 679 HH21 ARG 88 HH21 ARG 88 3.495 -14.182 -4.743 680 HH22 ARG 88 HH22 ARG 88 2.889 -15.495 -5.708 681 H LEU 89 HN LEU 89 -0.465 -9.593 -0.487 682 HA LEU 89 HA LEU 89 1.600 -7.700 -0.792 683 HB2 LEU 89 HB2 LEU 89 -0.582 -7.581 -1.941 684 HB3 LEU 89 HB1 LEU 89 -1.374 -7.272 -0.412 685 HG LEU 89 HG LEU 89 -0.996 -5.296 -1.993 686 HD11 LEU 89 HD11 LEU 89 -0.032 -5.092 0.851 687 HD12 LEU 89 HD12 LEU 89 -1.705 -4.990 0.302 688 HD13 LEU 89 HD13 LEU 89 -0.547 -3.744 -0.160 689 HD21 LEU 89 HD21 LEU 89 1.179 -4.175 -1.770 690 HD22 LEU 89 HD22 LEU 89 1.292 -5.721 -2.614 691 HD23 LEU 89 HD23 LEU 89 1.804 -5.593 -0.929 692 H PHE 90 HN PHE 90 -0.856 -8.095 1.749 693 HA PHE 90 HA PHE 90 0.132 -6.063 3.443 694 HB2 PHE 90 HB2 PHE 90 -2.152 -6.994 3.613 695 HB3 PHE 90 HB1 PHE 90 -1.483 -8.528 4.151 696 HD1 PHE 90 HD2 PHE 90 -1.915 -4.974 5.064 697 HD2 PHE 90 HD1 PHE 90 -0.916 -8.883 6.416 698 HE1 PHE 90 HE2 PHE 90 -2.029 -4.194 7.396 699 HE2 PHE 90 HE1 PHE 90 -1.033 -8.110 8.748 700 HZ PHE 90 HZ PHE 90 -1.587 -5.765 9.240 701 H ALA 91 HN ALA 91 0.800 -9.508 3.182 702 HA ALA 91 HA ALA 91 2.383 -9.752 5.506 703 HB1 ALA 91 HB1 ALA 91 3.189 -11.831 4.511 704 HB2 ALA 91 HB2 ALA 91 2.476 -11.371 2.964 705 HB3 ALA 91 HB3 ALA 91 1.439 -11.680 4.357 706 H LEU 92 HN LEU 92 3.254 -9.123 2.111 707 HA LEU 92 HA LEU 92 6.034 -9.245 2.449 708 HB2 LEU 92 HB2 LEU 92 4.878 -9.320 0.266 709 HB3 LEU 92 HB1 LEU 92 4.480 -7.621 0.434 710 HG LEU 92 HG LEU 92 6.868 -7.049 0.380 711 HD11 LEU 92 HD11 LEU 92 8.515 -8.759 -0.236 712 HD12 LEU 92 HD12 LEU 92 7.278 -10.003 -0.068 713 HD13 LEU 92 HD13 LEU 92 7.791 -9.076 1.340 714 HD21 LEU 92 HD21 LEU 92 7.265 -7.584 -1.973 715 HD22 LEU 92 HD22 LEU 92 5.604 -7.066 -1.697 716 HD23 LEU 92 HD23 LEU 92 5.967 -8.776 -1.921 717 H VAL 93 HN VAL 93 3.864 -6.409 2.478 718 HA VAL 93 HA VAL 93 5.926 -4.529 2.923 719 HB VAL 93 HB VAL 93 3.704 -3.883 2.081 720 HG11 VAL 93 HG11 VAL 93 2.292 -5.300 3.447 721 HG12 VAL 93 HG12 VAL 93 1.825 -3.608 3.625 722 HG13 VAL 93 HG13 VAL 93 2.757 -4.403 4.894 723 HG21 VAL 93 HG21 VAL 93 3.460 -1.822 3.389 724 HG22 VAL 93 HG22 VAL 93 5.145 -2.181 3.012 725 HG23 VAL 93 HG23 VAL 93 4.516 -2.498 4.630 726 H GLN 94 HN GLN 94 4.037 -6.530 5.087 727 HA GLN 94 HA GLN 94 4.823 -5.254 7.498 728 HB2 GLN 94 HB2 GLN 94 2.869 -6.703 7.429 729 HB3 GLN 94 HB1 GLN 94 3.865 -8.077 6.973 730 HG2 GLN 94 HG2 GLN 94 4.951 -8.061 9.118 731 HG3 GLN 94 HG1 GLN 94 4.099 -6.587 9.575 732 HE21 GLN 94 HE21 GLN 94 2.555 -9.158 7.793 733 HE22 GLN 94 HE22 GLN 94 1.514 -9.685 9.075 734 H VAL 95 HN VAL 95 6.113 -7.983 5.636 735 HA VAL 95 HA VAL 95 8.164 -8.711 7.411 736 HB VAL 95 HB VAL 95 8.072 -8.969 4.398 737 HG11 VAL 95 HG11 VAL 95 10.374 -9.085 5.191 738 HG12 VAL 95 HG12 VAL 95 9.817 -10.671 4.661 739 HG13 VAL 95 HG13 VAL 95 9.915 -10.302 6.383 740 HG21 VAL 95 HG21 VAL 95 6.280 -10.160 5.554 741 HG22 VAL 95 HG22 VAL 95 7.468 -10.959 6.583 742 HG23 VAL 95 HG23 VAL 95 7.439 -11.287 4.851 743 H VAL 96 HN VAL 96 8.272 -6.572 4.556 744 HA VAL 96 HA VAL 96 10.946 -5.830 4.703 745 HB VAL 96 HB VAL 96 8.612 -4.130 3.797 746 HG11 VAL 96 HG11 VAL 96 11.551 -3.868 3.171 747 HG12 VAL 96 HG12 VAL 96 10.617 -2.792 4.209 748 HG13 VAL 96 HG13 VAL 96 10.255 -2.889 2.486 749 HG21 VAL 96 HG21 VAL 96 8.743 -6.250 2.605 750 HG22 VAL 96 HG22 VAL 96 10.443 -5.953 2.240 751 HG23 VAL 96 HG23 VAL 96 9.199 -4.913 1.549 752 H ALA 97 HN ALA 97 8.126 -4.387 6.278 753 HA ALA 97 HA ALA 97 9.455 -2.284 7.579 754 HB1 ALA 97 HB1 ALA 97 7.503 -2.178 9.035 755 HB2 ALA 97 HB2 ALA 97 6.978 -3.762 8.464 756 HB3 ALA 97 HB3 ALA 97 7.017 -2.393 7.353 757 H ASP 98 HN ASP 98 8.519 -5.498 8.777 758 HA ASP 98 HA ASP 98 9.499 -5.270 11.366 759 HB2 ASP 98 HB2 ASP 98 8.017 -7.071 10.706 760 HB3 ASP 98 HB1 ASP 98 9.237 -7.724 9.619 761 H GLU 99 HN GLU 99 11.184 -6.289 8.430 762 HA GLU 99 HA GLU 99 13.583 -7.106 9.679 763 HB2 GLU 99 HB2 GLU 99 13.178 -5.997 6.892 764 HB3 GLU 99 HB1 GLU 99 14.621 -6.824 7.455 765 HG2 GLU 99 HG2 GLU 99 13.191 -8.831 7.887 766 HG3 GLU 99 HG1 GLU 99 11.878 -7.981 7.073 767 H HIS 100 HN HIS 100 12.669 -4.010 8.173 768 HA HIS 100 HA HIS 100 15.325 -2.977 8.645 769 HB2 HIS 100 HB2 HIS 100 12.896 -1.782 7.317 770 HB3 HIS 100 HB1 HIS 100 14.419 -0.919 7.506 771 HD1 HIS 100 HD1 HIS 100 16.312 -1.502 5.914 772 HD2 HIS 100 HD2 HIS 100 13.002 -3.988 5.507 773 HE1 HIS 100 HE1 HIS 100 16.706 -2.826 3.804 774 HE2 HIS 100 HE2 HIS 100 14.794 -4.473 3.713 775 H LEU 101 HN LEU 101 12.292 -2.834 10.288 776 HA LEU 101 HA LEU 101 12.652 -0.335 11.573 777 HB2 LEU 101 HB2 LEU 101 11.026 -2.761 12.290 778 HB3 LEU 101 HB1 LEU 101 11.069 -1.342 13.317 779 HG LEU 101 HG LEU 101 10.104 -1.425 10.457 780 HD11 LEU 101 HD11 LEU 101 8.584 -1.076 13.038 781 HD12 LEU 101 HD12 LEU 101 8.581 -2.517 12.022 782 HD13 LEU 101 HD13 LEU 101 7.906 -1.006 11.413 783 HD21 LEU 101 HD21 LEU 101 9.368 0.889 10.892 784 HD22 LEU 101 HD22 LEU 101 11.122 0.712 10.942 785 HD23 LEU 101 HD23 LEU 101 10.205 0.841 12.444 786 H GLU 102 HN GLU 102 14.049 -3.455 12.142 787 HA GLU 102 HA GLU 102 15.083 -2.524 14.722 788 HB2 GLU 102 HB2 GLU 102 14.066 -4.761 14.717 789 HB3 GLU 102 HB1 GLU 102 15.225 -5.284 13.499 790 HG2 GLU 102 HG2 GLU 102 17.045 -5.032 15.018 791 HG3 GLU 102 HG1 GLU 102 16.006 -4.268 16.219 792 H HIS 103 HN HIS 103 16.008 -2.972 11.447 793 HA HIS 103 HA HIS 103 18.820 -3.197 11.962 794 HB2 HIS 103 HB2 HIS 103 17.822 -3.989 9.833 795 HB3 HIS 103 HB1 HIS 103 17.426 -2.326 9.417 796 HD1 HIS 103 HD1 HIS 103 19.117 -1.169 8.014 797 HD2 HIS 103 HD2 HIS 103 20.785 -4.309 10.172 798 HE1 HIS 103 HE1 HIS 103 21.512 -1.297 7.275 799 HE2 HIS 103 HE2 HIS 103 22.548 -3.074 8.726 800 H HIS 104 HN HIS 104 19.191 -1.546 13.443 801 HA HIS 104 HA HIS 104 18.794 1.210 12.572 802 HB2 HIS 104 HB2 HIS 104 19.781 0.076 15.203 803 HB3 HIS 104 HB1 HIS 104 19.586 1.790 14.864 804 HD1 HIS 104 HD1 HIS 104 17.109 2.654 14.555 805 HD2 HIS 104 HD2 HIS 104 17.487 -1.246 15.958 806 HE1 HIS 104 HE1 HIS 104 14.839 2.026 15.450 807 HE2 HIS 104 HE2 HIS 104 15.069 -0.360 16.231 808 H HIS 105 HN HIS 105 20.913 2.477 13.787 809 HA HIS 105 HA HIS 105 22.943 1.975 11.809 810 HB2 HIS 105 HB2 HIS 105 22.232 4.273 12.456 811 HB3 HIS 105 HB1 HIS 105 22.924 4.010 14.051 812 HD1 HIS 105 HD1 HIS 105 23.830 4.706 10.509 813 HD2 HIS 105 HD2 HIS 105 25.746 4.132 14.156 814 HE1 HIS 105 HE1 HIS 105 26.211 5.429 10.147 815 HE2 HIS 105 HE2 HIS 105 27.277 5.302 12.423 816 H HIS 106 HN HIS 106 23.911 0.053 12.289 817 HA HIS 106 HA HIS 106 25.472 -1.333 13.189 818 HB2 HIS 106 HB2 HIS 106 26.387 1.212 14.552 819 HB3 HIS 106 HB1 HIS 106 27.310 -0.287 14.506 820 HD1 HIS 106 HD1 HIS 106 28.566 2.207 13.334 821 HD2 HIS 106 HD2 HIS 106 26.270 -0.472 11.125 822 HE1 HIS 106 HE1 HIS 106 29.246 2.541 10.930 823 HE2 HIS 106 HE2 HIS 106 27.947 0.809 9.632 824 H HIS 107 HN HIS 107 26.619 -0.759 15.954 825 HA HIS 107 HA HIS 107 24.279 -1.433 17.598 826 HB2 HIS 107 HB2 HIS 107 25.260 -3.568 17.120 827 HB3 HIS 107 HB1 HIS 107 26.884 -2.959 17.404 828 HD1 HIS 107 HD1 HIS 107 23.755 -3.964 19.267 829 HD2 HIS 107 HD2 HIS 107 27.761 -3.129 20.007 830 HE1 HIS 107 HE1 HIS 107 24.152 -4.604 21.666 831 HE2 HIS 107 HE2 HIS 107 26.530 -3.908 22.143 832 H HIS 108 HN HIS 108 24.396 -0.717 19.736 833 HA HIS 108 HA HIS 108 26.897 0.505 20.636 834 HB2 HIS 108 HB2 HIS 108 25.488 2.339 19.752 835 HB3 HIS 108 HB1 HIS 108 24.195 1.861 20.847 836 HD1 HIS 108 HD1 HIS 108 24.222 2.869 23.129 837 HD2 HIS 108 HD2 HIS 108 27.857 3.309 21.160 838 HE1 HIS 108 HE1 HIS 108 25.605 4.373 24.590 839 HE2 HIS 108 HE2 HIS 108 27.865 4.457 23.483 840 H1 MET 1 HT1 MET 1 3.089 -14.350 28.457 841 H2 MET 1 HT2 MET 1 4.071 -13.638 29.635 842 H3 MET 1 HT3 MET 1 4.749 -14.705 28.506 843 HA MET 1 HA MET 1 5.321 -12.494 27.889 844 HB2 MET 1 HB2 MET 1 3.126 -13.651 26.160 845 HB3 MET 1 HB1 MET 1 4.198 -12.356 25.653 846 HG2 MET 1 HG2 MET 1 6.117 -13.857 25.917 847 HG3 MET 1 HG1 MET 1 5.021 -15.154 26.388 848 HE1 MET 1 HE1 MET 1 2.949 -15.678 23.093 849 HE2 MET 1 HE2 MET 1 2.539 -14.583 24.412 850 HE3 MET 1 HE3 MET 1 3.179 -16.188 24.766 851 H ALA 2 HN ALA 2 4.539 -10.399 27.051 852 HA ALA 2 HA ALA 2 1.910 -9.626 28.118 853 HB1 ALA 2 HB1 ALA 2 3.602 -8.985 29.773 854 HB2 ALA 2 HB2 ALA 2 2.856 -7.567 29.038 855 HB3 ALA 2 HB3 ALA 2 4.468 -8.075 28.535 856 H GLY 3 HN GLY 3 0.943 -7.838 27.062 857 HA2 GLY 3 HA2 GLY 3 1.462 -6.010 25.374 858 HA3 GLY 3 HA1 GLY 3 2.107 -7.322 24.400 859 H GLN 4 HN GLN 4 -0.350 -5.352 24.411 860 HA GLN 4 HA GLN 4 -2.334 -7.425 23.739 861 HB2 GLN 4 HB2 GLN 4 -2.761 -4.613 24.756 862 HB3 GLN 4 HB1 GLN 4 -4.051 -5.648 24.160 863 HG2 GLN 4 HG2 GLN 4 -3.651 -7.239 25.928 864 HG3 GLN 4 HG1 GLN 4 -2.261 -6.311 26.489 865 HE21 GLN 4 HE21 GLN 4 -3.580 -3.756 26.030 866 HE22 GLN 4 HE22 GLN 4 -4.733 -3.571 27.306 867 H SER 5 HN SER 5 -2.222 -3.957 22.968 868 HA SER 5 HA SER 5 -2.509 -4.715 20.130 869 HB2 SER 5 HB2 SER 5 -3.871 -2.374 21.479 870 HB3 SER 5 HB1 SER 5 -4.156 -2.986 19.849 871 HG SER 5 HG SER 5 -5.464 -4.429 20.631 872 H ASP 6 HN ASP 6 -1.110 -2.557 22.466 873 HA ASP 6 HA ASP 6 -0.440 -0.429 20.738 874 HB2 ASP 6 HB2 ASP 6 0.728 -1.268 23.392 875 HB3 ASP 6 HB1 ASP 6 1.201 0.201 22.546 876 H ARG 7 HN ARG 7 1.011 -3.514 21.197 877 HA ARG 7 HA ARG 7 3.642 -2.727 20.350 878 HB2 ARG 7 HB2 ARG 7 2.475 -5.513 20.444 879 HB3 ARG 7 HB1 ARG 7 4.181 -5.085 20.382 880 HG2 ARG 7 HG2 ARG 7 3.779 -3.877 22.595 881 HG3 ARG 7 HG1 ARG 7 2.253 -4.764 22.659 882 HD2 ARG 7 HD2 ARG 7 3.978 -5.950 23.896 883 HD3 ARG 7 HD1 ARG 7 3.499 -6.880 22.475 884 HE ARG 7 HE ARG 7 5.599 -6.590 21.600 885 HH11 ARG 7 HH11 ARG 7 5.184 -4.486 24.364 886 HH12 ARG 7 HH12 ARG 7 6.834 -3.925 24.356 887 HH21 ARG 7 HH21 ARG 7 7.781 -5.896 21.601 888 HH22 ARG 7 HH22 ARG 7 8.324 -4.757 22.792 889 H LYS 8 HN LYS 8 0.732 -3.866 18.839 890 HA LYS 8 HA LYS 8 1.899 -4.532 16.314 891 HB2 LYS 8 HB2 LYS 8 -0.974 -3.777 16.907 892 HB3 LYS 8 HB1 LYS 8 -0.386 -4.656 15.504 893 HG2 LYS 8 HG2 LYS 8 -0.094 -5.712 18.297 894 HG3 LYS 8 HG1 LYS 8 -1.529 -6.002 17.317 895 HD2 LYS 8 HD2 LYS 8 1.271 -6.715 16.452 896 HD3 LYS 8 HD1 LYS 8 0.175 -7.840 17.256 897 HE2 LYS 8 HE2 LYS 8 -1.472 -7.356 15.400 898 HE3 LYS 8 HE1 LYS 8 -0.160 -6.519 14.572 899 HZ1 LYS 8 HZ1 LYS 8 1.107 -8.568 14.560 900 HZ2 LYS 8 HZ2 LYS 8 -0.401 -8.811 13.826 901 HZ3 LYS 8 HZ3 LYS 8 -0.126 -9.371 15.400 902 H ALA 9 HN ALA 9 0.662 -1.662 17.830 903 HA ALA 9 HA ALA 9 -0.088 -0.105 15.673 904 HB1 ALA 9 HB1 ALA 9 1.180 0.848 18.236 905 HB2 ALA 9 HB2 ALA 9 -0.529 0.467 18.011 906 HB3 ALA 9 HB3 ALA 9 0.198 1.813 17.131 907 H ALA 10 HN ALA 10 3.152 -0.498 17.062 908 HA ALA 10 HA ALA 10 4.417 1.546 15.604 909 HB1 ALA 10 HB1 ALA 10 6.495 0.468 16.200 910 HB2 ALA 10 HB2 ALA 10 5.644 -1.026 16.588 911 HB3 ALA 10 HB3 ALA 10 5.391 0.412 17.574 912 H LEU 11 HN LEU 11 3.895 -1.867 14.890 913 HA LEU 11 HA LEU 11 5.443 -1.865 12.492 914 HB2 LEU 11 HB2 LEU 11 5.003 -3.877 13.881 915 HB3 LEU 11 HB1 LEU 11 3.317 -3.806 13.410 916 HG LEU 11 HG LEU 11 3.946 -4.215 11.072 917 HD11 LEU 11 HD11 LEU 11 6.747 -4.468 12.158 918 HD12 LEU 11 HD12 LEU 11 6.157 -3.194 11.089 919 HD13 LEU 11 HD13 LEU 11 6.238 -4.861 10.515 920 HD21 LEU 11 HD21 LEU 11 4.686 -6.545 11.360 921 HD22 LEU 11 HD22 LEU 11 3.393 -6.104 12.474 922 HD23 LEU 11 HD23 LEU 11 5.056 -6.201 13.050 923 H LEU 12 HN LEU 12 2.025 -1.597 13.290 924 HA LEU 12 HA LEU 12 1.059 -1.579 10.633 925 HB2 LEU 12 HB2 LEU 12 -0.155 -0.381 13.125 926 HB3 LEU 12 HB1 LEU 12 -0.999 -0.627 11.607 927 HG LEU 12 HG LEU 12 0.113 -2.800 13.388 928 HD11 LEU 12 HD11 LEU 12 -2.728 -1.990 12.784 929 HD12 LEU 12 HD12 LEU 12 -1.874 -1.735 14.308 930 HD13 LEU 12 HD13 LEU 12 -2.232 -3.374 13.759 931 HD21 LEU 12 HD21 LEU 12 0.260 -3.434 11.042 932 HD22 LEU 12 HD22 LEU 12 -1.433 -2.998 10.802 933 HD23 LEU 12 HD23 LEU 12 -1.010 -4.349 11.854 934 H ASP 13 HN ASP 13 2.218 0.961 12.787 935 HA ASP 13 HA ASP 13 1.489 3.191 11.269 936 HB2 ASP 13 HB2 ASP 13 2.374 3.578 13.452 937 HB3 ASP 13 HB1 ASP 13 3.870 2.730 13.066 938 H GLN 14 HN GLN 14 4.462 1.233 11.130 939 HA GLN 14 HA GLN 14 5.661 2.688 9.042 940 HB2 GLN 14 HB2 GLN 14 6.893 1.097 10.454 941 HB3 GLN 14 HB1 GLN 14 6.007 -0.235 9.723 942 HG2 GLN 14 HG2 GLN 14 8.255 -0.002 8.791 943 HG3 GLN 14 HG1 GLN 14 7.006 0.233 7.572 944 HE21 GLN 14 HE21 GLN 14 6.704 2.263 6.670 945 HE22 GLN 14 HE22 GLN 14 7.870 3.528 6.842 946 H VAL 15 HN VAL 15 3.460 -0.095 8.983 947 HA VAL 15 HA VAL 15 3.497 -0.479 6.182 948 HB VAL 15 HB VAL 15 1.282 -1.082 8.154 949 HG11 VAL 15 HG11 VAL 15 0.435 -2.645 6.484 950 HG12 VAL 15 HG12 VAL 15 1.697 -2.140 5.357 951 HG13 VAL 15 HG13 VAL 15 0.448 -0.996 5.855 952 HG21 VAL 15 HG21 VAL 15 2.163 -3.367 8.107 953 HG22 VAL 15 HG22 VAL 15 3.364 -2.220 8.698 954 HG23 VAL 15 HG23 VAL 15 3.474 -2.839 7.052 955 H ALA 16 HN ALA 16 1.304 1.380 8.280 956 HA ALA 16 HA ALA 16 -0.356 2.398 6.256 957 HB1 ALA 16 HB1 ALA 16 -1.016 4.092 7.892 958 HB2 ALA 16 HB2 ALA 16 0.354 3.647 8.912 959 HB3 ALA 16 HB3 ALA 16 -0.949 2.491 8.628 960 H ARG 17 HN ARG 17 2.718 3.499 7.542 961 HA ARG 17 HA ARG 17 2.812 6.019 6.307 962 HB2 ARG 17 HB2 ARG 17 4.306 5.276 8.125 963 HB3 ARG 17 HB1 ARG 17 5.088 4.159 7.020 964 HG2 ARG 17 HG2 ARG 17 6.006 5.947 5.744 965 HG3 ARG 17 HG1 ARG 17 5.040 7.137 6.621 966 HD2 ARG 17 HD2 ARG 17 6.235 6.658 8.666 967 HD3 ARG 17 HD1 ARG 17 7.135 5.367 7.872 968 HE ARG 17 HE ARG 17 8.141 7.137 6.462 969 HH11 ARG 17 HH11 ARG 17 6.750 7.997 9.571 970 HH12 ARG 17 HH12 ARG 17 7.782 9.383 9.780 971 HH21 ARG 17 HH21 ARG 17 9.503 8.942 6.766 972 HH22 ARG 17 HH22 ARG 17 9.326 9.926 8.187 973 H VAL 18 HN VAL 18 3.809 2.812 5.184 974 HA VAL 18 HA VAL 18 4.890 3.638 2.704 975 HB VAL 18 HB VAL 18 3.567 0.993 3.364 976 HG11 VAL 18 HG11 VAL 18 4.903 0.093 1.527 977 HG12 VAL 18 HG12 VAL 18 5.527 1.705 1.181 978 HG13 VAL 18 HG13 VAL 18 3.812 1.359 0.961 979 HG21 VAL 18 HG21 VAL 18 5.863 0.190 3.773 980 HG22 VAL 18 HG22 VAL 18 5.361 1.433 4.918 981 HG23 VAL 18 HG23 VAL 18 6.451 1.844 3.594 982 H GLY 19 HN GLY 19 1.660 2.503 3.645 983 HA2 GLY 19 HA2 GLY 19 0.461 2.714 1.107 984 HA3 GLY 19 HA1 GLY 19 -0.391 2.742 2.644 985 H LYS 20 HN LYS 20 0.971 5.085 3.646 986 HA LYS 20 HA LYS 20 -0.699 7.117 2.647 987 HB2 LYS 20 HB2 LYS 20 0.183 7.165 4.910 988 HB3 LYS 20 HB1 LYS 20 1.828 7.278 4.302 989 HG2 LYS 20 HG2 LYS 20 1.450 9.484 3.479 990 HG3 LYS 20 HG1 LYS 20 -0.279 9.370 3.825 991 HD2 LYS 20 HD2 LYS 20 0.161 9.264 6.199 992 HD3 LYS 20 HD1 LYS 20 1.901 9.225 5.908 993 HE2 LYS 20 HE2 LYS 20 0.137 11.498 5.032 994 HE3 LYS 20 HE1 LYS 20 0.938 11.457 6.601 995 HZ1 LYS 20 HZ1 LYS 20 2.343 11.294 3.986 996 HZ2 LYS 20 HZ2 LYS 20 3.062 11.388 5.519 997 HZ3 LYS 20 HZ3 LYS 20 2.184 12.708 4.912 998 H ALA 21 HN ALA 21 2.649 6.251 1.936 999 HA ALA 21 HA ALA 21 3.135 8.488 0.225 1000 HB1 ALA 21 HB1 ALA 21 4.969 7.267 1.277 1001 HB2 ALA 21 HB2 ALA 21 5.131 7.260 -0.479 1002 HB3 ALA 21 HB3 ALA 21 4.546 5.823 0.358 1003 H LEU 22 HN LEU 22 1.733 5.332 -0.179 1004 HA LEU 22 HA LEU 22 1.859 5.359 -3.052 1005 HB2 LEU 22 HB2 LEU 22 0.300 3.582 -1.174 1006 HB3 LEU 22 HB1 LEU 22 0.475 3.323 -2.898 1007 HG LEU 22 HG LEU 22 2.729 3.268 -0.891 1008 HD11 LEU 22 HD11 LEU 22 2.769 0.853 -1.364 1009 HD12 LEU 22 HD12 LEU 22 1.313 1.036 -2.343 1010 HD13 LEU 22 HD13 LEU 22 1.258 1.364 -0.612 1011 HD21 LEU 22 HD21 LEU 22 3.454 4.027 -3.095 1012 HD22 LEU 22 HD22 LEU 22 2.702 2.612 -3.834 1013 HD23 LEU 22 HD23 LEU 22 4.069 2.413 -2.740 1014 H ALA 23 HN ALA 23 -0.360 6.420 -0.620 1015 HA ALA 23 HA ALA 23 -2.712 6.386 -2.219 1016 HB1 ALA 23 HB1 ALA 23 -3.738 7.676 -0.424 1017 HB2 ALA 23 HB2 ALA 23 -2.152 7.945 0.299 1018 HB3 ALA 23 HB3 ALA 23 -2.817 6.312 0.216 1019 H ASN 24 HN ASN 24 -1.788 7.393 -4.111 1020 HA ASN 24 HA ASN 24 -2.698 10.106 -4.277 1021 HB2 ASN 24 HB2 ASN 24 -0.425 10.596 -3.569 1022 HB3 ASN 24 HB1 ASN 24 0.228 9.507 -4.791 1023 HD21 ASN 24 HD21 ASN 24 -1.213 12.601 -4.170 1024 HD22 ASN 24 HD22 ASN 24 -0.909 13.275 -5.740 1025 H GLY 25 HN GLY 25 -0.713 7.662 -5.940 1026 HA2 GLY 25 HA2 GLY 25 -1.632 6.452 -7.807 1027 HA3 GLY 25 HA1 GLY 25 -2.576 7.876 -8.208 1028 H ARG 26 HN ARG 26 -1.172 9.872 -8.743 1029 HA ARG 26 HA ARG 26 0.458 8.925 -10.929 1030 HB2 ARG 26 HB2 ARG 26 -0.435 11.726 -10.251 1031 HB3 ARG 26 HB1 ARG 26 0.423 11.261 -11.717 1032 HG2 ARG 26 HG2 ARG 26 -1.511 9.596 -12.064 1033 HG3 ARG 26 HG1 ARG 26 -2.362 10.575 -10.871 1034 HD2 ARG 26 HD2 ARG 26 -1.219 11.539 -13.491 1035 HD3 ARG 26 HD1 ARG 26 -2.923 11.271 -13.133 1036 HE ARG 26 HE ARG 26 -1.243 13.446 -12.118 1037 HH11 ARG 26 HH11 ARG 26 -4.387 11.898 -12.297 1038 HH12 ARG 26 HH12 ARG 26 -5.261 13.338 -11.868 1039 HH21 ARG 26 HH21 ARG 26 -2.395 15.338 -11.553 1040 HH22 ARG 26 HH22 ARG 26 -4.135 15.289 -11.443 1041 H ARG 27 HN ARG 27 1.065 10.128 -7.786 1042 HA ARG 27 HA ARG 27 3.746 10.972 -8.232 1043 HB2 ARG 27 HB2 ARG 27 2.293 9.925 -5.814 1044 HB3 ARG 27 HB1 ARG 27 4.029 10.199 -5.771 1045 HG2 ARG 27 HG2 ARG 27 3.663 12.554 -6.341 1046 HG3 ARG 27 HG1 ARG 27 1.918 12.269 -6.351 1047 HD2 ARG 27 HD2 ARG 27 1.970 11.658 -4.008 1048 HD3 ARG 27 HD1 ARG 27 3.726 11.807 -3.979 1049 HE ARG 27 HE ARG 27 2.774 14.258 -4.802 1050 HH11 ARG 27 HH11 ARG 27 2.389 12.211 -1.981 1051 HH12 ARG 27 HH12 ARG 27 2.229 13.551 -0.879 1052 HH21 ARG 27 HH21 ARG 27 2.537 16.012 -3.377 1053 HH22 ARG 27 HH22 ARG 27 2.297 15.719 -1.677 1054 H LEU 28 HN LEU 28 2.178 7.946 -8.245 1055 HA LEU 28 HA LEU 28 4.507 6.373 -7.624 1056 HB2 LEU 28 HB2 LEU 28 1.874 5.467 -8.775 1057 HB3 LEU 28 HB1 LEU 28 3.094 4.459 -8.017 1058 HG LEU 28 HG LEU 28 1.363 6.528 -6.666 1059 HD11 LEU 28 HD11 LEU 28 0.215 4.447 -7.132 1060 HD12 LEU 28 HD12 LEU 28 0.528 4.598 -5.403 1061 HD13 LEU 28 HD13 LEU 28 1.529 3.531 -6.389 1062 HD21 LEU 28 HD21 LEU 28 3.663 6.523 -5.763 1063 HD22 LEU 28 HD22 LEU 28 3.505 4.795 -5.436 1064 HD23 LEU 28 HD23 LEU 28 2.466 5.953 -4.605 1065 H GLN 29 HN GLN 29 3.364 7.974 -10.341 1066 HA GLN 29 HA GLN 29 4.191 6.334 -12.453 1067 HB2 GLN 29 HB2 GLN 29 4.269 9.350 -12.190 1068 HB3 GLN 29 HB1 GLN 29 4.574 8.486 -13.692 1069 HG2 GLN 29 HG2 GLN 29 2.325 7.569 -13.649 1070 HG3 GLN 29 HG1 GLN 29 2.013 8.374 -12.114 1071 HE21 GLN 29 HE21 GLN 29 3.419 10.799 -12.873 1072 HE22 GLN 29 HE22 GLN 29 2.410 11.622 -14.014 1073 H ILE 30 HN ILE 30 5.963 8.303 -10.191 1074 HA ILE 30 HA ILE 30 8.496 8.203 -11.429 1075 HB ILE 30 HB ILE 30 7.815 8.388 -8.488 1076 HG12 ILE 30 HG12 ILE 30 8.433 10.574 -10.488 1077 HG13 ILE 30 HG11 ILE 30 6.824 10.181 -9.892 1078 HG21 ILE 30 HG21 ILE 30 10.124 7.701 -8.845 1079 HG22 ILE 30 HG22 ILE 30 10.045 9.351 -8.219 1080 HG23 ILE 30 HG23 ILE 30 10.372 9.070 -9.931 1081 HD11 ILE 30 HD11 ILE 30 7.732 12.129 -8.767 1082 HD12 ILE 30 HD12 ILE 30 9.127 11.188 -8.238 1083 HD13 ILE 30 HD13 ILE 30 7.516 10.794 -7.634 1084 H LEU 31 HN LEU 31 6.947 6.143 -8.991 1085 HA LEU 31 HA LEU 31 9.084 4.380 -8.567 1086 HB2 LEU 31 HB2 LEU 31 6.111 3.899 -8.338 1087 HB3 LEU 31 HB1 LEU 31 7.341 2.801 -7.741 1088 HG LEU 31 HG LEU 31 6.858 5.616 -6.765 1089 HD11 LEU 31 HD11 LEU 31 6.343 2.932 -5.490 1090 HD12 LEU 31 HD12 LEU 31 5.123 4.075 -6.054 1091 HD13 LEU 31 HD13 LEU 31 6.163 4.494 -4.692 1092 HD21 LEU 31 HD21 LEU 31 8.812 3.521 -5.828 1093 HD22 LEU 31 HD22 LEU 31 8.521 5.078 -5.051 1094 HD23 LEU 31 HD23 LEU 31 9.222 5.016 -6.669 1095 H ASP 32 HN ASP 32 6.384 4.252 -10.848 1096 HA ASP 32 HA ASP 32 6.963 1.716 -11.931 1097 HB2 ASP 32 HB2 ASP 32 4.825 3.034 -12.220 1098 HB3 ASP 32 HB1 ASP 32 5.675 4.021 -13.402 1099 H LEU 33 HN LEU 33 7.952 4.974 -12.862 1100 HA LEU 33 HA LEU 33 9.439 4.288 -15.146 1101 HB2 LEU 33 HB2 LEU 33 8.764 6.579 -14.637 1102 HB3 LEU 33 HB1 LEU 33 9.787 6.582 -13.212 1103 HG LEU 33 HG LEU 33 11.768 6.315 -14.705 1104 HD11 LEU 33 HD11 LEU 33 10.647 5.317 -16.623 1105 HD12 LEU 33 HD12 LEU 33 11.513 6.784 -17.086 1106 HD13 LEU 33 HD13 LEU 33 9.760 6.818 -16.897 1107 HD21 LEU 33 HD21 LEU 33 11.157 8.499 -13.847 1108 HD22 LEU 33 HD22 LEU 33 10.031 8.731 -15.184 1109 HD23 LEU 33 HD23 LEU 33 11.764 8.642 -15.497 1110 H LEU 34 HN LEU 34 10.347 4.577 -11.735 1111 HA LEU 34 HA LEU 34 13.117 4.085 -12.200 1112 HB2 LEU 34 HB2 LEU 34 11.532 3.888 -9.643 1113 HB3 LEU 34 HB1 LEU 34 13.281 3.884 -9.757 1114 HG LEU 34 HG LEU 34 11.442 6.170 -10.455 1115 HD11 LEU 34 HD11 LEU 34 11.720 5.861 -8.074 1116 HD12 LEU 34 HD12 LEU 34 12.597 7.294 -8.607 1117 HD13 LEU 34 HD13 LEU 34 13.472 5.803 -8.262 1118 HD21 LEU 34 HD21 LEU 34 13.477 7.448 -10.894 1119 HD22 LEU 34 HD22 LEU 34 13.328 6.085 -12.002 1120 HD23 LEU 34 HD23 LEU 34 14.448 5.997 -10.643 1121 H ALA 35 HN ALA 35 10.360 2.056 -11.844 1122 HA ALA 35 HA ALA 35 11.697 -0.331 -11.104 1123 HB1 ALA 35 HB1 ALA 35 9.729 -1.490 -11.951 1124 HB2 ALA 35 HB2 ALA 35 9.190 -0.017 -12.756 1125 HB3 ALA 35 HB3 ALA 35 9.255 -0.085 -10.996 1126 H GLN 36 HN GLN 36 11.347 1.424 -14.065 1127 HA GLN 36 HA GLN 36 12.343 -0.654 -15.779 1128 HB2 GLN 36 HB2 GLN 36 10.902 1.047 -16.711 1129 HB3 GLN 36 HB1 GLN 36 11.965 2.325 -16.147 1130 HG2 GLN 36 HG2 GLN 36 13.706 1.520 -17.688 1131 HG3 GLN 36 HG1 GLN 36 12.578 0.305 -18.290 1132 HE21 GLN 36 HE21 GLN 36 11.554 3.498 -17.360 1133 HE22 GLN 36 HE22 GLN 36 11.192 4.066 -18.956 1134 H GLY 37 HN GLY 37 13.660 2.285 -14.285 1135 HA2 GLY 37 HA2 GLY 37 16.261 1.150 -14.051 1136 HA3 GLY 37 HA1 GLY 37 16.190 2.303 -15.377 1137 H GLU 38 HN GLU 38 17.698 2.421 -12.890 1138 HA GLU 38 HA GLU 38 16.484 4.429 -11.236 1139 HB2 GLU 38 HB2 GLU 38 18.694 4.513 -10.143 1140 HB3 GLU 38 HB1 GLU 38 18.087 2.870 -10.288 1141 HG2 GLU 38 HG2 GLU 38 19.524 2.921 -12.506 1142 HG3 GLU 38 HG1 GLU 38 20.396 4.171 -11.618 1143 H ARG 39 HN ARG 39 16.699 6.622 -11.345 1144 HA ARG 39 HA ARG 39 18.528 7.781 -13.295 1145 HB2 ARG 39 HB2 ARG 39 15.518 8.004 -13.518 1146 HB3 ARG 39 HB1 ARG 39 16.639 9.064 -14.370 1147 HG2 ARG 39 HG2 ARG 39 17.512 7.286 -15.647 1148 HG3 ARG 39 HG1 ARG 39 16.749 6.074 -14.624 1149 HD2 ARG 39 HD2 ARG 39 14.528 7.012 -15.419 1150 HD3 ARG 39 HD1 ARG 39 15.458 7.904 -16.627 1151 HE ARG 39 HE ARG 39 16.005 5.063 -16.511 1152 HH11 ARG 39 HH11 ARG 39 14.115 7.596 -18.039 1153 HH12 ARG 39 HH12 ARG 39 13.772 6.646 -19.447 1154 HH21 ARG 39 HH21 ARG 39 15.518 3.809 -18.342 1155 HH22 ARG 39 HH22 ARG 39 14.580 4.505 -19.634 1156 H ALA 40 HN ALA 40 18.568 10.160 -13.183 1157 HA ALA 40 HA ALA 40 18.511 10.921 -10.400 1158 HB1 ALA 40 HB1 ALA 40 20.451 11.436 -11.792 1159 HB2 ALA 40 HB2 ALA 40 19.733 12.894 -11.106 1160 HB3 ALA 40 HB3 ALA 40 19.447 12.481 -12.798 1161 H VAL 41 HN VAL 41 17.879 13.237 -9.908 1162 HA VAL 41 HA VAL 41 15.124 13.371 -9.891 1163 HB VAL 41 HB VAL 41 17.037 15.686 -9.559 1164 HG11 VAL 41 HG11 VAL 41 14.187 15.333 -8.634 1165 HG12 VAL 41 HG12 VAL 41 14.764 16.465 -9.858 1166 HG13 VAL 41 HG13 VAL 41 15.248 16.665 -8.174 1167 HG21 VAL 41 HG21 VAL 41 17.598 13.846 -8.075 1168 HG22 VAL 41 HG22 VAL 41 15.924 13.750 -7.531 1169 HG23 VAL 41 HG23 VAL 41 16.893 15.175 -7.158 1170 H GLU 42 HN GLU 42 17.359 15.092 -12.079 1171 HA GLU 42 HA GLU 42 15.404 16.748 -13.250 1172 HB2 GLU 42 HB2 GLU 42 17.876 15.747 -14.663 1173 HB3 GLU 42 HB1 GLU 42 17.007 17.245 -14.957 1174 HG2 GLU 42 HG2 GLU 42 18.659 18.130 -13.731 1175 HG3 GLU 42 HG1 GLU 42 17.670 17.588 -12.374 1176 H ALA 43 HN ALA 43 16.737 13.631 -14.319 1177 HA ALA 43 HA ALA 43 15.195 13.342 -16.637 1178 HB1 ALA 43 HB1 ALA 43 16.245 11.180 -14.812 1179 HB2 ALA 43 HB2 ALA 43 17.132 11.942 -16.135 1180 HB3 ALA 43 HB3 ALA 43 15.706 10.961 -16.478 1181 H ILE 44 HN ILE 44 14.569 12.225 -13.326 1182 HA ILE 44 HA ILE 44 12.131 10.935 -13.804 1183 HB ILE 44 HB ILE 44 13.078 12.363 -11.315 1184 HG12 ILE 44 HG12 ILE 44 13.121 9.426 -12.042 1185 HG13 ILE 44 HG11 ILE 44 14.516 10.498 -12.096 1186 HG21 ILE 44 HG21 ILE 44 10.654 12.099 -11.282 1187 HG22 ILE 44 HG22 ILE 44 11.419 11.029 -10.107 1188 HG23 ILE 44 HG23 ILE 44 10.828 10.380 -11.635 1189 HD11 ILE 44 HD11 ILE 44 14.313 10.855 -9.679 1190 HD12 ILE 44 HD12 ILE 44 14.547 9.154 -10.088 1191 HD13 ILE 44 HD13 ILE 44 12.945 9.743 -9.644 1192 H ALA 45 HN ALA 45 12.781 14.268 -12.766 1193 HA ALA 45 HA ALA 45 10.143 15.138 -12.528 1194 HB1 ALA 45 HB1 ALA 45 12.561 16.752 -13.337 1195 HB2 ALA 45 HB2 ALA 45 12.057 16.403 -11.684 1196 HB3 ALA 45 HB3 ALA 45 11.041 17.401 -12.722 1197 H THR 46 HN THR 46 12.327 15.339 -15.318 1198 HA THR 46 HA THR 46 10.559 16.711 -17.014 1199 HB THR 46 HB THR 46 12.731 14.797 -17.879 1200 HG1 THR 46 HG1 THR 46 13.663 16.257 -16.450 1201 HG21 THR 46 HG21 THR 46 12.880 16.222 -19.845 1202 HG22 THR 46 HG22 THR 46 11.624 17.278 -19.202 1203 HG23 THR 46 HG23 THR 46 11.230 15.622 -19.663 1204 H ALA 47 HN ALA 47 11.138 13.241 -16.548 1205 HA ALA 47 HA ALA 47 9.537 12.371 -18.718 1206 HB1 ALA 47 HB1 ALA 47 11.280 10.980 -17.723 1207 HB2 ALA 47 HB2 ALA 47 9.722 10.156 -17.730 1208 HB3 ALA 47 HB3 ALA 47 10.341 10.860 -16.235 1209 H THR 48 HN THR 48 8.792 13.201 -15.406 1210 HA THR 48 HA THR 48 6.125 12.038 -15.628 1211 HB THR 48 HB THR 48 5.905 12.892 -13.232 1212 HG1 THR 48 HG1 THR 48 8.740 13.033 -13.311 1213 HG21 THR 48 HG21 THR 48 6.352 10.543 -13.785 1214 HG22 THR 48 HG22 THR 48 7.208 11.029 -12.321 1215 HG23 THR 48 HG23 THR 48 8.082 10.886 -13.847 1216 H GLY 49 HN GLY 49 7.627 14.937 -16.344 1217 HA2 GLY 49 HA2 GLY 49 6.645 16.845 -17.229 1218 HA3 GLY 49 HA1 GLY 49 5.071 16.205 -16.787 1219 H MET 50 HN MET 50 7.779 16.647 -14.576 1220 HA MET 50 HA MET 50 6.398 18.962 -13.404 1221 HB2 MET 50 HB2 MET 50 6.849 18.136 -11.141 1222 HB3 MET 50 HB1 MET 50 5.822 17.020 -12.029 1223 HG2 MET 50 HG2 MET 50 7.811 15.621 -12.483 1224 HG3 MET 50 HG1 MET 50 8.765 16.714 -11.479 1225 HE1 MET 50 HE1 MET 50 5.326 14.051 -9.921 1226 HE2 MET 50 HE2 MET 50 5.940 14.001 -11.573 1227 HE3 MET 50 HE3 MET 50 5.064 15.421 -11.001 1228 H ASN 51 HN ASN 51 7.938 20.061 -11.740 1229 HA ASN 51 HA ASN 51 10.461 20.417 -13.154 1230 HB2 ASN 51 HB2 ASN 51 9.052 22.036 -11.035 1231 HB3 ASN 51 HB1 ASN 51 10.701 22.387 -11.546 1232 HD21 ASN 51 HD21 ASN 51 8.220 23.946 -11.795 1233 HD22 ASN 51 HD22 ASN 51 8.056 24.295 -13.481 1234 H LEU 52 HN LEU 52 12.392 20.956 -11.635 1235 HA LEU 52 HA LEU 52 13.070 18.514 -10.414 1236 HB2 LEU 52 HB2 LEU 52 14.383 21.216 -10.414 1237 HB3 LEU 52 HB1 LEU 52 15.051 19.877 -9.501 1238 HG LEU 52 HG LEU 52 15.154 18.589 -11.676 1239 HD11 LEU 52 HD11 LEU 52 13.552 19.960 -12.936 1240 HD12 LEU 52 HD12 LEU 52 15.111 19.837 -13.749 1241 HD13 LEU 52 HD13 LEU 52 14.685 21.310 -12.879 1242 HD21 LEU 52 HD21 LEU 52 17.190 19.743 -12.428 1243 HD22 LEU 52 HD22 LEU 52 17.129 19.552 -10.676 1244 HD23 LEU 52 HD23 LEU 52 16.769 21.116 -11.405 1245 H THR 53 HN THR 53 12.121 21.629 -9.039 1246 HA THR 53 HA THR 53 12.478 20.899 -6.336 1247 HB THR 53 HB THR 53 10.790 22.780 -5.932 1248 HG1 THR 53 HG1 THR 53 11.117 23.837 -8.416 1249 HG21 THR 53 HG21 THR 53 13.262 23.340 -7.578 1250 HG22 THR 53 HG22 THR 53 13.209 23.114 -5.831 1251 HG23 THR 53 HG23 THR 53 12.420 24.509 -6.563 1252 H THR 54 HN THR 54 9.709 20.758 -8.513 1253 HA THR 54 HA THR 54 7.764 19.822 -6.751 1254 HB THR 54 HB THR 54 7.860 18.780 -9.552 1255 HG1 THR 54 HG1 THR 54 7.028 21.445 -9.125 1256 HG21 THR 54 HG21 THR 54 5.482 19.391 -9.494 1257 HG22 THR 54 HG22 THR 54 5.695 20.063 -7.876 1258 HG23 THR 54 HG23 THR 54 5.907 18.333 -8.149 1259 H ALA 55 HN ALA 55 9.962 18.020 -8.877 1260 HA ALA 55 HA ALA 55 9.122 15.452 -8.133 1261 HB1 ALA 55 HB1 ALA 55 11.177 14.667 -9.176 1262 HB2 ALA 55 HB2 ALA 55 11.806 16.314 -9.193 1263 HB3 ALA 55 HB3 ALA 55 10.392 15.903 -10.162 1264 H SER 56 HN SER 56 11.736 17.499 -6.877 1265 HA SER 56 HA SER 56 12.923 15.607 -5.207 1266 HB2 SER 56 HB2 SER 56 12.725 18.604 -4.823 1267 HB3 SER 56 HB1 SER 56 13.835 17.539 -3.959 1268 HG SER 56 HG SER 56 13.767 18.109 -6.741 1269 H ALA 57 HN ALA 57 10.131 17.696 -4.634 1270 HA ALA 57 HA ALA 57 9.878 17.109 -1.869 1271 HB1 ALA 57 HB1 ALA 57 7.666 18.085 -2.046 1272 HB2 ALA 57 HB2 ALA 57 7.744 17.994 -3.805 1273 HB3 ALA 57 HB3 ALA 57 8.837 19.066 -2.929 1274 H ASN 58 HN ASN 58 8.445 15.732 -4.786 1275 HA ASN 58 HA ASN 58 6.760 13.871 -3.466 1276 HB2 ASN 58 HB2 ASN 58 7.857 13.940 -6.283 1277 HB3 ASN 58 HB1 ASN 58 6.698 12.741 -5.723 1278 HD21 ASN 58 HD21 ASN 58 6.453 14.776 -7.805 1279 HD22 ASN 58 HD22 ASN 58 5.066 15.728 -7.379 1280 H LEU 59 HN LEU 59 9.997 13.638 -4.867 1281 HA LEU 59 HA LEU 59 10.395 10.889 -4.517 1282 HB2 LEU 59 HB2 LEU 59 12.375 13.165 -4.523 1283 HB3 LEU 59 HB1 LEU 59 12.828 11.471 -4.573 1284 HG LEU 59 HG LEU 59 11.110 12.799 -6.668 1285 HD11 LEU 59 HD11 LEU 59 13.097 12.805 -8.079 1286 HD12 LEU 59 HD12 LEU 59 14.061 12.199 -6.735 1287 HD13 LEU 59 HD13 LEU 59 13.336 13.804 -6.644 1288 HD21 LEU 59 HD21 LEU 59 12.545 10.149 -6.596 1289 HD22 LEU 59 HD22 LEU 59 11.664 10.803 -7.977 1290 HD23 LEU 59 HD23 LEU 59 10.802 10.397 -6.495 1291 H GLN 60 HN GLN 60 10.983 13.599 -2.313 1292 HA GLN 60 HA GLN 60 12.222 12.088 -0.278 1293 HB2 GLN 60 HB2 GLN 60 12.344 14.530 -0.319 1294 HB3 GLN 60 HB1 GLN 60 10.608 14.636 -0.058 1295 HG2 GLN 60 HG2 GLN 60 10.860 13.585 2.127 1296 HG3 GLN 60 HG1 GLN 60 12.599 13.459 1.868 1297 HE21 GLN 60 HE21 GLN 60 13.038 14.687 3.681 1298 HE22 GLN 60 HE22 GLN 60 12.794 16.401 3.722 1299 H ALA 61 HN ALA 61 8.833 12.878 -0.939 1300 HA ALA 61 HA ALA 61 7.729 11.772 1.404 1301 HB1 ALA 61 HB1 ALA 61 5.619 11.737 0.185 1302 HB2 ALA 61 HB2 ALA 61 6.480 11.981 -1.333 1303 HB3 ALA 61 HB3 ALA 61 6.483 13.248 -0.107 1304 H LEU 62 HN LEU 62 8.386 10.361 -1.780 1305 HA LEU 62 HA LEU 62 7.325 7.803 -1.213 1306 HB2 LEU 62 HB2 LEU 62 9.449 8.620 -3.192 1307 HB3 LEU 62 HB1 LEU 62 8.660 7.056 -3.160 1308 HG LEU 62 HG LEU 62 7.289 9.696 -3.683 1309 HD11 LEU 62 HD11 LEU 62 8.745 9.014 -5.515 1310 HD12 LEU 62 HD12 LEU 62 7.049 8.856 -5.967 1311 HD13 LEU 62 HD13 LEU 62 7.984 7.424 -5.539 1312 HD21 LEU 62 HD21 LEU 62 5.346 8.318 -4.261 1313 HD22 LEU 62 HD22 LEU 62 5.811 8.105 -2.574 1314 HD23 LEU 62 HD23 LEU 62 6.225 6.872 -3.765 1315 H LYS 63 HN LYS 63 10.567 9.176 -0.855 1316 HA LYS 63 HA LYS 63 11.821 6.748 -0.092 1317 HB2 LYS 63 HB2 LYS 63 13.027 8.826 -0.851 1318 HB3 LYS 63 HB1 LYS 63 12.670 9.534 0.722 1319 HG2 LYS 63 HG2 LYS 63 13.846 7.577 1.758 1320 HG3 LYS 63 HG1 LYS 63 14.359 7.117 0.136 1321 HD2 LYS 63 HD2 LYS 63 15.439 9.334 -0.094 1322 HD3 LYS 63 HD1 LYS 63 15.006 9.680 1.582 1323 HE2 LYS 63 HE2 LYS 63 16.239 7.558 2.197 1324 HE3 LYS 63 HE1 LYS 63 16.858 7.548 0.547 1325 HZ1 LYS 63 HZ1 LYS 63 18.451 8.587 1.958 1326 HZ2 LYS 63 HZ2 LYS 63 17.284 9.645 2.599 1327 HZ3 LYS 63 HZ3 LYS 63 17.763 9.789 0.979 1328 H SER 64 HN SER 64 10.208 9.316 1.701 1329 HA SER 64 HA SER 64 10.831 8.357 4.283 1330 HB2 SER 64 HB2 SER 64 8.471 10.020 3.364 1331 HB3 SER 64 HB1 SER 64 8.987 9.811 5.039 1332 HG SER 64 HG SER 64 10.411 11.059 2.923 1333 H GLY 65 HN GLY 65 8.407 7.499 1.936 1334 HA2 GLY 65 HA2 GLY 65 6.863 5.859 3.711 1335 HA3 GLY 65 HA1 GLY 65 6.787 5.855 1.954 1336 H GLY 66 HN GLY 66 9.739 5.448 1.811 1337 HA2 GLY 66 HA2 GLY 66 11.292 3.707 2.364 1338 HA3 GLY 66 HA1 GLY 66 9.933 2.691 2.817 1339 H LEU 67 HN LEU 67 9.669 4.528 -0.082 1340 HA LEU 67 HA LEU 67 9.596 2.049 -1.596 1341 HB2 LEU 67 HB2 LEU 67 8.817 4.879 -2.270 1342 HB3 LEU 67 HB1 LEU 67 8.825 3.597 -3.463 1343 HG LEU 67 HG LEU 67 6.582 3.873 -2.750 1344 HD11 LEU 67 HD11 LEU 67 7.710 1.471 -1.333 1345 HD12 LEU 67 HD12 LEU 67 7.279 1.562 -3.040 1346 HD13 LEU 67 HD13 LEU 67 6.027 1.704 -1.805 1347 HD21 LEU 67 HD21 LEU 67 6.957 5.086 -0.684 1348 HD22 LEU 67 HD22 LEU 67 7.558 3.617 0.088 1349 HD23 LEU 67 HD23 LEU 67 5.870 3.722 -0.415 1350 H VAL 68 HN VAL 68 11.325 5.165 -1.732 1351 HA VAL 68 HA VAL 68 13.146 3.924 -3.687 1352 HB VAL 68 HB VAL 68 13.634 6.210 -4.521 1353 HG11 VAL 68 HG11 VAL 68 12.032 4.786 -5.679 1354 HG12 VAL 68 HG12 VAL 68 11.559 6.482 -5.779 1355 HG13 VAL 68 HG13 VAL 68 10.733 5.402 -4.657 1356 HG21 VAL 68 HG21 VAL 68 11.334 7.007 -2.744 1357 HG22 VAL 68 HG22 VAL 68 12.086 8.035 -3.964 1358 HG23 VAL 68 HG23 VAL 68 13.018 7.498 -2.563 1359 H GLU 69 HN GLU 69 15.330 4.743 -3.718 1360 HA GLU 69 HA GLU 69 16.282 5.721 -1.105 1361 HB2 GLU 69 HB2 GLU 69 16.791 3.220 -2.182 1362 HB3 GLU 69 HB1 GLU 69 18.208 4.146 -2.656 1363 HG2 GLU 69 HG2 GLU 69 17.188 3.934 0.168 1364 HG3 GLU 69 HG1 GLU 69 18.447 2.910 -0.516 1365 H ALA 70 HN ALA 70 18.237 7.015 -1.230 1366 HA ALA 70 HA ALA 70 18.277 8.539 -3.751 1367 HB1 ALA 70 HB1 ALA 70 17.532 9.798 -1.792 1368 HB2 ALA 70 HB2 ALA 70 19.052 10.434 -2.425 1369 HB3 ALA 70 HB3 ALA 70 19.051 9.428 -0.974 1370 H ARG 71 HN ARG 71 19.932 8.122 -4.999 1371 HA ARG 71 HA ARG 71 22.517 7.371 -3.807 1372 HB2 ARG 71 HB2 ARG 71 21.674 7.206 -6.712 1373 HB3 ARG 71 HB1 ARG 71 23.082 6.460 -5.970 1374 HG2 ARG 71 HG2 ARG 71 20.287 5.748 -5.156 1375 HG3 ARG 71 HG1 ARG 71 21.104 4.959 -6.504 1376 HD2 ARG 71 HD2 ARG 71 22.219 5.100 -3.711 1377 HD3 ARG 71 HD1 ARG 71 21.262 3.751 -4.321 1378 HE ARG 71 HE ARG 71 23.105 3.707 -6.135 1379 HH11 ARG 71 HH11 ARG 71 23.599 4.540 -2.756 1380 HH12 ARG 71 HH12 ARG 71 25.228 3.920 -2.712 1381 HH21 ARG 71 HH21 ARG 71 25.220 2.834 -6.062 1382 HH22 ARG 71 HH22 ARG 71 26.131 2.908 -4.578 1383 H ARG 72 HN ARG 72 23.389 9.438 -3.306 1384 HA ARG 72 HA ARG 72 23.259 11.535 -5.275 1385 HB2 ARG 72 HB2 ARG 72 23.309 12.165 -2.906 1386 HB3 ARG 72 HB1 ARG 72 24.893 11.408 -2.729 1387 HG2 ARG 72 HG2 ARG 72 25.777 12.976 -4.432 1388 HG3 ARG 72 HG1 ARG 72 24.213 13.787 -4.443 1389 HD2 ARG 72 HD2 ARG 72 24.481 14.401 -2.120 1390 HD3 ARG 72 HD1 ARG 72 25.994 13.492 -2.029 1391 HE ARG 72 HE ARG 72 26.505 15.201 -4.028 1392 HH11 ARG 72 HH11 ARG 72 25.207 15.722 -0.821 1393 HH12 ARG 72 HH12 ARG 72 25.783 17.357 -0.720 1394 HH21 ARG 72 HH21 ARG 72 27.285 17.342 -3.883 1395 HH22 ARG 72 HH22 ARG 72 26.984 18.267 -2.445 1396 H GLU 73 HN GLU 73 24.534 11.722 -6.958 1397 HA GLU 73 HA GLU 73 27.351 10.978 -6.668 1398 HB2 GLU 73 HB2 GLU 73 25.709 10.366 -9.138 1399 HB3 GLU 73 HB1 GLU 73 27.417 10.017 -8.905 1400 HG2 GLU 73 HG2 GLU 73 26.615 8.617 -6.889 1401 HG3 GLU 73 HG1 GLU 73 25.036 8.699 -7.667 1402 H GLY 74 HN GLY 74 28.703 12.528 -7.368 1403 HA2 GLY 74 HA2 GLY 74 29.358 14.608 -8.094 1404 HA3 GLY 74 HA1 GLY 74 28.031 14.540 -9.249 1405 H THR 75 HN THR 75 26.513 16.021 -9.006 1406 HA THR 75 HA THR 75 26.159 17.223 -6.336 1407 HB THR 75 HB THR 75 27.128 18.773 -8.022 1408 HG1 THR 75 HG1 THR 75 25.725 19.531 -6.305 1409 HG21 THR 75 HG21 THR 75 25.706 19.621 -9.833 1410 HG22 THR 75 HG22 THR 75 24.484 18.411 -9.433 1411 HG23 THR 75 HG23 THR 75 26.064 17.906 -10.034 1412 H ARG 76 HN ARG 76 24.748 15.199 -8.538 1413 HA ARG 76 HA ARG 76 22.027 16.069 -7.789 1414 HB2 ARG 76 HB2 ARG 76 21.346 14.787 -9.923 1415 HB3 ARG 76 HB1 ARG 76 22.058 16.385 -10.098 1416 HG2 ARG 76 HG2 ARG 76 24.052 15.552 -10.906 1417 HG3 ARG 76 HG1 ARG 76 23.780 13.952 -10.215 1418 HD2 ARG 76 HD2 ARG 76 22.149 13.430 -11.862 1419 HD3 ARG 76 HD1 ARG 76 22.093 15.098 -12.423 1420 HE ARG 76 HE ARG 76 23.699 14.490 -13.901 1421 HH11 ARG 76 HH11 ARG 76 24.307 12.670 -10.953 1422 HH12 ARG 76 HH12 ARG 76 25.688 11.847 -11.607 1423 HH21 ARG 76 HH21 ARG 76 25.509 13.390 -14.737 1424 HH22 ARG 76 HH22 ARG 76 26.372 12.267 -13.734 1425 H GLN 77 HN GLN 77 20.510 14.482 -7.289 1426 HA GLN 77 HA GLN 77 21.726 11.981 -6.374 1427 HB2 GLN 77 HB2 GLN 77 19.050 13.212 -5.693 1428 HB3 GLN 77 HB1 GLN 77 19.702 11.738 -4.991 1429 HG2 GLN 77 HG2 GLN 77 21.571 13.033 -4.054 1430 HG3 GLN 77 HG1 GLN 77 20.864 14.504 -4.722 1431 HE21 GLN 77 HE21 GLN 77 18.134 13.595 -4.146 1432 HE22 GLN 77 HE22 GLN 77 17.922 13.777 -2.443 1433 H TYR 78 HN TYR 78 21.328 10.117 -7.292 1434 HA TYR 78 HA TYR 78 19.271 9.820 -9.322 1435 HB2 TYR 78 HB2 TYR 78 21.393 7.958 -8.250 1436 HB3 TYR 78 HB1 TYR 78 20.170 7.442 -9.400 1437 HD1 TYR 78 HD1 TYR 78 23.178 9.488 -8.922 1438 HD2 TYR 78 HD2 TYR 78 20.281 8.103 -11.709 1439 HE1 TYR 78 HE1 TYR 78 24.624 10.204 -10.775 1440 HE2 TYR 78 HE2 TYR 78 21.718 8.817 -13.571 1441 HH TYR 78 HH TYR 78 24.975 9.676 -13.140 1442 H TYR 79 HN TYR 79 17.316 8.938 -8.915 1443 HA TYR 79 HA TYR 79 16.987 7.671 -6.286 1444 HB2 TYR 79 HB2 TYR 79 15.143 9.320 -7.955 1445 HB3 TYR 79 HB1 TYR 79 14.457 8.098 -6.887 1446 HD1 TYR 79 HD2 TYR 79 16.307 11.273 -7.032 1447 HD2 TYR 79 HD1 TYR 79 14.566 8.339 -4.490 1448 HE1 TYR 79 HE2 TYR 79 16.499 12.815 -5.126 1449 HE2 TYR 79 HE1 TYR 79 14.753 9.871 -2.578 1450 HH TYR 79 HH TYR 79 15.322 13.145 -2.889 1451 H ARG 80 HN ARG 80 16.266 5.693 -6.105 1452 HA ARG 80 HA ARG 80 15.090 4.302 -8.371 1453 HB2 ARG 80 HB2 ARG 80 16.650 2.380 -8.110 1454 HB3 ARG 80 HB1 ARG 80 17.438 3.828 -8.721 1455 HG2 ARG 80 HG2 ARG 80 18.403 4.276 -6.571 1456 HG3 ARG 80 HG1 ARG 80 17.501 2.947 -5.843 1457 HD2 ARG 80 HD2 ARG 80 19.471 2.571 -8.086 1458 HD3 ARG 80 HD1 ARG 80 19.919 2.477 -6.383 1459 HE ARG 80 HE ARG 80 17.859 0.734 -6.570 1460 HH11 ARG 80 HH11 ARG 80 20.753 1.142 -8.495 1461 HH12 ARG 80 HH12 ARG 80 20.969 -0.567 -8.758 1462 HH21 ARG 80 HH21 ARG 80 18.099 -1.500 -6.959 1463 HH22 ARG 80 HH22 ARG 80 19.439 -2.070 -7.912 1464 H ILE 81 HN ILE 81 14.402 2.060 -7.640 1465 HA ILE 81 HA ILE 81 12.935 2.313 -5.214 1466 HB ILE 81 HB ILE 81 13.452 -0.197 -6.828 1467 HG12 ILE 81 HG12 ILE 81 11.182 1.803 -7.005 1468 HG13 ILE 81 HG11 ILE 81 12.480 1.635 -8.183 1469 HG21 ILE 81 HG21 ILE 81 12.602 -0.626 -4.577 1470 HG22 ILE 81 HG22 ILE 81 11.385 -1.004 -5.796 1471 HG23 ILE 81 HG23 ILE 81 11.265 0.489 -4.864 1472 HD11 ILE 81 HD11 ILE 81 10.427 0.576 -8.937 1473 HD12 ILE 81 HD12 ILE 81 10.434 -0.465 -7.512 1474 HD13 ILE 81 HD13 ILE 81 11.717 -0.608 -8.715 1475 H ALA 82 HN ALA 82 13.373 1.551 -3.193 1476 HA ALA 82 HA ALA 82 16.026 1.463 -2.377 1477 HB1 ALA 82 HB1 ALA 82 15.184 0.834 -0.187 1478 HB2 ALA 82 HB2 ALA 82 13.638 0.369 -0.897 1479 HB3 ALA 82 HB3 ALA 82 14.144 2.058 -0.918 1480 H GLY 83 HN GLY 83 13.800 -1.234 -2.952 1481 HA2 GLY 83 HA2 GLY 83 16.099 -2.996 -3.243 1482 HA3 GLY 83 HA1 GLY 83 14.953 -3.412 -1.975 1483 H GLU 84 HN GLU 84 15.372 -5.235 -3.882 1484 HA GLU 84 HA GLU 84 13.603 -4.988 -6.112 1485 HB2 GLU 84 HB2 GLU 84 15.584 -6.468 -6.114 1486 HB3 GLU 84 HB1 GLU 84 14.830 -7.460 -4.873 1487 HG2 GLU 84 HG2 GLU 84 13.032 -8.032 -6.413 1488 HG3 GLU 84 HG1 GLU 84 13.770 -7.023 -7.656 1489 H ASP 85 HN ASP 85 13.361 -6.131 -2.844 1490 HA ASP 85 HA ASP 85 10.891 -7.480 -3.025 1491 HB2 ASP 85 HB2 ASP 85 10.757 -6.834 -0.517 1492 HB3 ASP 85 HB1 ASP 85 12.043 -7.908 -1.044 1493 H VAL 86 HN VAL 86 11.712 -4.130 -2.253 1494 HA VAL 86 HA VAL 86 9.064 -3.189 -1.997 1495 HB VAL 86 HB VAL 86 11.488 -1.624 -2.906 1496 HG11 VAL 86 HG11 VAL 86 10.307 0.309 -1.963 1497 HG12 VAL 86 HG12 VAL 86 8.911 -0.718 -1.631 1498 HG13 VAL 86 HG13 VAL 86 9.418 -0.427 -3.295 1499 HG21 VAL 86 HG21 VAL 86 11.960 -2.762 -0.819 1500 HG22 VAL 86 HG22 VAL 86 10.459 -2.153 -0.120 1501 HG23 VAL 86 HG23 VAL 86 11.757 -1.032 -0.534 1502 H ALA 87 HN ALA 87 11.228 -3.476 -4.780 1503 HA ALA 87 HA ALA 87 9.639 -2.155 -6.685 1504 HB1 ALA 87 HB1 ALA 87 11.978 -2.769 -7.079 1505 HB2 ALA 87 HB2 ALA 87 10.927 -3.378 -8.357 1506 HB3 ALA 87 HB3 ALA 87 11.523 -4.472 -7.109 1507 H ARG 88 HN ARG 88 9.811 -5.566 -5.762 1508 HA ARG 88 HA ARG 88 7.819 -6.494 -7.525 1509 HB2 ARG 88 HB2 ARG 88 8.924 -7.566 -4.942 1510 HB3 ARG 88 HB1 ARG 88 7.680 -8.416 -5.846 1511 HG2 ARG 88 HG2 ARG 88 9.123 -8.757 -7.690 1512 HG3 ARG 88 HG1 ARG 88 10.321 -7.629 -7.047 1513 HD2 ARG 88 HD2 ARG 88 10.878 -10.059 -6.757 1514 HD3 ARG 88 HD1 ARG 88 10.882 -9.107 -5.274 1515 HE ARG 88 HE ARG 88 8.462 -10.608 -5.972 1516 HH11 ARG 88 HH11 ARG 88 11.330 -10.295 -3.978 1517 HH12 ARG 88 HH12 ARG 88 10.707 -11.309 -2.705 1518 HH21 ARG 88 HH21 ARG 88 7.662 -11.962 -4.339 1519 HH22 ARG 88 HH22 ARG 88 8.615 -12.290 -2.924 1520 H LEU 89 HN LEU 89 7.691 -5.143 -4.294 1521 HA LEU 89 HA LEU 89 5.034 -5.787 -3.659 1522 HB2 LEU 89 HB2 LEU 89 6.838 -4.852 -2.137 1523 HB3 LEU 89 HB1 LEU 89 6.497 -3.281 -2.828 1524 HG LEU 89 HG LEU 89 4.327 -4.880 -1.497 1525 HD11 LEU 89 HD11 LEU 89 6.257 -2.982 -0.170 1526 HD12 LEU 89 HD12 LEU 89 6.151 -4.720 0.108 1527 HD13 LEU 89 HD13 LEU 89 4.814 -3.669 0.574 1528 HD21 LEU 89 HD21 LEU 89 4.746 -1.914 -1.878 1529 HD22 LEU 89 HD22 LEU 89 3.346 -2.681 -1.127 1530 HD23 LEU 89 HD23 LEU 89 3.673 -2.930 -2.842 1531 H PHE 90 HN PHE 90 6.414 -2.885 -5.183 1532 HA PHE 90 HA PHE 90 3.949 -1.563 -5.579 1533 HB2 PHE 90 HB2 PHE 90 6.047 -0.334 -5.671 1534 HB3 PHE 90 HB1 PHE 90 6.574 -1.282 -7.058 1535 HD1 PHE 90 HD2 PHE 90 3.881 1.043 -5.972 1536 HD2 PHE 90 HD1 PHE 90 6.172 -0.514 -9.204 1537 HE1 PHE 90 HE2 PHE 90 2.851 2.685 -7.488 1538 HE2 PHE 90 HE1 PHE 90 5.145 1.125 -10.726 1539 HZ PHE 90 HZ PHE 90 3.481 2.727 -9.866 1540 H ALA 91 HN ALA 91 5.875 -3.682 -7.662 1541 HA ALA 91 HA ALA 91 4.267 -3.505 -9.952 1542 HB1 ALA 91 HB1 ALA 91 5.923 -5.852 -9.028 1543 HB2 ALA 91 HB2 ALA 91 6.525 -4.469 -9.946 1544 HB3 ALA 91 HB3 ALA 91 5.345 -5.563 -10.670 1545 H LEU 92 HN LEU 92 4.184 -5.765 -7.225 1546 HA LEU 92 HA LEU 92 2.241 -7.518 -8.134 1547 HB2 LEU 92 HB2 LEU 92 3.574 -7.927 -6.144 1548 HB3 LEU 92 HB1 LEU 92 2.794 -6.593 -5.317 1549 HG LEU 92 HG LEU 92 0.652 -7.812 -5.395 1550 HD11 LEU 92 HD11 LEU 92 1.053 -9.128 -7.404 1551 HD12 LEU 92 HD12 LEU 92 0.615 -10.159 -6.044 1552 HD13 LEU 92 HD13 LEU 92 2.298 -10.051 -6.560 1553 HD21 LEU 92 HD21 LEU 92 2.954 -9.322 -4.169 1554 HD22 LEU 92 HD22 LEU 92 1.254 -9.557 -3.764 1555 HD23 LEU 92 HD23 LEU 92 2.035 -8.012 -3.424 1556 H VAL 93 HN VAL 93 1.757 -4.599 -6.135 1557 HA VAL 93 HA VAL 93 -1.034 -4.948 -5.943 1558 HB VAL 93 HB VAL 93 0.259 -3.571 -4.359 1559 HG11 VAL 93 HG11 VAL 93 0.868 -1.275 -4.905 1560 HG12 VAL 93 HG12 VAL 93 0.377 -1.539 -6.579 1561 HG13 VAL 93 HG13 VAL 93 1.744 -2.431 -5.910 1562 HG21 VAL 93 HG21 VAL 93 -1.391 -1.779 -4.099 1563 HG22 VAL 93 HG22 VAL 93 -2.154 -3.328 -4.461 1564 HG23 VAL 93 HG23 VAL 93 -1.994 -2.107 -5.724 1565 H GLN 94 HN GLN 94 0.966 -3.243 -8.302 1566 HA GLN 94 HA GLN 94 -1.238 -1.963 -9.589 1567 HB2 GLN 94 HB2 GLN 94 1.044 -1.085 -9.807 1568 HB3 GLN 94 HB1 GLN 94 1.536 -2.548 -10.654 1569 HG2 GLN 94 HG2 GLN 94 0.085 -2.036 -12.496 1570 HG3 GLN 94 HG1 GLN 94 -0.589 -0.657 -11.636 1571 HE21 GLN 94 HE21 GLN 94 2.816 -1.426 -11.581 1572 HE22 GLN 94 HE22 GLN 94 3.336 -0.079 -12.538 1573 H VAL 95 HN VAL 95 0.537 -4.975 -10.113 1574 HA VAL 95 HA VAL 95 -0.642 -5.692 -12.559 1575 HB VAL 95 HB VAL 95 0.532 -7.419 -10.377 1576 HG11 VAL 95 HG11 VAL 95 -0.323 -8.241 -13.151 1577 HG12 VAL 95 HG12 VAL 95 -1.074 -8.751 -11.641 1578 HG13 VAL 95 HG13 VAL 95 0.578 -9.241 -12.015 1579 HG21 VAL 95 HG21 VAL 95 2.128 -5.965 -11.469 1580 HG22 VAL 95 HG22 VAL 95 1.578 -6.505 -13.054 1581 HG23 VAL 95 HG23 VAL 95 2.399 -7.632 -11.976 1582 H VAL 96 HN VAL 96 -1.556 -6.614 -9.233 1583 HA VAL 96 HA VAL 96 -3.754 -8.201 -10.051 1584 HB VAL 96 HB VAL 96 -4.498 -8.141 -7.711 1585 HG11 VAL 96 HG11 VAL 96 -1.528 -8.532 -8.053 1586 HG12 VAL 96 HG12 VAL 96 -2.787 -9.732 -8.344 1587 HG13 VAL 96 HG13 VAL 96 -2.491 -9.146 -6.708 1588 HG21 VAL 96 HG21 VAL 96 -3.981 -5.823 -7.173 1589 HG22 VAL 96 HG22 VAL 96 -2.254 -6.165 -7.302 1590 HG23 VAL 96 HG23 VAL 96 -3.208 -6.918 -6.024 1591 H ALA 97 HN ALA 97 -3.420 -4.786 -9.328 1592 HA ALA 97 HA ALA 97 -6.182 -4.169 -9.283 1593 HB1 ALA 97 HB1 ALA 97 -3.875 -2.389 -10.075 1594 HB2 ALA 97 HB2 ALA 97 -4.461 -2.637 -8.431 1595 HB3 ALA 97 HB3 ALA 97 -5.497 -1.859 -9.627 1596 H ASP 98 HN ASP 98 -3.754 -3.800 -11.857 1597 HA ASP 98 HA ASP 98 -5.490 -2.999 -13.893 1598 HB2 ASP 98 HB2 ASP 98 -3.123 -2.727 -14.157 1599 HB3 ASP 98 HB1 ASP 98 -2.843 -4.455 -13.991 1600 H GLU 99 HN GLU 99 -4.636 -6.207 -12.748 1601 HA GLU 99 HA GLU 99 -5.657 -7.759 -14.828 1602 HB2 GLU 99 HB2 GLU 99 -4.332 -8.743 -13.058 1603 HB3 GLU 99 HB1 GLU 99 -5.553 -8.335 -11.863 1604 HG2 GLU 99 HG2 GLU 99 -7.122 -9.867 -12.948 1605 HG3 GLU 99 HG1 GLU 99 -5.884 -10.286 -14.130 1606 H HIS 100 HN HIS 100 -7.331 -6.563 -11.906 1607 HA HIS 100 HA HIS 100 -9.796 -7.786 -12.860 1608 HB2 HIS 100 HB2 HIS 100 -9.133 -6.408 -10.253 1609 HB3 HIS 100 HB1 HIS 100 -10.723 -7.060 -10.645 1610 HD1 HIS 100 HD1 HIS 100 -11.026 -9.598 -10.511 1611 HD2 HIS 100 HD2 HIS 100 -7.123 -8.358 -9.823 1612 HE1 HIS 100 HE1 HIS 100 -9.809 -11.631 -9.683 1613 HE2 HIS 100 HE2 HIS 100 -7.393 -10.916 -9.611 1614 H LEU 101 HN LEU 101 -8.254 -4.866 -13.239 1615 HA LEU 101 HA LEU 101 -10.664 -3.294 -13.552 1616 HB2 LEU 101 HB2 LEU 101 -7.770 -2.823 -13.771 1617 HB3 LEU 101 HB1 LEU 101 -8.734 -1.937 -14.939 1618 HG LEU 101 HG LEU 101 -8.255 -0.634 -12.893 1619 HD11 LEU 101 HD11 LEU 101 -11.161 -1.323 -13.292 1620 HD12 LEU 101 HD12 LEU 101 -10.237 -0.138 -14.215 1621 HD13 LEU 101 HD13 LEU 101 -10.541 0.126 -12.499 1622 HD21 LEU 101 HD21 LEU 101 -9.957 -2.715 -11.530 1623 HD22 LEU 101 HD22 LEU 101 -9.381 -1.214 -10.804 1624 HD23 LEU 101 HD23 LEU 101 -8.229 -2.463 -11.284 1625 H GLU 102 HN GLU 102 -8.895 -5.560 -15.332 1626 HA GLU 102 HA GLU 102 -10.337 -4.876 -17.794 1627 HB2 GLU 102 HB2 GLU 102 -7.843 -5.438 -17.807 1628 HB3 GLU 102 HB1 GLU 102 -8.304 -7.083 -17.406 1629 HG2 GLU 102 HG2 GLU 102 -9.212 -5.615 -19.872 1630 HG3 GLU 102 HG1 GLU 102 -7.833 -6.710 -19.808 1631 H HIS 103 HN HIS 103 -9.681 -7.622 -15.627 1632 HA HIS 103 HA HIS 103 -11.863 -9.172 -16.649 1633 HB2 HIS 103 HB2 HIS 103 -9.841 -9.509 -14.490 1634 HB3 HIS 103 HB1 HIS 103 -11.316 -10.462 -14.385 1635 HD1 HIS 103 HD1 HIS 103 -9.414 -9.670 -17.580 1636 HD2 HIS 103 HD2 HIS 103 -10.365 -12.899 -15.134 1637 HE1 HIS 103 HE1 HIS 103 -8.596 -11.703 -18.795 1638 HE2 HIS 103 HE2 HIS 103 -9.394 -13.647 -17.412 1639 H HIS 104 HN HIS 104 -13.680 -7.947 -16.437 1640 HA HIS 104 HA HIS 104 -15.129 -8.288 -14.028 1641 HB2 HIS 104 HB2 HIS 104 -15.548 -5.989 -13.399 1642 HB3 HIS 104 HB1 HIS 104 -13.807 -6.240 -13.397 1643 HD1 HIS 104 HD1 HIS 104 -16.399 -4.041 -14.700 1644 HD2 HIS 104 HD2 HIS 104 -12.534 -5.114 -15.806 1645 HE1 HIS 104 HE1 HIS 104 -15.635 -2.266 -16.308 1646 HE2 HIS 104 HE2 HIS 104 -13.371 -3.036 -17.105 1647 H HIS 105 HN HIS 105 -17.246 -8.460 -14.568 1648 HA HIS 105 HA HIS 105 -19.141 -8.494 -15.841 1649 HB2 HIS 105 HB2 HIS 105 -18.780 -6.011 -15.926 1650 HB3 HIS 105 HB1 HIS 105 -17.871 -6.231 -17.413 1651 HD1 HIS 105 HD1 HIS 105 -19.202 -6.529 -19.574 1652 HD2 HIS 105 HD2 HIS 105 -21.580 -6.392 -16.167 1653 HE1 HIS 105 HE1 HIS 105 -21.552 -6.232 -20.403 1654 HE2 HIS 105 HE2 HIS 105 -22.989 -6.287 -18.336 1655 H HIS 106 HN HIS 106 -19.881 -9.501 -17.767 1656 HA HIS 106 HA HIS 106 -17.803 -10.877 -19.267 1657 HB2 HIS 106 HB2 HIS 106 -20.796 -10.988 -19.708 1658 HB3 HIS 106 HB1 HIS 106 -19.601 -12.149 -20.256 1659 HD1 HIS 106 HD1 HIS 106 -18.179 -13.148 -17.956 1660 HD2 HIS 106 HD2 HIS 106 -22.157 -11.971 -17.617 1661 HE1 HIS 106 HE1 HIS 106 -19.060 -14.300 -15.899 1662 HE2 HIS 106 HE2 HIS 106 -21.518 -13.741 -15.845 1663 H HIS 107 HN HIS 107 -19.095 -11.040 -21.823 1664 HA HIS 107 HA HIS 107 -18.912 -8.253 -22.695 1665 HB2 HIS 107 HB2 HIS 107 -18.925 -9.126 -25.019 1666 HB3 HIS 107 HB1 HIS 107 -17.577 -9.723 -24.070 1667 HD1 HIS 107 HD1 HIS 107 -17.530 -12.259 -23.538 1668 HD2 HIS 107 HD2 HIS 107 -20.692 -11.057 -25.963 1669 HE1 HIS 107 HE1 HIS 107 -18.465 -14.372 -24.543 1670 HE2 HIS 107 HE2 HIS 107 -20.409 -13.630 -25.966 1671 H HIS 108 HN HIS 108 -20.705 -7.276 -22.205 1672 HA HIS 108 HA HIS 108 -22.887 -6.734 -21.974 1673 HB2 HIS 108 HB2 HIS 108 -22.997 -7.155 -24.438 1674 HB3 HIS 108 HB1 HIS 108 -23.458 -8.819 -24.094 1675 HD1 HIS 108 HD1 HIS 108 -24.711 -5.288 -23.551 1676 HD2 HIS 108 HD2 HIS 108 -26.149 -9.192 -23.686 1677 HE1 HIS 108 HE1 HIS 108 -27.216 -5.098 -23.404 1678 HE2 HIS 108 HE2 HIS 108 -28.054 -7.472 -23.334 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 3.182 11.461 -31.110 2 H2 MET 1 HT2 MET 1 4.183 12.706 -31.685 3 H3 MET 1 HT3 MET 1 3.316 12.914 -30.245 4 HA MET 1 HA MET 1 5.451 10.909 -30.668 5 HB2 MET 1 HB2 MET 1 5.486 13.540 -29.168 6 HB3 MET 1 HB1 MET 1 6.754 12.327 -29.077 7 HG2 MET 1 HG2 MET 1 7.122 12.579 -31.502 8 HG3 MET 1 HG1 MET 1 5.914 13.862 -31.526 9 HE1 MET 1 HE1 MET 1 9.244 15.836 -32.022 10 HE2 MET 1 HE2 MET 1 7.606 15.575 -32.620 11 HE3 MET 1 HE3 MET 1 8.789 14.268 -32.689 12 H ALA 2 HN ALA 2 3.581 12.707 -28.215 13 HA ALA 2 HA ALA 2 3.789 10.467 -26.373 14 HB1 ALA 2 HB1 ALA 2 2.385 13.124 -26.063 15 HB2 ALA 2 HB2 ALA 2 4.018 12.750 -25.512 16 HB3 ALA 2 HB3 ALA 2 2.636 11.928 -24.790 17 H GLY 3 HN GLY 3 1.863 9.495 -25.419 18 HA2 GLY 3 HA2 GLY 3 -0.429 9.551 -27.279 19 HA3 GLY 3 HA1 GLY 3 0.225 8.044 -26.658 20 H GLN 4 HN GLN 4 -1.930 7.624 -25.897 21 HA GLN 4 HA GLN 4 -2.992 9.297 -23.785 22 HB2 GLN 4 HB2 GLN 4 -4.500 8.187 -25.389 23 HB3 GLN 4 HB1 GLN 4 -3.938 6.616 -24.832 24 HG2 GLN 4 HG2 GLN 4 -4.825 7.109 -22.598 25 HG3 GLN 4 HG1 GLN 4 -5.421 8.658 -23.191 26 HE21 GLN 4 HE21 GLN 4 -6.176 7.543 -25.788 27 HE22 GLN 4 HE22 GLN 4 -7.618 6.634 -25.511 28 H SER 5 HN SER 5 -2.206 9.191 -21.811 29 HA SER 5 HA SER 5 -1.048 6.654 -20.861 30 HB2 SER 5 HB2 SER 5 0.139 8.154 -19.201 31 HB3 SER 5 HB1 SER 5 0.600 8.390 -20.887 32 HG SER 5 HG SER 5 0.058 10.389 -20.593 33 H ASP 6 HN ASP 6 -3.881 8.071 -20.736 34 HA ASP 6 HA ASP 6 -4.308 8.379 -17.926 35 HB2 ASP 6 HB2 ASP 6 -6.085 8.503 -20.330 36 HB3 ASP 6 HB1 ASP 6 -6.791 8.442 -18.716 37 H ARG 7 HN ARG 7 -4.594 5.705 -20.133 38 HA ARG 7 HA ARG 7 -6.290 4.127 -18.466 39 HB2 ARG 7 HB2 ARG 7 -6.018 3.580 -20.841 40 HB3 ARG 7 HB1 ARG 7 -4.307 3.261 -20.586 41 HG2 ARG 7 HG2 ARG 7 -4.866 1.394 -19.118 42 HG3 ARG 7 HG1 ARG 7 -6.583 1.718 -19.352 43 HD2 ARG 7 HD2 ARG 7 -4.630 0.969 -21.527 44 HD3 ARG 7 HD1 ARG 7 -5.771 -0.133 -20.758 45 HE ARG 7 HE ARG 7 -6.859 2.252 -22.059 46 HH11 ARG 7 HH11 ARG 7 -6.313 -1.218 -22.139 47 HH12 ARG 7 HH12 ARG 7 -7.470 -1.495 -23.407 48 HH21 ARG 7 HH21 ARG 7 -8.389 1.878 -23.695 49 HH22 ARG 7 HH22 ARG 7 -8.674 0.265 -24.276 50 H LYS 8 HN LYS 8 -2.804 4.478 -18.869 51 HA LYS 8 HA LYS 8 -1.986 2.609 -16.933 52 HB2 LYS 8 HB2 LYS 8 -0.475 3.706 -18.571 53 HB3 LYS 8 HB1 LYS 8 -0.666 5.222 -17.704 54 HG2 LYS 8 HG2 LYS 8 0.303 4.094 -15.692 55 HG3 LYS 8 HG1 LYS 8 0.670 2.711 -16.729 56 HD2 LYS 8 HD2 LYS 8 1.991 4.198 -18.190 57 HD3 LYS 8 HD1 LYS 8 1.670 5.536 -17.084 58 HE2 LYS 8 HE2 LYS 8 3.837 4.688 -16.574 59 HE3 LYS 8 HE1 LYS 8 2.753 4.192 -15.276 60 HZ1 LYS 8 HZ1 LYS 8 3.546 2.470 -17.561 61 HZ2 LYS 8 HZ2 LYS 8 2.623 2.000 -16.215 62 HZ3 LYS 8 HZ3 LYS 8 4.257 2.410 -16.021 63 H ALA 9 HN ALA 9 -2.627 6.088 -16.699 64 HA ALA 9 HA ALA 9 -2.139 6.386 -13.957 65 HB1 ALA 9 HB1 ALA 9 -3.387 8.466 -14.127 66 HB2 ALA 9 HB2 ALA 9 -4.057 7.957 -15.678 67 HB3 ALA 9 HB3 ALA 9 -2.328 8.268 -15.523 68 H ALA 10 HN ALA 10 -4.978 5.284 -15.699 69 HA ALA 10 HA ALA 10 -6.796 5.359 -13.535 70 HB1 ALA 10 HB1 ALA 10 -8.163 3.835 -14.870 71 HB2 ALA 10 HB2 ALA 10 -6.800 3.553 -15.953 72 HB3 ALA 10 HB3 ALA 10 -7.532 5.155 -15.855 73 H LEU 11 HN LEU 11 -4.507 2.929 -14.682 74 HA LEU 11 HA LEU 11 -5.298 0.876 -12.890 75 HB2 LEU 11 HB2 LEU 11 -2.611 1.362 -14.187 76 HB3 LEU 11 HB1 LEU 11 -3.099 -0.120 -13.392 77 HG LEU 11 HG LEU 11 -4.408 1.009 -15.866 78 HD11 LEU 11 HD11 LEU 11 -2.461 -1.270 -15.542 79 HD12 LEU 11 HD12 LEU 11 -2.130 0.282 -16.314 80 HD13 LEU 11 HD13 LEU 11 -3.294 -0.831 -17.034 81 HD21 LEU 11 HD21 LEU 11 -5.498 -1.185 -15.983 82 HD22 LEU 11 HD22 LEU 11 -5.925 -0.328 -14.501 83 HD23 LEU 11 HD23 LEU 11 -4.746 -1.637 -14.454 84 H LEU 12 HN LEU 12 -2.968 3.496 -12.736 85 HA LEU 12 HA LEU 12 -1.793 2.839 -10.267 86 HB2 LEU 12 HB2 LEU 12 -2.194 5.556 -11.527 87 HB3 LEU 12 HB1 LEU 12 -1.132 5.223 -10.174 88 HG LEU 12 HG LEU 12 -0.817 4.110 -12.963 89 HD11 LEU 12 HD11 LEU 12 0.732 6.232 -11.485 90 HD12 LEU 12 HD12 LEU 12 -0.330 6.485 -12.871 91 HD13 LEU 12 HD13 LEU 12 1.158 5.557 -13.058 92 HD21 LEU 12 HD21 LEU 12 0.931 3.845 -10.520 93 HD22 LEU 12 HD22 LEU 12 1.348 3.299 -12.144 94 HD23 LEU 12 HD23 LEU 12 -0.001 2.557 -11.285 95 H ASP 13 HN ASP 13 -4.812 4.367 -11.081 96 HA ASP 13 HA ASP 13 -5.307 5.417 -8.460 97 HB2 ASP 13 HB2 ASP 13 -6.369 6.279 -10.587 98 HB3 ASP 13 HB1 ASP 13 -7.376 4.832 -10.583 99 H GLN 14 HN GLN 14 -6.064 2.443 -10.177 100 HA GLN 14 HA GLN 14 -7.711 1.308 -8.163 101 HB2 GLN 14 HB2 GLN 14 -5.902 -0.217 -10.048 102 HB3 GLN 14 HB1 GLN 14 -7.346 -0.815 -9.245 103 HG2 GLN 14 HG2 GLN 14 -7.212 1.237 -11.435 104 HG3 GLN 14 HG1 GLN 14 -7.817 -0.411 -11.557 105 HE21 GLN 14 HE21 GLN 14 -9.819 -0.917 -10.691 106 HE22 GLN 14 HE22 GLN 14 -10.976 0.298 -10.267 107 H VAL 15 HN VAL 15 -4.263 1.259 -8.832 108 HA VAL 15 HA VAL 15 -3.423 -0.334 -6.677 109 HB VAL 15 HB VAL 15 -1.988 1.930 -8.092 110 HG11 VAL 15 HG11 VAL 15 -0.852 -0.202 -6.286 111 HG12 VAL 15 HG12 VAL 15 -0.978 1.516 -5.911 112 HG13 VAL 15 HG13 VAL 15 0.080 0.974 -7.214 113 HG21 VAL 15 HG21 VAL 15 -0.858 0.126 -9.307 114 HG22 VAL 15 HG22 VAL 15 -2.601 0.107 -9.574 115 HG23 VAL 15 HG23 VAL 15 -1.865 -1.059 -8.473 116 H ALA 16 HN ALA 16 -3.948 3.166 -6.955 117 HA ALA 16 HA ALA 16 -3.155 3.850 -4.344 118 HB1 ALA 16 HB1 ALA 16 -3.451 5.501 -6.132 119 HB2 ALA 16 HB2 ALA 16 -4.387 5.923 -4.698 120 HB3 ALA 16 HB3 ALA 16 -5.191 5.218 -6.101 121 H ARG 17 HN ARG 17 -6.235 2.773 -5.679 122 HA ARG 17 HA ARG 17 -7.895 3.269 -3.501 123 HB2 ARG 17 HB2 ARG 17 -8.692 2.565 -5.731 124 HB3 ARG 17 HB1 ARG 17 -8.048 0.954 -5.443 125 HG2 ARG 17 HG2 ARG 17 -9.587 0.743 -3.510 126 HG3 ARG 17 HG1 ARG 17 -10.289 2.301 -3.951 127 HD2 ARG 17 HD2 ARG 17 -10.246 -0.203 -5.634 128 HD3 ARG 17 HD1 ARG 17 -11.648 0.507 -4.837 129 HE ARG 17 HE ARG 17 -10.523 2.427 -6.548 130 HH11 ARG 17 HH11 ARG 17 -12.267 -0.619 -6.725 131 HH12 ARG 17 HH12 ARG 17 -12.947 -0.269 -8.290 132 HH21 ARG 17 HH21 ARG 17 -11.417 2.881 -8.571 133 HH22 ARG 17 HH22 ARG 17 -12.450 1.717 -9.354 134 H VAL 18 HN VAL 18 -6.181 0.237 -4.297 135 HA VAL 18 HA VAL 18 -6.913 -1.016 -1.847 136 HB VAL 18 HB VAL 18 -5.260 -2.756 -2.428 137 HG11 VAL 18 HG11 VAL 18 -7.521 -2.843 -3.357 138 HG12 VAL 18 HG12 VAL 18 -6.337 -3.527 -4.471 139 HG13 VAL 18 HG13 VAL 18 -6.983 -1.911 -4.754 140 HG21 VAL 18 HG21 VAL 18 -4.049 -2.633 -4.557 141 HG22 VAL 18 HG22 VAL 18 -3.537 -1.370 -3.437 142 HG23 VAL 18 HG23 VAL 18 -4.616 -0.977 -4.776 143 H GLY 19 HN GLY 19 -4.243 0.983 -2.856 144 HA2 GLY 19 HA2 GLY 19 -2.504 0.428 -0.685 145 HA3 GLY 19 HA1 GLY 19 -2.460 1.861 -1.704 146 H LYS 20 HN LYS 20 -5.019 2.879 -1.172 147 HA LYS 20 HA LYS 20 -4.513 4.240 1.269 148 HB2 LYS 20 HB2 LYS 20 -6.955 4.195 -0.510 149 HB3 LYS 20 HB1 LYS 20 -6.770 5.260 0.879 150 HG2 LYS 20 HG2 LYS 20 -4.883 6.348 -0.138 151 HG3 LYS 20 HG1 LYS 20 -4.895 5.204 -1.479 152 HD2 LYS 20 HD2 LYS 20 -5.896 7.265 -2.200 153 HD3 LYS 20 HD1 LYS 20 -7.151 6.031 -2.096 154 HE2 LYS 20 HE2 LYS 20 -7.896 6.912 0.025 155 HE3 LYS 20 HE1 LYS 20 -6.575 8.081 0.034 156 HZ1 LYS 20 HZ1 LYS 20 -8.755 7.986 -1.981 157 HZ2 LYS 20 HZ2 LYS 20 -7.509 9.134 -1.908 158 HZ3 LYS 20 HZ3 LYS 20 -8.672 9.067 -0.680 159 H ALA 21 HN ALA 21 -6.563 1.529 0.395 160 HA ALA 21 HA ALA 21 -8.000 1.399 2.841 161 HB1 ALA 21 HB1 ALA 21 -8.801 0.254 0.846 162 HB2 ALA 21 HB2 ALA 21 -8.552 -0.902 2.155 163 HB3 ALA 21 HB3 ALA 21 -7.373 -0.784 0.848 164 H LEU 22 HN LEU 22 -4.894 0.200 1.771 165 HA LEU 22 HA LEU 22 -4.475 -1.340 4.194 166 HB2 LEU 22 HB2 LEU 22 -3.696 -2.117 1.957 167 HB3 LEU 22 HB1 LEU 22 -2.583 -0.769 1.907 168 HG LEU 22 HG LEU 22 -2.341 -2.593 4.239 169 HD11 LEU 22 HD11 LEU 22 -2.715 -4.154 2.386 170 HD12 LEU 22 HD12 LEU 22 -1.050 -4.216 2.965 171 HD13 LEU 22 HD13 LEU 22 -1.433 -3.365 1.469 172 HD21 LEU 22 HD21 LEU 22 0.046 -2.200 3.821 173 HD22 LEU 22 HD22 LEU 22 -0.847 -0.687 3.977 174 HD23 LEU 22 HD23 LEU 22 -0.364 -1.265 2.382 175 H ALA 23 HN ALA 23 -4.041 1.845 3.145 176 HA ALA 23 HA ALA 23 -1.738 2.490 4.728 177 HB1 ALA 23 HB1 ALA 23 -2.242 4.807 4.150 178 HB2 ALA 23 HB2 ALA 23 -3.792 4.310 3.474 179 HB3 ALA 23 HB3 ALA 23 -2.289 3.772 2.723 180 H ASN 24 HN ASN 24 -4.881 1.780 5.530 181 HA ASN 24 HA ASN 24 -4.998 3.610 7.800 182 HB2 ASN 24 HB2 ASN 24 -6.969 1.679 6.600 183 HB3 ASN 24 HB1 ASN 24 -7.212 2.327 8.217 184 HD21 ASN 24 HD21 ASN 24 -5.746 4.113 5.585 185 HD22 ASN 24 HD22 ASN 24 -7.028 5.255 5.403 186 H GLY 25 HN GLY 25 -3.449 2.940 9.177 187 HA2 GLY 25 HA2 GLY 25 -2.691 0.281 9.647 188 HA3 GLY 25 HA1 GLY 25 -2.319 1.646 10.687 189 H ARG 26 HN ARG 26 -5.191 2.227 11.130 190 HA ARG 26 HA ARG 26 -5.463 0.565 13.447 191 HB2 ARG 26 HB2 ARG 26 -7.484 2.491 12.283 192 HB3 ARG 26 HB1 ARG 26 -7.454 1.863 13.928 193 HG2 ARG 26 HG2 ARG 26 -5.378 3.657 12.681 194 HG3 ARG 26 HG1 ARG 26 -6.620 4.149 13.835 195 HD2 ARG 26 HD2 ARG 26 -5.635 2.867 15.571 196 HD3 ARG 26 HD1 ARG 26 -4.566 2.033 14.441 197 HE ARG 26 HE ARG 26 -3.271 4.015 14.244 198 HH11 ARG 26 HH11 ARG 26 -5.783 4.196 16.689 199 HH12 ARG 26 HH12 ARG 26 -5.057 5.549 17.513 200 HH21 ARG 26 HH21 ARG 26 -2.306 5.759 15.345 201 HH22 ARG 26 HH22 ARG 26 -3.091 6.443 16.738 202 H ARG 27 HN ARG 27 -6.591 0.416 10.203 203 HA ARG 27 HA ARG 27 -8.690 -1.496 10.892 204 HB2 ARG 27 HB2 ARG 27 -7.928 -0.467 8.153 205 HB3 ARG 27 HB1 ARG 27 -9.382 -1.359 8.581 206 HG2 ARG 27 HG2 ARG 27 -10.046 0.532 10.042 207 HG3 ARG 27 HG1 ARG 27 -8.651 1.432 9.447 208 HD2 ARG 27 HD2 ARG 27 -9.604 1.003 7.111 209 HD3 ARG 27 HD1 ARG 27 -11.088 0.529 7.939 210 HE ARG 27 HE ARG 27 -9.875 3.179 8.392 211 HH11 ARG 27 HH11 ARG 27 -12.620 1.224 7.430 212 HH12 ARG 27 HH12 ARG 27 -13.709 2.573 7.339 213 HH21 ARG 27 HH21 ARG 27 -11.279 4.942 8.249 214 HH22 ARG 27 HH22 ARG 27 -12.933 4.707 7.763 215 H LEU 28 HN LEU 28 -5.436 -1.410 9.966 216 HA LEU 28 HA LEU 28 -5.282 -3.845 8.507 217 HB2 LEU 28 HB2 LEU 28 -3.154 -2.388 10.076 218 HB3 LEU 28 HB1 LEU 28 -2.861 -3.717 8.972 219 HG LEU 28 HG LEU 28 -3.958 -1.009 8.215 220 HD11 LEU 28 HD11 LEU 28 -1.592 -0.959 8.793 221 HD12 LEU 28 HD12 LEU 28 -1.830 -0.728 7.061 222 HD13 LEU 28 HD13 LEU 28 -1.284 -2.289 7.677 223 HD21 LEU 28 HD21 LEU 28 -3.266 -3.395 6.502 224 HD22 LEU 28 HD22 LEU 28 -3.725 -1.801 5.905 225 HD23 LEU 28 HD23 LEU 28 -4.886 -2.771 6.812 226 H GLN 29 HN GLN 29 -5.407 -3.057 11.870 227 HA GLN 29 HA GLN 29 -4.383 -5.433 12.961 228 HB2 GLN 29 HB2 GLN 29 -4.859 -3.396 14.279 229 HB3 GLN 29 HB1 GLN 29 -6.581 -3.645 14.040 230 HG2 GLN 29 HG2 GLN 29 -4.972 -5.807 15.313 231 HG3 GLN 29 HG1 GLN 29 -5.394 -4.380 16.256 232 HE21 GLN 29 HE21 GLN 29 -6.243 -7.205 16.493 233 HE22 GLN 29 HE22 GLN 29 -7.971 -7.162 16.448 234 H ILE 30 HN ILE 30 -7.492 -4.608 11.595 235 HA ILE 30 HA ILE 30 -8.863 -6.965 12.381 236 HB ILE 30 HB ILE 30 -9.428 -5.188 10.000 237 HG12 ILE 30 HG12 ILE 30 -10.519 -5.046 12.822 238 HG13 ILE 30 HG11 ILE 30 -9.354 -3.924 12.126 239 HG21 ILE 30 HG21 ILE 30 -10.573 -7.308 9.849 240 HG22 ILE 30 HG22 ILE 30 -11.736 -6.047 10.260 241 HG23 ILE 30 HG23 ILE 30 -11.152 -7.150 11.506 242 HD11 ILE 30 HD11 ILE 30 -11.017 -3.220 10.487 243 HD12 ILE 30 HD12 ILE 30 -11.591 -2.984 12.138 244 HD13 ILE 30 HD13 ILE 30 -12.180 -4.346 11.184 245 H LEU 31 HN LEU 31 -6.987 -6.037 9.527 246 HA LEU 31 HA LEU 31 -7.421 -8.351 7.992 247 HB2 LEU 31 HB2 LEU 31 -5.082 -6.453 8.111 248 HB3 LEU 31 HB1 LEU 31 -5.168 -7.780 6.970 249 HG LEU 31 HG LEU 31 -7.163 -5.518 7.125 250 HD11 LEU 31 HD11 LEU 31 -6.127 -4.748 5.047 251 HD12 LEU 31 HD12 LEU 31 -4.919 -6.025 5.175 252 HD13 LEU 31 HD13 LEU 31 -4.972 -4.740 6.378 253 HD21 LEU 31 HD21 LEU 31 -7.958 -6.406 4.997 254 HD22 LEU 31 HD22 LEU 31 -8.099 -7.611 6.277 255 HD23 LEU 31 HD23 LEU 31 -6.787 -7.722 5.100 256 H ASP 32 HN ASP 32 -4.914 -7.570 10.364 257 HA ASP 32 HA ASP 32 -3.491 -9.978 10.277 258 HB2 ASP 32 HB2 ASP 32 -2.569 -8.099 11.446 259 HB3 ASP 32 HB1 ASP 32 -3.959 -8.005 12.520 260 H LEU 33 HN LEU 33 -6.377 -9.055 12.064 261 HA LEU 33 HA LEU 33 -6.573 -11.405 13.628 262 HB2 LEU 33 HB2 LEU 33 -7.711 -9.188 14.039 263 HB3 LEU 33 HB1 LEU 33 -8.839 -9.614 12.767 264 HG LEU 33 HG LEU 33 -9.483 -11.632 14.095 265 HD11 LEU 33 HD11 LEU 33 -8.860 -11.712 16.454 266 HD12 LEU 33 HD12 LEU 33 -7.808 -10.314 16.230 267 HD13 LEU 33 HD13 LEU 33 -7.438 -11.834 15.415 268 HD21 LEU 33 HD21 LEU 33 -10.829 -10.389 15.719 269 HD22 LEU 33 HD22 LEU 33 -10.827 -9.599 14.141 270 HD23 LEU 33 HD23 LEU 33 -9.832 -8.959 15.449 271 H LEU 34 HN LEU 34 -7.831 -10.489 10.468 272 HA LEU 34 HA LEU 34 -9.426 -12.859 10.171 273 HB2 LEU 34 HB2 LEU 34 -8.558 -10.768 8.175 274 HB3 LEU 34 HB1 LEU 34 -9.643 -12.093 7.801 275 HG LEU 34 HG LEU 34 -10.179 -9.892 9.796 276 HD11 LEU 34 HD11 LEU 34 -10.276 -9.150 7.467 277 HD12 LEU 34 HD12 LEU 34 -11.874 -9.164 8.212 278 HD13 LEU 34 HD13 LEU 34 -11.409 -10.452 7.101 279 HD21 LEU 34 HD21 LEU 34 -12.426 -10.865 9.934 280 HD22 LEU 34 HD22 LEU 34 -11.189 -11.989 10.495 281 HD23 LEU 34 HD23 LEU 34 -11.909 -12.197 8.898 282 H ALA 35 HN ALA 35 -6.155 -11.951 9.460 283 HA ALA 35 HA ALA 35 -5.554 -14.054 7.650 284 HB1 ALA 35 HB1 ALA 35 -3.722 -12.553 9.527 285 HB2 ALA 35 HB2 ALA 35 -4.114 -12.089 7.869 286 HB3 ALA 35 HB3 ALA 35 -3.206 -13.569 8.181 287 H GLN 36 HN GLN 36 -5.956 -13.858 11.056 288 HA GLN 36 HA GLN 36 -4.681 -16.409 11.590 289 HB2 GLN 36 HB2 GLN 36 -6.200 -14.479 13.349 290 HB3 GLN 36 HB1 GLN 36 -5.493 -15.984 13.926 291 HG2 GLN 36 HG2 GLN 36 -3.296 -15.227 13.490 292 HG3 GLN 36 HG1 GLN 36 -3.885 -13.837 12.577 293 HE21 GLN 36 HE21 GLN 36 -4.633 -12.060 13.642 294 HE22 GLN 36 HE22 GLN 36 -4.401 -11.811 15.336 295 H GLY 37 HN GLY 37 -7.511 -15.555 10.209 296 HA2 GLY 37 HA2 GLY 37 -8.713 -17.858 9.837 297 HA3 GLY 37 HA1 GLY 37 -9.127 -17.606 11.526 298 H GLU 38 HN GLU 38 -10.829 -17.764 9.122 299 HA GLU 38 HA GLU 38 -11.874 -15.166 8.596 300 HB2 GLU 38 HB2 GLU 38 -13.755 -16.429 7.546 301 HB3 GLU 38 HB1 GLU 38 -12.172 -16.922 6.966 302 HG2 GLU 38 HG2 GLU 38 -12.312 -18.791 8.699 303 HG3 GLU 38 HG1 GLU 38 -14.024 -18.388 8.814 304 H ARG 39 HN ARG 39 -13.778 -14.199 9.439 305 HA ARG 39 HA ARG 39 -14.782 -15.345 11.933 306 HB2 ARG 39 HB2 ARG 39 -12.535 -13.991 12.142 307 HB3 ARG 39 HB1 ARG 39 -13.605 -12.602 12.046 308 HG2 ARG 39 HG2 ARG 39 -14.762 -13.271 14.018 309 HG3 ARG 39 HG1 ARG 39 -13.906 -14.816 14.057 310 HD2 ARG 39 HD2 ARG 39 -12.750 -12.063 14.487 311 HD3 ARG 39 HD1 ARG 39 -12.896 -13.364 15.670 312 HE ARG 39 HE ARG 39 -11.208 -13.711 13.286 313 HH11 ARG 39 HH11 ARG 39 -11.569 -13.584 16.766 314 HH12 ARG 39 HH12 ARG 39 -9.953 -14.144 17.084 315 HH21 ARG 39 HH21 ARG 39 -9.079 -14.434 13.688 316 HH22 ARG 39 HH22 ARG 39 -8.528 -14.617 15.329 317 H ALA 40 HN ALA 40 -16.673 -14.373 12.712 318 HA ALA 40 HA ALA 40 -18.206 -12.897 10.756 319 HB1 ALA 40 HB1 ALA 40 -19.239 -14.683 12.083 320 HB2 ALA 40 HB2 ALA 40 -20.059 -13.138 12.307 321 HB3 ALA 40 HB3 ALA 40 -18.961 -13.742 13.549 322 H VAL 41 HN VAL 41 -19.336 -10.908 11.253 323 HA VAL 41 HA VAL 41 -17.641 -8.841 11.949 324 HB VAL 41 HB VAL 41 -20.663 -8.841 11.999 325 HG11 VAL 41 HG11 VAL 41 -19.775 -6.958 13.269 326 HG12 VAL 41 HG12 VAL 41 -20.501 -6.412 11.757 327 HG13 VAL 41 HG13 VAL 41 -18.745 -6.511 11.908 328 HG21 VAL 41 HG21 VAL 41 -18.701 -8.034 9.852 329 HG22 VAL 41 HG22 VAL 41 -20.454 -7.839 9.766 330 HG23 VAL 41 HG23 VAL 41 -19.749 -9.454 9.832 331 H GLU 42 HN GLU 42 -20.118 -10.397 13.984 332 HA GLU 42 HA GLU 42 -19.858 -8.653 16.180 333 HB2 GLU 42 HB2 GLU 42 -20.491 -11.566 16.541 334 HB3 GLU 42 HB1 GLU 42 -21.117 -10.185 17.428 335 HG2 GLU 42 HG2 GLU 42 -22.935 -10.690 16.170 336 HG3 GLU 42 HG1 GLU 42 -22.129 -9.574 15.066 337 H ALA 43 HN ALA 43 -18.201 -11.674 15.391 338 HA ALA 43 HA ALA 43 -16.724 -11.815 17.820 339 HB1 ALA 43 HB1 ALA 43 -15.466 -13.583 16.747 340 HB2 ALA 43 HB2 ALA 43 -16.118 -13.129 15.173 341 HB3 ALA 43 HB3 ALA 43 -17.187 -13.785 16.413 342 H ILE 44 HN ILE 44 -16.104 -10.483 14.615 343 HA ILE 44 HA ILE 44 -13.418 -9.724 15.055 344 HB ILE 44 HB ILE 44 -15.497 -8.467 13.250 345 HG12 ILE 44 HG12 ILE 44 -13.254 -10.406 12.639 346 HG13 ILE 44 HG11 ILE 44 -14.956 -10.839 12.773 347 HG21 ILE 44 HG21 ILE 44 -13.698 -6.890 13.743 348 HG22 ILE 44 HG22 ILE 44 -13.625 -7.434 12.067 349 HG23 ILE 44 HG23 ILE 44 -12.504 -8.094 13.257 350 HD11 ILE 44 HD11 ILE 44 -14.262 -10.641 10.453 351 HD12 ILE 44 HD12 ILE 44 -13.767 -8.971 10.735 352 HD13 ILE 44 HD13 ILE 44 -15.468 -9.419 10.860 353 H ALA 45 HN ALA 45 -16.464 -7.926 15.403 354 HA ALA 45 HA ALA 45 -15.433 -5.503 16.293 355 HB1 ALA 45 HB1 ALA 45 -18.038 -6.777 17.115 356 HB2 ALA 45 HB2 ALA 45 -17.768 -5.868 15.629 357 HB3 ALA 45 HB3 ALA 45 -17.640 -5.060 17.190 358 H THR 46 HN THR 46 -16.293 -8.384 18.151 359 HA THR 46 HA THR 46 -15.889 -7.268 20.700 360 HB THR 46 HB THR 46 -15.584 -10.164 19.882 361 HG1 THR 46 HG1 THR 46 -17.635 -9.348 19.306 362 HG21 THR 46 HG21 THR 46 -16.175 -10.636 22.220 363 HG22 THR 46 HG22 THR 46 -16.200 -8.906 22.559 364 HG23 THR 46 HG23 THR 46 -14.687 -9.695 22.112 365 H ALA 47 HN ALA 47 -13.722 -9.173 18.615 366 HA ALA 47 HA ALA 47 -11.566 -9.195 20.453 367 HB1 ALA 47 HB1 ALA 47 -10.252 -10.102 18.641 368 HB2 ALA 47 HB2 ALA 47 -11.473 -9.607 17.471 369 HB3 ALA 47 HB3 ALA 47 -11.847 -10.853 18.660 370 H THR 48 HN THR 48 -12.519 -6.982 17.908 371 HA THR 48 HA THR 48 -10.006 -5.553 17.957 372 HB THR 48 HB THR 48 -11.186 -3.960 16.419 373 HG1 THR 48 HG1 THR 48 -13.280 -5.827 16.203 374 HG21 THR 48 HG21 THR 48 -11.314 -6.885 15.671 375 HG22 THR 48 HG22 THR 48 -9.912 -5.826 15.506 376 HG23 THR 48 HG23 THR 48 -11.355 -5.536 14.534 377 H GLY 49 HN GLY 49 -12.848 -5.547 19.800 378 HA2 GLY 49 HA2 GLY 49 -13.421 -4.225 21.613 379 HA3 GLY 49 HA1 GLY 49 -11.989 -3.251 21.304 380 H MET 50 HN MET 50 -14.436 -3.908 18.901 381 HA MET 50 HA MET 50 -15.240 -1.069 19.002 382 HB2 MET 50 HB2 MET 50 -15.245 -2.906 16.598 383 HB3 MET 50 HB1 MET 50 -15.680 -1.205 16.605 384 HG2 MET 50 HG2 MET 50 -13.377 -0.629 17.197 385 HG3 MET 50 HG1 MET 50 -12.949 -2.340 17.157 386 HE1 MET 50 HE1 MET 50 -11.186 -1.176 13.914 387 HE2 MET 50 HE2 MET 50 -11.045 -2.066 15.431 388 HE3 MET 50 HE3 MET 50 -11.274 -0.317 15.453 389 H ASN 51 HN ASN 51 -17.449 -0.871 17.721 390 HA ASN 51 HA ASN 51 -19.310 -2.822 18.843 391 HB2 ASN 51 HB2 ASN 51 -19.783 -0.383 19.098 392 HB3 ASN 51 HB1 ASN 51 -19.876 -0.243 17.346 393 HD21 ASN 51 HD21 ASN 51 -21.998 0.472 17.429 394 HD22 ASN 51 HD22 ASN 51 -23.316 -0.590 17.801 395 H LEU 52 HN LEU 52 -21.063 -3.621 17.368 396 HA LEU 52 HA LEU 52 -19.950 -5.069 15.259 397 HB2 LEU 52 HB2 LEU 52 -22.798 -4.435 15.977 398 HB3 LEU 52 HB1 LEU 52 -22.403 -5.416 14.581 399 HG LEU 52 HG LEU 52 -21.224 -7.009 16.111 400 HD11 LEU 52 HD11 LEU 52 -21.705 -6.897 18.501 401 HD12 LEU 52 HD12 LEU 52 -22.512 -5.345 18.269 402 HD13 LEU 52 HD13 LEU 52 -20.780 -5.492 17.962 403 HD21 LEU 52 HD21 LEU 52 -24.140 -6.501 16.666 404 HD22 LEU 52 HD22 LEU 52 -23.278 -8.007 16.984 405 HD23 LEU 52 HD23 LEU 52 -23.480 -7.438 15.326 406 H THR 53 HN THR 53 -22.094 -2.233 15.107 407 HA THR 53 HA THR 53 -22.114 -1.933 12.332 408 HB THR 53 HB THR 53 -22.247 0.307 14.361 409 HG1 THR 53 HG1 THR 53 -24.392 -1.291 13.347 410 HG21 THR 53 HG21 THR 53 -23.491 0.023 11.617 411 HG22 THR 53 HG22 THR 53 -22.096 1.029 12.011 412 HG23 THR 53 HG23 THR 53 -23.675 1.398 12.706 413 H THR 54 HN THR 54 -19.908 -0.622 14.775 414 HA THR 54 HA THR 54 -18.335 0.998 13.143 415 HB THR 54 HB THR 54 -17.206 -0.590 15.438 416 HG1 THR 54 HG1 THR 54 -18.119 1.441 16.598 417 HG21 THR 54 HG21 THR 54 -15.960 1.477 15.856 418 HG22 THR 54 HG22 THR 54 -16.790 2.259 14.512 419 HG23 THR 54 HG23 THR 54 -15.694 0.912 14.206 420 H ALA 55 HN ALA 55 -17.752 -2.365 14.181 421 HA ALA 55 HA ALA 55 -15.449 -2.824 12.674 422 HB1 ALA 55 HB1 ALA 55 -16.183 -4.309 14.464 423 HB2 ALA 55 HB2 ALA 55 -15.935 -5.206 12.965 424 HB3 ALA 55 HB3 ALA 55 -17.569 -4.806 13.496 425 H SER 56 HN SER 56 -18.857 -3.416 11.864 426 HA SER 56 HA SER 56 -18.419 -4.588 9.354 427 HB2 SER 56 HB2 SER 56 -20.567 -4.643 10.620 428 HB3 SER 56 HB1 SER 56 -20.812 -2.945 10.218 429 HG SER 56 HG SER 56 -21.666 -4.885 8.823 430 H ALA 57 HN ALA 57 -18.686 -1.212 10.337 431 HA ALA 57 HA ALA 57 -18.821 -0.107 7.733 432 HB1 ALA 57 HB1 ALA 57 -18.242 2.012 8.817 433 HB2 ALA 57 HB2 ALA 57 -17.824 1.142 10.291 434 HB3 ALA 57 HB3 ALA 57 -19.490 1.149 9.715 435 H ASN 58 HN ASN 58 -16.117 -0.764 9.929 436 HA ASN 58 HA ASN 58 -14.131 0.339 8.216 437 HB2 ASN 58 HB2 ASN 58 -14.008 -1.519 10.586 438 HB3 ASN 58 HB1 ASN 58 -12.563 -1.091 9.677 439 HD21 ASN 58 HD21 ASN 58 -15.072 0.072 11.792 440 HD22 ASN 58 HD22 ASN 58 -14.309 1.574 12.201 441 H LEU 59 HN LEU 59 -15.426 -2.895 8.707 442 HA LEU 59 HA LEU 59 -13.692 -4.261 6.950 443 HB2 LEU 59 HB2 LEU 59 -16.498 -4.843 7.883 444 HB3 LEU 59 HB1 LEU 59 -15.582 -5.946 6.873 445 HG LEU 59 HG LEU 59 -14.588 -5.015 9.562 446 HD11 LEU 59 HD11 LEU 59 -16.712 -6.133 9.905 447 HD12 LEU 59 HD12 LEU 59 -15.384 -7.169 10.431 448 HD13 LEU 59 HD13 LEU 59 -16.189 -7.480 8.892 449 HD21 LEU 59 HD21 LEU 59 -13.164 -6.983 9.383 450 HD22 LEU 59 HD22 LEU 59 -12.921 -5.906 8.008 451 HD23 LEU 59 HD23 LEU 59 -13.880 -7.373 7.820 452 H GLN 60 HN GLN 60 -16.811 -2.669 6.454 453 HA GLN 60 HA GLN 60 -17.260 -3.411 3.799 454 HB2 GLN 60 HB2 GLN 60 -18.948 -2.297 5.204 455 HB3 GLN 60 HB1 GLN 60 -17.994 -0.819 5.179 456 HG2 GLN 60 HG2 GLN 60 -18.297 -0.681 2.752 457 HG3 GLN 60 HG1 GLN 60 -19.295 -2.134 2.808 458 HE21 GLN 60 HE21 GLN 60 -19.087 1.238 3.632 459 HE22 GLN 60 HE22 GLN 60 -20.781 1.472 3.919 460 H ALA 61 HN ALA 61 -15.373 -0.752 5.159 461 HA ALA 61 HA ALA 61 -14.744 0.543 2.737 462 HB1 ALA 61 HB1 ALA 61 -14.431 1.590 4.923 463 HB2 ALA 61 HB2 ALA 61 -12.942 1.616 3.979 464 HB3 ALA 61 HB3 ALA 61 -13.136 0.449 5.287 465 H LEU 62 HN LEU 62 -13.035 -1.966 4.576 466 HA LEU 62 HA LEU 62 -10.844 -2.207 2.808 467 HB2 LEU 62 HB2 LEU 62 -12.031 -4.270 4.670 468 HB3 LEU 62 HB1 LEU 62 -10.460 -4.383 3.900 469 HG LEU 62 HG LEU 62 -11.266 -2.285 5.918 470 HD11 LEU 62 HD11 LEU 62 -9.471 -4.693 6.180 471 HD12 LEU 62 HD12 LEU 62 -11.056 -4.487 6.926 472 HD13 LEU 62 HD13 LEU 62 -9.713 -3.451 7.408 473 HD21 LEU 62 HD21 LEU 62 -8.903 -1.676 5.908 474 HD22 LEU 62 HD22 LEU 62 -9.620 -1.459 4.311 475 HD23 LEU 62 HD23 LEU 62 -8.596 -2.858 4.636 476 H LYS 63 HN LYS 63 -14.029 -3.647 2.909 477 HA LYS 63 HA LYS 63 -13.665 -5.600 0.906 478 HB2 LYS 63 HB2 LYS 63 -15.580 -5.498 2.509 479 HB3 LYS 63 HB1 LYS 63 -16.199 -4.113 1.624 480 HG2 LYS 63 HG2 LYS 63 -16.402 -5.539 -0.388 481 HG3 LYS 63 HG1 LYS 63 -15.889 -6.925 0.581 482 HD2 LYS 63 HD2 LYS 63 -17.807 -6.466 2.112 483 HD3 LYS 63 HD1 LYS 63 -18.347 -5.225 0.981 484 HE2 LYS 63 HE2 LYS 63 -18.032 -8.164 0.369 485 HE3 LYS 63 HE1 LYS 63 -19.556 -7.329 0.657 486 HZ1 LYS 63 HZ1 LYS 63 -18.870 -5.874 -1.310 487 HZ2 LYS 63 HZ2 LYS 63 -19.384 -7.452 -1.639 488 HZ3 LYS 63 HZ3 LYS 63 -17.733 -7.087 -1.656 489 H SER 64 HN SER 64 -14.865 -2.245 0.767 490 HA SER 64 HA SER 64 -15.316 -2.246 -2.024 491 HB2 SER 64 HB2 SER 64 -15.287 0.276 -1.766 492 HB3 SER 64 HB1 SER 64 -16.442 -0.584 -0.752 493 HG SER 64 HG SER 64 -13.976 -0.222 0.418 494 H GLY 65 HN GLY 65 -12.439 -1.591 -0.093 495 HA2 GLY 65 HA2 GLY 65 -10.844 -0.608 -2.221 496 HA3 GLY 65 HA1 GLY 65 -10.249 -1.364 -0.748 497 H GLY 66 HN GLY 66 -11.699 -3.836 -1.135 498 HA2 GLY 66 HA2 GLY 66 -11.736 -5.622 -2.776 499 HA3 GLY 66 HA1 GLY 66 -10.298 -4.913 -3.497 500 H LEU 67 HN LEU 67 -10.363 -4.956 -0.081 501 HA LEU 67 HA LEU 67 -8.158 -6.839 -0.113 502 HB2 LEU 67 HB2 LEU 67 -9.150 -4.776 1.764 503 HB3 LEU 67 HB1 LEU 67 -8.314 -6.144 2.470 504 HG LEU 67 HG LEU 67 -6.317 -5.657 1.197 505 HD11 LEU 67 HD11 LEU 67 -7.323 -4.854 -0.860 506 HD12 LEU 67 HD12 LEU 67 -6.154 -3.688 -0.243 507 HD13 LEU 67 HD13 LEU 67 -7.883 -3.395 -0.040 508 HD21 LEU 67 HD21 LEU 67 -7.457 -3.192 2.502 509 HD22 LEU 67 HD22 LEU 67 -5.751 -3.472 2.149 510 HD23 LEU 67 HD23 LEU 67 -6.592 -4.503 3.307 511 H VAL 68 HN VAL 68 -11.311 -6.528 1.503 512 HA VAL 68 HA VAL 68 -11.091 -9.384 2.181 513 HB VAL 68 HB VAL 68 -12.589 -8.973 4.101 514 HG11 VAL 68 HG11 VAL 68 -10.175 -9.034 4.431 515 HG12 VAL 68 HG12 VAL 68 -10.939 -7.893 5.537 516 HG13 VAL 68 HG13 VAL 68 -10.082 -7.300 4.115 517 HG21 VAL 68 HG21 VAL 68 -12.968 -6.681 4.879 518 HG22 VAL 68 HG22 VAL 68 -13.714 -6.966 3.309 519 HG23 VAL 68 HG23 VAL 68 -12.204 -6.061 3.417 520 H GLU 69 HN GLU 69 -13.052 -10.582 2.251 521 HA GLU 69 HA GLU 69 -15.190 -9.487 0.545 522 HB2 GLU 69 HB2 GLU 69 -13.549 -11.722 0.073 523 HB3 GLU 69 HB1 GLU 69 -15.094 -12.381 0.590 524 HG2 GLU 69 HG2 GLU 69 -14.808 -10.346 -1.600 525 HG3 GLU 69 HG1 GLU 69 -14.817 -12.085 -1.880 526 H ALA 70 HN ALA 70 -17.335 -10.403 1.013 527 HA ALA 70 HA ALA 70 -17.577 -10.969 3.903 528 HB1 ALA 70 HB1 ALA 70 -19.714 -9.799 3.857 529 HB2 ALA 70 HB2 ALA 70 -19.517 -9.487 2.133 530 HB3 ALA 70 HB3 ALA 70 -18.410 -8.753 3.295 531 H ARG 71 HN ARG 71 -18.154 -12.975 4.278 532 HA ARG 71 HA ARG 71 -19.924 -14.362 2.380 533 HB2 ARG 71 HB2 ARG 71 -17.782 -15.479 2.970 534 HB3 ARG 71 HB1 ARG 71 -18.264 -15.478 4.659 535 HG2 ARG 71 HG2 ARG 71 -18.832 -17.602 4.069 536 HG3 ARG 71 HG1 ARG 71 -20.353 -16.773 3.740 537 HD2 ARG 71 HD2 ARG 71 -18.240 -17.610 1.766 538 HD3 ARG 71 HD1 ARG 71 -19.891 -18.208 1.895 539 HE ARG 71 HE ARG 71 -19.075 -15.579 0.851 540 HH11 ARG 71 HH11 ARG 71 -21.555 -18.003 1.352 541 HH12 ARG 71 HH12 ARG 71 -22.643 -17.314 0.187 542 HH21 ARG 71 HH21 ARG 71 -20.479 -14.675 -0.664 543 HH22 ARG 71 HH22 ARG 71 -22.036 -15.390 -0.955 544 H ARG 72 HN ARG 72 -21.991 -13.930 2.920 545 HA ARG 72 HA ARG 72 -22.729 -13.671 5.721 546 HB2 ARG 72 HB2 ARG 72 -23.707 -12.067 4.206 547 HB3 ARG 72 HB1 ARG 72 -24.327 -13.354 3.178 548 HG2 ARG 72 HG2 ARG 72 -25.785 -14.094 5.015 549 HG3 ARG 72 HG1 ARG 72 -25.202 -12.748 5.996 550 HD2 ARG 72 HD2 ARG 72 -26.141 -11.152 4.486 551 HD3 ARG 72 HD1 ARG 72 -26.529 -12.411 3.313 552 HE ARG 72 HE ARG 72 -27.900 -13.199 5.499 553 HH11 ARG 72 HH11 ARG 72 -27.755 -10.146 3.772 554 HH12 ARG 72 HH12 ARG 72 -29.385 -9.701 4.178 555 HH21 ARG 72 HH21 ARG 72 -30.043 -12.627 5.997 556 HH22 ARG 72 HH22 ARG 72 -30.669 -11.092 5.475 557 H GLU 73 HN GLU 73 -23.233 -15.372 6.878 558 HA GLU 73 HA GLU 73 -24.543 -17.653 5.553 559 HB2 GLU 73 HB2 GLU 73 -22.857 -17.579 8.063 560 HB3 GLU 73 HB1 GLU 73 -23.736 -18.995 7.505 561 HG2 GLU 73 HG2 GLU 73 -21.530 -17.591 6.011 562 HG3 GLU 73 HG1 GLU 73 -21.376 -19.098 6.915 563 H GLY 74 HN GLY 74 -26.638 -16.989 5.726 564 HA2 GLY 74 HA2 GLY 74 -28.687 -16.931 6.785 565 HA3 GLY 74 HA1 GLY 74 -27.875 -17.288 8.304 566 H THR 75 HN THR 75 -27.808 -15.724 9.758 567 HA THR 75 HA THR 75 -28.424 -12.991 8.884 568 HB THR 75 HB THR 75 -28.926 -12.597 11.313 569 HG1 THR 75 HG1 THR 75 -28.682 -14.173 12.724 570 HG21 THR 75 HG21 THR 75 -30.494 -14.793 9.961 571 HG22 THR 75 HG22 THR 75 -30.702 -13.062 9.699 572 HG23 THR 75 HG23 THR 75 -31.076 -13.766 11.272 573 H ARG 76 HN ARG 76 -25.788 -14.843 9.666 574 HA ARG 76 HA ARG 76 -24.385 -12.625 10.990 575 HB2 ARG 76 HB2 ARG 76 -23.546 -15.515 10.700 576 HB3 ARG 76 HB1 ARG 76 -22.646 -14.269 11.553 577 HG2 ARG 76 HG2 ARG 76 -24.638 -14.009 13.062 578 HG3 ARG 76 HG1 ARG 76 -25.306 -15.451 12.293 579 HD2 ARG 76 HD2 ARG 76 -23.198 -16.646 12.917 580 HD3 ARG 76 HD1 ARG 76 -22.739 -15.223 13.850 581 HE ARG 76 HE ARG 76 -25.330 -16.160 14.579 582 HH11 ARG 76 HH11 ARG 76 -21.904 -16.645 15.085 583 HH12 ARG 76 HH12 ARG 76 -22.106 -17.531 16.568 584 HH21 ARG 76 HH21 ARG 76 -25.623 -17.354 16.512 585 HH22 ARG 76 HH22 ARG 76 -24.229 -17.946 17.376 586 H GLN 77 HN GLN 77 -22.665 -11.653 10.089 587 HA GLN 77 HA GLN 77 -22.097 -12.360 7.290 588 HB2 GLN 77 HB2 GLN 77 -23.087 -10.091 7.889 589 HB3 GLN 77 HB1 GLN 77 -21.553 -9.728 8.663 590 HG2 GLN 77 HG2 GLN 77 -20.391 -9.870 6.588 591 HG3 GLN 77 HG1 GLN 77 -21.832 -10.479 5.767 592 HE21 GLN 77 HE21 GLN 77 -20.246 -8.117 5.160 593 HE22 GLN 77 HE22 GLN 77 -21.324 -6.767 5.260 594 H TYR 78 HN TYR 78 -20.270 -13.461 7.068 595 HA TYR 78 HA TYR 78 -18.122 -13.100 9.018 596 HB2 TYR 78 HB2 TYR 78 -18.593 -15.225 6.916 597 HB3 TYR 78 HB1 TYR 78 -17.159 -15.153 7.934 598 HD1 TYR 78 HD2 TYR 78 -20.872 -15.447 8.093 599 HD2 TYR 78 HD1 TYR 78 -17.155 -16.165 10.034 600 HE1 TYR 78 HE2 TYR 78 -22.035 -16.733 9.833 601 HE2 TYR 78 HE1 TYR 78 -18.312 -17.455 11.779 602 HH TYR 78 HH TYR 78 -20.493 -17.705 12.746 603 H TYR 79 HN TYR 79 -16.011 -12.614 8.404 604 HA TYR 79 HA TYR 79 -15.734 -11.612 5.654 605 HB2 TYR 79 HB2 TYR 79 -15.028 -10.313 8.241 606 HB3 TYR 79 HB1 TYR 79 -13.979 -10.032 6.855 607 HD1 TYR 79 HD1 TYR 79 -17.406 -9.598 8.154 608 HD2 TYR 79 HD2 TYR 79 -14.662 -8.646 5.049 609 HE1 TYR 79 HE1 TYR 79 -18.940 -7.858 7.338 610 HE2 TYR 79 HE2 TYR 79 -16.185 -6.904 4.225 611 HH TYR 79 HH TYR 79 -18.817 -5.774 6.017 612 H ARG 80 HN ARG 80 -13.884 -11.964 4.605 613 HA ARG 80 HA ARG 80 -11.608 -13.179 5.931 614 HB2 ARG 80 HB2 ARG 80 -13.033 -15.106 5.344 615 HB3 ARG 80 HB1 ARG 80 -13.095 -14.553 3.678 616 HG2 ARG 80 HG2 ARG 80 -10.667 -14.886 3.497 617 HG3 ARG 80 HG1 ARG 80 -10.647 -15.500 5.152 618 HD2 ARG 80 HD2 ARG 80 -12.160 -17.302 4.502 619 HD3 ARG 80 HD1 ARG 80 -12.198 -16.681 2.852 620 HE ARG 80 HE ARG 80 -9.810 -17.218 2.711 621 HH11 ARG 80 HH11 ARG 80 -11.735 -18.730 5.205 622 HH12 ARG 80 HH12 ARG 80 -10.649 -20.070 5.426 623 HH21 ARG 80 HH21 ARG 80 -8.366 -18.992 2.974 624 HH22 ARG 80 HH22 ARG 80 -8.744 -20.223 4.137 625 H ILE 81 HN ILE 81 -9.699 -13.124 4.539 626 HA ILE 81 HA ILE 81 -9.516 -10.838 2.920 627 HB ILE 81 HB ILE 81 -7.687 -13.245 2.881 628 HG12 ILE 81 HG12 ILE 81 -7.568 -10.730 4.565 629 HG13 ILE 81 HG11 ILE 81 -8.002 -12.330 5.155 630 HG21 ILE 81 HG21 ILE 81 -6.000 -11.690 2.073 631 HG22 ILE 81 HG22 ILE 81 -7.169 -10.372 2.118 632 HG23 ILE 81 HG23 ILE 81 -7.390 -11.709 0.988 633 HD11 ILE 81 HD11 ILE 81 -5.761 -13.132 4.609 634 HD12 ILE 81 HD12 ILE 81 -5.717 -11.771 5.732 635 HD13 ILE 81 HD13 ILE 81 -5.333 -11.522 4.029 636 H ALA 82 HN ALA 82 -9.858 -10.489 0.802 637 HA ALA 82 HA ALA 82 -11.677 -12.181 -0.510 638 HB1 ALA 82 HB1 ALA 82 -10.092 -9.893 -1.660 639 HB2 ALA 82 HB2 ALA 82 -11.632 -9.759 -0.810 640 HB3 ALA 82 HB3 ALA 82 -11.547 -10.605 -2.355 641 H GLY 83 HN GLY 83 -8.197 -11.848 -0.850 642 HA2 GLY 83 HA2 GLY 83 -8.190 -14.230 -2.530 643 HA3 GLY 83 HA1 GLY 83 -7.497 -12.773 -3.226 644 H GLU 84 HN GLU 84 -6.177 -15.270 -2.674 645 HA GLU 84 HA GLU 84 -4.565 -15.089 -0.361 646 HB2 GLU 84 HB2 GLU 84 -4.873 -17.165 -1.681 647 HB3 GLU 84 HB1 GLU 84 -3.953 -16.448 -2.994 648 HG2 GLU 84 HG2 GLU 84 -1.992 -16.316 -1.545 649 HG3 GLU 84 HG1 GLU 84 -2.918 -17.048 -0.235 650 H ASP 85 HN ASP 85 -4.312 -13.821 -3.608 651 HA ASP 85 HA ASP 85 -1.668 -12.860 -3.486 652 HB2 ASP 85 HB2 ASP 85 -2.506 -11.248 -5.293 653 HB3 ASP 85 HB1 ASP 85 -2.648 -12.969 -5.635 654 H VAL 86 HN VAL 86 -4.762 -11.384 -2.602 655 HA VAL 86 HA VAL 86 -3.751 -8.869 -1.815 656 HB VAL 86 HB VAL 86 -6.156 -10.346 -0.724 657 HG11 VAL 86 HG11 VAL 86 -5.415 -8.460 0.678 658 HG12 VAL 86 HG12 VAL 86 -6.989 -8.180 -0.062 659 HG13 VAL 86 HG13 VAL 86 -5.554 -7.391 -0.719 660 HG21 VAL 86 HG21 VAL 86 -6.279 -10.113 -3.144 661 HG22 VAL 86 HG22 VAL 86 -5.952 -8.385 -3.011 662 HG23 VAL 86 HG23 VAL 86 -7.449 -9.054 -2.359 663 H ALA 87 HN ALA 87 -4.297 -11.885 -0.044 664 HA ALA 87 HA ALA 87 -3.572 -10.973 2.511 665 HB1 ALA 87 HB1 ALA 87 -4.771 -13.068 2.137 666 HB2 ALA 87 HB2 ALA 87 -3.304 -13.333 3.080 667 HB3 ALA 87 HB3 ALA 87 -3.341 -13.755 1.369 668 H ARG 88 HN ARG 88 -1.659 -12.522 -0.041 669 HA ARG 88 HA ARG 88 0.737 -12.597 1.493 670 HB2 ARG 88 HB2 ARG 88 0.268 -12.871 -1.478 671 HB3 ARG 88 HB1 ARG 88 1.817 -13.149 -0.689 672 HG2 ARG 88 HG2 ARG 88 -0.711 -14.650 -0.039 673 HG3 ARG 88 HG1 ARG 88 0.536 -15.222 -1.151 674 HD2 ARG 88 HD2 ARG 88 2.119 -15.450 0.565 675 HD3 ARG 88 HD1 ARG 88 1.185 -14.451 1.678 676 HE ARG 88 HE ARG 88 -0.268 -16.269 2.062 677 HH11 ARG 88 HH11 ARG 88 2.363 -17.105 -0.110 678 HH12 ARG 88 HH12 ARG 88 2.195 -18.810 0.162 679 HH21 ARG 88 HH21 ARG 88 -0.496 -18.515 2.386 680 HH22 ARG 88 HH22 ARG 88 0.561 -19.614 1.553 681 H LEU 89 HN LEU 89 -0.761 -10.196 -0.514 682 HA LEU 89 HA LEU 89 1.488 -8.547 -0.953 683 HB2 LEU 89 HB2 LEU 89 -0.849 -8.404 -2.004 684 HB3 LEU 89 HB1 LEU 89 -1.337 -7.577 -0.542 685 HG LEU 89 HG LEU 89 0.896 -6.556 -2.294 686 HD11 LEU 89 HD11 LEU 89 -0.721 -5.055 -3.313 687 HD12 LEU 89 HD12 LEU 89 -2.023 -5.812 -2.398 688 HD13 LEU 89 HD13 LEU 89 -1.156 -6.737 -3.623 689 HD21 LEU 89 HD21 LEU 89 0.405 -4.429 -1.198 690 HD22 LEU 89 HD22 LEU 89 0.816 -5.668 -0.012 691 HD23 LEU 89 HD23 LEU 89 -0.868 -5.202 -0.252 692 H PHE 90 HN PHE 90 -1.070 -8.379 1.524 693 HA PHE 90 HA PHE 90 0.118 -6.383 3.103 694 HB2 PHE 90 HB2 PHE 90 -2.225 -6.975 3.361 695 HB3 PHE 90 HB1 PHE 90 -1.798 -8.606 3.859 696 HD1 PHE 90 HD1 PHE 90 -1.264 -5.054 4.865 697 HD2 PHE 90 HD2 PHE 90 -1.716 -9.097 6.101 698 HE1 PHE 90 HE1 PHE 90 -1.263 -4.330 7.217 699 HE2 PHE 90 HE2 PHE 90 -1.713 -8.384 8.455 700 HZ PHE 90 HZ PHE 90 -1.487 -5.998 9.016 701 H ALA 91 HN ALA 91 0.449 -9.897 3.127 702 HA ALA 91 HA ALA 91 2.014 -10.116 5.461 703 HB1 ALA 91 HB1 ALA 91 1.998 -11.888 3.021 704 HB2 ALA 91 HB2 ALA 91 0.934 -12.039 4.420 705 HB3 ALA 91 HB3 ALA 91 2.669 -12.309 4.597 706 H LEU 92 HN LEU 92 2.930 -9.765 2.042 707 HA LEU 92 HA LEU 92 5.709 -9.847 2.398 708 HB2 LEU 92 HB2 LEU 92 4.499 -10.026 0.225 709 HB3 LEU 92 HB1 LEU 92 4.149 -8.315 0.311 710 HG LEU 92 HG LEU 92 7.006 -9.198 0.380 711 HD11 LEU 92 HD11 LEU 92 7.074 -9.175 -2.063 712 HD12 LEU 92 HD12 LEU 92 5.322 -8.977 -2.113 713 HD13 LEU 92 HD13 LEU 92 6.024 -10.460 -1.468 714 HD21 LEU 92 HD21 LEU 92 5.580 -6.827 -0.823 715 HD22 LEU 92 HD22 LEU 92 7.325 -7.080 -0.797 716 HD23 LEU 92 HD23 LEU 92 6.444 -6.839 0.713 717 H VAL 93 HN VAL 93 3.435 -7.138 2.394 718 HA VAL 93 HA VAL 93 5.250 -5.052 2.765 719 HB VAL 93 HB VAL 93 2.380 -5.341 3.679 720 HG11 VAL 93 HG11 VAL 93 2.322 -2.942 3.980 721 HG12 VAL 93 HG12 VAL 93 4.032 -2.823 3.566 722 HG13 VAL 93 HG13 VAL 93 3.537 -3.655 5.040 723 HG21 VAL 93 HG21 VAL 93 2.658 -5.415 1.280 724 HG22 VAL 93 HG22 VAL 93 3.632 -3.947 1.319 725 HG23 VAL 93 HG23 VAL 93 1.924 -3.881 1.749 726 H GLN 94 HN GLN 94 3.658 -7.174 5.108 727 HA GLN 94 HA GLN 94 4.584 -5.934 7.456 728 HB2 GLN 94 HB2 GLN 94 2.795 -7.653 7.382 729 HB3 GLN 94 HB1 GLN 94 4.010 -8.870 7.016 730 HG2 GLN 94 HG2 GLN 94 5.106 -8.349 9.180 731 HG3 GLN 94 HG1 GLN 94 3.771 -7.256 9.546 732 HE21 GLN 94 HE21 GLN 94 1.718 -8.129 9.946 733 HE22 GLN 94 HE22 GLN 94 1.503 -9.790 10.361 734 H VAL 95 HN VAL 95 5.957 -8.559 5.510 735 HA VAL 95 HA VAL 95 8.196 -9.073 7.125 736 HB VAL 95 HB VAL 95 7.899 -9.426 4.138 737 HG11 VAL 95 HG11 VAL 95 10.246 -9.431 4.795 738 HG12 VAL 95 HG12 VAL 95 9.719 -11.046 4.325 739 HG13 VAL 95 HG13 VAL 95 9.908 -10.644 6.032 740 HG21 VAL 95 HG21 VAL 95 6.221 -10.658 5.380 741 HG22 VAL 95 HG22 VAL 95 7.468 -11.350 6.419 742 HG23 VAL 95 HG23 VAL 95 7.414 -11.769 4.707 743 H VAL 96 HN VAL 96 7.813 -6.938 4.307 744 HA VAL 96 HA VAL 96 10.445 -6.009 4.166 745 HB VAL 96 HB VAL 96 7.882 -4.580 3.428 746 HG11 VAL 96 HG11 VAL 96 10.720 -3.940 2.634 747 HG12 VAL 96 HG12 VAL 96 9.705 -2.980 3.712 748 HG13 VAL 96 HG13 VAL 96 9.269 -3.154 2.011 749 HG21 VAL 96 HG21 VAL 96 8.232 -6.681 2.238 750 HG22 VAL 96 HG22 VAL 96 9.841 -6.146 1.755 751 HG23 VAL 96 HG23 VAL 96 8.415 -5.300 1.157 752 H ALA 97 HN ALA 97 7.709 -4.869 6.084 753 HA ALA 97 HA ALA 97 8.924 -2.574 7.164 754 HB1 ALA 97 HB1 ALA 97 6.518 -2.992 7.298 755 HB2 ALA 97 HB2 ALA 97 7.204 -2.697 8.895 756 HB3 ALA 97 HB3 ALA 97 6.809 -4.340 8.395 757 H ASP 98 HN ASP 98 8.663 -5.885 8.433 758 HA ASP 98 HA ASP 98 10.058 -5.511 10.828 759 HB2 ASP 98 HB2 ASP 98 8.684 -7.529 10.128 760 HB3 ASP 98 HB1 ASP 98 10.077 -8.049 9.187 761 H GLU 99 HN GLU 99 11.204 -6.364 7.597 762 HA GLU 99 HA GLU 99 13.896 -6.832 8.190 763 HB2 GLU 99 HB2 GLU 99 12.554 -5.797 5.692 764 HB3 GLU 99 HB1 GLU 99 14.276 -6.142 5.771 765 HG2 GLU 99 HG2 GLU 99 12.106 -8.150 6.316 766 HG3 GLU 99 HG1 GLU 99 12.936 -7.958 4.772 767 H HIS 100 HN HIS 100 12.169 -3.811 7.655 768 HA HIS 100 HA HIS 100 14.593 -2.265 7.456 769 HB2 HIS 100 HB2 HIS 100 11.687 -1.485 7.615 770 HB3 HIS 100 HB1 HIS 100 12.988 -0.298 7.583 771 HD1 HIS 100 HD1 HIS 100 14.774 -1.664 5.417 772 HD2 HIS 100 HD2 HIS 100 10.657 -1.109 5.121 773 HE1 HIS 100 HE1 HIS 100 14.260 -1.663 2.955 774 HE2 HIS 100 HE2 HIS 100 11.775 -1.269 2.790 775 H LEU 101 HN LEU 101 12.543 -3.347 9.993 776 HA LEU 101 HA LEU 101 13.178 -1.325 11.892 777 HB2 LEU 101 HB2 LEU 101 12.238 -4.166 12.295 778 HB3 LEU 101 HB1 LEU 101 12.351 -2.965 13.567 779 HG LEU 101 HG LEU 101 10.539 -2.826 11.158 780 HD11 LEU 101 HD11 LEU 101 9.957 -3.284 14.077 781 HD12 LEU 101 HD12 LEU 101 9.825 -4.477 12.785 782 HD13 LEU 101 HD13 LEU 101 8.750 -3.080 12.809 783 HD21 LEU 101 HD21 LEU 101 9.591 -0.844 12.258 784 HD22 LEU 101 HD22 LEU 101 11.281 -0.604 11.814 785 HD23 LEU 101 HD23 LEU 101 10.848 -0.936 13.492 786 H GLU 102 HN GLU 102 14.676 -4.324 10.902 787 HA GLU 102 HA GLU 102 16.654 -4.235 12.991 788 HB2 GLU 102 HB2 GLU 102 16.450 -5.893 10.472 789 HB3 GLU 102 HB1 GLU 102 17.774 -6.029 11.622 790 HG2 GLU 102 HG2 GLU 102 16.117 -6.582 13.385 791 HG3 GLU 102 HG1 GLU 102 14.867 -6.590 12.142 792 H HIS 103 HN HIS 103 17.448 -2.126 12.751 793 HA HIS 103 HA HIS 103 18.701 -1.248 10.321 794 HB2 HIS 103 HB2 HIS 103 18.964 -0.187 13.148 795 HB3 HIS 103 HB1 HIS 103 19.569 0.613 11.704 796 HD1 HIS 103 HD1 HIS 103 17.823 1.752 10.151 797 HD2 HIS 103 HD2 HIS 103 16.230 0.051 13.597 798 HE1 HIS 103 HE1 HIS 103 15.481 2.651 10.335 799 HE2 HIS 103 HE2 HIS 103 14.597 1.730 12.513 800 H HIS 104 HN HIS 104 19.697 -2.737 13.323 801 HA HIS 104 HA HIS 104 22.430 -3.012 12.319 802 HB2 HIS 104 HB2 HIS 104 21.191 -2.995 14.949 803 HB3 HIS 104 HB1 HIS 104 22.231 -4.400 14.734 804 HD1 HIS 104 HD1 HIS 104 22.350 -0.624 14.750 805 HD2 HIS 104 HD2 HIS 104 24.931 -3.888 14.794 806 HE1 HIS 104 HE1 HIS 104 24.633 0.318 15.231 807 HE2 HIS 104 HE2 HIS 104 26.155 -1.688 15.391 808 H HIS 105 HN HIS 105 23.010 -4.737 11.232 809 HA HIS 105 HA HIS 105 21.220 -7.049 11.158 810 HB2 HIS 105 HB2 HIS 105 23.600 -6.281 9.449 811 HB3 HIS 105 HB1 HIS 105 22.673 -7.764 9.242 812 HD1 HIS 105 HD1 HIS 105 22.974 -4.705 7.642 813 HD2 HIS 105 HD2 HIS 105 19.683 -6.812 9.080 814 HE1 HIS 105 HE1 HIS 105 20.984 -3.803 6.392 815 HE2 HIS 105 HE2 HIS 105 19.017 -5.150 7.210 816 H HIS 106 HN HIS 106 23.292 -8.928 10.384 817 HA HIS 106 HA HIS 106 23.969 -9.916 12.953 818 HB2 HIS 106 HB2 HIS 106 25.138 -10.691 10.267 819 HB3 HIS 106 HB1 HIS 106 25.281 -11.619 11.756 820 HD1 HIS 106 HD1 HIS 106 23.104 -12.821 12.614 821 HD2 HIS 106 HD2 HIS 106 22.767 -11.004 8.889 822 HE1 HIS 106 HE1 HIS 106 20.980 -13.730 11.599 823 HE2 HIS 106 HE2 HIS 106 20.721 -12.492 9.411 824 H HIS 107 HN HIS 107 25.769 -8.270 10.424 825 HA HIS 107 HA HIS 107 27.633 -7.011 10.396 826 HB2 HIS 107 HB2 HIS 107 27.852 -5.348 12.096 827 HB3 HIS 107 HB1 HIS 107 26.140 -5.649 11.853 828 HD1 HIS 107 HD1 HIS 107 24.803 -6.577 13.850 829 HD2 HIS 107 HD2 HIS 107 28.872 -6.169 14.621 830 HE1 HIS 107 HE1 HIS 107 25.054 -6.829 16.342 831 HE2 HIS 107 HE2 HIS 107 27.528 -6.644 16.780 832 H HIS 108 HN HIS 108 29.618 -6.282 11.924 833 HA HIS 108 HA HIS 108 30.763 -8.744 13.066 834 HB2 HIS 108 HB2 HIS 108 31.728 -8.250 10.835 835 HB3 HIS 108 HB1 HIS 108 32.215 -6.661 11.411 836 HD1 HIS 108 HD1 HIS 108 34.531 -6.512 12.269 837 HD2 HIS 108 HD2 HIS 108 33.054 -10.403 12.410 838 HE1 HIS 108 HE1 HIS 108 36.457 -7.950 13.021 839 HE2 HIS 108 HE2 HIS 108 35.566 -10.309 13.028 840 H1 MET 1 HT1 MET 1 -2.235 -10.117 30.693 841 H2 MET 1 HT2 MET 1 -0.919 -10.877 29.946 842 H3 MET 1 HT3 MET 1 -1.949 -11.771 30.950 843 HA MET 1 HA MET 1 -2.382 -12.240 28.637 844 HB2 MET 1 HB2 MET 1 -4.544 -10.633 30.015 845 HB3 MET 1 HB1 MET 1 -4.811 -11.671 28.621 846 HG2 MET 1 HG2 MET 1 -4.030 -13.596 29.952 847 HG3 MET 1 HG1 MET 1 -3.874 -12.531 31.348 848 HE1 MET 1 HE1 MET 1 -5.969 -11.233 32.436 849 HE2 MET 1 HE2 MET 1 -7.627 -11.422 31.862 850 HE3 MET 1 HE3 MET 1 -6.428 -10.619 30.848 851 H ALA 2 HN ALA 2 -3.832 -11.240 26.784 852 HA ALA 2 HA ALA 2 -2.309 -9.106 25.677 853 HB1 ALA 2 HB1 ALA 2 -4.917 -10.286 24.726 854 HB2 ALA 2 HB2 ALA 2 -3.305 -10.856 24.289 855 HB3 ALA 2 HB3 ALA 2 -3.842 -9.253 23.786 856 H GLY 3 HN GLY 3 -2.914 -6.997 25.214 857 HA2 GLY 3 HA2 GLY 3 -5.294 -5.708 25.579 858 HA3 GLY 3 HA1 GLY 3 -4.589 -5.762 27.190 859 H GLN 4 HN GLN 4 -1.898 -5.492 26.532 860 HA GLN 4 HA GLN 4 -1.790 -2.707 25.688 861 HB2 GLN 4 HB2 GLN 4 0.303 -4.554 26.854 862 HB3 GLN 4 HB1 GLN 4 0.599 -2.875 26.424 863 HG2 GLN 4 HG2 GLN 4 -0.888 -2.091 28.089 864 HG3 GLN 4 HG1 GLN 4 -1.524 -3.709 28.380 865 HE21 GLN 4 HE21 GLN 4 -0.328 -5.164 29.578 866 HE22 GLN 4 HE22 GLN 4 1.019 -4.680 30.554 867 H SER 5 HN SER 5 0.594 -5.254 25.100 868 HA SER 5 HA SER 5 1.767 -5.854 23.245 869 HB2 SER 5 HB2 SER 5 -0.983 -5.641 21.996 870 HB3 SER 5 HB1 SER 5 0.373 -6.573 21.356 871 HG SER 5 HG SER 5 -0.361 -7.070 24.001 872 H ASP 6 HN ASP 6 2.350 -3.372 23.670 873 HA ASP 6 HA ASP 6 1.493 -1.422 21.824 874 HB2 ASP 6 HB2 ASP 6 3.974 -1.563 23.542 875 HB3 ASP 6 HB1 ASP 6 3.487 -0.138 22.631 876 H ARG 7 HN ARG 7 4.072 -3.782 21.696 877 HA ARG 7 HA ARG 7 5.562 -2.411 19.696 878 HB2 ARG 7 HB2 ARG 7 6.670 -3.948 21.212 879 HB3 ARG 7 HB1 ARG 7 5.705 -5.287 20.605 880 HG2 ARG 7 HG2 ARG 7 6.836 -5.351 18.580 881 HG3 ARG 7 HG1 ARG 7 7.438 -3.703 18.755 882 HD2 ARG 7 HD2 ARG 7 9.194 -5.405 19.070 883 HD3 ARG 7 HD1 ARG 7 8.956 -4.388 20.487 884 HE ARG 7 HE ARG 7 7.675 -6.288 21.443 885 HH11 ARG 7 HH11 ARG 7 9.889 -6.911 18.808 886 HH12 ARG 7 HH12 ARG 7 10.290 -8.509 19.354 887 HH21 ARG 7 HH21 ARG 7 8.184 -8.387 22.163 888 HH22 ARG 7 HH22 ARG 7 9.327 -9.354 21.267 889 H LYS 8 HN LYS 8 3.118 -4.972 19.603 890 HA LYS 8 HA LYS 8 3.430 -5.492 16.828 891 HB2 LYS 8 HB2 LYS 8 2.310 -7.110 18.290 892 HB3 LYS 8 HB1 LYS 8 1.004 -5.962 18.578 893 HG2 LYS 8 HG2 LYS 8 0.347 -6.052 16.267 894 HG3 LYS 8 HG1 LYS 8 1.739 -7.059 15.871 895 HD2 LYS 8 HD2 LYS 8 0.849 -8.855 17.257 896 HD3 LYS 8 HD1 LYS 8 -0.532 -7.840 17.700 897 HE2 LYS 8 HE2 LYS 8 -1.267 -7.770 15.401 898 HE3 LYS 8 HE1 LYS 8 0.166 -8.649 14.878 899 HZ1 LYS 8 HZ1 LYS 8 -0.588 -10.601 15.950 900 HZ2 LYS 8 HZ2 LYS 8 -1.907 -9.999 15.065 901 HZ3 LYS 8 HZ3 LYS 8 -1.838 -9.781 16.744 902 H ALA 9 HN ALA 9 1.500 -3.209 18.666 903 HA ALA 9 HA ALA 9 -0.150 -2.294 16.587 904 HB1 ALA 9 HB1 ALA 9 0.905 -0.753 18.964 905 HB2 ALA 9 HB2 ALA 9 -0.552 -1.748 18.941 906 HB3 ALA 9 HB3 ALA 9 -0.466 -0.289 17.954 907 H ALA 10 HN ALA 10 3.130 -1.462 17.534 908 HA ALA 10 HA ALA 10 3.460 0.741 15.787 909 HB1 ALA 10 HB1 ALA 10 5.853 0.438 16.162 910 HB2 ALA 10 HB2 ALA 10 5.544 -1.135 16.896 911 HB3 ALA 10 HB3 ALA 10 4.955 0.333 17.676 912 H LEU 11 HN LEU 11 3.787 -2.727 15.389 913 HA LEU 11 HA LEU 11 5.158 -2.726 12.918 914 HB2 LEU 11 HB2 LEU 11 3.242 -4.752 14.081 915 HB3 LEU 11 HB1 LEU 11 4.239 -5.027 12.665 916 HG LEU 11 HG LEU 11 5.315 -4.458 15.427 917 HD11 LEU 11 HD11 LEU 11 5.919 -6.843 15.442 918 HD12 LEU 11 HD12 LEU 11 5.041 -7.061 13.927 919 HD13 LEU 11 HD13 LEU 11 4.173 -6.600 15.391 920 HD21 LEU 11 HD21 LEU 11 6.682 -5.399 12.908 921 HD22 LEU 11 HD22 LEU 11 7.444 -5.156 14.480 922 HD23 LEU 11 HD23 LEU 11 6.794 -3.778 13.593 923 H LEU 12 HN LEU 12 1.732 -2.727 13.752 924 HA LEU 12 HA LEU 12 0.793 -2.963 11.084 925 HB2 LEU 12 HB2 LEU 12 -0.573 -1.951 13.575 926 HB3 LEU 12 HB1 LEU 12 -1.388 -2.271 12.055 927 HG LEU 12 HG LEU 12 0.083 -4.353 13.673 928 HD11 LEU 12 HD11 LEU 12 -2.866 -3.785 13.442 929 HD12 LEU 12 HD12 LEU 12 -1.866 -3.587 14.881 930 HD13 LEU 12 HD13 LEU 12 -2.156 -5.197 14.226 931 HD21 LEU 12 HD21 LEU 12 0.009 -4.836 11.279 932 HD22 LEU 12 HD22 LEU 12 -1.738 -4.602 11.279 933 HD23 LEU 12 HD23 LEU 12 -1.029 -5.940 12.181 934 H ASP 13 HN ASP 13 1.593 -0.239 13.148 935 HA ASP 13 HA ASP 13 0.550 1.737 11.366 936 HB2 ASP 13 HB2 ASP 13 1.024 2.122 13.816 937 HB3 ASP 13 HB1 ASP 13 2.740 2.112 13.421 938 H GLN 14 HN GLN 14 3.640 0.130 11.793 939 HA GLN 14 HA GLN 14 5.183 1.734 10.071 940 HB2 GLN 14 HB2 GLN 14 6.171 0.185 11.685 941 HB3 GLN 14 HB1 GLN 14 5.510 -1.181 10.800 942 HG2 GLN 14 HG2 GLN 14 7.854 -0.933 10.319 943 HG3 GLN 14 HG1 GLN 14 6.903 -0.598 8.875 944 HE21 GLN 14 HE21 GLN 14 6.826 1.489 8.064 945 HE22 GLN 14 HE22 GLN 14 7.936 2.716 8.571 946 H VAL 15 HN VAL 15 3.391 -1.293 9.456 947 HA VAL 15 HA VAL 15 4.103 -1.400 6.712 948 HB VAL 15 HB VAL 15 2.309 -3.046 6.435 949 HG11 VAL 15 HG11 VAL 15 4.437 -3.801 7.294 950 HG12 VAL 15 HG12 VAL 15 3.128 -4.710 8.051 951 HG13 VAL 15 HG13 VAL 15 3.937 -3.423 8.943 952 HG21 VAL 15 HG21 VAL 15 0.936 -3.733 8.351 953 HG22 VAL 15 HG22 VAL 15 0.605 -2.072 7.861 954 HG23 VAL 15 HG23 VAL 15 1.589 -2.390 9.290 955 H ALA 16 HN ALA 16 1.524 0.170 8.474 956 HA ALA 16 HA ALA 16 -0.040 0.952 6.253 957 HB1 ALA 16 HB1 ALA 16 -0.878 1.038 8.551 958 HB2 ALA 16 HB2 ALA 16 -1.020 2.605 7.754 959 HB3 ALA 16 HB3 ALA 16 0.272 2.324 8.922 960 H ARG 17 HN ARG 17 2.804 2.293 7.790 961 HA ARG 17 HA ARG 17 2.835 4.790 6.472 962 HB2 ARG 17 HB2 ARG 17 4.196 4.404 8.432 963 HB3 ARG 17 HB1 ARG 17 5.066 3.108 7.627 964 HG2 ARG 17 HG2 ARG 17 6.111 4.676 6.128 965 HG3 ARG 17 HG1 ARG 17 5.149 6.000 6.793 966 HD2 ARG 17 HD2 ARG 17 6.224 5.798 8.919 967 HD3 ARG 17 HD1 ARG 17 7.042 4.320 8.426 968 HE ARG 17 HE ARG 17 8.209 5.825 6.747 969 HH11 ARG 17 HH11 ARG 17 7.012 7.008 9.824 970 HH12 ARG 17 HH12 ARG 17 8.261 8.206 9.990 971 HH21 ARG 17 HH21 ARG 17 9.877 7.357 6.981 972 HH22 ARG 17 HH22 ARG 17 9.892 8.413 8.368 973 H VAL 18 HN VAL 18 4.135 1.615 5.629 974 HA VAL 18 HA VAL 18 5.420 2.408 3.231 975 HB VAL 18 HB VAL 18 4.215 -0.291 3.885 976 HG11 VAL 18 HG11 VAL 18 5.860 -1.154 2.274 977 HG12 VAL 18 HG12 VAL 18 6.331 0.500 1.887 978 HG13 VAL 18 HG13 VAL 18 4.699 -0.060 1.522 979 HG21 VAL 18 HG21 VAL 18 5.798 0.418 5.603 980 HG22 VAL 18 HG22 VAL 18 7.013 0.732 4.364 981 HG23 VAL 18 HG23 VAL 18 6.451 -0.914 4.649 982 H GLY 19 HN GLY 19 2.200 1.045 3.883 983 HA2 GLY 19 HA2 GLY 19 1.250 1.109 1.234 984 HA3 GLY 19 HA1 GLY 19 0.248 1.107 2.679 985 H LYS 20 HN LYS 20 1.299 3.571 3.744 986 HA LYS 20 HA LYS 20 -0.402 5.414 2.428 987 HB2 LYS 20 HB2 LYS 20 0.130 5.480 4.856 988 HB3 LYS 20 HB1 LYS 20 1.768 5.982 4.458 989 HG2 LYS 20 HG2 LYS 20 0.940 8.021 3.466 990 HG3 LYS 20 HG1 LYS 20 -0.724 7.510 3.749 991 HD2 LYS 20 HD2 LYS 20 -0.251 7.482 6.182 992 HD3 LYS 20 HD1 LYS 20 1.361 8.118 5.840 993 HE2 LYS 20 HE2 LYS 20 -0.170 9.907 6.482 994 HE3 LYS 20 HE1 LYS 20 0.368 10.098 4.813 995 HZ1 LYS 20 HZ1 LYS 20 -2.007 10.495 5.033 996 HZ2 LYS 20 HZ2 LYS 20 -2.234 8.937 5.664 997 HZ3 LYS 20 HZ3 LYS 20 -1.716 9.139 4.061 998 H ALA 21 HN ALA 21 3.035 4.761 2.261 999 HA ALA 21 HA ALA 21 3.737 7.068 0.757 1000 HB1 ALA 21 HB1 ALA 21 5.403 5.742 1.948 1001 HB2 ALA 21 HB2 ALA 21 5.792 5.863 0.231 1002 HB3 ALA 21 HB3 ALA 21 5.091 4.378 0.874 1003 H LEU 22 HN LEU 22 2.528 3.886 -0.039 1004 HA LEU 22 HA LEU 22 2.714 4.247 -2.878 1005 HB2 LEU 22 HB2 LEU 22 2.663 2.030 -1.772 1006 HB3 LEU 22 HB1 LEU 22 1.023 2.341 -1.245 1007 HG LEU 22 HG LEU 22 1.649 2.360 -4.176 1008 HD11 LEU 22 HD11 LEU 22 1.207 -0.035 -4.271 1009 HD12 LEU 22 HD12 LEU 22 1.122 -0.099 -2.511 1010 HD13 LEU 22 HD13 LEU 22 2.645 0.300 -3.307 1011 HD21 LEU 22 HD21 LEU 22 -0.660 1.547 -4.315 1012 HD22 LEU 22 HD22 LEU 22 -0.565 3.077 -3.443 1013 HD23 LEU 22 HD23 LEU 22 -0.772 1.567 -2.555 1014 H ALA 23 HN ALA 23 0.320 4.826 -0.391 1015 HA ALA 23 HA ALA 23 -1.804 5.440 -2.211 1016 HB1 ALA 23 HB1 ALA 23 -3.066 6.051 -0.235 1017 HB2 ALA 23 HB2 ALA 23 -1.598 6.006 0.742 1018 HB3 ALA 23 HB3 ALA 23 -2.225 4.522 0.024 1019 H ASN 24 HN ASN 24 -0.538 7.015 -3.473 1020 HA ASN 24 HA ASN 24 -1.006 9.699 -2.372 1021 HB2 ASN 24 HB2 ASN 24 1.478 8.702 -3.739 1022 HB3 ASN 24 HB1 ASN 24 1.026 10.398 -3.846 1023 HD21 ASN 24 HD21 ASN 24 2.228 7.877 -1.808 1024 HD22 ASN 24 HD22 ASN 24 2.616 8.880 -0.457 1025 H GLY 25 HN GLY 25 -0.472 7.772 -5.311 1026 HA2 GLY 25 HA2 GLY 25 -2.333 7.876 -6.943 1027 HA3 GLY 25 HA1 GLY 25 -2.323 9.615 -6.691 1028 H ARG 26 HN ARG 26 -1.093 10.850 -7.983 1029 HA ARG 26 HA ARG 26 0.003 9.695 -10.315 1030 HB2 ARG 26 HB2 ARG 26 0.759 11.977 -10.876 1031 HB3 ARG 26 HB1 ARG 26 -0.921 11.932 -10.362 1032 HG2 ARG 26 HG2 ARG 26 -0.333 12.790 -8.191 1033 HG3 ARG 26 HG1 ARG 26 1.384 12.722 -8.595 1034 HD2 ARG 26 HD2 ARG 26 0.431 14.994 -8.779 1035 HD3 ARG 26 HD1 ARG 26 1.099 14.399 -10.297 1036 HE ARG 26 HE ARG 26 -1.132 14.070 -11.102 1037 HH11 ARG 26 HH11 ARG 26 -0.907 15.790 -8.052 1038 HH12 ARG 26 HH12 ARG 26 -2.486 16.506 -8.205 1039 HH21 ARG 26 HH21 ARG 26 -3.205 15.018 -11.295 1040 HH22 ARG 26 HH22 ARG 26 -3.775 16.090 -10.049 1041 H ARG 27 HN ARG 27 1.384 10.331 -7.243 1042 HA ARG 27 HA ARG 27 4.092 10.605 -8.023 1043 HB2 ARG 27 HB2 ARG 27 2.846 9.724 -5.418 1044 HB3 ARG 27 HB1 ARG 27 4.568 10.006 -5.631 1045 HG2 ARG 27 HG2 ARG 27 4.168 12.322 -6.164 1046 HG3 ARG 27 HG1 ARG 27 2.427 12.067 -6.101 1047 HD2 ARG 27 HD2 ARG 27 2.558 11.561 -3.731 1048 HD3 ARG 27 HD1 ARG 27 4.315 11.724 -3.775 1049 HE ARG 27 HE ARG 27 3.277 14.103 -4.746 1050 HH11 ARG 27 HH11 ARG 27 3.050 12.317 -1.732 1051 HH12 ARG 27 HH12 ARG 27 2.972 13.750 -0.749 1052 HH21 ARG 27 HH21 ARG 27 3.122 15.961 -3.481 1053 HH22 ARG 27 HH22 ARG 27 3.000 15.834 -1.750 1054 H LEU 28 HN LEU 28 2.002 7.911 -7.959 1055 HA LEU 28 HA LEU 28 3.956 5.865 -7.616 1056 HB2 LEU 28 HB2 LEU 28 1.251 5.816 -8.955 1057 HB3 LEU 28 HB1 LEU 28 2.226 4.393 -8.649 1058 HG LEU 28 HG LEU 28 1.119 6.220 -6.515 1059 HD11 LEU 28 HD11 LEU 28 -0.406 4.396 -6.014 1060 HD12 LEU 28 HD12 LEU 28 0.250 3.457 -7.357 1061 HD13 LEU 28 HD13 LEU 28 -0.631 4.954 -7.673 1062 HD21 LEU 28 HD21 LEU 28 2.545 3.571 -6.312 1063 HD22 LEU 28 HD22 LEU 28 1.852 4.482 -4.970 1064 HD23 LEU 28 HD23 LEU 28 3.217 5.142 -5.873 1065 H GLN 29 HN GLN 29 3.005 7.888 -10.247 1066 HA GLN 29 HA GLN 29 3.904 6.246 -12.379 1067 HB2 GLN 29 HB2 GLN 29 2.355 8.229 -12.580 1068 HB3 GLN 29 HB1 GLN 29 3.758 9.268 -12.351 1069 HG2 GLN 29 HG2 GLN 29 4.773 8.401 -14.363 1070 HG3 GLN 29 HG1 GLN 29 3.449 7.256 -14.569 1071 HE21 GLN 29 HE21 GLN 29 4.419 9.356 -16.342 1072 HE22 GLN 29 HE22 GLN 29 3.063 10.381 -16.650 1073 H ILE 30 HN ILE 30 5.479 8.308 -10.107 1074 HA ILE 30 HA ILE 30 7.909 8.649 -11.561 1075 HB ILE 30 HB ILE 30 7.406 8.875 -8.587 1076 HG12 ILE 30 HG12 ILE 30 7.463 10.987 -10.753 1077 HG13 ILE 30 HG11 ILE 30 6.022 10.408 -9.926 1078 HG21 ILE 30 HG21 ILE 30 9.706 9.882 -10.260 1079 HG22 ILE 30 HG22 ILE 30 9.772 8.571 -9.081 1080 HG23 ILE 30 HG23 ILE 30 9.456 10.223 -8.548 1081 HD11 ILE 30 HD11 ILE 30 6.754 12.562 -9.071 1082 HD12 ILE 30 HD12 ILE 30 8.318 11.869 -8.643 1083 HD13 ILE 30 HD13 ILE 30 6.854 11.315 -7.829 1084 H LEU 31 HN LEU 31 6.709 6.345 -9.174 1085 HA LEU 31 HA LEU 31 9.079 4.883 -8.782 1086 HB2 LEU 31 HB2 LEU 31 6.224 3.890 -8.750 1087 HB3 LEU 31 HB1 LEU 31 7.604 3.044 -8.079 1088 HG LEU 31 HG LEU 31 6.588 5.710 -7.096 1089 HD11 LEU 31 HD11 LEU 31 5.773 4.457 -5.165 1090 HD12 LEU 31 HD12 LEU 31 6.268 2.948 -5.932 1091 HD13 LEU 31 HD13 LEU 31 4.991 3.926 -6.653 1092 HD21 LEU 31 HD21 LEU 31 8.082 5.305 -5.213 1093 HD22 LEU 31 HD22 LEU 31 8.974 5.381 -6.731 1094 HD23 LEU 31 HD23 LEU 31 8.652 3.822 -5.977 1095 H ASP 32 HN ASP 32 6.476 4.600 -11.138 1096 HA ASP 32 HA ASP 32 7.395 2.367 -12.555 1097 HB2 ASP 32 HB2 ASP 32 5.174 3.213 -12.926 1098 HB3 ASP 32 HB1 ASP 32 5.797 4.778 -13.434 1099 H LEU 33 HN LEU 33 8.126 5.796 -12.875 1100 HA LEU 33 HA LEU 33 9.676 5.591 -15.234 1101 HB2 LEU 33 HB2 LEU 33 8.602 7.671 -14.237 1102 HB3 LEU 33 HB1 LEU 33 9.937 7.707 -13.103 1103 HG LEU 33 HG LEU 33 11.474 7.799 -15.129 1104 HD11 LEU 33 HD11 LEU 33 10.498 8.634 -17.195 1105 HD12 LEU 33 HD12 LEU 33 8.884 8.498 -16.498 1106 HD13 LEU 33 HD13 LEU 33 9.844 7.047 -16.782 1107 HD21 LEU 33 HD21 LEU 33 9.574 10.086 -14.623 1108 HD22 LEU 33 HD22 LEU 33 11.152 10.213 -15.401 1109 HD23 LEU 33 HD23 LEU 33 11.038 9.730 -13.710 1110 H LEU 34 HN LEU 34 10.430 5.381 -11.802 1111 HA LEU 34 HA LEU 34 13.280 5.343 -12.222 1112 HB2 LEU 34 HB2 LEU 34 11.629 4.742 -9.770 1113 HB3 LEU 34 HB1 LEU 34 13.381 4.831 -9.796 1114 HG LEU 34 HG LEU 34 11.481 7.105 -10.376 1115 HD11 LEU 34 HD11 LEU 34 12.351 8.061 -8.309 1116 HD12 LEU 34 HD12 LEU 34 13.324 6.613 -8.046 1117 HD13 LEU 34 HD13 LEU 34 11.564 6.507 -8.020 1118 HD21 LEU 34 HD21 LEU 34 13.498 8.497 -10.447 1119 HD22 LEU 34 HD22 LEU 34 13.486 7.288 -11.729 1120 HD23 LEU 34 HD23 LEU 34 14.495 7.048 -10.303 1121 H ALA 35 HN ALA 35 10.739 3.029 -12.161 1122 HA ALA 35 HA ALA 35 12.335 0.724 -11.654 1123 HB1 ALA 35 HB1 ALA 35 10.437 -0.538 -12.554 1124 HB2 ALA 35 HB2 ALA 35 9.709 0.964 -13.127 1125 HB3 ALA 35 HB3 ALA 35 9.905 0.683 -11.396 1126 H GLN 36 HN GLN 36 11.750 2.747 -14.368 1127 HA GLN 36 HA GLN 36 12.722 0.934 -16.369 1128 HB2 GLN 36 HB2 GLN 36 12.359 3.932 -16.425 1129 HB3 GLN 36 HB1 GLN 36 12.728 2.934 -17.823 1130 HG2 GLN 36 HG2 GLN 36 10.608 1.809 -17.630 1131 HG3 GLN 36 HG1 GLN 36 10.247 2.682 -16.139 1132 HE21 GLN 36 HE21 GLN 36 10.607 2.939 -19.595 1133 HE22 GLN 36 HE22 GLN 36 9.787 4.456 -19.762 1134 H GLY 37 HN GLY 37 14.137 3.076 -14.075 1135 HA2 GLY 37 HA2 GLY 37 16.701 2.231 -14.265 1136 HA3 GLY 37 HA1 GLY 37 16.601 3.448 -15.529 1137 H GLU 38 HN GLU 38 18.371 3.798 -13.578 1138 HA GLU 38 HA GLU 38 17.367 5.348 -11.370 1139 HB2 GLU 38 HB2 GLU 38 19.426 3.923 -11.341 1140 HB3 GLU 38 HB1 GLU 38 20.177 5.056 -12.452 1141 HG2 GLU 38 HG2 GLU 38 20.066 6.805 -10.780 1142 HG3 GLU 38 HG1 GLU 38 19.240 5.709 -9.668 1143 H ARG 39 HN ARG 39 16.979 7.532 -11.374 1144 HA ARG 39 HA ARG 39 18.035 9.068 -13.658 1145 HB2 ARG 39 HB2 ARG 39 15.183 9.245 -12.680 1146 HB3 ARG 39 HB1 ARG 39 15.892 10.134 -14.020 1147 HG2 ARG 39 HG2 ARG 39 16.252 7.978 -15.190 1148 HG3 ARG 39 HG1 ARG 39 15.391 7.169 -13.878 1149 HD2 ARG 39 HD2 ARG 39 13.473 8.759 -14.353 1150 HD3 ARG 39 HD1 ARG 39 14.327 9.195 -15.831 1151 HE ARG 39 HE ARG 39 13.307 6.498 -15.205 1152 HH11 ARG 39 HH11 ARG 39 14.183 8.993 -17.517 1153 HH12 ARG 39 HH12 ARG 39 13.657 8.063 -18.890 1154 HH21 ARG 39 HH21 ARG 39 12.584 5.311 -17.022 1155 HH22 ARG 39 HH22 ARG 39 12.759 5.986 -18.611 1156 H ALA 40 HN ALA 40 18.382 11.237 -13.314 1157 HA ALA 40 HA ALA 40 18.602 12.116 -10.578 1158 HB1 ALA 40 HB1 ALA 40 19.100 13.615 -13.147 1159 HB2 ALA 40 HB2 ALA 40 20.306 12.707 -12.237 1160 HB3 ALA 40 HB3 ALA 40 19.567 14.144 -11.530 1161 H VAL 41 HN VAL 41 17.662 14.174 -9.836 1162 HA VAL 41 HA VAL 41 14.887 14.221 -10.005 1163 HB VAL 41 HB VAL 41 16.676 16.554 -9.295 1164 HG11 VAL 41 HG11 VAL 41 13.802 15.994 -8.563 1165 HG12 VAL 41 HG12 VAL 41 14.358 17.220 -9.702 1166 HG13 VAL 41 HG13 VAL 41 14.770 17.353 -7.992 1167 HG21 VAL 41 HG21 VAL 41 17.203 14.586 -7.970 1168 HG22 VAL 41 HG22 VAL 41 15.500 14.394 -7.551 1169 HG23 VAL 41 HG23 VAL 41 16.396 15.802 -6.981 1170 H GLU 42 HN GLU 42 17.247 16.214 -11.738 1171 HA GLU 42 HA GLU 42 15.465 17.870 -13.107 1172 HB2 GLU 42 HB2 GLU 42 18.230 16.886 -13.804 1173 HB3 GLU 42 HB1 GLU 42 17.366 18.066 -14.782 1174 HG2 GLU 42 HG2 GLU 42 17.411 18.767 -11.963 1175 HG3 GLU 42 HG1 GLU 42 19.024 18.619 -12.663 1176 H ALA 43 HN ALA 43 16.671 14.655 -13.876 1177 HA ALA 43 HA ALA 43 15.520 14.522 -16.479 1178 HB1 ALA 43 HB1 ALA 43 17.403 13.101 -15.784 1179 HB2 ALA 43 HB2 ALA 43 16.042 12.153 -16.381 1180 HB3 ALA 43 HB3 ALA 43 16.342 12.269 -14.648 1181 H ILE 44 HN ILE 44 14.571 13.261 -13.301 1182 HA ILE 44 HA ILE 44 12.204 11.984 -14.049 1183 HB ILE 44 HB ILE 44 12.813 13.372 -11.433 1184 HG12 ILE 44 HG12 ILE 44 13.158 10.469 -12.209 1185 HG13 ILE 44 HG11 ILE 44 14.464 11.644 -12.110 1186 HG21 ILE 44 HG21 ILE 44 10.436 12.934 -11.669 1187 HG22 ILE 44 HG22 ILE 44 11.147 11.859 -10.463 1188 HG23 ILE 44 HG23 ILE 44 10.770 11.250 -12.075 1189 HD11 ILE 44 HD11 ILE 44 14.058 11.912 -9.727 1190 HD12 ILE 44 HD12 ILE 44 14.368 10.224 -10.135 1191 HD13 ILE 44 HD13 ILE 44 12.719 10.767 -9.821 1192 H ALA 45 HN ALA 45 12.702 15.302 -12.866 1193 HA ALA 45 HA ALA 45 10.014 16.083 -12.858 1194 HB1 ALA 45 HB1 ALA 45 12.423 17.844 -13.300 1195 HB2 ALA 45 HB2 ALA 45 11.833 17.305 -11.728 1196 HB3 ALA 45 HB3 ALA 45 10.832 18.355 -12.731 1197 H THR 46 HN THR 46 12.488 16.429 -15.377 1198 HA THR 46 HA THR 46 10.863 17.857 -17.189 1199 HB THR 46 HB THR 46 13.231 16.089 -17.841 1200 HG1 THR 46 HG1 THR 46 13.967 17.587 -16.397 1201 HG21 THR 46 HG21 THR 46 13.495 17.557 -19.782 1202 HG22 THR 46 HG22 THR 46 12.050 18.450 -19.312 1203 HG23 THR 46 HG23 THR 46 11.922 16.763 -19.810 1204 H ALA 47 HN ALA 47 11.562 14.403 -16.815 1205 HA ALA 47 HA ALA 47 10.242 13.536 -19.154 1206 HB1 ALA 47 HB1 ALA 47 10.390 11.302 -18.195 1207 HB2 ALA 47 HB2 ALA 47 10.791 11.992 -16.624 1208 HB3 ALA 47 HB3 ALA 47 11.904 12.180 -17.978 1209 H THR 48 HN THR 48 9.076 14.236 -15.933 1210 HA THR 48 HA THR 48 6.496 13.004 -16.533 1211 HB THR 48 HB THR 48 5.977 13.616 -14.130 1212 HG1 THR 48 HG1 THR 48 8.786 14.008 -13.904 1213 HG21 THR 48 HG21 THR 48 6.667 11.359 -14.766 1214 HG22 THR 48 HG22 THR 48 7.334 11.800 -13.194 1215 HG23 THR 48 HG23 THR 48 8.362 11.828 -14.626 1216 H GLY 49 HN GLY 49 7.960 15.994 -16.867 1217 HA2 GLY 49 HA2 GLY 49 7.095 18.055 -17.428 1218 HA3 GLY 49 HA1 GLY 49 5.500 17.317 -17.454 1219 H MET 50 HN MET 50 7.684 17.314 -14.708 1220 HA MET 50 HA MET 50 5.870 19.179 -13.321 1221 HB2 MET 50 HB2 MET 50 7.208 16.694 -12.239 1222 HB3 MET 50 HB1 MET 50 6.489 17.922 -11.208 1223 HG2 MET 50 HG2 MET 50 4.328 17.550 -12.380 1224 HG3 MET 50 HG1 MET 50 5.082 16.211 -13.243 1225 HE1 MET 50 HE1 MET 50 6.865 14.742 -11.187 1226 HE2 MET 50 HE2 MET 50 5.678 13.893 -12.177 1227 HE3 MET 50 HE3 MET 50 5.741 13.607 -10.438 1228 H ASN 51 HN ASN 51 7.014 20.125 -11.305 1229 HA ASN 51 HA ASN 51 9.475 21.296 -12.319 1230 HB2 ASN 51 HB2 ASN 51 7.640 22.724 -11.408 1231 HB3 ASN 51 HB1 ASN 51 7.913 22.005 -9.824 1232 HD21 ASN 51 HD21 ASN 51 9.128 24.192 -12.229 1233 HD22 ASN 51 HD22 ASN 51 10.375 24.898 -11.249 1234 H LEU 52 HN LEU 52 11.374 21.523 -11.001 1235 HA LEU 52 HA LEU 52 12.348 19.177 -9.911 1236 HB2 LEU 52 HB2 LEU 52 13.232 22.021 -9.439 1237 HB3 LEU 52 HB1 LEU 52 14.141 20.619 -8.911 1238 HG LEU 52 HG LEU 52 13.502 21.299 -11.782 1239 HD11 LEU 52 HD11 LEU 52 15.089 22.866 -10.873 1240 HD12 LEU 52 HD12 LEU 52 15.926 21.735 -11.939 1241 HD13 LEU 52 HD13 LEU 52 16.045 21.550 -10.188 1242 HD21 LEU 52 HD21 LEU 52 15.039 19.491 -12.327 1243 HD22 LEU 52 HD22 LEU 52 13.671 18.892 -11.387 1244 HD23 LEU 52 HD23 LEU 52 15.237 19.129 -10.612 1245 H THR 53 HN THR 53 11.068 22.022 -8.202 1246 HA THR 53 HA THR 53 11.573 21.138 -5.597 1247 HB THR 53 HB THR 53 9.668 22.683 -4.947 1248 HG1 THR 53 HG1 THR 53 9.705 23.407 -7.706 1249 HG21 THR 53 HG21 THR 53 11.985 23.453 -5.033 1250 HG22 THR 53 HG22 THR 53 10.884 24.717 -5.581 1251 HG23 THR 53 HG23 THR 53 11.819 23.789 -6.756 1252 H THR 54 HN THR 54 8.616 20.856 -7.541 1253 HA THR 54 HA THR 54 7.031 19.479 -5.731 1254 HB THR 54 HB THR 54 7.027 19.007 -8.716 1255 HG1 THR 54 HG1 THR 54 5.931 21.164 -7.189 1256 HG21 THR 54 HG21 THR 54 4.828 18.986 -6.642 1257 HG22 THR 54 HG22 THR 54 5.532 17.568 -7.420 1258 HG23 THR 54 HG23 THR 54 4.608 18.728 -8.375 1259 H ALA 55 HN ALA 55 9.270 18.217 -8.178 1260 HA ALA 55 HA ALA 55 8.779 15.489 -7.679 1261 HB1 ALA 55 HB1 ALA 55 11.252 16.791 -8.814 1262 HB2 ALA 55 HB2 ALA 55 9.836 16.275 -9.732 1263 HB3 ALA 55 HB3 ALA 55 10.844 15.079 -8.917 1264 H SER 56 HN SER 56 11.470 17.575 -6.614 1265 HA SER 56 HA SER 56 12.850 15.667 -5.129 1266 HB2 SER 56 HB2 SER 56 13.719 17.908 -5.797 1267 HB3 SER 56 HB1 SER 56 12.694 18.639 -4.565 1268 HG SER 56 HG SER 56 14.602 18.384 -3.569 1269 H ALA 57 HN ALA 57 10.218 17.821 -4.150 1270 HA ALA 57 HA ALA 57 10.351 17.324 -1.387 1271 HB1 ALA 57 HB1 ALA 57 9.124 19.208 -2.362 1272 HB2 ALA 57 HB2 ALA 57 8.114 18.258 -1.274 1273 HB3 ALA 57 HB3 ALA 57 7.931 18.083 -3.017 1274 H ASN 58 HN ASN 58 8.307 15.818 -3.899 1275 HA ASN 58 HA ASN 58 7.085 14.080 -1.972 1276 HB2 ASN 58 HB2 ASN 58 5.732 13.263 -3.684 1277 HB3 ASN 58 HB1 ASN 58 6.040 14.922 -4.175 1278 HD21 ASN 58 HD21 ASN 58 7.198 15.323 -6.011 1279 HD22 ASN 58 HD22 ASN 58 7.651 14.082 -7.125 1280 H LEU 59 HN LEU 59 9.836 13.889 -4.092 1281 HA LEU 59 HA LEU 59 10.232 11.096 -3.994 1282 HB2 LEU 59 HB2 LEU 59 12.138 13.401 -4.350 1283 HB3 LEU 59 HB1 LEU 59 12.674 11.733 -4.380 1284 HG LEU 59 HG LEU 59 10.602 12.859 -6.264 1285 HD11 LEU 59 HD11 LEU 59 12.725 13.963 -6.649 1286 HD12 LEU 59 HD12 LEU 59 12.382 12.823 -7.952 1287 HD13 LEU 59 HD13 LEU 59 13.550 12.406 -6.696 1288 HD21 LEU 59 HD21 LEU 59 11.031 10.824 -7.535 1289 HD22 LEU 59 HD22 LEU 59 10.467 10.446 -5.908 1290 HD23 LEU 59 HD23 LEU 59 12.177 10.289 -6.305 1291 H GLN 60 HN GLN 60 11.159 13.719 -1.830 1292 HA GLN 60 HA GLN 60 12.661 12.136 -0.025 1293 HB2 GLN 60 HB2 GLN 60 12.757 14.603 -0.065 1294 HB3 GLN 60 HB1 GLN 60 11.096 14.673 0.511 1295 HG2 GLN 60 HG2 GLN 60 11.763 13.574 2.584 1296 HG3 GLN 60 HG1 GLN 60 13.425 13.486 2.005 1297 HE21 GLN 60 HE21 GLN 60 11.353 16.230 1.416 1298 HE22 GLN 60 HE22 GLN 60 12.192 17.328 2.453 1299 H ALA 61 HN ALA 61 9.246 12.965 -0.270 1300 HA ALA 61 HA ALA 61 8.388 11.756 2.132 1301 HB1 ALA 61 HB1 ALA 61 6.156 11.843 1.186 1302 HB2 ALA 61 HB2 ALA 61 6.825 12.122 -0.423 1303 HB3 ALA 61 HB3 ALA 61 7.017 13.342 0.836 1304 H LEU 62 HN LEU 62 8.625 10.525 -1.194 1305 HA LEU 62 HA LEU 62 7.604 7.952 -0.663 1306 HB2 LEU 62 HB2 LEU 62 9.533 8.866 -2.798 1307 HB3 LEU 62 HB1 LEU 62 8.741 7.302 -2.777 1308 HG LEU 62 HG LEU 62 7.353 9.974 -3.017 1309 HD11 LEU 62 HD11 LEU 62 8.607 9.338 -5.022 1310 HD12 LEU 62 HD12 LEU 62 6.865 9.281 -5.293 1311 HD13 LEU 62 HD13 LEU 62 7.769 7.785 -5.047 1312 HD21 LEU 62 HD21 LEU 62 5.342 8.642 -3.451 1313 HD22 LEU 62 HD22 LEU 62 5.979 8.355 -1.831 1314 HD23 LEU 62 HD23 LEU 62 6.248 7.169 -3.107 1315 H LYS 63 HN LYS 63 10.844 9.306 -0.387 1316 HA LYS 63 HA LYS 63 12.180 6.866 0.124 1317 HB2 LYS 63 HB2 LYS 63 13.418 8.925 -0.395 1318 HB3 LYS 63 HB1 LYS 63 12.873 9.640 1.118 1319 HG2 LYS 63 HG2 LYS 63 14.019 7.777 2.325 1320 HG3 LYS 63 HG1 LYS 63 14.692 7.267 0.777 1321 HD2 LYS 63 HD2 LYS 63 15.102 9.965 2.060 1322 HD3 LYS 63 HD1 LYS 63 16.259 8.634 2.096 1323 HE2 LYS 63 HE2 LYS 63 16.135 8.711 -0.460 1324 HE3 LYS 63 HE1 LYS 63 15.357 10.279 -0.246 1325 HZ1 LYS 63 HZ1 LYS 63 18.107 9.471 0.427 1326 HZ2 LYS 63 HZ2 LYS 63 17.381 10.770 1.241 1327 HZ3 LYS 63 HZ3 LYS 63 17.571 10.830 -0.440 1328 H SER 64 HN SER 64 10.460 9.143 2.169 1329 HA SER 64 HA SER 64 11.193 8.017 4.656 1330 HB2 SER 64 HB2 SER 64 8.700 9.595 3.967 1331 HB3 SER 64 HB1 SER 64 9.374 9.353 5.581 1332 HG SER 64 HG SER 64 10.644 10.704 3.416 1333 H GLY 65 HN GLY 65 8.800 7.199 2.278 1334 HA2 GLY 65 HA2 GLY 65 7.337 5.405 3.991 1335 HA3 GLY 65 HA1 GLY 65 7.186 5.541 2.246 1336 H GLY 66 HN GLY 66 10.281 5.238 2.290 1337 HA2 GLY 66 HA2 GLY 66 11.813 3.465 2.474 1338 HA3 GLY 66 HA1 GLY 66 10.490 2.396 2.911 1339 H LEU 67 HN LEU 67 9.936 4.399 0.202 1340 HA LEU 67 HA LEU 67 9.900 2.024 -1.476 1341 HB2 LEU 67 HB2 LEU 67 8.661 4.727 -1.615 1342 HB3 LEU 67 HB1 LEU 67 8.906 3.854 -3.115 1343 HG LEU 67 HG LEU 67 7.523 2.012 -2.307 1344 HD11 LEU 67 HD11 LEU 67 6.270 2.208 -0.208 1345 HD12 LEU 67 HD12 LEU 67 7.182 3.664 0.191 1346 HD13 LEU 67 HD13 LEU 67 8.011 2.112 0.063 1347 HD21 LEU 67 HD21 LEU 67 6.189 4.691 -1.946 1348 HD22 LEU 67 HD22 LEU 67 5.375 3.159 -2.265 1349 HD23 LEU 67 HD23 LEU 67 6.445 3.858 -3.481 1350 H VAL 68 HN VAL 68 11.385 5.260 -1.509 1351 HA VAL 68 HA VAL 68 13.252 4.214 -3.528 1352 HB VAL 68 HB VAL 68 13.413 6.442 -4.549 1353 HG11 VAL 68 HG11 VAL 68 11.879 4.807 -5.505 1354 HG12 VAL 68 HG12 VAL 68 11.253 6.447 -5.688 1355 HG13 VAL 68 HG13 VAL 68 10.593 5.384 -4.443 1356 HG21 VAL 68 HG21 VAL 68 11.124 7.179 -2.730 1357 HG22 VAL 68 HG22 VAL 68 11.801 8.185 -4.012 1358 HG23 VAL 68 HG23 VAL 68 12.778 7.777 -2.602 1359 H GLU 69 HN GLU 69 15.287 5.427 -3.655 1360 HA GLU 69 HA GLU 69 16.038 6.847 -1.206 1361 HB2 GLU 69 HB2 GLU 69 16.821 4.199 -1.728 1362 HB3 GLU 69 HB1 GLU 69 18.216 5.180 -2.154 1363 HG2 GLU 69 HG2 GLU 69 16.792 5.476 0.472 1364 HG3 GLU 69 HG1 GLU 69 18.088 4.310 0.225 1365 H ALA 70 HN ALA 70 18.287 7.878 -1.582 1366 HA ALA 70 HA ALA 70 18.281 8.932 -4.338 1367 HB1 ALA 70 HB1 ALA 70 17.440 10.557 -2.708 1368 HB2 ALA 70 HB2 ALA 70 18.948 11.087 -3.451 1369 HB3 ALA 70 HB3 ALA 70 18.954 10.431 -1.814 1370 H ARG 71 HN ARG 71 20.178 9.268 -5.355 1371 HA ARG 71 HA ARG 71 22.628 8.440 -3.947 1372 HB2 ARG 71 HB2 ARG 71 21.818 8.074 -6.829 1373 HB3 ARG 71 HB1 ARG 71 23.488 7.936 -6.301 1374 HG2 ARG 71 HG2 ARG 71 21.199 6.260 -5.298 1375 HG3 ARG 71 HG1 ARG 71 22.384 5.763 -6.506 1376 HD2 ARG 71 HD2 ARG 71 22.878 6.414 -3.606 1377 HD3 ARG 71 HD1 ARG 71 23.036 4.846 -4.393 1378 HE ARG 71 HE ARG 71 24.861 7.137 -4.698 1379 HH11 ARG 71 HH11 ARG 71 24.140 3.740 -5.239 1380 HH12 ARG 71 HH12 ARG 71 25.764 3.346 -5.715 1381 HH21 ARG 71 HH21 ARG 71 26.974 6.620 -5.345 1382 HH22 ARG 71 HH22 ARG 71 27.375 4.986 -5.782 1383 H ARG 72 HN ARG 72 23.401 10.380 -3.294 1384 HA ARG 72 HA ARG 72 23.502 12.645 -5.069 1385 HB2 ARG 72 HB2 ARG 72 23.345 12.742 -2.522 1386 HB3 ARG 72 HB1 ARG 72 25.039 12.279 -2.492 1387 HG2 ARG 72 HG2 ARG 72 24.792 14.673 -2.232 1388 HG3 ARG 72 HG1 ARG 72 25.618 14.296 -3.745 1389 HD2 ARG 72 HD2 ARG 72 23.633 14.709 -5.011 1390 HD3 ARG 72 HD1 ARG 72 22.661 14.837 -3.545 1391 HE ARG 72 HE ARG 72 24.280 16.844 -3.112 1392 HH11 ARG 72 HH11 ARG 72 22.940 15.872 -6.197 1393 HH12 ARG 72 HH12 ARG 72 22.862 17.489 -6.826 1394 HH21 ARG 72 HH21 ARG 72 24.180 18.971 -3.928 1395 HH22 ARG 72 HH22 ARG 72 23.568 19.260 -5.530 1396 H GLU 73 HN GLU 73 24.704 12.215 -6.836 1397 HA GLU 73 HA GLU 73 27.368 11.036 -6.426 1398 HB2 GLU 73 HB2 GLU 73 25.782 9.599 -7.672 1399 HB3 GLU 73 HB1 GLU 73 25.593 10.869 -8.871 1400 HG2 GLU 73 HG2 GLU 73 27.100 9.123 -9.639 1401 HG3 GLU 73 HG1 GLU 73 27.930 10.669 -9.485 1402 H GLY 74 HN GLY 74 28.883 12.518 -6.564 1403 HA2 GLY 74 HA2 GLY 74 30.163 14.247 -7.355 1404 HA3 GLY 74 HA1 GLY 74 29.342 14.033 -8.894 1405 H THR 75 HN THR 75 27.863 15.471 -9.520 1406 HA THR 75 HA THR 75 27.096 17.561 -7.598 1407 HB THR 75 HB THR 75 27.083 19.078 -9.691 1408 HG1 THR 75 HG1 THR 75 28.833 18.304 -11.177 1409 HG21 THR 75 HG21 THR 75 28.670 19.320 -7.838 1410 HG22 THR 75 HG22 THR 75 29.453 19.626 -9.388 1411 HG23 THR 75 HG23 THR 75 29.706 18.089 -8.562 1412 H ARG 76 HN ARG 76 25.787 15.059 -8.743 1413 HA ARG 76 HA ARG 76 23.322 16.373 -9.678 1414 HB2 ARG 76 HB2 ARG 76 24.500 13.739 -10.577 1415 HB3 ARG 76 HB1 ARG 76 22.868 14.267 -10.966 1416 HG2 ARG 76 HG2 ARG 76 23.702 16.131 -12.213 1417 HG3 ARG 76 HG1 ARG 76 25.355 15.790 -11.698 1418 HD2 ARG 76 HD2 ARG 76 25.349 13.712 -12.918 1419 HD3 ARG 76 HD1 ARG 76 23.648 13.925 -13.336 1420 HE ARG 76 HE ARG 76 24.325 15.852 -14.679 1421 HH11 ARG 76 HH11 ARG 76 26.814 13.574 -13.744 1422 HH12 ARG 76 HH12 ARG 76 27.870 13.997 -15.052 1423 HH21 ARG 76 HH21 ARG 76 25.677 16.389 -16.412 1424 HH22 ARG 76 HH22 ARG 76 27.223 15.602 -16.583 1425 H GLN 77 HN GLN 77 21.353 15.424 -9.022 1426 HA GLN 77 HA GLN 77 21.604 13.718 -6.635 1427 HB2 GLN 77 HB2 GLN 77 20.692 15.914 -6.116 1428 HB3 GLN 77 HB1 GLN 77 19.473 15.736 -7.368 1429 HG2 GLN 77 HG2 GLN 77 18.439 15.367 -5.260 1430 HG3 GLN 77 HG1 GLN 77 18.528 13.824 -6.104 1431 HE21 GLN 77 HE21 GLN 77 18.253 14.401 -3.261 1432 HE22 GLN 77 HE22 GLN 77 19.575 13.613 -2.475 1433 H TYR 78 HN TYR 78 21.194 11.684 -7.171 1434 HA TYR 78 HA TYR 78 19.206 11.124 -9.245 1435 HB2 TYR 78 HB2 TYR 78 21.385 9.424 -8.028 1436 HB3 TYR 78 HB1 TYR 78 20.176 8.793 -9.143 1437 HD1 TYR 78 HD1 TYR 78 20.168 9.484 -11.485 1438 HD2 TYR 78 HD2 TYR 78 23.200 10.813 -8.811 1439 HE1 TYR 78 HE1 TYR 78 21.543 10.172 -13.398 1440 HE2 TYR 78 HE2 TYR 78 24.586 11.506 -10.724 1441 HH TYR 78 HH TYR 78 24.841 11.026 -13.091 1442 H TYR 79 HN TYR 79 17.512 9.727 -8.931 1443 HA TYR 79 HA TYR 79 17.130 8.676 -6.216 1444 HB2 TYR 79 HB2 TYR 79 15.158 10.174 -7.918 1445 HB3 TYR 79 HB1 TYR 79 14.599 8.985 -6.745 1446 HD1 TYR 79 HD1 TYR 79 16.193 12.260 -7.185 1447 HD2 TYR 79 HD2 TYR 79 14.783 9.405 -4.362 1448 HE1 TYR 79 HE1 TYR 79 16.319 13.957 -5.412 1449 HE2 TYR 79 HE2 TYR 79 14.904 11.099 -2.580 1450 HH TYR 79 HH TYR 79 15.220 14.378 -3.177 1451 H ARG 80 HN ARG 80 16.060 6.701 -6.093 1452 HA ARG 80 HA ARG 80 15.284 5.277 -8.470 1453 HB2 ARG 80 HB2 ARG 80 17.843 5.236 -8.394 1454 HB3 ARG 80 HB1 ARG 80 17.683 4.257 -6.946 1455 HG2 ARG 80 HG2 ARG 80 16.464 2.565 -8.245 1456 HG3 ARG 80 HG1 ARG 80 16.690 3.548 -9.697 1457 HD2 ARG 80 HD2 ARG 80 19.156 3.427 -9.281 1458 HD3 ARG 80 HD1 ARG 80 18.821 2.260 -8.003 1459 HE ARG 80 HE ARG 80 17.613 1.086 -10.051 1460 HH11 ARG 80 HH11 ARG 80 20.725 2.682 -9.897 1461 HH12 ARG 80 HH12 ARG 80 21.457 1.649 -11.092 1462 HH21 ARG 80 HH21 ARG 80 18.552 -0.250 -11.648 1463 HH22 ARG 80 HH22 ARG 80 20.217 -0.006 -12.112 1464 H ILE 81 HN ILE 81 14.459 3.121 -7.906 1465 HA ILE 81 HA ILE 81 13.014 2.985 -5.522 1466 HB ILE 81 HB ILE 81 13.907 0.715 -7.316 1467 HG12 ILE 81 HG12 ILE 81 11.337 2.318 -7.271 1468 HG13 ILE 81 HG11 ILE 81 12.608 2.459 -8.480 1469 HG21 ILE 81 HG21 ILE 81 13.211 -0.115 -5.147 1470 HG22 ILE 81 HG22 ILE 81 12.004 -0.516 -6.370 1471 HG23 ILE 81 HG23 ILE 81 11.716 0.814 -5.248 1472 HD11 ILE 81 HD11 ILE 81 10.732 1.155 -9.303 1473 HD12 ILE 81 HD12 ILE 81 10.928 0.014 -7.971 1474 HD13 ILE 81 HD13 ILE 81 12.190 0.168 -9.193 1475 H ALA 82 HN ALA 82 13.444 2.164 -3.530 1476 HA ALA 82 HA ALA 82 16.060 2.329 -2.604 1477 HB1 ALA 82 HB1 ALA 82 15.204 1.570 -0.473 1478 HB2 ALA 82 HB2 ALA 82 13.748 0.954 -1.251 1479 HB3 ALA 82 HB3 ALA 82 14.064 2.690 -1.221 1480 H GLY 83 HN GLY 83 14.157 -0.566 -3.380 1481 HA2 GLY 83 HA2 GLY 83 16.558 -2.075 -3.788 1482 HA3 GLY 83 HA1 GLY 83 15.724 -2.538 -2.313 1483 H GLU 84 HN GLU 84 15.951 -4.525 -3.887 1484 HA GLU 84 HA GLU 84 14.222 -4.878 -6.047 1485 HB2 GLU 84 HB2 GLU 84 16.113 -6.394 -5.216 1486 HB3 GLU 84 HB1 GLU 84 14.943 -7.049 -4.079 1487 HG2 GLU 84 HG2 GLU 84 15.031 -8.502 -5.949 1488 HG3 GLU 84 HG1 GLU 84 13.497 -7.633 -6.025 1489 H ASP 85 HN ASP 85 13.697 -5.144 -2.600 1490 HA ASP 85 HA ASP 85 11.280 -6.538 -2.568 1491 HB2 ASP 85 HB2 ASP 85 10.938 -5.370 -0.341 1492 HB3 ASP 85 HB1 ASP 85 12.448 -6.257 -0.516 1493 H VAL 86 HN VAL 86 11.863 -3.033 -2.714 1494 HA VAL 86 HA VAL 86 9.108 -2.334 -2.792 1495 HB VAL 86 HB VAL 86 11.396 -0.699 -3.893 1496 HG11 VAL 86 HG11 VAL 86 9.962 1.207 -3.332 1497 HG12 VAL 86 HG12 VAL 86 8.703 0.095 -2.790 1498 HG13 VAL 86 HG13 VAL 86 9.185 0.121 -4.485 1499 HG21 VAL 86 HG21 VAL 86 11.606 0.308 -1.692 1500 HG22 VAL 86 HG22 VAL 86 11.906 -1.428 -1.610 1501 HG23 VAL 86 HG23 VAL 86 10.363 -0.773 -1.061 1502 H ALA 87 HN ALA 87 11.563 -2.933 -5.248 1503 HA ALA 87 HA ALA 87 10.135 -2.063 -7.497 1504 HB1 ALA 87 HB1 ALA 87 12.545 -2.533 -7.503 1505 HB2 ALA 87 HB2 ALA 87 11.702 -3.377 -8.804 1506 HB3 ALA 87 HB3 ALA 87 12.199 -4.256 -7.357 1507 H ARG 88 HN ARG 88 10.306 -5.237 -5.935 1508 HA ARG 88 HA ARG 88 8.558 -6.477 -7.829 1509 HB2 ARG 88 HB2 ARG 88 9.382 -7.377 -5.059 1510 HB3 ARG 88 HB1 ARG 88 8.516 -8.363 -6.229 1511 HG2 ARG 88 HG2 ARG 88 11.311 -7.280 -6.504 1512 HG3 ARG 88 HG1 ARG 88 10.841 -8.959 -6.239 1513 HD2 ARG 88 HD2 ARG 88 9.729 -9.009 -8.403 1514 HD3 ARG 88 HD1 ARG 88 10.141 -7.312 -8.667 1515 HE ARG 88 HE ARG 88 12.261 -9.318 -8.298 1516 HH11 ARG 88 HH11 ARG 88 10.654 -6.943 -10.293 1517 HH12 ARG 88 HH12 ARG 88 11.917 -6.883 -11.482 1518 HH21 ARG 88 HH21 ARG 88 13.926 -9.267 -9.849 1519 HH22 ARG 88 HH22 ARG 88 13.790 -8.208 -11.224 1520 H LEU 89 HN LEU 89 8.158 -4.914 -4.710 1521 HA LEU 89 HA LEU 89 5.495 -5.672 -4.208 1522 HB2 LEU 89 HB2 LEU 89 7.079 -4.622 -2.577 1523 HB3 LEU 89 HB1 LEU 89 6.872 -3.101 -3.414 1524 HG LEU 89 HG LEU 89 4.486 -4.504 -2.249 1525 HD11 LEU 89 HD11 LEU 89 6.344 -2.649 -0.763 1526 HD12 LEU 89 HD12 LEU 89 6.174 -4.380 -0.466 1527 HD13 LEU 89 HD13 LEU 89 4.813 -3.295 -0.167 1528 HD21 LEU 89 HD21 LEU 89 5.181 -1.611 -2.759 1529 HD22 LEU 89 HD22 LEU 89 3.682 -2.182 -2.026 1530 HD23 LEU 89 HD23 LEU 89 4.063 -2.602 -3.697 1531 H PHE 90 HN PHE 90 6.844 -2.795 -5.809 1532 HA PHE 90 HA PHE 90 4.377 -1.583 -6.409 1533 HB2 PHE 90 HB2 PHE 90 6.529 -0.387 -6.484 1534 HB3 PHE 90 HB1 PHE 90 7.010 -1.339 -7.883 1535 HD1 PHE 90 HD2 PHE 90 4.222 0.876 -6.774 1536 HD2 PHE 90 HD1 PHE 90 6.715 -0.423 -9.965 1537 HE1 PHE 90 HE2 PHE 90 3.182 2.540 -8.256 1538 HE2 PHE 90 HE1 PHE 90 5.679 1.239 -11.456 1539 HZ PHE 90 HZ PHE 90 3.911 2.721 -10.599 1540 H ALA 91 HN ALA 91 6.368 -3.879 -8.211 1541 HA ALA 91 HA ALA 91 4.800 -3.923 -10.557 1542 HB1 ALA 91 HB1 ALA 91 7.070 -4.828 -10.479 1543 HB2 ALA 91 HB2 ALA 91 5.923 -6.044 -11.043 1544 HB3 ALA 91 HB3 ALA 91 6.534 -6.105 -9.388 1545 H LEU 92 HN LEU 92 4.766 -5.919 -7.626 1546 HA LEU 92 HA LEU 92 2.785 -7.735 -8.406 1547 HB2 LEU 92 HB2 LEU 92 4.359 -7.886 -6.431 1548 HB3 LEU 92 HB1 LEU 92 3.304 -6.767 -5.596 1549 HG LEU 92 HG LEU 92 2.234 -9.372 -6.650 1550 HD11 LEU 92 HD11 LEU 92 2.694 -10.368 -4.464 1551 HD12 LEU 92 HD12 LEU 92 3.581 -8.919 -3.990 1552 HD13 LEU 92 HD13 LEU 92 4.185 -9.933 -5.300 1553 HD21 LEU 92 HD21 LEU 92 0.659 -9.100 -4.782 1554 HD22 LEU 92 HD22 LEU 92 0.601 -7.732 -5.894 1555 HD23 LEU 92 HD23 LEU 92 1.444 -7.579 -4.354 1556 H VAL 93 HN VAL 93 2.509 -4.635 -6.666 1557 HA VAL 93 HA VAL 93 -0.296 -4.888 -6.266 1558 HB VAL 93 HB VAL 93 1.189 -3.439 -4.876 1559 HG11 VAL 93 HG11 VAL 93 1.651 -1.151 -5.665 1560 HG12 VAL 93 HG12 VAL 93 1.090 -1.619 -7.272 1561 HG13 VAL 93 HG13 VAL 93 2.518 -2.386 -6.577 1562 HG21 VAL 93 HG21 VAL 93 -0.462 -1.655 -4.573 1563 HG22 VAL 93 HG22 VAL 93 -1.223 -3.234 -4.758 1564 HG23 VAL 93 HG23 VAL 93 -1.214 -2.099 -6.106 1565 H GLN 94 HN GLN 94 1.655 -3.543 -8.869 1566 HA GLN 94 HA GLN 94 -0.528 -2.332 -10.230 1567 HB2 GLN 94 HB2 GLN 94 2.208 -3.213 -11.080 1568 HB3 GLN 94 HB1 GLN 94 1.029 -2.699 -12.281 1569 HG2 GLN 94 HG2 GLN 94 0.798 -0.565 -10.955 1570 HG3 GLN 94 HG1 GLN 94 2.205 -1.093 -10.033 1571 HE21 GLN 94 HE21 GLN 94 3.480 -2.353 -12.320 1572 HE22 GLN 94 HE22 GLN 94 4.065 -1.073 -13.322 1573 H VAL 95 HN VAL 95 1.012 -5.518 -10.439 1574 HA VAL 95 HA VAL 95 -0.571 -6.504 -12.543 1575 HB VAL 95 HB VAL 95 0.811 -8.029 -10.327 1576 HG11 VAL 95 HG11 VAL 95 -0.287 -9.040 -12.951 1577 HG12 VAL 95 HG12 VAL 95 -0.956 -9.377 -11.354 1578 HG13 VAL 95 HG13 VAL 95 0.645 -9.982 -11.785 1579 HG21 VAL 95 HG21 VAL 95 2.308 -6.676 -11.719 1580 HG22 VAL 95 HG22 VAL 95 1.663 -7.456 -13.165 1581 HG23 VAL 95 HG23 VAL 95 2.559 -8.403 -11.978 1582 H VAL 96 HN VAL 96 -1.039 -6.652 -9.010 1583 HA VAL 96 HA VAL 96 -3.298 -8.335 -9.103 1584 HB VAL 96 HB VAL 96 -1.996 -7.908 -7.028 1585 HG11 VAL 96 HG11 VAL 96 -3.451 -5.271 -6.998 1586 HG12 VAL 96 HG12 VAL 96 -1.713 -5.508 -7.178 1587 HG13 VAL 96 HG13 VAL 96 -2.511 -5.938 -5.665 1588 HG21 VAL 96 HG21 VAL 96 -4.946 -7.338 -6.793 1589 HG22 VAL 96 HG22 VAL 96 -3.898 -7.946 -5.511 1590 HG23 VAL 96 HG23 VAL 96 -4.210 -8.934 -6.939 1591 H ALA 97 HN ALA 97 -2.991 -4.817 -9.293 1592 HA ALA 97 HA ALA 97 -5.811 -4.330 -9.338 1593 HB1 ALA 97 HB1 ALA 97 -5.213 -2.077 -10.014 1594 HB2 ALA 97 HB2 ALA 97 -3.559 -2.593 -10.348 1595 HB3 ALA 97 HB3 ALA 97 -4.174 -2.614 -8.695 1596 H ASP 98 HN ASP 98 -3.301 -4.570 -11.815 1597 HA ASP 98 HA ASP 98 -4.906 -3.851 -14.011 1598 HB2 ASP 98 HB2 ASP 98 -2.506 -3.692 -14.122 1599 HB3 ASP 98 HB1 ASP 98 -2.330 -5.421 -13.846 1600 H GLU 99 HN GLU 99 -3.998 -7.069 -12.769 1601 HA GLU 99 HA GLU 99 -5.267 -8.343 -15.029 1602 HB2 GLU 99 HB2 GLU 99 -3.115 -9.097 -13.923 1603 HB3 GLU 99 HB1 GLU 99 -4.105 -9.695 -12.601 1604 HG2 GLU 99 HG2 GLU 99 -5.219 -11.239 -14.058 1605 HG3 GLU 99 HG1 GLU 99 -4.402 -10.562 -15.466 1606 H HIS 100 HN HIS 100 -6.189 -7.511 -11.802 1607 HA HIS 100 HA HIS 100 -8.281 -9.509 -11.650 1608 HB2 HIS 100 HB2 HIS 100 -7.413 -7.264 -9.864 1609 HB3 HIS 100 HB1 HIS 100 -8.984 -8.012 -9.630 1610 HD1 HIS 100 HD1 HIS 100 -7.044 -10.770 -10.624 1611 HD2 HIS 100 HD2 HIS 100 -7.204 -8.471 -7.156 1612 HE1 HIS 100 HE1 HIS 100 -6.034 -12.191 -8.812 1613 HE2 HIS 100 HE2 HIS 100 -5.956 -10.706 -6.770 1614 H LEU 101 HN LEU 101 -7.950 -6.265 -12.783 1615 HA LEU 101 HA LEU 101 -10.691 -5.520 -12.496 1616 HB2 LEU 101 HB2 LEU 101 -8.240 -4.304 -13.447 1617 HB3 LEU 101 HB1 LEU 101 -9.596 -3.902 -14.481 1618 HG LEU 101 HG LEU 101 -9.238 -2.209 -12.739 1619 HD11 LEU 101 HD11 LEU 101 -11.784 -3.776 -12.353 1620 HD12 LEU 101 HD12 LEU 101 -11.490 -2.583 -13.616 1621 HD13 LEU 101 HD13 LEU 101 -11.528 -2.084 -11.924 1622 HD21 LEU 101 HD21 LEU 101 -9.686 -2.732 -10.396 1623 HD22 LEU 101 HD22 LEU 101 -8.315 -3.663 -11.000 1624 HD23 LEU 101 HD23 LEU 101 -9.890 -4.434 -10.807 1625 H GLU 102 HN GLU 102 -8.960 -7.335 -14.853 1626 HA GLU 102 HA GLU 102 -10.653 -6.863 -17.072 1627 HB2 GLU 102 HB2 GLU 102 -8.967 -9.283 -16.409 1628 HB3 GLU 102 HB1 GLU 102 -9.751 -9.001 -17.957 1629 HG2 GLU 102 HG2 GLU 102 -8.415 -6.889 -18.142 1630 HG3 GLU 102 HG1 GLU 102 -7.525 -7.413 -16.712 1631 H HIS 103 HN HIS 103 -12.789 -7.070 -16.757 1632 HA HIS 103 HA HIS 103 -13.986 -9.023 -15.092 1633 HB2 HIS 103 HB2 HIS 103 -15.234 -7.418 -17.339 1634 HB3 HIS 103 HB1 HIS 103 -16.120 -8.320 -16.114 1635 HD1 HIS 103 HD1 HIS 103 -15.628 -7.423 -13.542 1636 HD2 HIS 103 HD2 HIS 103 -14.769 -4.840 -16.690 1637 HE1 HIS 103 HE1 HIS 103 -15.509 -5.125 -12.527 1638 HE2 HIS 103 HE2 HIS 103 -14.807 -3.609 -14.416 1639 H HIS 104 HN HIS 104 -12.939 -9.010 -18.373 1640 HA HIS 104 HA HIS 104 -14.316 -11.510 -18.971 1641 HB2 HIS 104 HB2 HIS 104 -13.761 -9.442 -20.582 1642 HB3 HIS 104 HB1 HIS 104 -12.279 -10.360 -20.816 1643 HD1 HIS 104 HD1 HIS 104 -15.718 -10.101 -21.920 1644 HD2 HIS 104 HD2 HIS 104 -12.792 -13.057 -21.870 1645 HE1 HIS 104 HE1 HIS 104 -16.496 -11.849 -23.546 1646 HE2 HIS 104 HE2 HIS 104 -14.585 -13.475 -23.696 1647 H HIS 105 HN HIS 105 -13.315 -12.896 -17.494 1648 HA HIS 105 HA HIS 105 -10.449 -12.980 -17.246 1649 HB2 HIS 105 HB2 HIS 105 -12.570 -14.835 -16.141 1650 HB3 HIS 105 HB1 HIS 105 -10.870 -14.850 -15.687 1651 HD1 HIS 105 HD1 HIS 105 -14.077 -13.352 -14.806 1652 HD2 HIS 105 HD2 HIS 105 -10.056 -12.385 -14.324 1653 HE1 HIS 105 HE1 HIS 105 -14.006 -11.614 -12.993 1654 HE2 HIS 105 HE2 HIS 105 -11.559 -11.199 -12.581 1655 H HIS 106 HN HIS 106 -12.899 -15.328 -18.329 1656 HA HIS 106 HA HIS 106 -10.983 -16.317 -20.317 1657 HB2 HIS 106 HB2 HIS 106 -12.566 -18.135 -18.477 1658 HB3 HIS 106 HB1 HIS 106 -11.546 -18.657 -19.810 1659 HD1 HIS 106 HD1 HIS 106 -8.898 -17.738 -19.454 1660 HD2 HIS 106 HD2 HIS 106 -11.302 -18.286 -16.105 1661 HE1 HIS 106 HE1 HIS 106 -7.315 -17.978 -17.515 1662 HE2 HIS 106 HE2 HIS 106 -8.786 -18.418 -15.509 1663 H HIS 107 HN HIS 107 -11.941 -17.026 -22.211 1664 HA HIS 107 HA HIS 107 -14.810 -16.413 -22.403 1665 HB2 HIS 107 HB2 HIS 107 -14.507 -16.063 -24.744 1666 HB3 HIS 107 HB1 HIS 107 -13.187 -15.237 -23.936 1667 HD1 HIS 107 HD1 HIS 107 -10.795 -16.177 -24.289 1668 HD2 HIS 107 HD2 HIS 107 -13.764 -18.186 -26.401 1669 HE1 HIS 107 HE1 HIS 107 -9.588 -17.591 -25.989 1670 HE2 HIS 107 HE2 HIS 107 -11.417 -18.640 -27.377 1671 H HIS 108 HN HIS 108 -12.569 -18.986 -22.482 1672 HA HIS 108 HA HIS 108 -14.570 -20.971 -22.551 1673 HB2 HIS 108 HB2 HIS 108 -14.581 -20.384 -24.971 1674 HB3 HIS 108 HB1 HIS 108 -12.871 -20.788 -25.055 1675 HD1 HIS 108 HD1 HIS 108 -12.313 -23.172 -25.551 1676 HD2 HIS 108 HD2 HIS 108 -16.269 -22.687 -24.386 1677 HE1 HIS 108 HE1 HIS 108 -13.404 -25.404 -25.929 1678 HE2 HIS 108 HE2 HIS 108 -15.847 -24.993 -25.482 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -12.089 12.766 -23.093 2 H2 MET 1 HT2 MET 1 -13.245 11.537 -22.942 3 H3 MET 1 HT3 MET 1 -12.432 11.755 -24.412 4 HA MET 1 HA MET 1 -10.336 11.176 -23.350 5 HB2 MET 1 HB2 MET 1 -10.923 11.854 -21.074 6 HB3 MET 1 HB1 MET 1 -12.142 10.589 -20.992 7 HG2 MET 1 HG2 MET 1 -10.363 8.900 -21.212 8 HG3 MET 1 HG1 MET 1 -9.166 10.196 -21.206 9 HE1 MET 1 HE1 MET 1 -7.927 8.939 -19.212 10 HE2 MET 1 HE2 MET 1 -9.165 7.683 -19.190 11 HE3 MET 1 HE3 MET 1 -8.708 8.498 -17.693 12 H ALA 2 HN ALA 2 -10.163 9.602 -24.837 13 HA ALA 2 HA ALA 2 -12.070 7.409 -24.897 14 HB1 ALA 2 HB1 ALA 2 -10.854 6.656 -26.866 15 HB2 ALA 2 HB2 ALA 2 -9.615 7.878 -26.584 16 HB3 ALA 2 HB3 ALA 2 -11.255 8.369 -27.003 17 H GLY 3 HN GLY 3 -8.524 7.698 -24.627 18 HA2 GLY 3 HA2 GLY 3 -8.541 5.611 -22.590 19 HA3 GLY 3 HA1 GLY 3 -7.672 5.243 -24.072 20 H GLN 4 HN GLN 4 -6.711 7.872 -24.568 21 HA GLN 4 HA GLN 4 -5.055 9.335 -24.068 22 HB2 GLN 4 HB2 GLN 4 -6.288 9.759 -21.978 23 HB3 GLN 4 HB1 GLN 4 -5.433 8.434 -21.204 24 HG2 GLN 4 HG2 GLN 4 -3.333 9.619 -21.445 25 HG3 GLN 4 HG1 GLN 4 -4.153 10.932 -22.290 26 HE21 GLN 4 HE21 GLN 4 -3.502 12.436 -20.757 27 HE22 GLN 4 HE22 GLN 4 -4.216 12.502 -19.184 28 H SER 5 HN SER 5 -2.766 9.371 -23.773 29 HA SER 5 HA SER 5 -1.536 6.865 -24.303 30 HB2 SER 5 HB2 SER 5 -0.243 9.517 -23.610 31 HB3 SER 5 HB1 SER 5 0.560 8.134 -24.356 32 HG SER 5 HG SER 5 -0.127 9.779 -25.861 33 H ASP 6 HN ASP 6 -1.824 8.904 -21.469 34 HA ASP 6 HA ASP 6 -0.055 7.249 -19.882 35 HB2 ASP 6 HB2 ASP 6 -0.548 9.850 -19.701 36 HB3 ASP 6 HB1 ASP 6 -1.879 9.306 -18.686 37 H ARG 7 HN ARG 7 -1.804 5.552 -20.810 38 HA ARG 7 HA ARG 7 -4.298 5.351 -19.511 39 HB2 ARG 7 HB2 ARG 7 -3.784 4.181 -21.611 40 HB3 ARG 7 HB1 ARG 7 -2.625 3.165 -20.764 41 HG2 ARG 7 HG2 ARG 7 -4.502 2.339 -19.345 42 HG3 ARG 7 HG1 ARG 7 -5.608 3.233 -20.389 43 HD2 ARG 7 HD2 ARG 7 -4.904 1.935 -22.305 44 HD3 ARG 7 HD1 ARG 7 -3.700 1.097 -21.326 45 HE ARG 7 HE ARG 7 -6.500 0.887 -20.521 46 HH11 ARG 7 HH11 ARG 7 -3.714 -0.590 -22.044 47 HH12 ARG 7 HH12 ARG 7 -4.320 -2.214 -21.860 48 HH21 ARG 7 HH21 ARG 7 -7.287 -1.242 -20.263 49 HH22 ARG 7 HH22 ARG 7 -6.343 -2.581 -20.839 50 H LYS 8 HN LYS 8 -1.102 4.566 -18.503 51 HA LYS 8 HA LYS 8 -1.689 2.555 -16.614 52 HB2 LYS 8 HB2 LYS 8 0.500 2.984 -15.691 53 HB3 LYS 8 HB1 LYS 8 0.591 3.036 -17.445 54 HG2 LYS 8 HG2 LYS 8 0.556 5.482 -17.365 55 HG3 LYS 8 HG1 LYS 8 0.503 5.412 -15.602 56 HD2 LYS 8 HD2 LYS 8 2.651 4.226 -15.604 57 HD3 LYS 8 HD1 LYS 8 2.699 4.335 -17.364 58 HE2 LYS 8 HE2 LYS 8 2.757 6.612 -15.392 59 HE3 LYS 8 HE1 LYS 8 4.068 6.079 -16.446 60 HZ1 LYS 8 HZ1 LYS 8 2.626 6.655 -18.362 61 HZ2 LYS 8 HZ2 LYS 8 3.047 7.991 -17.407 62 HZ3 LYS 8 HZ3 LYS 8 1.496 7.315 -17.278 63 H ALA 9 HN ALA 9 -2.114 5.989 -16.586 64 HA ALA 9 HA ALA 9 -2.206 6.464 -13.820 65 HB1 ALA 9 HB1 ALA 9 -3.833 7.809 -15.977 66 HB2 ALA 9 HB2 ALA 9 -2.191 8.251 -15.510 67 HB3 ALA 9 HB3 ALA 9 -3.515 8.440 -14.361 68 H ALA 10 HN ALA 10 -4.457 4.940 -15.989 69 HA ALA 10 HA ALA 10 -6.657 4.932 -14.139 70 HB1 ALA 10 HB1 ALA 10 -7.035 4.795 -16.557 71 HB2 ALA 10 HB2 ALA 10 -7.721 3.407 -15.714 72 HB3 ALA 10 HB3 ALA 10 -6.204 3.242 -16.597 73 H LEU 11 HN LEU 11 -4.008 2.779 -14.979 74 HA LEU 11 HA LEU 11 -4.908 0.576 -13.398 75 HB2 LEU 11 HB2 LEU 11 -2.117 1.275 -14.328 76 HB3 LEU 11 HB1 LEU 11 -2.610 -0.268 -13.659 77 HG LEU 11 HG LEU 11 -3.621 0.906 -16.249 78 HD11 LEU 11 HD11 LEU 11 -1.291 0.252 -16.418 79 HD12 LEU 11 HD12 LEU 11 -2.313 -0.885 -17.298 80 HD13 LEU 11 HD13 LEU 11 -1.663 -1.325 -15.720 81 HD21 LEU 11 HD21 LEU 11 -5.276 -0.509 -15.153 82 HD22 LEU 11 HD22 LEU 11 -4.081 -1.797 -14.990 83 HD23 LEU 11 HD23 LEU 11 -4.626 -1.297 -16.593 84 H LEU 12 HN LEU 12 -2.681 3.266 -12.918 85 HA LEU 12 HA LEU 12 -1.950 2.607 -10.258 86 HB2 LEU 12 HB2 LEU 12 -1.911 5.258 -11.704 87 HB3 LEU 12 HB1 LEU 12 -1.161 4.960 -10.148 88 HG LEU 12 HG LEU 12 -0.393 3.616 -12.741 89 HD11 LEU 12 HD11 LEU 12 0.980 5.776 -11.152 90 HD12 LEU 12 HD12 LEU 12 0.220 5.962 -12.732 91 HD13 LEU 12 HD13 LEU 12 1.654 4.952 -12.556 92 HD21 LEU 12 HD21 LEU 12 1.517 2.760 -11.461 93 HD22 LEU 12 HD22 LEU 12 -0.017 2.173 -10.816 94 HD23 LEU 12 HD23 LEU 12 0.845 3.473 -9.993 95 H ASP 13 HN ASP 13 -4.721 4.101 -11.662 96 HA ASP 13 HA ASP 13 -5.708 5.392 -9.321 97 HB2 ASP 13 HB2 ASP 13 -6.513 5.785 -11.702 98 HB3 ASP 13 HB1 ASP 13 -7.358 4.245 -11.589 99 H GLN 14 HN GLN 14 -6.235 2.227 -10.819 100 HA GLN 14 HA GLN 14 -7.909 1.164 -8.814 101 HB2 GLN 14 HB2 GLN 14 -7.670 0.167 -11.057 102 HB3 GLN 14 HB1 GLN 14 -6.010 -0.272 -10.684 103 HG2 GLN 14 HG2 GLN 14 -7.495 -2.182 -10.502 104 HG3 GLN 14 HG1 GLN 14 -6.788 -1.778 -8.940 105 HE21 GLN 14 HE21 GLN 14 -8.081 -0.987 -7.319 106 HE22 GLN 14 HE22 GLN 14 -9.806 -1.078 -7.383 107 H VAL 15 HN VAL 15 -4.393 1.098 -9.273 108 HA VAL 15 HA VAL 15 -3.717 -0.381 -6.988 109 HB VAL 15 HB VAL 15 -2.179 1.841 -8.353 110 HG11 VAL 15 HG11 VAL 15 -1.236 -0.161 -6.301 111 HG12 VAL 15 HG12 VAL 15 -1.368 1.586 -6.080 112 HG13 VAL 15 HG13 VAL 15 -0.193 0.925 -7.220 113 HG21 VAL 15 HG21 VAL 15 -0.897 -0.013 -9.340 114 HG22 VAL 15 HG22 VAL 15 -2.598 -0.057 -9.798 115 HG23 VAL 15 HG23 VAL 15 -1.989 -1.162 -8.568 116 H ALA 16 HN ALA 16 -4.178 3.106 -7.431 117 HA ALA 16 HA ALA 16 -3.532 3.878 -4.804 118 HB1 ALA 16 HB1 ALA 16 -4.546 6.006 -5.343 119 HB2 ALA 16 HB2 ALA 16 -5.369 5.293 -6.732 120 HB3 ALA 16 HB3 ALA 16 -3.609 5.430 -6.721 121 H ARG 17 HN ARG 17 -6.372 2.439 -6.118 122 HA ARG 17 HA ARG 17 -8.108 3.187 -3.938 123 HB2 ARG 17 HB2 ARG 17 -9.036 2.728 -6.142 124 HB3 ARG 17 HB1 ARG 17 -8.361 1.109 -6.128 125 HG2 ARG 17 HG2 ARG 17 -9.863 0.459 -4.349 126 HG3 ARG 17 HG1 ARG 17 -10.495 2.107 -4.250 127 HD2 ARG 17 HD2 ARG 17 -11.325 1.956 -6.519 128 HD3 ARG 17 HD1 ARG 17 -10.614 0.358 -6.702 129 HE ARG 17 HE ARG 17 -12.251 -0.162 -4.729 130 HH11 ARG 17 HH11 ARG 17 -12.821 1.985 -7.446 131 HH12 ARG 17 HH12 ARG 17 -14.522 1.611 -7.547 132 HH21 ARG 17 HH21 ARG 17 -14.494 -0.665 -4.881 133 HH22 ARG 17 HH22 ARG 17 -15.459 0.120 -6.094 134 H VAL 18 HN VAL 18 -6.233 0.336 -4.883 135 HA VAL 18 HA VAL 18 -7.044 -1.279 -2.686 136 HB VAL 18 HB VAL 18 -4.514 -1.496 -4.331 137 HG11 VAL 18 HG11 VAL 18 -4.383 -2.764 -2.262 138 HG12 VAL 18 HG12 VAL 18 -4.532 -3.852 -3.642 139 HG13 VAL 18 HG13 VAL 18 -5.930 -3.533 -2.615 140 HG21 VAL 18 HG21 VAL 18 -5.734 -3.146 -5.664 141 HG22 VAL 18 HG22 VAL 18 -6.493 -1.557 -5.750 142 HG23 VAL 18 HG23 VAL 18 -7.196 -2.818 -4.735 143 H GLY 19 HN GLY 19 -4.185 0.722 -3.332 144 HA2 GLY 19 HA2 GLY 19 -2.897 0.242 -0.859 145 HA3 GLY 19 HA1 GLY 19 -2.587 1.596 -1.936 146 H LYS 20 HN LYS 20 -5.311 2.589 -1.865 147 HA LYS 20 HA LYS 20 -5.172 4.264 0.392 148 HB2 LYS 20 HB2 LYS 20 -6.354 4.824 -1.712 149 HB3 LYS 20 HB1 LYS 20 -7.580 3.631 -1.314 150 HG2 LYS 20 HG2 LYS 20 -8.193 4.892 0.660 151 HG3 LYS 20 HG1 LYS 20 -6.939 6.080 0.306 152 HD2 LYS 20 HD2 LYS 20 -8.044 6.648 -1.787 153 HD3 LYS 20 HD1 LYS 20 -9.281 5.425 -1.482 154 HE2 LYS 20 HE2 LYS 20 -10.019 6.625 0.490 155 HE3 LYS 20 HE1 LYS 20 -8.732 7.813 0.276 156 HZ1 LYS 20 HZ1 LYS 20 -10.918 7.318 -1.672 157 HZ2 LYS 20 HZ2 LYS 20 -9.729 8.526 -1.772 158 HZ3 LYS 20 HZ3 LYS 20 -10.898 8.582 -0.543 159 H ALA 21 HN ALA 21 -6.972 1.300 -0.247 160 HA ALA 21 HA ALA 21 -8.352 1.298 2.259 161 HB1 ALA 21 HB1 ALA 21 -8.954 -0.995 1.697 162 HB2 ALA 21 HB2 ALA 21 -7.786 -0.990 0.374 163 HB3 ALA 21 HB3 ALA 21 -9.194 0.072 0.314 164 H LEU 22 HN LEU 22 -5.351 -0.066 1.039 165 HA LEU 22 HA LEU 22 -4.804 -1.375 3.580 166 HB2 LEU 22 HB2 LEU 22 -4.305 -2.506 1.425 167 HB3 LEU 22 HB1 LEU 22 -3.132 -1.254 1.064 168 HG LEU 22 HG LEU 22 -1.823 -1.950 3.055 169 HD11 LEU 22 HD11 LEU 22 -3.626 -2.905 4.375 170 HD12 LEU 22 HD12 LEU 22 -2.328 -4.077 4.135 171 HD13 LEU 22 HD13 LEU 22 -3.815 -4.201 3.195 172 HD21 LEU 22 HD21 LEU 22 -1.237 -2.811 0.867 173 HD22 LEU 22 HD22 LEU 22 -2.393 -4.129 1.056 174 HD23 LEU 22 HD23 LEU 22 -0.978 -4.040 2.104 175 H ALA 23 HN ALA 23 -4.896 1.616 3.230 176 HA ALA 23 HA ALA 23 -2.181 2.469 3.656 177 HB1 ALA 23 HB1 ALA 23 -3.861 3.956 2.623 178 HB2 ALA 23 HB2 ALA 23 -3.066 4.669 4.028 179 HB3 ALA 23 HB3 ALA 23 -4.706 4.029 4.169 180 H ASN 24 HN ASN 24 -3.453 0.441 5.404 181 HA ASN 24 HA ASN 24 -2.981 -0.316 7.461 182 HB2 ASN 24 HB2 ASN 24 -1.317 2.163 7.844 183 HB3 ASN 24 HB1 ASN 24 -1.091 0.574 8.576 184 HD21 ASN 24 HD21 ASN 24 -0.440 -1.178 7.168 185 HD22 ASN 24 HD22 ASN 24 0.481 -0.835 5.750 186 H GLY 25 HN GLY 25 -2.385 1.198 9.816 187 HA2 GLY 25 HA2 GLY 25 -3.466 2.621 11.362 188 HA3 GLY 25 HA1 GLY 25 -4.879 2.644 10.314 189 H ARG 26 HN ARG 26 -6.179 2.148 12.131 190 HA ARG 26 HA ARG 26 -5.847 -0.179 13.702 191 HB2 ARG 26 HB2 ARG 26 -8.151 0.220 14.426 192 HB3 ARG 26 HB1 ARG 26 -7.231 1.717 14.407 193 HG2 ARG 26 HG2 ARG 26 -8.273 1.858 11.965 194 HG3 ARG 26 HG1 ARG 26 -9.515 0.872 12.738 195 HD2 ARG 26 HD2 ARG 26 -8.525 3.565 13.662 196 HD3 ARG 26 HD1 ARG 26 -10.074 3.229 12.892 197 HE ARG 26 HE ARG 26 -10.208 1.654 15.043 198 HH11 ARG 26 HH11 ARG 26 -9.161 4.984 14.726 199 HH12 ARG 26 HH12 ARG 26 -9.738 5.451 16.302 200 HH21 ARG 26 HH21 ARG 26 -10.949 2.257 17.118 201 HH22 ARG 26 HH22 ARG 26 -10.768 3.896 17.664 202 H ARG 27 HN ARG 27 -6.719 0.182 10.497 203 HA ARG 27 HA ARG 27 -8.568 -1.948 10.177 204 HB2 ARG 27 HB2 ARG 27 -6.728 -0.546 8.240 205 HB3 ARG 27 HB1 ARG 27 -7.891 -1.772 7.752 206 HG2 ARG 27 HG2 ARG 27 -9.720 -0.404 8.500 207 HG3 ARG 27 HG1 ARG 27 -8.604 0.789 9.164 208 HD2 ARG 27 HD2 ARG 27 -8.694 0.036 6.250 209 HD3 ARG 27 HD1 ARG 27 -9.616 1.372 6.937 210 HE ARG 27 HE ARG 27 -6.791 1.484 7.502 211 HH11 ARG 27 HH11 ARG 27 -9.301 2.304 5.220 212 HH12 ARG 27 HH12 ARG 27 -8.439 3.644 4.534 213 HH21 ARG 27 HH21 ARG 27 -5.628 3.238 6.608 214 HH22 ARG 27 HH22 ARG 27 -6.336 4.173 5.330 215 H LEU 28 HN LEU 28 -5.122 -1.816 10.495 216 HA LEU 28 HA LEU 28 -4.564 -4.222 9.077 217 HB2 LEU 28 HB2 LEU 28 -2.928 -2.728 11.122 218 HB3 LEU 28 HB1 LEU 28 -2.343 -4.086 10.179 219 HG LEU 28 HG LEU 28 -3.175 -1.383 9.124 220 HD11 LEU 28 HD11 LEU 28 -0.844 -1.214 8.455 221 HD12 LEU 28 HD12 LEU 28 -0.512 -2.788 9.185 222 HD13 LEU 28 HD13 LEU 28 -0.993 -1.427 10.201 223 HD21 LEU 28 HD21 LEU 28 -2.208 -3.802 7.597 224 HD22 LEU 28 HD22 LEU 28 -2.510 -2.200 6.924 225 HD23 LEU 28 HD23 LEU 28 -3.847 -3.153 7.569 226 H GLN 29 HN GLN 29 -5.490 -3.503 12.360 227 HA GLN 29 HA GLN 29 -4.771 -6.033 13.451 228 HB2 GLN 29 HB2 GLN 29 -6.883 -4.075 14.380 229 HB3 GLN 29 HB1 GLN 29 -6.280 -5.440 15.311 230 HG2 GLN 29 HG2 GLN 29 -4.016 -4.423 15.214 231 HG3 GLN 29 HG1 GLN 29 -4.733 -3.012 14.441 232 HE21 GLN 29 HE21 GLN 29 -4.150 -1.635 16.105 233 HE22 GLN 29 HE22 GLN 29 -4.917 -1.673 17.650 234 H ILE 30 HN ILE 30 -7.541 -4.767 11.767 235 HA ILE 30 HA ILE 30 -9.270 -6.974 12.139 236 HB ILE 30 HB ILE 30 -9.175 -5.024 9.829 237 HG12 ILE 30 HG12 ILE 30 -10.825 -4.940 12.366 238 HG13 ILE 30 HG11 ILE 30 -9.419 -3.931 12.043 239 HG21 ILE 30 HG21 ILE 30 -10.459 -7.027 9.314 240 HG22 ILE 30 HG22 ILE 30 -11.524 -5.636 9.504 241 HG23 ILE 30 HG23 ILE 30 -11.391 -6.825 10.797 242 HD11 ILE 30 HD11 ILE 30 -10.589 -2.902 10.167 243 HD12 ILE 30 HD12 ILE 30 -11.481 -2.714 11.676 244 HD13 ILE 30 HD13 ILE 30 -11.996 -3.914 10.490 245 H LEU 31 HN LEU 31 -7.036 -6.067 9.523 246 HA LEU 31 HA LEU 31 -7.372 -8.343 7.927 247 HB2 LEU 31 HB2 LEU 31 -4.914 -6.630 8.315 248 HB3 LEU 31 HB1 LEU 31 -5.137 -7.784 7.014 249 HG LEU 31 HG LEU 31 -6.857 -5.341 7.458 250 HD11 LEU 31 HD11 LEU 31 -5.718 -4.434 5.501 251 HD12 LEU 31 HD12 LEU 31 -4.672 -5.852 5.447 252 HD13 LEU 31 HD13 LEU 31 -4.581 -4.741 6.814 253 HD21 LEU 31 HD21 LEU 31 -7.733 -5.845 5.241 254 HD22 LEU 31 HD22 LEU 31 -8.025 -7.184 6.352 255 HD23 LEU 31 HD23 LEU 31 -6.727 -7.291 5.163 256 H ASP 32 HN ASP 32 -5.200 -7.691 10.617 257 HA ASP 32 HA ASP 32 -3.715 -10.055 10.608 258 HB2 ASP 32 HB2 ASP 32 -3.136 -8.101 11.959 259 HB3 ASP 32 HB1 ASP 32 -4.584 -8.321 12.929 260 H LEU 33 HN LEU 33 -6.931 -9.367 11.792 261 HA LEU 33 HA LEU 33 -7.224 -11.925 13.100 262 HB2 LEU 33 HB2 LEU 33 -8.371 -9.944 13.957 263 HB3 LEU 33 HB1 LEU 33 -9.246 -9.781 12.447 264 HG LEU 33 HG LEU 33 -10.325 -11.986 12.897 265 HD11 LEU 33 HD11 LEU 33 -8.652 -12.932 14.380 266 HD12 LEU 33 HD12 LEU 33 -10.227 -12.886 15.172 267 HD13 LEU 33 HD13 LEU 33 -8.996 -11.692 15.586 268 HD21 LEU 33 HD21 LEU 33 -11.475 -9.909 13.402 269 HD22 LEU 33 HD22 LEU 33 -10.705 -9.848 14.988 270 HD23 LEU 33 HD23 LEU 33 -11.853 -11.133 14.613 271 H LEU 34 HN LEU 34 -8.111 -10.473 10.019 272 HA LEU 34 HA LEU 34 -9.870 -12.594 9.244 273 HB2 LEU 34 HB2 LEU 34 -8.532 -10.490 7.543 274 HB3 LEU 34 HB1 LEU 34 -9.849 -11.528 7.036 275 HG LEU 34 HG LEU 34 -9.973 -9.379 9.149 276 HD11 LEU 34 HD11 LEU 34 -11.524 -8.302 7.611 277 HD12 LEU 34 HD12 LEU 34 -11.298 -9.611 6.451 278 HD13 LEU 34 HD13 LEU 34 -9.950 -8.547 6.853 279 HD21 LEU 34 HD21 LEU 34 -11.352 -11.269 9.796 280 HD22 LEU 34 HD22 LEU 34 -12.109 -11.284 8.205 281 HD23 LEU 34 HD23 LEU 34 -12.360 -9.915 9.288 282 H ALA 35 HN ALA 35 -6.459 -11.962 8.916 283 HA ALA 35 HA ALA 35 -5.923 -13.816 6.839 284 HB1 ALA 35 HB1 ALA 35 -4.078 -12.810 9.002 285 HB2 ALA 35 HB2 ALA 35 -4.364 -12.029 7.448 286 HB3 ALA 35 HB3 ALA 35 -3.587 -13.610 7.510 287 H GLN 36 HN GLN 36 -6.476 -14.165 10.234 288 HA GLN 36 HA GLN 36 -5.452 -16.903 10.191 289 HB2 GLN 36 HB2 GLN 36 -5.742 -16.858 12.630 290 HB3 GLN 36 HB1 GLN 36 -4.736 -15.529 12.072 291 HG2 GLN 36 HG2 GLN 36 -6.705 -14.039 12.217 292 HG3 GLN 36 HG1 GLN 36 -7.624 -15.380 12.901 293 HE21 GLN 36 HE21 GLN 36 -5.109 -13.057 13.428 294 HE22 GLN 36 HE22 GLN 36 -4.969 -13.286 15.139 295 H GLY 37 HN GLY 37 -8.109 -15.688 9.073 296 HA2 GLY 37 HA2 GLY 37 -9.633 -17.719 8.618 297 HA3 GLY 37 HA1 GLY 37 -9.913 -17.634 10.349 298 H GLU 38 HN GLU 38 -11.841 -17.382 8.206 299 HA GLU 38 HA GLU 38 -12.599 -14.644 7.956 300 HB2 GLU 38 HB2 GLU 38 -14.765 -15.603 7.126 301 HB3 GLU 38 HB1 GLU 38 -13.339 -16.169 6.269 302 HG2 GLU 38 HG2 GLU 38 -13.388 -18.221 7.671 303 HG3 GLU 38 HG1 GLU 38 -14.914 -17.658 8.352 304 H ARG 39 HN ARG 39 -13.909 -13.420 9.192 305 HA ARG 39 HA ARG 39 -15.078 -14.699 11.574 306 HB2 ARG 39 HB2 ARG 39 -13.735 -11.993 11.612 307 HB3 ARG 39 HB1 ARG 39 -14.312 -12.923 12.987 308 HG2 ARG 39 HG2 ARG 39 -12.013 -13.699 11.198 309 HG3 ARG 39 HG1 ARG 39 -11.870 -12.958 12.793 310 HD2 ARG 39 HD2 ARG 39 -12.826 -14.879 13.845 311 HD3 ARG 39 HD1 ARG 39 -13.263 -15.585 12.289 312 HE ARG 39 HE ARG 39 -10.629 -15.410 12.023 313 HH11 ARG 39 HH11 ARG 39 -12.556 -16.548 14.718 314 HH12 ARG 39 HH12 ARG 39 -11.347 -17.669 15.277 315 HH21 ARG 39 HH21 ARG 39 -9.041 -16.907 12.741 316 HH22 ARG 39 HH22 ARG 39 -9.342 -17.862 14.159 317 H ALA 40 HN ALA 40 -17.005 -13.812 12.309 318 HA ALA 40 HA ALA 40 -18.532 -12.291 10.421 319 HB1 ALA 40 HB1 ALA 40 -19.597 -14.006 11.800 320 HB2 ALA 40 HB2 ALA 40 -20.333 -12.427 12.077 321 HB3 ALA 40 HB3 ALA 40 -19.200 -13.092 13.255 322 H VAL 41 HN VAL 41 -19.598 -10.250 10.956 323 HA VAL 41 HA VAL 41 -17.863 -8.213 11.585 324 HB VAL 41 HB VAL 41 -20.864 -8.154 11.934 325 HG11 VAL 41 HG11 VAL 41 -20.645 -5.731 11.575 326 HG12 VAL 41 HG12 VAL 41 -18.889 -5.901 11.564 327 HG13 VAL 41 HG13 VAL 41 -19.802 -6.261 13.030 328 HG21 VAL 41 HG21 VAL 41 -20.275 -8.862 9.706 329 HG22 VAL 41 HG22 VAL 41 -19.133 -7.529 9.546 330 HG23 VAL 41 HG23 VAL 41 -20.863 -7.201 9.653 331 H GLU 42 HN GLU 42 -20.210 -9.780 13.763 332 HA GLU 42 HA GLU 42 -19.690 -8.115 15.986 333 HB2 GLU 42 HB2 GLU 42 -20.561 -10.994 16.186 334 HB3 GLU 42 HB1 GLU 42 -20.920 -9.676 17.290 335 HG2 GLU 42 HG2 GLU 42 -22.902 -9.748 16.231 336 HG3 GLU 42 HG1 GLU 42 -22.065 -8.701 15.086 337 H ALA 43 HN ALA 43 -18.210 -11.103 14.869 338 HA ALA 43 HA ALA 43 -16.633 -11.568 17.187 339 HB1 ALA 43 HB1 ALA 43 -17.144 -13.354 15.607 340 HB2 ALA 43 HB2 ALA 43 -15.401 -13.156 15.781 341 HB3 ALA 43 HB3 ALA 43 -16.222 -12.525 14.354 342 H ILE 44 HN ILE 44 -16.014 -10.008 14.067 343 HA ILE 44 HA ILE 44 -13.310 -9.365 14.478 344 HB ILE 44 HB ILE 44 -15.382 -7.857 12.871 345 HG12 ILE 44 HG12 ILE 44 -13.353 -9.912 11.975 346 HG13 ILE 44 HG11 ILE 44 -15.064 -10.243 12.229 347 HG21 ILE 44 HG21 ILE 44 -13.471 -6.939 11.632 348 HG22 ILE 44 HG22 ILE 44 -12.369 -7.738 12.755 349 HG23 ILE 44 HG23 ILE 44 -13.445 -6.463 13.330 350 HD11 ILE 44 HD11 ILE 44 -15.625 -8.639 10.473 351 HD12 ILE 44 HD12 ILE 44 -14.580 -9.929 9.879 352 HD13 ILE 44 HD13 ILE 44 -13.908 -8.332 10.214 353 H ALA 45 HN ALA 45 -16.263 -7.523 15.099 354 HA ALA 45 HA ALA 45 -15.150 -5.175 16.064 355 HB1 ALA 45 HB1 ALA 45 -17.523 -5.449 15.532 356 HB2 ALA 45 HB2 ALA 45 -17.296 -4.791 17.152 357 HB3 ALA 45 HB3 ALA 45 -17.719 -6.491 16.942 358 H THR 46 HN THR 46 -16.084 -8.090 17.853 359 HA THR 46 HA THR 46 -15.433 -7.133 20.410 360 HB THR 46 HB THR 46 -15.369 -10.016 19.496 361 HG1 THR 46 HG1 THR 46 -17.388 -9.302 18.956 362 HG21 THR 46 HG21 THR 46 -15.989 -10.489 21.827 363 HG22 THR 46 HG22 THR 46 -15.894 -8.768 22.198 364 HG23 THR 46 HG23 THR 46 -14.441 -9.650 21.729 365 H ALA 47 HN ALA 47 -13.541 -9.073 18.098 366 HA ALA 47 HA ALA 47 -11.371 -9.532 19.843 367 HB1 ALA 47 HB1 ALA 47 -11.412 -9.619 16.832 368 HB2 ALA 47 HB2 ALA 47 -11.841 -10.945 17.911 369 HB3 ALA 47 HB3 ALA 47 -10.187 -10.336 17.879 370 H THR 48 HN THR 48 -12.014 -6.954 17.519 371 HA THR 48 HA THR 48 -9.329 -5.897 17.808 372 HB THR 48 HB THR 48 -10.234 -4.008 16.371 373 HG1 THR 48 HG1 THR 48 -12.417 -5.788 15.940 374 HG21 THR 48 HG21 THR 48 -10.237 -5.380 14.318 375 HG22 THR 48 HG22 THR 48 -10.356 -6.835 15.310 376 HG23 THR 48 HG23 THR 48 -8.920 -5.810 15.412 377 H GLY 49 HN GLY 49 -12.274 -5.617 19.457 378 HA2 GLY 49 HA2 GLY 49 -12.750 -4.362 21.348 379 HA3 GLY 49 HA1 GLY 49 -11.216 -3.529 21.143 380 H MET 50 HN MET 50 -13.136 -3.610 18.350 381 HA MET 50 HA MET 50 -14.088 -0.863 18.865 382 HB2 MET 50 HB2 MET 50 -13.152 -2.050 16.242 383 HB3 MET 50 HB1 MET 50 -13.805 -0.432 16.451 384 HG2 MET 50 HG2 MET 50 -11.922 0.135 17.904 385 HG3 MET 50 HG1 MET 50 -11.262 -1.483 17.671 386 HE1 MET 50 HE1 MET 50 -10.445 -1.469 13.835 387 HE2 MET 50 HE2 MET 50 -11.938 -2.010 14.607 388 HE3 MET 50 HE3 MET 50 -10.377 -2.398 15.332 389 H ASN 51 HN ASN 51 -16.255 -0.649 18.740 390 HA ASN 51 HA ASN 51 -17.796 -2.995 18.371 391 HB2 ASN 51 HB2 ASN 51 -18.248 -0.858 19.844 392 HB3 ASN 51 HB1 ASN 51 -19.110 -0.312 18.408 393 HD21 ASN 51 HD21 ASN 51 -21.051 -0.391 19.626 394 HD22 ASN 51 HD22 ASN 51 -21.855 -1.900 19.913 395 H LEU 52 HN LEU 52 -19.889 -2.863 17.025 396 HA LEU 52 HA LEU 52 -19.072 -3.549 14.504 397 HB2 LEU 52 HB2 LEU 52 -21.788 -2.838 15.551 398 HB3 LEU 52 HB1 LEU 52 -21.551 -3.334 13.889 399 HG LEU 52 HG LEU 52 -20.493 -5.460 14.817 400 HD11 LEU 52 HD11 LEU 52 -20.092 -4.698 17.095 401 HD12 LEU 52 HD12 LEU 52 -21.162 -6.101 17.080 402 HD13 LEU 52 HD13 LEU 52 -21.826 -4.488 17.342 403 HD21 LEU 52 HD21 LEU 52 -23.405 -4.916 15.366 404 HD22 LEU 52 HD22 LEU 52 -22.668 -6.508 15.185 405 HD23 LEU 52 HD23 LEU 52 -22.711 -5.394 13.817 406 H THR 53 HN THR 53 -20.457 -0.415 15.450 407 HA THR 53 HA THR 53 -20.875 0.630 12.902 408 HB THR 53 HB THR 53 -20.020 2.131 15.389 409 HG1 THR 53 HG1 THR 53 -22.421 0.987 14.528 410 HG21 THR 53 HG21 THR 53 -21.419 3.094 12.888 411 HG22 THR 53 HG22 THR 53 -19.781 3.508 13.392 412 HG23 THR 53 HG23 THR 53 -21.161 4.051 14.346 413 H THR 54 HN THR 54 -17.988 1.082 14.967 414 HA THR 54 HA THR 54 -16.492 2.452 13.003 415 HB THR 54 HB THR 54 -15.389 0.846 15.317 416 HG1 THR 54 HG1 THR 54 -16.424 3.511 15.250 417 HG21 THR 54 HG21 THR 54 -13.587 2.505 15.267 418 HG22 THR 54 HG22 THR 54 -14.355 3.303 13.893 419 HG23 THR 54 HG23 THR 54 -13.719 1.667 13.718 420 H ALA 55 HN ALA 55 -16.725 -0.943 13.941 421 HA ALA 55 HA ALA 55 -14.595 -1.934 12.416 422 HB1 ALA 55 HB1 ALA 55 -15.653 -4.109 12.661 423 HB2 ALA 55 HB2 ALA 55 -17.157 -3.337 13.169 424 HB3 ALA 55 HB3 ALA 55 -15.715 -3.211 14.177 425 H SER 56 HN SER 56 -18.065 -1.726 11.617 426 HA SER 56 HA SER 56 -17.902 -2.936 9.104 427 HB2 SER 56 HB2 SER 56 -19.882 -0.848 10.038 428 HB3 SER 56 HB1 SER 56 -20.100 -1.948 8.678 429 HG SER 56 HG SER 56 -19.953 -2.560 11.439 430 H ALA 57 HN ALA 57 -17.596 0.481 10.016 431 HA ALA 57 HA ALA 57 -17.556 1.578 7.447 432 HB1 ALA 57 HB1 ALA 57 -16.435 3.493 8.448 433 HB2 ALA 57 HB2 ALA 57 -16.060 2.539 9.883 434 HB3 ALA 57 HB3 ALA 57 -17.737 2.920 9.491 435 H ASN 58 HN ASN 58 -14.921 0.301 9.437 436 HA ASN 58 HA ASN 58 -12.908 0.864 7.472 437 HB2 ASN 58 HB2 ASN 58 -12.905 -0.751 10.021 438 HB3 ASN 58 HB1 ASN 58 -11.492 -0.644 8.973 439 HD21 ASN 58 HD21 ASN 58 -13.589 1.084 11.152 440 HD22 ASN 58 HD22 ASN 58 -12.569 2.470 11.339 441 H LEU 59 HN LEU 59 -14.796 -1.968 8.396 442 HA LEU 59 HA LEU 59 -13.495 -3.881 6.809 443 HB2 LEU 59 HB2 LEU 59 -16.348 -3.654 7.747 444 HB3 LEU 59 HB1 LEU 59 -15.751 -5.046 6.864 445 HG LEU 59 HG LEU 59 -14.583 -4.116 9.484 446 HD11 LEU 59 HD11 LEU 59 -16.905 -4.768 9.825 447 HD12 LEU 59 HD12 LEU 59 -15.813 -5.974 10.505 448 HD13 LEU 59 HD13 LEU 59 -16.619 -6.282 8.966 449 HD21 LEU 59 HD21 LEU 59 -13.078 -5.435 8.105 450 HD22 LEU 59 HD22 LEU 59 -14.313 -6.680 7.921 451 HD23 LEU 59 HD23 LEU 59 -13.609 -6.365 9.506 452 H GLN 60 HN GLN 60 -16.257 -1.783 6.096 453 HA GLN 60 HA GLN 60 -16.740 -2.677 3.479 454 HB2 GLN 60 HB2 GLN 60 -18.309 -1.288 4.776 455 HB3 GLN 60 HB1 GLN 60 -17.190 0.063 4.694 456 HG2 GLN 60 HG2 GLN 60 -19.049 0.278 3.119 457 HG3 GLN 60 HG1 GLN 60 -17.489 0.215 2.306 458 HE21 GLN 60 HE21 GLN 60 -17.021 -1.476 0.952 459 HE22 GLN 60 HE22 GLN 60 -18.204 -2.652 0.475 460 H ALA 61 HN ALA 61 -14.632 -0.118 4.736 461 HA ALA 61 HA ALA 61 -13.747 0.919 2.294 462 HB1 ALA 61 HB1 ALA 61 -11.815 1.757 3.536 463 HB2 ALA 61 HB2 ALA 61 -12.221 0.698 4.887 464 HB3 ALA 61 HB3 ALA 61 -13.311 2.007 4.435 465 H LEU 62 HN LEU 62 -12.516 -1.792 4.219 466 HA LEU 62 HA LEU 62 -10.281 -2.346 2.573 467 HB2 LEU 62 HB2 LEU 62 -11.819 -4.144 4.443 468 HB3 LEU 62 HB1 LEU 62 -10.269 -4.539 3.728 469 HG LEU 62 HG LEU 62 -10.746 -2.213 5.594 470 HD11 LEU 62 HD11 LEU 62 -11.053 -4.357 6.730 471 HD12 LEU 62 HD12 LEU 62 -9.589 -3.535 7.270 472 HD13 LEU 62 HD13 LEU 62 -9.474 -4.888 6.146 473 HD21 LEU 62 HD21 LEU 62 -8.308 -2.112 5.698 474 HD22 LEU 62 HD22 LEU 62 -8.888 -1.864 4.052 475 HD23 LEU 62 HD23 LEU 62 -8.198 -3.419 4.520 476 H LYS 63 HN LYS 63 -13.639 -3.408 2.516 477 HA LYS 63 HA LYS 63 -13.177 -5.416 0.527 478 HB2 LYS 63 HB2 LYS 63 -15.138 -5.282 2.218 479 HB3 LYS 63 HB1 LYS 63 -15.865 -4.175 1.059 480 HG2 LYS 63 HG2 LYS 63 -15.813 -5.868 -0.656 481 HG3 LYS 63 HG1 LYS 63 -14.974 -6.977 0.426 482 HD2 LYS 63 HD2 LYS 63 -17.176 -7.699 0.537 483 HD3 LYS 63 HD1 LYS 63 -17.027 -6.668 1.958 484 HE2 LYS 63 HE2 LYS 63 -19.104 -6.211 0.821 485 HE3 LYS 63 HE1 LYS 63 -18.034 -4.815 0.690 486 HZ1 LYS 63 HZ1 LYS 63 -19.115 -5.284 -1.415 487 HZ2 LYS 63 HZ2 LYS 63 -18.499 -6.861 -1.419 488 HZ3 LYS 63 HZ3 LYS 63 -17.445 -5.537 -1.554 489 H SER 64 HN SER 64 -14.265 -2.055 0.524 490 HA SER 64 HA SER 64 -14.768 -1.883 -2.254 491 HB2 SER 64 HB2 SER 64 -13.932 0.297 -0.326 492 HB3 SER 64 HB1 SER 64 -14.631 0.550 -1.926 493 HG SER 64 HG SER 64 -16.554 0.092 -1.178 494 H GLY 65 HN GLY 65 -11.874 -1.638 -0.312 495 HA2 GLY 65 HA2 GLY 65 -10.135 -0.741 -2.373 496 HA3 GLY 65 HA1 GLY 65 -9.656 -1.582 -0.902 497 H GLY 66 HN GLY 66 -11.443 -3.836 -1.477 498 HA2 GLY 66 HA2 GLY 66 -11.731 -5.594 -2.989 499 HA3 GLY 66 HA1 GLY 66 -10.482 -4.898 -4.006 500 H LEU 67 HN LEU 67 -9.692 -5.249 -0.632 501 HA LEU 67 HA LEU 67 -7.983 -7.497 -1.455 502 HB2 LEU 67 HB2 LEU 67 -6.371 -6.910 0.108 503 HB3 LEU 67 HB1 LEU 67 -6.894 -5.390 -0.584 504 HG LEU 67 HG LEU 67 -8.144 -6.297 1.968 505 HD11 LEU 67 HD11 LEU 67 -5.456 -4.943 1.783 506 HD12 LEU 67 HD12 LEU 67 -5.692 -6.644 2.191 507 HD13 LEU 67 HD13 LEU 67 -6.326 -5.384 3.254 508 HD21 LEU 67 HD21 LEU 67 -8.192 -3.894 2.383 509 HD22 LEU 67 HD22 LEU 67 -8.940 -4.273 0.833 510 HD23 LEU 67 HD23 LEU 67 -7.308 -3.607 0.884 511 H VAL 68 HN VAL 68 -10.675 -6.766 0.450 512 HA VAL 68 HA VAL 68 -10.524 -9.491 1.542 513 HB VAL 68 HB VAL 68 -11.713 -8.861 3.545 514 HG11 VAL 68 HG11 VAL 68 -9.326 -7.077 3.108 515 HG12 VAL 68 HG12 VAL 68 -9.292 -8.760 3.631 516 HG13 VAL 68 HG13 VAL 68 -10.004 -7.528 4.672 517 HG21 VAL 68 HG21 VAL 68 -13.054 -7.037 2.679 518 HG22 VAL 68 HG22 VAL 68 -11.614 -6.034 2.504 519 HG23 VAL 68 HG23 VAL 68 -12.162 -6.518 4.109 520 H GLU 69 HN GLU 69 -12.683 -10.431 1.980 521 HA GLU 69 HA GLU 69 -14.797 -9.263 0.305 522 HB2 GLU 69 HB2 GLU 69 -13.264 -11.567 -0.356 523 HB3 GLU 69 HB1 GLU 69 -14.881 -12.115 0.069 524 HG2 GLU 69 HG2 GLU 69 -14.301 -9.944 -1.931 525 HG3 GLU 69 HG1 GLU 69 -14.564 -11.637 -2.345 526 H ALA 70 HN ALA 70 -16.926 -10.062 0.796 527 HA ALA 70 HA ALA 70 -17.129 -11.163 3.529 528 HB1 ALA 70 HB1 ALA 70 -17.611 -8.765 3.518 529 HB2 ALA 70 HB2 ALA 70 -19.044 -9.712 3.922 530 HB3 ALA 70 HB3 ALA 70 -18.867 -9.024 2.306 531 H ARG 71 HN ARG 71 -18.572 -12.745 3.861 532 HA ARG 71 HA ARG 71 -20.375 -13.463 1.636 533 HB2 ARG 71 HB2 ARG 71 -19.044 -15.292 3.645 534 HB3 ARG 71 HB1 ARG 71 -20.217 -15.806 2.441 535 HG2 ARG 71 HG2 ARG 71 -17.513 -14.610 1.863 536 HG3 ARG 71 HG1 ARG 71 -17.933 -16.320 1.757 537 HD2 ARG 71 HD2 ARG 71 -19.123 -14.085 0.115 538 HD3 ARG 71 HD1 ARG 71 -17.950 -15.275 -0.446 539 HE ARG 71 HE ARG 71 -20.233 -16.588 0.580 540 HH11 ARG 71 HH11 ARG 71 -19.160 -14.736 -2.207 541 HH12 ARG 71 HH12 ARG 71 -20.341 -15.439 -3.270 542 HH21 ARG 71 HH21 ARG 71 -21.752 -17.504 -0.812 543 HH22 ARG 71 HH22 ARG 71 -21.816 -17.020 -2.483 544 H ARG 72 HN ARG 72 -22.498 -14.046 2.147 545 HA ARG 72 HA ARG 72 -23.362 -13.142 4.794 546 HB2 ARG 72 HB2 ARG 72 -24.895 -13.625 2.240 547 HB3 ARG 72 HB1 ARG 72 -25.659 -13.218 3.770 548 HG2 ARG 72 HG2 ARG 72 -23.828 -11.518 2.105 549 HG3 ARG 72 HG1 ARG 72 -25.513 -11.220 2.537 550 HD2 ARG 72 HD2 ARG 72 -24.668 -11.250 4.969 551 HD3 ARG 72 HD1 ARG 72 -23.067 -11.040 4.263 552 HE ARG 72 HE ARG 72 -25.182 -9.084 4.440 553 HH11 ARG 72 HH11 ARG 72 -22.296 -9.988 2.664 554 HH12 ARG 72 HH12 ARG 72 -21.850 -8.345 2.321 555 HH21 ARG 72 HH21 ARG 72 -24.595 -6.937 3.978 556 HH22 ARG 72 HH22 ARG 72 -23.157 -6.607 3.058 557 H GLU 73 HN GLU 73 -23.698 -14.609 6.303 558 HA GLU 73 HA GLU 73 -24.901 -17.168 5.503 559 HB2 GLU 73 HB2 GLU 73 -22.617 -16.672 7.379 560 HB3 GLU 73 HB1 GLU 73 -23.672 -18.055 7.632 561 HG2 GLU 73 HG2 GLU 73 -22.221 -17.498 5.057 562 HG3 GLU 73 HG1 GLU 73 -21.607 -18.546 6.336 563 H GLY 74 HN GLY 74 -26.932 -16.984 6.098 564 HA2 GLY 74 HA2 GLY 74 -28.758 -16.832 7.497 565 HA3 GLY 74 HA1 GLY 74 -27.645 -16.733 8.856 566 H THR 75 HN THR 75 -27.298 -14.823 9.802 567 HA THR 75 HA THR 75 -28.489 -12.438 8.529 568 HB THR 75 HB THR 75 -28.017 -12.706 11.495 569 HG1 THR 75 HG1 THR 75 -30.463 -13.242 11.322 570 HG21 THR 75 HG21 THR 75 -28.549 -10.483 10.611 571 HG22 THR 75 HG22 THR 75 -29.864 -11.091 11.615 572 HG23 THR 75 HG23 THR 75 -30.009 -11.123 9.858 573 H ARG 76 HN ARG 76 -25.636 -13.929 9.295 574 HA ARG 76 HA ARG 76 -24.271 -11.506 10.195 575 HB2 ARG 76 HB2 ARG 76 -23.468 -14.405 10.203 576 HB3 ARG 76 HB1 ARG 76 -22.360 -13.105 10.619 577 HG2 ARG 76 HG2 ARG 76 -23.791 -12.441 12.456 578 HG3 ARG 76 HG1 ARG 76 -24.954 -13.696 12.023 579 HD2 ARG 76 HD2 ARG 76 -23.356 -15.418 12.514 580 HD3 ARG 76 HD1 ARG 76 -22.085 -14.223 12.775 581 HE ARG 76 HE ARG 76 -23.436 -13.444 14.703 582 HH11 ARG 76 HH11 ARG 76 -23.835 -16.707 13.481 583 HH12 ARG 76 HH12 ARG 76 -24.385 -17.344 15.000 584 HH21 ARG 76 HH21 ARG 76 -24.169 -14.293 16.703 585 HH22 ARG 76 HH22 ARG 76 -24.592 -15.976 16.823 586 H GLN 77 HN GLN 77 -22.396 -10.774 9.286 587 HA GLN 77 HA GLN 77 -21.882 -11.624 6.522 588 HB2 GLN 77 HB2 GLN 77 -22.643 -9.295 6.728 589 HB3 GLN 77 HB1 GLN 77 -21.360 -8.967 7.881 590 HG2 GLN 77 HG2 GLN 77 -19.691 -9.349 6.160 591 HG3 GLN 77 HG1 GLN 77 -20.961 -9.734 4.999 592 HE21 GLN 77 HE21 GLN 77 -21.312 -7.217 7.380 593 HE22 GLN 77 HE22 GLN 77 -21.249 -5.890 6.280 594 H TYR 78 HN TYR 78 -20.131 -12.851 6.378 595 HA TYR 78 HA TYR 78 -18.068 -12.646 8.444 596 HB2 TYR 78 HB2 TYR 78 -18.734 -14.781 6.420 597 HB3 TYR 78 HB1 TYR 78 -17.227 -14.794 7.329 598 HD1 TYR 78 HD2 TYR 78 -20.914 -14.976 7.653 599 HD2 TYR 78 HD1 TYR 78 -17.158 -15.529 9.577 600 HE1 TYR 78 HE2 TYR 78 -22.044 -16.097 9.530 601 HE2 TYR 78 HE1 TYR 78 -18.278 -16.650 11.456 602 HH TYR 78 HH TYR 78 -20.559 -16.655 12.499 603 H TYR 79 HN TYR 79 -16.251 -11.623 8.070 604 HA TYR 79 HA TYR 79 -15.504 -11.012 5.298 605 HB2 TYR 79 HB2 TYR 79 -14.836 -9.720 7.932 606 HB3 TYR 79 HB1 TYR 79 -13.849 -9.428 6.508 607 HD1 TYR 79 HD2 TYR 79 -14.797 -8.252 4.566 608 HD2 TYR 79 HD1 TYR 79 -17.001 -8.719 8.175 609 HE1 TYR 79 HE2 TYR 79 -16.325 -6.462 3.854 610 HE2 TYR 79 HE1 TYR 79 -18.535 -6.931 7.473 611 HH TYR 79 HH TYR 79 -18.849 -5.867 4.429 612 H ARG 80 HN ARG 80 -13.576 -11.585 4.462 613 HA ARG 80 HA ARG 80 -11.421 -12.522 6.137 614 HB2 ARG 80 HB2 ARG 80 -12.798 -14.579 5.743 615 HB3 ARG 80 HB1 ARG 80 -12.556 -14.366 4.014 616 HG2 ARG 80 HG2 ARG 80 -10.159 -14.658 4.293 617 HG3 ARG 80 HG1 ARG 80 -10.368 -14.805 6.038 618 HD2 ARG 80 HD2 ARG 80 -10.094 -16.991 5.017 619 HD3 ARG 80 HD1 ARG 80 -11.705 -16.823 5.712 620 HE ARG 80 HE ARG 80 -12.590 -16.614 3.494 621 HH11 ARG 80 HH11 ARG 80 -9.222 -17.582 3.656 622 HH12 ARG 80 HH12 ARG 80 -9.214 -18.278 2.064 623 HH21 ARG 80 HH21 ARG 80 -12.588 -17.531 1.416 624 HH22 ARG 80 HH22 ARG 80 -11.136 -18.248 0.777 625 H ILE 81 HN ILE 81 -9.431 -12.829 4.822 626 HA ILE 81 HA ILE 81 -8.976 -10.812 2.958 627 HB ILE 81 HB ILE 81 -7.489 -13.440 3.203 628 HG12 ILE 81 HG12 ILE 81 -7.613 -12.274 5.357 629 HG13 ILE 81 HG11 ILE 81 -5.975 -12.233 4.716 630 HG21 ILE 81 HG21 ILE 81 -6.615 -10.787 2.078 631 HG22 ILE 81 HG22 ILE 81 -6.954 -12.249 1.154 632 HG23 ILE 81 HG23 ILE 81 -5.592 -12.210 2.273 633 HD11 ILE 81 HD11 ILE 81 -6.349 -9.933 3.951 634 HD12 ILE 81 HD12 ILE 81 -6.559 -10.107 5.693 635 HD13 ILE 81 HD13 ILE 81 -7.971 -9.980 4.644 636 H ALA 82 HN ALA 82 -9.220 -10.671 0.770 637 HA ALA 82 HA ALA 82 -11.198 -12.242 -0.436 638 HB1 ALA 82 HB1 ALA 82 -9.181 -10.432 -1.757 639 HB2 ALA 82 HB2 ALA 82 -10.753 -9.951 -1.119 640 HB3 ALA 82 HB3 ALA 82 -10.659 -11.041 -2.502 641 H GLY 83 HN GLY 83 -7.691 -12.467 -0.594 642 HA2 GLY 83 HA2 GLY 83 -7.934 -15.131 -1.700 643 HA3 GLY 83 HA1 GLY 83 -7.142 -13.965 -2.748 644 H GLU 84 HN GLU 84 -6.019 -16.341 -1.619 645 HA GLU 84 HA GLU 84 -4.409 -15.962 0.605 646 HB2 GLU 84 HB2 GLU 84 -4.768 -18.093 -0.631 647 HB3 GLU 84 HB1 GLU 84 -3.708 -17.499 -1.899 648 HG2 GLU 84 HG2 GLU 84 -1.897 -17.325 -0.187 649 HG3 GLU 84 HG1 GLU 84 -2.978 -18.146 0.941 650 H ASP 85 HN ASP 85 -3.931 -14.917 -2.711 651 HA ASP 85 HA ASP 85 -1.235 -14.134 -2.473 652 HB2 ASP 85 HB2 ASP 85 -3.426 -13.288 -4.365 653 HB3 ASP 85 HB1 ASP 85 -1.777 -12.681 -4.489 654 H VAL 86 HN VAL 86 -4.208 -12.587 -1.550 655 HA VAL 86 HA VAL 86 -3.047 -9.987 -1.121 656 HB VAL 86 HB VAL 86 -5.604 -11.113 0.030 657 HG11 VAL 86 HG11 VAL 86 -4.779 -9.150 1.210 658 HG12 VAL 86 HG12 VAL 86 -6.238 -8.768 0.296 659 HG13 VAL 86 HG13 VAL 86 -4.659 -8.271 -0.314 660 HG21 VAL 86 HG21 VAL 86 -6.739 -9.963 -1.813 661 HG22 VAL 86 HG22 VAL 86 -5.642 -11.208 -2.408 662 HG23 VAL 86 HG23 VAL 86 -5.176 -9.509 -2.492 663 H ALA 87 HN ALA 87 -3.680 -12.874 0.778 664 HA ALA 87 HA ALA 87 -2.881 -11.835 3.286 665 HB1 ALA 87 HB1 ALA 87 -4.145 -13.921 3.084 666 HB2 ALA 87 HB2 ALA 87 -2.646 -14.164 3.978 667 HB3 ALA 87 HB3 ALA 87 -2.763 -14.686 2.297 668 H ARG 88 HN ARG 88 -1.149 -13.444 0.662 669 HA ARG 88 HA ARG 88 1.398 -13.354 1.909 670 HB2 ARG 88 HB2 ARG 88 0.386 -13.906 -0.830 671 HB3 ARG 88 HB1 ARG 88 2.078 -13.448 -0.677 672 HG2 ARG 88 HG2 ARG 88 2.451 -15.280 0.882 673 HG3 ARG 88 HG1 ARG 88 0.748 -15.728 0.779 674 HD2 ARG 88 HD2 ARG 88 2.334 -15.559 -1.736 675 HD3 ARG 88 HD1 ARG 88 2.587 -16.942 -0.673 676 HE ARG 88 HE ARG 88 0.273 -17.518 -0.968 677 HH11 ARG 88 HH11 ARG 88 1.508 -15.074 -3.152 678 HH12 ARG 88 HH12 ARG 88 0.242 -15.314 -4.330 679 HH21 ARG 88 HH21 ARG 88 -1.327 -17.899 -2.537 680 HH22 ARG 88 HH22 ARG 88 -1.371 -16.917 -3.978 681 H LEU 89 HN LEU 89 -0.428 -11.066 -0.015 682 HA LEU 89 HA LEU 89 1.653 -9.217 -0.483 683 HB2 LEU 89 HB2 LEU 89 -0.691 -9.296 -1.517 684 HB3 LEU 89 HB1 LEU 89 -1.249 -8.513 -0.054 685 HG LEU 89 HG LEU 89 0.885 -7.297 -1.803 686 HD11 LEU 89 HD11 LEU 89 -2.093 -6.847 -1.945 687 HD12 LEU 89 HD12 LEU 89 -1.114 -7.664 -3.163 688 HD13 LEU 89 HD13 LEU 89 -0.863 -5.949 -2.834 689 HD21 LEU 89 HD21 LEU 89 -1.026 -6.089 0.194 690 HD22 LEU 89 HD22 LEU 89 0.202 -5.223 -0.731 691 HD23 LEU 89 HD23 LEU 89 0.685 -6.414 0.477 692 H PHE 90 HN PHE 90 -0.792 -9.462 2.084 693 HA PHE 90 HA PHE 90 0.157 -7.333 3.665 694 HB2 PHE 90 HB2 PHE 90 -2.060 -8.321 4.002 695 HB3 PHE 90 HB1 PHE 90 -1.324 -9.842 4.489 696 HD1 PHE 90 HD2 PHE 90 -1.685 -6.278 5.458 697 HD2 PHE 90 HD1 PHE 90 -0.732 -10.233 6.718 698 HE1 PHE 90 HE2 PHE 90 -1.686 -5.531 7.800 699 HE2 PHE 90 HE1 PHE 90 -0.736 -9.489 9.062 700 HZ PHE 90 HZ PHE 90 -1.212 -7.135 9.605 701 H ALA 91 HN ALA 91 0.997 -10.755 3.537 702 HA ALA 91 HA ALA 91 2.747 -10.796 5.739 703 HB1 ALA 91 HB1 ALA 91 1.901 -12.828 4.666 704 HB2 ALA 91 HB2 ALA 91 3.662 -12.827 4.754 705 HB3 ALA 91 HB3 ALA 91 2.856 -12.464 3.228 706 H LEU 92 HN LEU 92 3.288 -10.131 2.306 707 HA LEU 92 HA LEU 92 6.068 -9.908 2.355 708 HB2 LEU 92 HB2 LEU 92 4.745 -10.037 0.298 709 HB3 LEU 92 HB1 LEU 92 4.084 -8.445 0.614 710 HG LEU 92 HG LEU 92 6.362 -7.487 0.392 711 HD11 LEU 92 HD11 LEU 92 8.128 -8.861 -0.606 712 HD12 LEU 92 HD12 LEU 92 7.102 -10.286 -0.442 713 HD13 LEU 92 HD13 LEU 92 7.668 -9.438 0.995 714 HD21 LEU 92 HD21 LEU 92 6.501 -7.733 -2.039 715 HD22 LEU 92 HD22 LEU 92 4.840 -7.491 -1.499 716 HD23 LEU 92 HD23 LEU 92 5.390 -9.102 -1.958 717 H VAL 93 HN VAL 93 3.608 -7.338 2.704 718 HA VAL 93 HA VAL 93 5.526 -5.285 3.098 719 HB VAL 93 HB VAL 93 3.159 -4.885 2.374 720 HG11 VAL 93 HG11 VAL 93 1.993 -6.326 3.922 721 HG12 VAL 93 HG12 VAL 93 1.426 -4.665 4.091 722 HG13 VAL 93 HG13 VAL 93 2.536 -5.344 5.283 723 HG21 VAL 93 HG21 VAL 93 4.107 -3.327 4.776 724 HG22 VAL 93 HG22 VAL 93 2.900 -2.784 3.610 725 HG23 VAL 93 HG23 VAL 93 4.566 -3.048 3.095 726 H GLN 94 HN GLN 94 3.950 -7.543 5.252 727 HA GLN 94 HA GLN 94 4.743 -6.285 7.679 728 HB2 GLN 94 HB2 GLN 94 2.913 -7.969 7.503 729 HB3 GLN 94 HB1 GLN 94 4.125 -9.205 7.193 730 HG2 GLN 94 HG2 GLN 94 5.075 -8.888 9.385 731 HG3 GLN 94 HG1 GLN 94 3.981 -7.541 9.696 732 HE21 GLN 94 HE21 GLN 94 2.997 -10.437 8.028 733 HE22 GLN 94 HE22 GLN 94 1.959 -11.041 9.273 734 H VAL 95 HN VAL 95 6.176 -8.713 5.558 735 HA VAL 95 HA VAL 95 8.451 -9.307 7.108 736 HB VAL 95 HB VAL 95 8.053 -9.346 4.108 737 HG11 VAL 95 HG11 VAL 95 10.376 -10.457 5.681 738 HG12 VAL 95 HG12 VAL 95 10.435 -9.050 4.619 739 HG13 VAL 95 HG13 VAL 95 10.104 -10.647 3.948 740 HG21 VAL 95 HG21 VAL 95 8.149 -11.549 6.169 741 HG22 VAL 95 HG22 VAL 95 7.962 -11.776 4.429 742 HG23 VAL 95 HG23 VAL 95 6.705 -10.950 5.351 743 H VAL 96 HN VAL 96 7.832 -6.800 4.683 744 HA VAL 96 HA VAL 96 10.316 -5.580 4.582 745 HB VAL 96 HB VAL 96 7.608 -4.225 4.517 746 HG11 VAL 96 HG11 VAL 96 10.286 -3.223 3.550 747 HG12 VAL 96 HG12 VAL 96 9.401 -2.619 4.949 748 HG13 VAL 96 HG13 VAL 96 8.737 -2.409 3.329 749 HG21 VAL 96 HG21 VAL 96 7.849 -5.953 2.813 750 HG22 VAL 96 HG22 VAL 96 9.365 -5.227 2.278 751 HG23 VAL 96 HG23 VAL 96 7.848 -4.347 2.083 752 H ALA 97 HN ALA 97 7.711 -5.134 6.947 753 HA ALA 97 HA ALA 97 9.150 -3.197 8.481 754 HB1 ALA 97 HB1 ALA 97 7.408 -3.489 10.140 755 HB2 ALA 97 HB2 ALA 97 6.846 -4.949 9.326 756 HB3 ALA 97 HB3 ALA 97 6.698 -3.383 8.529 757 H ASP 98 HN ASP 98 8.372 -6.622 9.055 758 HA ASP 98 HA ASP 98 9.586 -6.832 11.547 759 HB2 ASP 98 HB2 ASP 98 7.994 -8.480 10.724 760 HB3 ASP 98 HB1 ASP 98 9.133 -8.991 9.482 761 H GLU 99 HN GLU 99 10.986 -7.654 8.357 762 HA GLU 99 HA GLU 99 13.423 -8.490 9.668 763 HB2 GLU 99 HB2 GLU 99 12.613 -8.439 6.770 764 HB3 GLU 99 HB1 GLU 99 14.224 -8.909 7.303 765 HG2 GLU 99 HG2 GLU 99 12.986 -10.580 8.826 766 HG3 GLU 99 HG1 GLU 99 11.609 -10.281 7.766 767 H HIS 100 HN HIS 100 12.240 -5.529 8.519 768 HA HIS 100 HA HIS 100 14.923 -4.475 8.113 769 HB2 HIS 100 HB2 HIS 100 12.185 -3.313 7.816 770 HB3 HIS 100 HB1 HIS 100 13.556 -2.231 8.045 771 HD1 HIS 100 HD1 HIS 100 14.484 -1.434 5.915 772 HD2 HIS 100 HD2 HIS 100 12.920 -5.273 5.555 773 HE1 HIS 100 HE1 HIS 100 14.831 -2.087 3.509 774 HE2 HIS 100 HE2 HIS 100 14.082 -4.496 3.374 775 H LEU 101 HN LEU 101 12.778 -5.050 10.651 776 HA LEU 101 HA LEU 101 14.012 -3.224 12.485 777 HB2 LEU 101 HB2 LEU 101 12.083 -5.459 12.668 778 HB3 LEU 101 HB1 LEU 101 13.071 -5.189 14.090 779 HG LEU 101 HG LEU 101 12.255 -2.903 14.273 780 HD11 LEU 101 HD11 LEU 101 10.610 -3.529 11.829 781 HD12 LEU 101 HD12 LEU 101 11.955 -2.391 11.918 782 HD13 LEU 101 HD13 LEU 101 10.472 -2.076 12.820 783 HD21 LEU 101 HD21 LEU 101 10.032 -4.906 13.915 784 HD22 LEU 101 HD22 LEU 101 9.913 -3.384 14.799 785 HD23 LEU 101 HD23 LEU 101 10.989 -4.658 15.376 786 H GLU 102 HN GLU 102 14.792 -6.202 11.032 787 HA GLU 102 HA GLU 102 16.755 -7.315 10.894 788 HB2 GLU 102 HB2 GLU 102 17.679 -5.035 10.779 789 HB3 GLU 102 HB1 GLU 102 17.814 -5.007 12.527 790 HG2 GLU 102 HG2 GLU 102 19.424 -6.853 12.416 791 HG3 GLU 102 HG1 GLU 102 19.306 -6.825 10.655 792 H HIS 103 HN HIS 103 17.610 -5.999 14.041 793 HA HIS 103 HA HIS 103 17.070 -8.631 15.253 794 HB2 HIS 103 HB2 HIS 103 19.508 -6.890 15.708 795 HB3 HIS 103 HB1 HIS 103 19.126 -8.347 16.620 796 HD1 HIS 103 HD1 HIS 103 21.464 -7.475 14.319 797 HD2 HIS 103 HD2 HIS 103 18.575 -10.468 14.283 798 HE1 HIS 103 HE1 HIS 103 22.269 -9.178 12.650 799 HE2 HIS 103 HE2 HIS 103 20.424 -10.893 12.523 800 H HIS 104 HN HIS 104 17.465 -5.163 15.676 801 HA HIS 104 HA HIS 104 15.437 -5.276 17.794 802 HB2 HIS 104 HB2 HIS 104 17.992 -3.650 17.951 803 HB3 HIS 104 HB1 HIS 104 16.624 -3.466 19.041 804 HD1 HIS 104 HD1 HIS 104 16.271 -5.304 20.837 805 HD2 HIS 104 HD2 HIS 104 19.603 -5.894 18.406 806 HE1 HIS 104 HE1 HIS 104 17.633 -7.094 21.967 807 HE2 HIS 104 HE2 HIS 104 19.630 -7.464 20.469 808 H HIS 105 HN HIS 105 17.131 -2.341 17.000 809 HA HIS 105 HA HIS 105 16.836 -0.646 15.531 810 HB2 HIS 105 HB2 HIS 105 16.792 -2.556 13.904 811 HB3 HIS 105 HB1 HIS 105 15.039 -2.501 13.975 812 HD1 HIS 105 HD1 HIS 105 17.948 -1.004 12.334 813 HD2 HIS 105 HD2 HIS 105 13.916 -0.086 12.827 814 HE1 HIS 105 HE1 HIS 105 17.425 0.739 10.593 815 HE2 HIS 105 HE2 HIS 105 14.987 1.304 10.923 816 H HIS 106 HN HIS 106 14.025 -2.063 16.975 817 HA HIS 106 HA HIS 106 12.253 -0.088 15.849 818 HB2 HIS 106 HB2 HIS 106 10.476 -1.193 17.209 819 HB3 HIS 106 HB1 HIS 106 11.293 -2.245 16.070 820 HD1 HIS 106 HD1 HIS 106 12.559 -4.253 17.010 821 HD2 HIS 106 HD2 HIS 106 10.922 -1.799 19.941 822 HE1 HIS 106 HE1 HIS 106 12.714 -5.558 19.152 823 HE2 HIS 106 HE2 HIS 106 11.534 -4.132 20.866 824 H HIS 107 HN HIS 107 13.378 1.749 16.682 825 HA HIS 107 HA HIS 107 12.856 2.386 19.463 826 HB2 HIS 107 HB2 HIS 107 13.716 4.695 18.761 827 HB3 HIS 107 HB1 HIS 107 14.865 3.368 18.701 828 HD1 HIS 107 HD1 HIS 107 15.813 2.714 16.417 829 HD2 HIS 107 HD2 HIS 107 12.975 5.756 16.236 830 HE1 HIS 107 HE1 HIS 107 15.963 3.652 14.086 831 HE2 HIS 107 HE2 HIS 107 14.157 5.408 13.955 832 H HIS 108 HN HIS 108 10.641 2.211 19.595 833 HA HIS 108 HA HIS 108 9.049 3.936 17.830 834 HB2 HIS 108 HB2 HIS 108 8.521 1.483 17.939 835 HB3 HIS 108 HB1 HIS 108 8.095 1.699 19.633 836 HD1 HIS 108 HD1 HIS 108 5.654 1.859 19.948 837 HD2 HIS 108 HD2 HIS 108 6.852 3.455 16.296 838 HE1 HIS 108 HE1 HIS 108 3.538 2.581 18.794 839 HE2 HIS 108 HE2 HIS 108 4.272 3.373 16.515 840 H1 MET 1 HT1 MET 1 7.115 3.822 30.368 841 H2 MET 1 HT2 MET 1 6.124 2.515 30.792 842 H3 MET 1 HT3 MET 1 5.541 4.099 30.937 843 HA MET 1 HA MET 1 4.631 2.976 29.002 844 HB2 MET 1 HB2 MET 1 4.871 5.403 28.937 845 HB3 MET 1 HB1 MET 1 6.543 5.250 28.410 846 HG2 MET 1 HG2 MET 1 5.807 4.233 26.325 847 HG3 MET 1 HG1 MET 1 4.131 4.337 26.856 848 HE1 MET 1 HE1 MET 1 4.428 6.988 23.959 849 HE2 MET 1 HE2 MET 1 3.604 5.533 24.516 850 HE3 MET 1 HE3 MET 1 5.309 5.466 24.074 851 H ALA 2 HN ALA 2 4.916 1.470 27.504 852 HA ALA 2 HA ALA 2 7.337 1.157 26.023 853 HB1 ALA 2 HB1 ALA 2 8.074 0.148 28.128 854 HB2 ALA 2 HB2 ALA 2 7.956 -1.060 26.849 855 HB3 ALA 2 HB3 ALA 2 6.700 -0.958 28.082 856 H GLY 3 HN GLY 3 7.175 -0.627 24.478 857 HA2 GLY 3 HA2 GLY 3 4.489 -1.012 23.532 858 HA3 GLY 3 HA1 GLY 3 5.954 -1.682 22.824 859 H GLN 4 HN GLN 4 3.856 -2.026 25.657 860 HA GLN 4 HA GLN 4 4.538 -4.886 25.749 861 HB2 GLN 4 HB2 GLN 4 3.522 -4.744 28.069 862 HB3 GLN 4 HB1 GLN 4 5.025 -3.866 27.827 863 HG2 GLN 4 HG2 GLN 4 3.700 -1.795 27.503 864 HG3 GLN 4 HG1 GLN 4 2.250 -2.709 27.915 865 HE21 GLN 4 HE21 GLN 4 1.908 -3.343 30.038 866 HE22 GLN 4 HE22 GLN 4 2.846 -2.716 31.353 867 H SER 5 HN SER 5 1.956 -2.630 25.315 868 HA SER 5 HA SER 5 0.014 -4.839 25.120 869 HB2 SER 5 HB2 SER 5 -1.666 -2.907 25.264 870 HB3 SER 5 HB1 SER 5 -0.745 -3.249 26.730 871 HG SER 5 HG SER 5 0.182 -1.348 24.850 872 H ASP 6 HN ASP 6 2.069 -3.425 23.237 873 HA ASP 6 HA ASP 6 0.383 -3.233 20.888 874 HB2 ASP 6 HB2 ASP 6 1.387 -0.918 20.402 875 HB3 ASP 6 HB1 ASP 6 0.100 -1.002 21.600 876 H ARG 7 HN ARG 7 2.279 -5.114 21.400 877 HA ARG 7 HA ARG 7 4.884 -4.374 20.493 878 HB2 ARG 7 HB2 ARG 7 3.643 -7.124 20.703 879 HB3 ARG 7 HB1 ARG 7 5.352 -6.782 20.458 880 HG2 ARG 7 HG2 ARG 7 5.238 -5.500 22.655 881 HG3 ARG 7 HG1 ARG 7 3.677 -6.289 22.894 882 HD2 ARG 7 HD2 ARG 7 4.749 -8.477 22.689 883 HD3 ARG 7 HD1 ARG 7 6.311 -7.690 22.451 884 HE ARG 7 HE ARG 7 4.755 -7.766 24.947 885 HH11 ARG 7 HH11 ARG 7 7.720 -6.958 23.250 886 HH12 ARG 7 HH12 ARG 7 8.640 -6.744 24.706 887 HH21 ARG 7 HH21 ARG 7 5.969 -7.464 26.856 888 HH22 ARG 7 HH22 ARG 7 7.649 -7.029 26.748 889 H LYS 8 HN LYS 8 2.265 -6.310 19.003 890 HA LYS 8 HA LYS 8 3.547 -6.421 16.474 891 HB2 LYS 8 HB2 LYS 8 1.475 -7.291 15.601 892 HB3 LYS 8 HB1 LYS 8 1.788 -8.021 17.165 893 HG2 LYS 8 HG2 LYS 8 0.160 -6.529 18.197 894 HG3 LYS 8 HG1 LYS 8 -0.142 -5.771 16.631 895 HD2 LYS 8 HD2 LYS 8 -0.823 -8.004 15.757 896 HD3 LYS 8 HD1 LYS 8 -0.668 -8.641 17.394 897 HE2 LYS 8 HE2 LYS 8 -2.359 -7.047 18.168 898 HE3 LYS 8 HE1 LYS 8 -2.519 -6.427 16.525 899 HZ1 LYS 8 HZ1 LYS 8 -4.276 -7.963 16.940 900 HZ2 LYS 8 HZ2 LYS 8 -3.198 -9.151 17.473 901 HZ3 LYS 8 HZ3 LYS 8 -3.209 -8.696 15.843 902 H ALA 9 HN ALA 9 1.603 -4.061 18.049 903 HA ALA 9 HA ALA 9 0.715 -2.598 15.808 904 HB1 ALA 9 HB1 ALA 9 1.301 -1.614 18.595 905 HB2 ALA 9 HB2 ALA 9 -0.230 -2.288 18.037 906 HB3 ALA 9 HB3 ALA 9 0.357 -0.764 17.372 907 H ALA 10 HN ALA 10 3.756 -2.689 17.538 908 HA ALA 10 HA ALA 10 4.899 -0.370 16.367 909 HB1 ALA 10 HB1 ALA 10 5.829 -1.431 18.376 910 HB2 ALA 10 HB2 ALA 10 7.039 -1.273 17.102 911 HB3 ALA 10 HB3 ALA 10 6.285 -2.837 17.415 912 H LEU 11 HN LEU 11 4.674 -3.742 15.409 913 HA LEU 11 HA LEU 11 6.363 -3.521 13.118 914 HB2 LEU 11 HB2 LEU 11 4.272 -5.518 13.965 915 HB3 LEU 11 HB1 LEU 11 5.030 -5.613 12.390 916 HG LEU 11 HG LEU 11 6.111 -7.154 13.892 917 HD11 LEU 11 HD11 LEU 11 8.421 -6.401 13.711 918 HD12 LEU 11 HD12 LEU 11 7.866 -4.760 13.380 919 HD13 LEU 11 HD13 LEU 11 7.515 -6.057 12.237 920 HD21 LEU 11 HD21 LEU 11 5.557 -6.069 16.011 921 HD22 LEU 11 HD22 LEU 11 6.706 -4.780 15.652 922 HD23 LEU 11 HD23 LEU 11 7.281 -6.429 15.901 923 H LEU 12 HN LEU 12 2.888 -3.384 13.685 924 HA LEU 12 HA LEU 12 2.149 -2.895 10.997 925 HB2 LEU 12 HB2 LEU 12 0.698 -2.168 13.544 926 HB3 LEU 12 HB1 LEU 12 -0.004 -2.170 11.938 927 HG LEU 12 HG LEU 12 1.027 -4.603 13.404 928 HD11 LEU 12 HD11 LEU 12 -1.781 -3.698 12.782 929 HD12 LEU 12 HD12 LEU 12 -1.027 -3.751 14.379 930 HD13 LEU 12 HD13 LEU 12 -1.336 -5.248 13.498 931 HD21 LEU 12 HD21 LEU 12 -0.377 -4.366 10.743 932 HD22 LEU 12 HD22 LEU 12 0.038 -5.871 11.563 933 HD23 LEU 12 HD23 LEU 12 1.316 -4.800 10.988 934 H ASP 13 HN ASP 13 3.494 -0.911 13.448 935 HA ASP 13 HA ASP 13 2.622 1.619 12.485 936 HB2 ASP 13 HB2 ASP 13 3.542 1.176 14.786 937 HB3 ASP 13 HB1 ASP 13 5.133 1.000 14.056 938 H GLN 14 HN GLN 14 5.611 -0.265 12.063 939 HA GLN 14 HA GLN 14 6.827 1.502 10.224 940 HB2 GLN 14 HB2 GLN 14 8.026 -0.338 11.397 941 HB3 GLN 14 HB1 GLN 14 7.159 -1.502 10.406 942 HG2 GLN 14 HG2 GLN 14 9.377 -1.172 9.534 943 HG3 GLN 14 HG1 GLN 14 8.186 -0.547 8.397 944 HE21 GLN 14 HE21 GLN 14 9.111 1.133 11.323 945 HE22 GLN 14 HE22 GLN 14 9.941 2.429 10.544 946 H VAL 15 HN VAL 15 4.763 -1.352 9.776 947 HA VAL 15 HA VAL 15 4.618 -1.316 6.978 948 HB VAL 15 HB VAL 15 2.470 -2.152 8.944 949 HG11 VAL 15 HG11 VAL 15 1.568 -1.819 6.699 950 HG12 VAL 15 HG12 VAL 15 1.597 -3.531 7.125 951 HG13 VAL 15 HG13 VAL 15 2.817 -2.871 6.035 952 HG21 VAL 15 HG21 VAL 15 3.335 -4.421 8.599 953 HG22 VAL 15 HG22 VAL 15 4.549 -3.354 9.308 954 HG23 VAL 15 HG23 VAL 15 4.629 -3.768 7.594 955 H ALA 16 HN ALA 16 2.867 0.490 9.431 956 HA ALA 16 HA ALA 16 0.836 1.585 7.873 957 HB1 ALA 16 HB1 ALA 16 0.619 3.287 9.588 958 HB2 ALA 16 HB2 ALA 16 2.205 2.862 10.236 959 HB3 ALA 16 HB3 ALA 16 0.877 1.704 10.320 960 H ARG 17 HN ARG 17 4.116 2.723 8.442 961 HA ARG 17 HA ARG 17 3.791 5.197 7.082 962 HB2 ARG 17 HB2 ARG 17 5.597 4.592 8.748 963 HB3 ARG 17 HB1 ARG 17 6.360 3.650 7.478 964 HG2 ARG 17 HG2 ARG 17 6.687 5.628 6.144 965 HG3 ARG 17 HG1 ARG 17 5.814 6.604 7.329 966 HD2 ARG 17 HD2 ARG 17 8.458 5.207 7.666 967 HD3 ARG 17 HD1 ARG 17 8.135 6.941 7.724 968 HE ARG 17 HE ARG 17 7.446 4.968 9.800 969 HH11 ARG 17 HH11 ARG 17 7.627 8.315 8.765 970 HH12 ARG 17 HH12 ARG 17 7.490 8.946 10.384 971 HH21 ARG 17 HH21 ARG 17 7.269 5.789 11.904 972 HH22 ARG 17 HH22 ARG 17 7.320 7.506 12.175 973 H VAL 18 HN VAL 18 4.961 2.003 6.091 974 HA VAL 18 HA VAL 18 5.756 2.742 3.481 975 HB VAL 18 HB VAL 18 4.859 0.022 4.450 976 HG11 VAL 18 HG11 VAL 18 6.194 -0.851 2.597 977 HG12 VAL 18 HG12 VAL 18 6.551 0.797 2.075 978 HG13 VAL 18 HG13 VAL 18 4.894 0.191 2.017 979 HG21 VAL 18 HG21 VAL 18 6.683 0.901 5.810 980 HG22 VAL 18 HG22 VAL 18 7.621 1.232 4.352 981 HG23 VAL 18 HG23 VAL 18 7.240 -0.432 4.797 982 H GLY 19 HN GLY 19 2.761 1.193 4.661 983 HA2 GLY 19 HA2 GLY 19 1.539 0.992 2.116 984 HA3 GLY 19 HA1 GLY 19 0.711 0.899 3.664 985 H LYS 20 HN LYS 20 1.027 3.322 4.744 986 HA LYS 20 HA LYS 20 -0.783 5.018 3.586 987 HB2 LYS 20 HB2 LYS 20 0.001 5.206 5.887 988 HB3 LYS 20 HB1 LYS 20 1.581 5.730 5.326 989 HG2 LYS 20 HG2 LYS 20 0.645 7.763 4.461 990 HG3 LYS 20 HG1 LYS 20 -0.986 7.231 4.877 991 HD2 LYS 20 HD2 LYS 20 -0.262 7.131 7.263 992 HD3 LYS 20 HD1 LYS 20 1.278 7.841 6.773 993 HE2 LYS 20 HE2 LYS 20 -0.250 9.535 7.651 994 HE3 LYS 20 HE1 LYS 20 0.123 9.815 5.950 995 HZ1 LYS 20 HZ1 LYS 20 -1.982 9.060 5.297 996 HZ2 LYS 20 HZ2 LYS 20 -2.288 10.047 6.639 997 HZ3 LYS 20 HZ3 LYS 20 -2.313 8.358 6.802 998 H ALA 21 HN ALA 21 2.721 4.942 3.034 999 HA ALA 21 HA ALA 21 2.746 7.309 1.429 1000 HB1 ALA 21 HB1 ALA 21 4.734 6.543 2.623 1001 HB2 ALA 21 HB2 ALA 21 5.041 6.682 0.892 1002 HB3 ALA 21 HB3 ALA 21 4.783 5.097 1.618 1003 H LEU 22 HN LEU 22 2.366 3.885 0.782 1004 HA LEU 22 HA LEU 22 2.591 4.283 -2.103 1005 HB2 LEU 22 HB2 LEU 22 3.663 2.342 -0.973 1006 HB3 LEU 22 HB1 LEU 22 2.074 1.765 -0.515 1007 HG LEU 22 HG LEU 22 1.539 1.614 -2.981 1008 HD11 LEU 22 HD11 LEU 22 3.435 1.482 -4.519 1009 HD12 LEU 22 HD12 LEU 22 4.513 2.007 -3.225 1010 HD13 LEU 22 HD13 LEU 22 3.262 3.095 -3.826 1011 HD21 LEU 22 HD21 LEU 22 2.753 -0.495 -3.266 1012 HD22 LEU 22 HD22 LEU 22 2.048 -0.348 -1.655 1013 HD23 LEU 22 HD23 LEU 22 3.777 -0.082 -1.891 1014 H ALA 23 HN ALA 23 0.259 4.827 0.043 1015 HA ALA 23 HA ALA 23 -1.963 3.337 -0.692 1016 HB1 ALA 23 HB1 ALA 23 -1.878 4.749 1.303 1017 HB2 ALA 23 HB2 ALA 23 -3.313 5.077 0.331 1018 HB3 ALA 23 HB3 ALA 23 -1.940 6.188 0.286 1019 H ASN 24 HN ASN 24 -0.805 6.400 -2.056 1020 HA ASN 24 HA ASN 24 -1.983 6.030 -4.564 1021 HB2 ASN 24 HB2 ASN 24 -3.872 7.520 -4.548 1022 HB3 ASN 24 HB1 ASN 24 -4.111 6.343 -3.268 1023 HD21 ASN 24 HD21 ASN 24 -2.315 7.596 -1.390 1024 HD22 ASN 24 HD22 ASN 24 -3.084 9.046 -0.853 1025 H GLY 25 HN GLY 25 -1.965 8.091 -5.883 1026 HA2 GLY 25 HA2 GLY 25 -1.410 10.542 -5.539 1027 HA3 GLY 25 HA1 GLY 25 0.066 9.935 -4.812 1028 H ARG 26 HN ARG 26 0.315 11.690 -6.811 1029 HA ARG 26 HA ARG 26 0.562 10.373 -9.368 1030 HB2 ARG 26 HB2 ARG 26 1.364 12.481 -10.198 1031 HB3 ARG 26 HB1 ARG 26 0.015 12.807 -9.120 1032 HG2 ARG 26 HG2 ARG 26 1.572 13.422 -7.345 1033 HG3 ARG 26 HG1 ARG 26 2.930 13.082 -8.421 1034 HD2 ARG 26 HD2 ARG 26 2.821 15.185 -9.120 1035 HD3 ARG 26 HD1 ARG 26 1.265 14.805 -9.853 1036 HE ARG 26 HE ARG 26 1.374 15.664 -7.045 1037 HH11 ARG 26 HH11 ARG 26 0.329 16.168 -10.350 1038 HH12 ARG 26 HH12 ARG 26 -0.641 17.562 -9.969 1039 HH21 ARG 26 HH21 ARG 26 0.098 17.494 -6.528 1040 HH22 ARG 26 HH22 ARG 26 -0.781 18.309 -7.788 1041 H ARG 27 HN ARG 27 2.400 10.667 -6.565 1042 HA ARG 27 HA ARG 27 5.031 10.493 -7.494 1043 HB2 ARG 27 HB2 ARG 27 5.434 9.324 -5.275 1044 HB3 ARG 27 HB1 ARG 27 4.689 10.915 -5.191 1045 HG2 ARG 27 HG2 ARG 27 2.465 9.743 -5.037 1046 HG3 ARG 27 HG1 ARG 27 3.367 8.240 -4.838 1047 HD2 ARG 27 HD2 ARG 27 4.352 8.991 -2.820 1048 HD3 ARG 27 HD1 ARG 27 3.795 10.643 -3.084 1049 HE ARG 27 HE ARG 27 1.688 8.674 -2.870 1050 HH11 ARG 27 HH11 ARG 27 3.724 10.936 -1.144 1051 HH12 ARG 27 HH12 ARG 27 2.623 11.117 0.187 1052 HH21 ARG 27 HH21 ARG 27 0.233 8.922 -1.129 1053 HH22 ARG 27 HH22 ARG 27 0.644 9.963 0.195 1054 H LEU 28 HN LEU 28 2.474 8.222 -7.624 1055 HA LEU 28 HA LEU 28 3.994 5.839 -7.786 1056 HB2 LEU 28 HB2 LEU 28 1.259 6.521 -8.868 1057 HB3 LEU 28 HB1 LEU 28 1.941 4.904 -8.862 1058 HG LEU 28 HG LEU 28 1.293 6.567 -6.422 1059 HD11 LEU 28 HD11 LEU 28 -0.436 4.920 -6.009 1060 HD12 LEU 28 HD12 LEU 28 0.005 4.058 -7.485 1061 HD13 LEU 28 HD13 LEU 28 -0.679 5.681 -7.584 1062 HD21 LEU 28 HD21 LEU 28 1.852 4.543 -5.155 1063 HD22 LEU 28 HD22 LEU 28 3.245 5.176 -6.032 1064 HD23 LEU 28 HD23 LEU 28 2.386 3.763 -6.645 1065 H GLN 29 HN GLN 29 3.093 8.301 -10.121 1066 HA GLN 29 HA GLN 29 3.872 6.884 -12.458 1067 HB2 GLN 29 HB2 GLN 29 3.700 9.858 -11.917 1068 HB3 GLN 29 HB1 GLN 29 3.961 9.151 -13.506 1069 HG2 GLN 29 HG2 GLN 29 1.804 8.085 -13.434 1070 HG3 GLN 29 HG1 GLN 29 1.546 8.652 -11.784 1071 HE21 GLN 29 HE21 GLN 29 1.644 9.537 -15.137 1072 HE22 GLN 29 HE22 GLN 29 0.916 11.090 -14.958 1073 H ILE 30 HN ILE 30 5.555 8.725 -10.049 1074 HA ILE 30 HA ILE 30 8.006 9.021 -11.452 1075 HB ILE 30 HB ILE 30 7.483 8.980 -8.475 1076 HG12 ILE 30 HG12 ILE 30 7.776 11.290 -10.408 1077 HG13 ILE 30 HG11 ILE 30 6.264 10.749 -9.687 1078 HG21 ILE 30 HG21 ILE 30 9.819 8.522 -8.977 1079 HG22 ILE 30 HG22 ILE 30 9.637 10.130 -8.279 1080 HG23 ILE 30 HG23 ILE 30 9.889 9.948 -10.015 1081 HD11 ILE 30 HD11 ILE 30 7.131 12.728 -8.576 1082 HD12 ILE 30 HD12 ILE 30 8.623 11.870 -8.193 1083 HD13 ILE 30 HD13 ILE 30 7.098 11.348 -7.479 1084 H LEU 31 HN LEU 31 6.668 6.588 -9.272 1085 HA LEU 31 HA LEU 31 8.926 4.930 -9.077 1086 HB2 LEU 31 HB2 LEU 31 5.989 4.228 -9.005 1087 HB3 LEU 31 HB1 LEU 31 7.280 3.121 -8.579 1088 HG LEU 31 HG LEU 31 6.701 5.716 -7.148 1089 HD11 LEU 31 HD11 LEU 31 5.897 4.278 -5.331 1090 HD12 LEU 31 HD12 LEU 31 6.099 2.869 -6.368 1091 HD13 LEU 31 HD13 LEU 31 4.917 4.108 -6.787 1092 HD21 LEU 31 HD21 LEU 31 9.045 5.082 -7.031 1093 HD22 LEU 31 HD22 LEU 31 8.593 3.458 -6.515 1094 HD23 LEU 31 HD23 LEU 31 8.262 4.838 -5.470 1095 H ASP 32 HN ASP 32 6.320 5.086 -11.445 1096 HA ASP 32 HA ASP 32 6.989 2.944 -13.077 1097 HB2 ASP 32 HB2 ASP 32 5.590 5.527 -13.464 1098 HB3 ASP 32 HB1 ASP 32 6.203 4.758 -14.924 1099 H LEU 33 HN LEU 33 8.260 6.250 -13.090 1100 HA LEU 33 HA LEU 33 9.987 5.807 -15.318 1101 HB2 LEU 33 HB2 LEU 33 9.182 8.039 -14.710 1102 HB3 LEU 33 HB1 LEU 33 10.072 7.958 -13.202 1103 HG LEU 33 HG LEU 33 12.191 7.840 -14.493 1104 HD11 LEU 33 HD11 LEU 33 11.282 6.882 -16.549 1105 HD12 LEU 33 HD12 LEU 33 12.177 8.368 -16.868 1106 HD13 LEU 33 HD13 LEU 33 10.414 8.384 -16.869 1107 HD21 LEU 33 HD21 LEU 33 10.428 10.220 -15.066 1108 HD22 LEU 33 HD22 LEU 33 12.186 10.192 -15.202 1109 HD23 LEU 33 HD23 LEU 33 11.421 9.969 -13.629 1110 H LEU 34 HN LEU 34 10.439 5.752 -11.806 1111 HA LEU 34 HA LEU 34 13.257 5.450 -11.893 1112 HB2 LEU 34 HB2 LEU 34 11.298 4.709 -9.723 1113 HB3 LEU 34 HB1 LEU 34 13.041 4.733 -9.533 1114 HG LEU 34 HG LEU 34 11.268 7.115 -10.090 1115 HD11 LEU 34 HD11 LEU 34 11.156 6.320 -7.795 1116 HD12 LEU 34 HD12 LEU 34 12.011 7.859 -7.885 1117 HD13 LEU 34 HD13 LEU 34 12.915 6.358 -7.683 1118 HD21 LEU 34 HD21 LEU 34 14.263 6.988 -9.758 1119 HD22 LEU 34 HD22 LEU 34 13.295 8.456 -9.916 1120 HD23 LEU 34 HD23 LEU 34 13.404 7.320 -11.261 1121 H ALA 35 HN ALA 35 10.617 3.191 -12.140 1122 HA ALA 35 HA ALA 35 12.192 0.836 -11.761 1123 HB1 ALA 35 HB1 ALA 35 9.765 0.826 -11.461 1124 HB2 ALA 35 HB2 ALA 35 10.266 -0.358 -12.668 1125 HB3 ALA 35 HB3 ALA 35 9.549 1.172 -13.176 1126 H GLN 36 HN GLN 36 12.029 3.116 -14.200 1127 HA GLN 36 HA GLN 36 12.996 1.259 -16.257 1128 HB2 GLN 36 HB2 GLN 36 12.038 4.122 -16.435 1129 HB3 GLN 36 HB1 GLN 36 12.717 3.229 -17.789 1130 HG2 GLN 36 HG2 GLN 36 10.913 1.673 -17.763 1131 HG3 GLN 36 HG1 GLN 36 10.288 2.345 -16.257 1132 HE21 GLN 36 HE21 GLN 36 9.153 4.260 -16.292 1133 HE22 GLN 36 HE22 GLN 36 8.565 4.970 -17.759 1134 H GLY 37 HN GLY 37 14.318 2.696 -13.792 1135 HA2 GLY 37 HA2 GLY 37 16.839 2.504 -13.978 1136 HA3 GLY 37 HA1 GLY 37 16.672 3.682 -15.273 1137 H GLU 38 HN GLU 38 18.153 3.866 -12.762 1138 HA GLU 38 HA GLU 38 16.771 5.673 -11.044 1139 HB2 GLU 38 HB2 GLU 38 19.001 6.064 -10.040 1140 HB3 GLU 38 HB1 GLU 38 18.606 4.358 -10.169 1141 HG2 GLU 38 HG2 GLU 38 19.955 4.401 -12.344 1142 HG3 GLU 38 HG1 GLU 38 20.569 5.953 -11.771 1143 H ARG 39 HN ARG 39 16.883 7.912 -10.953 1144 HA ARG 39 HA ARG 39 18.234 9.307 -13.116 1145 HB2 ARG 39 HB2 ARG 39 15.851 8.266 -13.739 1146 HB3 ARG 39 HB1 ARG 39 15.300 9.757 -12.988 1147 HG2 ARG 39 HG2 ARG 39 16.289 11.087 -14.599 1148 HG3 ARG 39 HG1 ARG 39 17.395 9.810 -15.114 1149 HD2 ARG 39 HD2 ARG 39 14.408 9.858 -15.535 1150 HD3 ARG 39 HD1 ARG 39 15.635 10.161 -16.765 1151 HE ARG 39 HE ARG 39 14.932 7.583 -15.583 1152 HH11 ARG 39 HH11 ARG 39 17.012 9.411 -17.713 1153 HH12 ARG 39 HH12 ARG 39 17.548 8.022 -18.606 1154 HH21 ARG 39 HH21 ARG 39 15.635 5.732 -16.759 1155 HH22 ARG 39 HH22 ARG 39 16.763 5.931 -18.068 1156 H ALA 40 HN ALA 40 18.211 11.604 -12.877 1157 HA ALA 40 HA ALA 40 18.045 12.401 -10.109 1158 HB1 ALA 40 HB1 ALA 40 18.813 14.005 -12.543 1159 HB2 ALA 40 HB2 ALA 40 19.922 13.128 -11.489 1160 HB3 ALA 40 HB3 ALA 40 19.017 14.507 -10.864 1161 H VAL 41 HN VAL 41 16.989 14.398 -9.456 1162 HA VAL 41 HA VAL 41 14.261 14.282 -9.724 1163 HB VAL 41 HB VAL 41 15.796 16.802 -9.086 1164 HG11 VAL 41 HG11 VAL 41 13.420 17.175 -9.391 1165 HG12 VAL 41 HG12 VAL 41 13.843 17.323 -7.685 1166 HG13 VAL 41 HG13 VAL 41 13.047 15.862 -8.272 1167 HG21 VAL 41 HG21 VAL 41 15.025 14.523 -7.271 1168 HG22 VAL 41 HG22 VAL 41 15.707 16.061 -6.744 1169 HG23 VAL 41 HG23 VAL 41 16.661 14.972 -7.752 1170 H GLU 42 HN GLU 42 16.482 16.430 -11.481 1171 HA GLU 42 HA GLU 42 14.611 17.996 -12.812 1172 HB2 GLU 42 HB2 GLU 42 17.226 17.067 -14.004 1173 HB3 GLU 42 HB1 GLU 42 16.322 18.509 -14.435 1174 HG2 GLU 42 HG2 GLU 42 18.016 19.349 -13.128 1175 HG3 GLU 42 HG1 GLU 42 16.688 19.194 -11.977 1176 H ALA 43 HN ALA 43 16.113 14.974 -13.921 1177 HA ALA 43 HA ALA 43 14.723 14.914 -16.388 1178 HB1 ALA 43 HB1 ALA 43 16.835 13.724 -16.004 1179 HB2 ALA 43 HB2 ALA 43 15.569 12.653 -16.608 1180 HB3 ALA 43 HB3 ALA 43 16.004 12.630 -14.898 1181 H ILE 44 HN ILE 44 14.092 13.536 -13.207 1182 HA ILE 44 HA ILE 44 11.879 11.939 -13.878 1183 HB ILE 44 HB ILE 44 12.454 13.401 -11.294 1184 HG12 ILE 44 HG12 ILE 44 12.956 10.522 -12.081 1185 HG13 ILE 44 HG11 ILE 44 14.190 11.778 -12.017 1186 HG21 ILE 44 HG21 ILE 44 10.102 12.808 -11.438 1187 HG22 ILE 44 HG22 ILE 44 10.924 11.800 -10.248 1188 HG23 ILE 44 HG23 ILE 44 10.527 11.145 -11.837 1189 HD11 ILE 44 HD11 ILE 44 13.825 12.019 -9.622 1190 HD12 ILE 44 HD12 ILE 44 14.254 10.364 -10.047 1191 HD13 ILE 44 HD13 ILE 44 12.578 10.774 -9.683 1192 H ALA 45 HN ALA 45 12.068 15.310 -12.785 1193 HA ALA 45 HA ALA 45 9.309 15.868 -12.889 1194 HB1 ALA 45 HB1 ALA 45 10.863 17.291 -11.679 1195 HB2 ALA 45 HB2 ALA 45 9.991 18.231 -12.889 1196 HB3 ALA 45 HB3 ALA 45 11.658 17.739 -13.187 1197 H THR 46 HN THR 46 11.879 16.207 -15.290 1198 HA THR 46 HA THR 46 10.374 17.543 -17.252 1199 HB THR 46 HB THR 46 12.702 15.663 -17.703 1200 HG1 THR 46 HG1 THR 46 13.094 17.439 -16.193 1201 HG21 THR 46 HG21 THR 46 11.514 16.224 -19.762 1202 HG22 THR 46 HG22 THR 46 13.087 17.023 -19.717 1203 HG23 THR 46 HG23 THR 46 11.622 17.941 -19.369 1204 H ALA 47 HN ALA 47 10.989 14.081 -16.737 1205 HA ALA 47 HA ALA 47 9.729 13.163 -19.073 1206 HB1 ALA 47 HB1 ALA 47 11.283 11.816 -17.741 1207 HB2 ALA 47 HB2 ALA 47 9.759 10.977 -18.031 1208 HB3 ALA 47 HB3 ALA 47 10.076 11.711 -16.459 1209 H THR 48 HN THR 48 8.467 13.739 -15.818 1210 HA THR 48 HA THR 48 5.862 12.700 -16.549 1211 HB THR 48 HB THR 48 5.274 13.555 -14.194 1212 HG1 THR 48 HG1 THR 48 8.090 13.527 -13.832 1213 HG21 THR 48 HG21 THR 48 6.369 11.603 -13.134 1214 HG22 THR 48 HG22 THR 48 7.352 11.397 -14.586 1215 HG23 THR 48 HG23 THR 48 5.599 11.199 -14.671 1216 H GLY 49 HN GLY 49 7.459 15.619 -16.897 1217 HA2 GLY 49 HA2 GLY 49 6.709 17.631 -17.733 1218 HA3 GLY 49 HA1 GLY 49 5.093 16.943 -17.806 1219 H MET 50 HN MET 50 6.898 16.929 -14.843 1220 HA MET 50 HA MET 50 4.979 18.871 -13.742 1221 HB2 MET 50 HB2 MET 50 6.562 16.714 -12.325 1222 HB3 MET 50 HB1 MET 50 5.469 17.846 -11.543 1223 HG2 MET 50 HG2 MET 50 3.622 16.921 -12.928 1224 HG3 MET 50 HG1 MET 50 4.749 15.704 -13.526 1225 HE1 MET 50 HE1 MET 50 5.647 13.798 -10.190 1226 HE2 MET 50 HE2 MET 50 6.498 15.174 -10.892 1227 HE3 MET 50 HE3 MET 50 5.920 13.871 -11.930 1228 H ASN 51 HN ASN 51 5.904 20.053 -11.764 1229 HA ASN 51 HA ASN 51 8.288 21.428 -12.604 1230 HB2 ASN 51 HB2 ASN 51 6.321 22.559 -11.505 1231 HB3 ASN 51 HB1 ASN 51 6.763 21.751 -10.004 1232 HD21 ASN 51 HD21 ASN 51 7.467 24.306 -12.186 1233 HD22 ASN 51 HD22 ASN 51 8.729 25.049 -11.262 1234 H LEU 52 HN LEU 52 10.245 21.562 -11.464 1235 HA LEU 52 HA LEU 52 11.408 19.293 -10.462 1236 HB2 LEU 52 HB2 LEU 52 11.991 22.186 -10.251 1237 HB3 LEU 52 HB1 LEU 52 12.805 21.150 -9.099 1238 HG LEU 52 HG LEU 52 14.195 21.606 -11.061 1239 HD11 LEU 52 HD11 LEU 52 14.850 19.328 -11.528 1240 HD12 LEU 52 HD12 LEU 52 13.304 18.733 -10.924 1241 HD13 LEU 52 HD13 LEU 52 14.444 19.505 -9.822 1242 HD21 LEU 52 HD21 LEU 52 12.071 20.130 -12.616 1243 HD22 LEU 52 HD22 LEU 52 13.627 20.677 -13.240 1244 HD23 LEU 52 HD23 LEU 52 12.419 21.856 -12.729 1245 H THR 53 HN THR 53 9.812 21.852 -8.590 1246 HA THR 53 HA THR 53 10.426 20.745 -6.055 1247 HB THR 53 HB THR 53 8.624 22.276 -5.213 1248 HG1 THR 53 HG1 THR 53 8.491 23.267 -7.874 1249 HG21 THR 53 HG21 THR 53 9.831 24.331 -5.771 1250 HG22 THR 53 HG22 THR 53 10.651 23.497 -7.091 1251 HG23 THR 53 HG23 THR 53 10.950 23.014 -5.421 1252 H THR 54 HN THR 54 7.653 20.446 -8.216 1253 HA THR 54 HA THR 54 5.935 19.031 -6.513 1254 HB THR 54 HB THR 54 6.135 18.548 -9.486 1255 HG1 THR 54 HG1 THR 54 5.240 20.826 -8.062 1256 HG21 THR 54 HG21 THR 54 3.783 18.615 -7.591 1257 HG22 THR 54 HG22 THR 54 4.548 17.156 -8.223 1258 HG23 THR 54 HG23 THR 54 3.715 18.261 -9.318 1259 H ALA 55 HN ALA 55 8.323 17.878 -8.875 1260 HA ALA 55 HA ALA 55 8.000 15.129 -8.392 1261 HB1 ALA 55 HB1 ALA 55 10.446 16.616 -9.347 1262 HB2 ALA 55 HB2 ALA 55 9.148 15.981 -10.363 1263 HB3 ALA 55 HB3 ALA 55 10.190 14.874 -9.466 1264 H SER 56 HN SER 56 10.322 17.466 -7.056 1265 HA SER 56 HA SER 56 11.784 15.719 -5.458 1266 HB2 SER 56 HB2 SER 56 12.524 17.994 -5.931 1267 HB3 SER 56 HB1 SER 56 11.165 18.652 -5.024 1268 HG SER 56 HG SER 56 12.130 18.197 -3.186 1269 H ALA 57 HN ALA 57 8.881 17.616 -4.632 1270 HA ALA 57 HA ALA 57 8.727 16.977 -1.928 1271 HB1 ALA 57 HB1 ALA 57 6.383 17.588 -2.061 1272 HB2 ALA 57 HB2 ALA 57 6.422 17.433 -3.818 1273 HB3 ALA 57 HB3 ALA 57 7.360 18.698 -3.025 1274 H ASN 58 HN ASN 58 7.378 15.256 -4.720 1275 HA ASN 58 HA ASN 58 6.154 13.218 -3.134 1276 HB2 ASN 58 HB2 ASN 58 6.732 13.480 -6.077 1277 HB3 ASN 58 HB1 ASN 58 6.052 12.004 -5.402 1278 HD21 ASN 58 HD21 ASN 58 5.490 15.363 -6.117 1279 HD22 ASN 58 HD22 ASN 58 3.775 15.338 -5.844 1280 H LEU 59 HN LEU 59 9.249 13.560 -4.764 1281 HA LEU 59 HA LEU 59 10.157 10.912 -4.467 1282 HB2 LEU 59 HB2 LEU 59 11.627 13.537 -4.652 1283 HB3 LEU 59 HB1 LEU 59 12.454 11.992 -4.576 1284 HG LEU 59 HG LEU 59 10.464 12.714 -6.725 1285 HD11 LEU 59 HD11 LEU 59 12.393 13.056 -8.176 1286 HD12 LEU 59 HD12 LEU 59 13.477 12.795 -6.811 1287 HD13 LEU 59 HD13 LEU 59 12.408 14.196 -6.832 1288 HD21 LEU 59 HD21 LEU 59 10.740 10.324 -6.319 1289 HD22 LEU 59 HD22 LEU 59 12.487 10.490 -6.492 1290 HD23 LEU 59 HD23 LEU 59 11.432 10.790 -7.872 1291 H GLN 60 HN GLN 60 10.527 13.759 -2.383 1292 HA GLN 60 HA GLN 60 12.056 12.527 -0.372 1293 HB2 GLN 60 HB2 GLN 60 10.087 14.808 -0.116 1294 HB3 GLN 60 HB1 GLN 60 11.311 14.382 1.069 1295 HG2 GLN 60 HG2 GLN 60 13.069 14.927 -0.500 1296 HG3 GLN 60 HG1 GLN 60 11.874 15.265 -1.752 1297 HE21 GLN 60 HE21 GLN 60 13.906 17.020 -0.662 1298 HE22 GLN 60 HE22 GLN 60 13.067 18.387 -0.004 1299 H ALA 61 HN ALA 61 8.579 12.765 -0.874 1300 HA ALA 61 HA ALA 61 7.765 11.633 1.574 1301 HB1 ALA 61 HB1 ALA 61 5.623 11.238 0.469 1302 HB2 ALA 61 HB2 ALA 61 6.363 11.567 -1.096 1303 HB3 ALA 61 HB3 ALA 61 6.237 12.850 0.107 1304 H LEU 62 HN LEU 62 8.404 10.182 -1.600 1305 HA LEU 62 HA LEU 62 7.759 7.537 -0.895 1306 HB2 LEU 62 HB2 LEU 62 9.658 8.603 -2.985 1307 HB3 LEU 62 HB1 LEU 62 9.193 6.918 -2.852 1308 HG LEU 62 HG LEU 62 7.283 9.193 -3.399 1309 HD11 LEU 62 HD11 LEU 62 8.434 7.126 -5.270 1310 HD12 LEU 62 HD12 LEU 62 8.817 8.848 -5.261 1311 HD13 LEU 62 HD13 LEU 62 7.187 8.308 -5.672 1312 HD21 LEU 62 HD21 LEU 62 6.212 7.343 -2.261 1313 HD22 LEU 62 HD22 LEU 62 6.903 6.202 -3.416 1314 HD23 LEU 62 HD23 LEU 62 5.710 7.387 -3.951 1315 H LYS 63 HN LYS 63 10.777 9.366 -0.696 1316 HA LYS 63 HA LYS 63 12.363 7.154 0.124 1317 HB2 LYS 63 HB2 LYS 63 13.238 9.321 -0.846 1318 HB3 LYS 63 HB1 LYS 63 12.909 10.067 0.713 1319 HG2 LYS 63 HG2 LYS 63 14.434 8.489 1.789 1320 HG3 LYS 63 HG1 LYS 63 14.773 7.756 0.222 1321 HD2 LYS 63 HD2 LYS 63 15.602 9.983 -0.551 1322 HD3 LYS 63 HD1 LYS 63 15.410 10.571 1.102 1323 HE2 LYS 63 HE2 LYS 63 17.169 8.281 0.224 1324 HE3 LYS 63 HE1 LYS 63 17.719 9.899 0.654 1325 HZ1 LYS 63 HZ1 LYS 63 17.974 8.241 2.450 1326 HZ2 LYS 63 HZ2 LYS 63 16.286 8.077 2.517 1327 HZ3 LYS 63 HZ3 LYS 63 17.014 9.564 2.894 1328 H SER 64 HN SER 64 10.385 9.498 1.805 1329 HA SER 64 HA SER 64 11.323 8.932 4.422 1330 HB2 SER 64 HB2 SER 64 10.110 11.005 3.854 1331 HB3 SER 64 HB1 SER 64 8.649 10.064 3.557 1332 HG SER 64 HG SER 64 9.428 9.350 5.932 1333 H GLY 65 HN GLY 65 8.957 7.438 2.332 1334 HA2 GLY 65 HA2 GLY 65 7.909 5.780 4.479 1335 HA3 GLY 65 HA1 GLY 65 7.420 5.737 2.791 1336 H GLY 66 HN GLY 66 10.600 5.693 2.479 1337 HA2 GLY 66 HA2 GLY 66 12.264 4.055 2.493 1338 HA3 GLY 66 HA1 GLY 66 11.124 2.935 3.218 1339 H LEU 67 HN LEU 67 10.155 4.683 0.394 1340 HA LEU 67 HA LEU 67 9.953 2.177 -1.049 1341 HB2 LEU 67 HB2 LEU 67 9.055 4.977 -1.724 1342 HB3 LEU 67 HB1 LEU 67 8.877 3.628 -2.825 1343 HG LEU 67 HG LEU 67 6.774 3.921 -1.810 1344 HD11 LEU 67 HD11 LEU 67 6.424 1.863 -0.542 1345 HD12 LEU 67 HD12 LEU 67 8.170 1.677 -0.373 1346 HD13 LEU 67 HD13 LEU 67 7.425 1.601 -1.969 1347 HD21 LEU 67 HD21 LEU 67 7.471 5.339 0.051 1348 HD22 LEU 67 HD22 LEU 67 8.133 3.929 0.877 1349 HD23 LEU 67 HD23 LEU 67 6.399 4.045 0.585 1350 H VAL 68 HN VAL 68 11.699 5.245 -1.350 1351 HA VAL 68 HA VAL 68 13.351 3.977 -3.427 1352 HB VAL 68 HB VAL 68 13.561 6.102 -4.611 1353 HG11 VAL 68 HG11 VAL 68 11.281 6.212 -5.541 1354 HG12 VAL 68 HG12 VAL 68 10.713 5.205 -4.210 1355 HG13 VAL 68 HG13 VAL 68 11.872 4.560 -5.372 1356 HG21 VAL 68 HG21 VAL 68 12.076 7.986 -4.081 1357 HG22 VAL 68 HG22 VAL 68 13.203 7.642 -2.769 1358 HG23 VAL 68 HG23 VAL 68 11.521 7.132 -2.642 1359 H GLU 69 HN GLU 69 15.475 4.723 -3.621 1360 HA GLU 69 HA GLU 69 16.570 6.035 -1.224 1361 HB2 GLU 69 HB2 GLU 69 17.639 3.952 -3.098 1362 HB3 GLU 69 HB1 GLU 69 18.763 5.005 -2.253 1363 HG2 GLU 69 HG2 GLU 69 16.669 3.412 -0.812 1364 HG3 GLU 69 HG1 GLU 69 18.268 2.767 -1.186 1365 H ALA 70 HN ALA 70 18.494 7.429 -1.647 1366 HA ALA 70 HA ALA 70 18.294 8.739 -4.275 1367 HB1 ALA 70 HB1 ALA 70 17.100 10.073 -2.603 1368 HB2 ALA 70 HB2 ALA 70 18.527 10.915 -3.211 1369 HB3 ALA 70 HB3 ALA 70 18.565 10.147 -1.623 1370 H ARG 71 HN ARG 71 20.145 8.638 -5.295 1371 HA ARG 71 HA ARG 71 22.654 8.581 -3.764 1372 HB2 ARG 71 HB2 ARG 71 22.175 6.764 -5.469 1373 HB3 ARG 71 HB1 ARG 71 22.274 8.007 -6.709 1374 HG2 ARG 71 HG2 ARG 71 24.376 6.903 -6.625 1375 HG3 ARG 71 HG1 ARG 71 24.589 8.505 -5.912 1376 HD2 ARG 71 HD2 ARG 71 24.246 7.434 -3.664 1377 HD3 ARG 71 HD1 ARG 71 24.327 5.871 -4.477 1378 HE ARG 71 HE ARG 71 26.537 7.838 -4.439 1379 HH11 ARG 71 HH11 ARG 71 25.363 4.537 -4.497 1380 HH12 ARG 71 HH12 ARG 71 26.947 3.832 -4.343 1381 HH21 ARG 71 HH21 ARG 71 28.610 6.924 -4.237 1382 HH22 ARG 71 HH22 ARG 71 28.801 5.197 -4.214 1383 H ARG 72 HN ARG 72 23.398 10.605 -3.449 1384 HA ARG 72 HA ARG 72 22.795 12.614 -5.479 1385 HB2 ARG 72 HB2 ARG 72 22.214 12.999 -3.053 1386 HB3 ARG 72 HB1 ARG 72 23.942 13.102 -2.733 1387 HG2 ARG 72 HG2 ARG 72 24.143 15.019 -4.170 1388 HG3 ARG 72 HG1 ARG 72 22.453 14.869 -4.661 1389 HD2 ARG 72 HD2 ARG 72 21.817 15.208 -2.268 1390 HD3 ARG 72 HD1 ARG 72 23.514 15.545 -1.921 1391 HE ARG 72 HE ARG 72 21.938 17.163 -3.822 1392 HH11 ARG 72 HH11 ARG 72 24.188 16.888 -1.148 1393 HH12 ARG 72 HH12 ARG 72 24.357 18.611 -0.960 1394 HH21 ARG 72 HH21 ARG 72 22.162 19.407 -3.579 1395 HH22 ARG 72 HH22 ARG 72 23.213 20.040 -2.339 1396 H GLU 73 HN GLU 73 24.247 12.600 -7.021 1397 HA GLU 73 HA GLU 73 27.101 12.568 -6.344 1398 HB2 GLU 73 HB2 GLU 73 25.576 12.114 -8.903 1399 HB3 GLU 73 HB1 GLU 73 27.306 12.424 -8.908 1400 HG2 GLU 73 HG2 GLU 73 26.065 10.206 -7.310 1401 HG3 GLU 73 HG1 GLU 73 26.589 10.006 -8.982 1402 H GLY 74 HN GLY 74 27.934 14.522 -5.988 1403 HA2 GLY 74 HA2 GLY 74 28.341 16.776 -6.173 1404 HA3 GLY 74 HA1 GLY 74 27.678 16.683 -7.801 1405 H THR 75 HN THR 75 26.209 18.244 -7.973 1406 HA THR 75 HA THR 75 24.429 18.820 -5.738 1407 HB THR 75 HB THR 75 23.620 20.645 -7.386 1408 HG1 THR 75 HG1 THR 75 25.772 21.037 -8.730 1409 HG21 THR 75 HG21 THR 75 24.989 21.102 -5.412 1410 HG22 THR 75 HG22 THR 75 25.487 22.111 -6.772 1411 HG23 THR 75 HG23 THR 75 26.446 20.701 -6.321 1412 H ARG 76 HN ARG 76 24.341 16.432 -7.745 1413 HA ARG 76 HA ARG 76 21.557 16.805 -8.633 1414 HB2 ARG 76 HB2 ARG 76 23.578 14.778 -9.593 1415 HB3 ARG 76 HB1 ARG 76 21.951 15.004 -10.223 1416 HG2 ARG 76 HG2 ARG 76 22.540 17.213 -11.016 1417 HG3 ARG 76 HG1 ARG 76 24.165 17.032 -10.343 1418 HD2 ARG 76 HD2 ARG 76 24.454 15.018 -11.779 1419 HD3 ARG 76 HD1 ARG 76 22.905 15.400 -12.531 1420 HE ARG 76 HE ARG 76 23.914 17.078 -13.717 1421 HH11 ARG 76 HH11 ARG 76 26.090 15.972 -11.199 1422 HH12 ARG 76 HH12 ARG 76 27.427 16.921 -11.762 1423 HH21 ARG 76 HH21 ARG 76 25.661 18.317 -14.454 1424 HH22 ARG 76 HH22 ARG 76 27.184 18.261 -13.624 1425 H GLN 77 HN GLN 77 20.001 15.435 -8.027 1426 HA GLN 77 HA GLN 77 20.742 13.347 -6.072 1427 HB2 GLN 77 HB2 GLN 77 18.166 14.917 -6.339 1428 HB3 GLN 77 HB1 GLN 77 18.438 13.622 -5.182 1429 HG2 GLN 77 HG2 GLN 77 20.138 14.906 -4.067 1430 HG3 GLN 77 HG1 GLN 77 20.038 16.168 -5.292 1431 HE21 GLN 77 HE21 GLN 77 17.221 14.532 -4.033 1432 HE22 GLN 77 HE22 GLN 77 16.584 15.884 -3.164 1433 H TYR 78 HN TYR 78 20.839 11.491 -7.195 1434 HA TYR 78 HA TYR 78 18.836 10.908 -9.239 1435 HB2 TYR 78 HB2 TYR 78 21.289 9.375 -8.347 1436 HB3 TYR 78 HB1 TYR 78 20.208 8.862 -9.634 1437 HD1 TYR 78 HD1 TYR 78 22.697 11.411 -8.648 1438 HD2 TYR 78 HD2 TYR 78 20.369 9.794 -11.823 1439 HE1 TYR 78 HE1 TYR 78 24.040 12.676 -10.272 1440 HE2 TYR 78 HE2 TYR 78 21.705 11.060 -13.453 1441 HH TYR 78 HH TYR 78 23.138 12.977 -13.584 1442 H TYR 79 HN TYR 79 17.045 9.818 -8.749 1443 HA TYR 79 HA TYR 79 16.993 8.379 -6.197 1444 HB2 TYR 79 HB2 TYR 79 14.813 9.567 -7.899 1445 HB3 TYR 79 HB1 TYR 79 14.462 8.418 -6.610 1446 HD1 TYR 79 HD2 TYR 79 15.922 11.744 -7.324 1447 HD2 TYR 79 HD1 TYR 79 14.445 9.090 -4.348 1448 HE1 TYR 79 HE2 TYR 79 15.971 13.569 -5.680 1449 HE2 TYR 79 HE1 TYR 79 14.489 10.909 -2.694 1450 HH TYR 79 HH TYR 79 15.713 13.080 -2.369 1451 H ARG 80 HN ARG 80 16.204 6.319 -6.024 1452 HA ARG 80 HA ARG 80 15.592 4.776 -8.414 1453 HB2 ARG 80 HB2 ARG 80 18.102 4.755 -8.144 1454 HB3 ARG 80 HB1 ARG 80 17.871 4.002 -6.576 1455 HG2 ARG 80 HG2 ARG 80 16.579 2.190 -7.883 1456 HG3 ARG 80 HG1 ARG 80 17.387 2.868 -9.299 1457 HD2 ARG 80 HD2 ARG 80 18.660 1.672 -6.846 1458 HD3 ARG 80 HD1 ARG 80 18.725 1.059 -8.498 1459 HE ARG 80 HE ARG 80 20.070 3.058 -9.041 1460 HH11 ARG 80 HH11 ARG 80 19.875 1.959 -5.725 1461 HH12 ARG 80 HH12 ARG 80 21.350 2.740 -5.239 1462 HH21 ARG 80 HH21 ARG 80 21.987 4.114 -8.413 1463 HH22 ARG 80 HH22 ARG 80 22.559 3.957 -6.772 1464 H ILE 81 HN ILE 81 14.656 2.684 -7.826 1465 HA ILE 81 HA ILE 81 13.117 2.656 -5.477 1466 HB ILE 81 HB ILE 81 13.977 0.264 -7.117 1467 HG12 ILE 81 HG12 ILE 81 11.548 2.046 -7.409 1468 HG13 ILE 81 HG11 ILE 81 12.923 2.006 -8.504 1469 HG21 ILE 81 HG21 ILE 81 11.955 -0.794 -6.261 1470 HG22 ILE 81 HG22 ILE 81 11.591 0.646 -5.310 1471 HG23 ILE 81 HG23 ILE 81 13.021 -0.318 -4.938 1472 HD11 ILE 81 HD11 ILE 81 11.003 -0.252 -7.992 1473 HD12 ILE 81 HD12 ILE 81 12.388 -0.306 -9.083 1474 HD13 ILE 81 HD13 ILE 81 11.044 0.786 -9.418 1475 H ALA 82 HN ALA 82 13.524 1.960 -3.445 1476 HA ALA 82 HA ALA 82 16.141 1.929 -2.510 1477 HB1 ALA 82 HB1 ALA 82 14.161 2.465 -1.139 1478 HB2 ALA 82 HB2 ALA 82 15.235 1.303 -0.363 1479 HB3 ALA 82 HB3 ALA 82 13.740 0.753 -1.118 1480 H GLY 83 HN GLY 83 13.933 -0.842 -2.858 1481 HA2 GLY 83 HA2 GLY 83 16.251 -2.569 -3.283 1482 HA3 GLY 83 HA1 GLY 83 15.194 -2.956 -1.929 1483 H GLU 84 HN GLU 84 15.539 -4.821 -3.875 1484 HA GLU 84 HA GLU 84 13.640 -4.592 -5.987 1485 HB2 GLU 84 HB2 GLU 84 14.006 -7.053 -6.276 1486 HB3 GLU 84 HB1 GLU 84 15.472 -6.089 -6.324 1487 HG2 GLU 84 HG2 GLU 84 14.589 -7.422 -3.794 1488 HG3 GLU 84 HG1 GLU 84 15.481 -8.306 -5.030 1489 H ASP 85 HN ASP 85 13.479 -5.645 -2.685 1490 HA ASP 85 HA ASP 85 11.078 -7.108 -2.798 1491 HB2 ASP 85 HB2 ASP 85 12.172 -5.424 -0.535 1492 HB3 ASP 85 HB1 ASP 85 10.873 -6.604 -0.384 1493 H VAL 86 HN VAL 86 11.729 -3.675 -2.336 1494 HA VAL 86 HA VAL 86 9.050 -2.832 -2.048 1495 HB VAL 86 HB VAL 86 11.394 -1.283 -3.175 1496 HG11 VAL 86 HG11 VAL 86 10.139 0.708 -2.474 1497 HG12 VAL 86 HG12 VAL 86 8.785 -0.319 -2.001 1498 HG13 VAL 86 HG13 VAL 86 9.271 -0.224 -3.695 1499 HG21 VAL 86 HG21 VAL 86 11.900 -2.149 -0.962 1500 HG22 VAL 86 HG22 VAL 86 10.386 -1.499 -0.339 1501 HG23 VAL 86 HG23 VAL 86 11.652 -0.405 -0.894 1502 H ALA 87 HN ALA 87 11.164 -3.247 -4.842 1503 HA ALA 87 HA ALA 87 9.448 -2.187 -6.794 1504 HB1 ALA 87 HB1 ALA 87 10.823 -3.375 -8.409 1505 HB2 ALA 87 HB2 ALA 87 11.526 -4.351 -7.119 1506 HB3 ALA 87 HB3 ALA 87 11.831 -2.613 -7.179 1507 H ARG 88 HN ARG 88 9.849 -5.519 -5.599 1508 HA ARG 88 HA ARG 88 7.904 -6.594 -7.390 1509 HB2 ARG 88 HB2 ARG 88 8.917 -7.799 -4.808 1510 HB3 ARG 88 HB1 ARG 88 8.068 -8.648 -6.092 1511 HG2 ARG 88 HG2 ARG 88 9.975 -8.004 -7.611 1512 HG3 ARG 88 HG1 ARG 88 10.833 -7.481 -6.162 1513 HD2 ARG 88 HD2 ARG 88 9.965 -10.244 -6.944 1514 HD3 ARG 88 HD1 ARG 88 11.580 -9.668 -6.545 1515 HE ARG 88 HE ARG 88 9.565 -10.603 -4.728 1516 HH11 ARG 88 HH11 ARG 88 12.404 -8.579 -5.026 1517 HH12 ARG 88 HH12 ARG 88 12.808 -8.678 -3.340 1518 HH21 ARG 88 HH21 ARG 88 10.110 -10.740 -2.498 1519 HH22 ARG 88 HH22 ARG 88 11.506 -9.875 -1.910 1520 H LEU 89 HN LEU 89 7.767 -5.066 -4.290 1521 HA LEU 89 HA LEU 89 5.164 -5.926 -3.546 1522 HB2 LEU 89 HB2 LEU 89 7.000 -4.736 -2.147 1523 HB3 LEU 89 HB1 LEU 89 6.350 -3.257 -2.821 1524 HG LEU 89 HG LEU 89 4.685 -5.216 -1.241 1525 HD11 LEU 89 HD11 LEU 89 6.076 -2.721 -0.277 1526 HD12 LEU 89 HD12 LEU 89 6.521 -4.376 0.140 1527 HD13 LEU 89 HD13 LEU 89 4.967 -3.723 0.659 1528 HD21 LEU 89 HD21 LEU 89 4.246 -2.322 -1.974 1529 HD22 LEU 89 HD22 LEU 89 3.175 -3.311 -0.982 1530 HD23 LEU 89 HD23 LEU 89 3.416 -3.707 -2.683 1531 H PHE 90 HN PHE 90 6.391 -3.029 -5.196 1532 HA PHE 90 HA PHE 90 3.871 -1.892 -5.771 1533 HB2 PHE 90 HB2 PHE 90 5.961 -0.605 -5.866 1534 HB3 PHE 90 HB1 PHE 90 6.510 -1.576 -7.224 1535 HD1 PHE 90 HD2 PHE 90 3.770 0.726 -6.196 1536 HD2 PHE 90 HD1 PHE 90 6.082 -0.879 -9.393 1537 HE1 PHE 90 HE2 PHE 90 2.719 2.316 -7.753 1538 HE2 PHE 90 HE1 PHE 90 5.034 0.708 -10.951 1539 HZ PHE 90 HZ PHE 90 3.352 2.309 -10.132 1540 H ALA 91 HN ALA 91 5.889 -4.224 -7.460 1541 HA ALA 91 HA ALA 91 4.322 -4.339 -9.827 1542 HB1 ALA 91 HB1 ALA 91 6.161 -6.426 -8.661 1543 HB2 ALA 91 HB2 ALA 91 6.640 -5.116 -9.741 1544 HB3 ALA 91 HB3 ALA 91 5.552 -6.379 -10.317 1545 H LEU 92 HN LEU 92 4.237 -6.049 -6.754 1546 HA LEU 92 HA LEU 92 2.410 -8.065 -7.471 1547 HB2 LEU 92 HB2 LEU 92 3.815 -8.106 -5.441 1548 HB3 LEU 92 HB1 LEU 92 2.864 -6.797 -4.768 1549 HG LEU 92 HG LEU 92 0.881 -8.254 -4.729 1550 HD11 LEU 92 HD11 LEU 92 1.116 -10.647 -5.156 1551 HD12 LEU 92 HD12 LEU 92 2.779 -10.395 -5.684 1552 HD13 LEU 92 HD13 LEU 92 1.447 -9.701 -6.608 1553 HD21 LEU 92 HD21 LEU 92 2.277 -8.117 -2.752 1554 HD22 LEU 92 HD22 LEU 92 3.327 -9.388 -3.375 1555 HD23 LEU 92 HD23 LEU 92 1.659 -9.759 -2.939 1556 H VAL 93 HN VAL 93 1.893 -4.881 -5.935 1557 HA VAL 93 HA VAL 93 -0.929 -5.144 -5.822 1558 HB VAL 93 HB VAL 93 0.364 -3.509 -4.446 1559 HG11 VAL 93 HG11 VAL 93 0.947 -1.334 -5.424 1560 HG12 VAL 93 HG12 VAL 93 0.563 -1.971 -7.025 1561 HG13 VAL 93 HG13 VAL 93 1.896 -2.659 -6.096 1562 HG21 VAL 93 HG21 VAL 93 -1.846 -2.317 -6.113 1563 HG22 VAL 93 HG22 VAL 93 -1.300 -1.723 -4.547 1564 HG23 VAL 93 HG23 VAL 93 -2.054 -3.311 -4.672 1565 H GLN 94 HN GLN 94 1.285 -4.127 -8.308 1566 HA GLN 94 HA GLN 94 -0.535 -2.946 -10.101 1567 HB2 GLN 94 HB2 GLN 94 1.910 -2.818 -10.366 1568 HB3 GLN 94 HB1 GLN 94 1.965 -4.541 -10.698 1569 HG2 GLN 94 HG2 GLN 94 0.496 -4.109 -12.683 1570 HG3 GLN 94 HG1 GLN 94 0.713 -2.388 -12.382 1571 HE21 GLN 94 HE21 GLN 94 3.212 -4.808 -11.911 1572 HE22 GLN 94 HE22 GLN 94 4.236 -4.272 -13.196 1573 H VAL 95 HN VAL 95 0.514 -6.300 -9.653 1574 HA VAL 95 HA VAL 95 -0.974 -7.429 -11.765 1575 HB VAL 95 HB VAL 95 -0.095 -8.729 -9.176 1576 HG11 VAL 95 HG11 VAL 95 -1.862 -10.005 -10.282 1577 HG12 VAL 95 HG12 VAL 95 -0.315 -10.846 -10.384 1578 HG13 VAL 95 HG13 VAL 95 -0.944 -9.983 -11.788 1579 HG21 VAL 95 HG21 VAL 95 1.231 -8.680 -11.888 1580 HG22 VAL 95 HG22 VAL 95 1.803 -9.557 -10.469 1581 HG23 VAL 95 HG23 VAL 95 1.768 -7.795 -10.461 1582 H VAL 96 HN VAL 96 -1.704 -7.053 -8.308 1583 HA VAL 96 HA VAL 96 -4.216 -8.249 -8.253 1584 HB VAL 96 HB VAL 96 -3.304 -5.842 -6.656 1585 HG11 VAL 96 HG11 VAL 96 -5.513 -7.821 -6.110 1586 HG12 VAL 96 HG12 VAL 96 -5.718 -6.127 -6.549 1587 HG13 VAL 96 HG13 VAL 96 -4.977 -6.554 -5.008 1588 HG21 VAL 96 HG21 VAL 96 -3.117 -8.790 -6.053 1589 HG22 VAL 96 HG22 VAL 96 -2.727 -7.494 -4.922 1590 HG23 VAL 96 HG23 VAL 96 -1.775 -7.699 -6.391 1591 H ALA 97 HN ALA 97 -3.283 -4.978 -9.172 1592 HA ALA 97 HA ALA 97 -5.941 -4.030 -9.542 1593 HB1 ALA 97 HB1 ALA 97 -4.890 -2.128 -10.656 1594 HB2 ALA 97 HB2 ALA 97 -3.350 -2.987 -10.684 1595 HB3 ALA 97 HB3 ALA 97 -4.067 -2.512 -9.145 1596 H ASP 98 HN ASP 98 -3.394 -4.770 -11.916 1597 HA ASP 98 HA ASP 98 -4.885 -4.366 -14.210 1598 HB2 ASP 98 HB2 ASP 98 -2.493 -4.534 -14.322 1599 HB3 ASP 98 HB1 ASP 98 -2.525 -6.190 -13.730 1600 H GLU 99 HN GLU 99 -4.453 -7.385 -12.405 1601 HA GLU 99 HA GLU 99 -5.597 -9.123 -14.259 1602 HB2 GLU 99 HB2 GLU 99 -4.348 -9.964 -12.377 1603 HB3 GLU 99 HB1 GLU 99 -5.504 -9.276 -11.245 1604 HG2 GLU 99 HG2 GLU 99 -7.235 -10.796 -12.222 1605 HG3 GLU 99 HG1 GLU 99 -5.947 -11.571 -13.139 1606 H HIS 100 HN HIS 100 -7.176 -6.864 -12.121 1607 HA HIS 100 HA HIS 100 -9.633 -8.439 -12.238 1608 HB2 HIS 100 HB2 HIS 100 -8.768 -6.213 -10.408 1609 HB3 HIS 100 HB1 HIS 100 -10.422 -6.829 -10.436 1610 HD1 HIS 100 HD1 HIS 100 -10.833 -8.642 -8.787 1611 HD2 HIS 100 HD2 HIS 100 -6.858 -8.519 -10.002 1612 HE1 HIS 100 HE1 HIS 100 -9.674 -10.488 -7.526 1613 HE2 HIS 100 HE2 HIS 100 -7.352 -10.563 -8.516 1614 H LEU 101 HN LEU 101 -8.323 -5.888 -13.950 1615 HA LEU 101 HA LEU 101 -11.046 -5.358 -14.941 1616 HB2 LEU 101 HB2 LEU 101 -10.629 -3.091 -15.372 1617 HB3 LEU 101 HB1 LEU 101 -10.014 -3.365 -13.756 1618 HG LEU 101 HG LEU 101 -8.206 -3.361 -16.168 1619 HD11 LEU 101 HD11 LEU 101 -8.936 -1.031 -14.398 1620 HD12 LEU 101 HD12 LEU 101 -9.371 -1.218 -16.097 1621 HD13 LEU 101 HD13 LEU 101 -7.679 -1.038 -15.634 1622 HD21 LEU 101 HD21 LEU 101 -7.704 -2.899 -13.234 1623 HD22 LEU 101 HD22 LEU 101 -6.492 -2.855 -14.514 1624 HD23 LEU 101 HD23 LEU 101 -7.315 -4.368 -14.130 1625 H GLU 102 HN GLU 102 -8.556 -7.071 -15.557 1626 HA GLU 102 HA GLU 102 -7.504 -6.179 -18.028 1627 HB2 GLU 102 HB2 GLU 102 -6.549 -7.854 -16.274 1628 HB3 GLU 102 HB1 GLU 102 -7.484 -9.052 -17.150 1629 HG2 GLU 102 HG2 GLU 102 -5.586 -7.282 -18.619 1630 HG3 GLU 102 HG1 GLU 102 -4.983 -8.667 -17.715 1631 H HIS 103 HN HIS 103 -9.964 -8.618 -17.191 1632 HA HIS 103 HA HIS 103 -10.383 -9.237 -19.989 1633 HB2 HIS 103 HB2 HIS 103 -11.809 -10.221 -17.514 1634 HB3 HIS 103 HB1 HIS 103 -12.145 -10.783 -19.145 1635 HD1 HIS 103 HD1 HIS 103 -9.267 -11.190 -20.169 1636 HD2 HIS 103 HD2 HIS 103 -10.607 -12.379 -16.413 1637 HE1 HIS 103 HE1 HIS 103 -7.741 -13.065 -19.460 1638 HE2 HIS 103 HE2 HIS 103 -8.626 -13.829 -17.221 1639 H HIS 104 HN HIS 104 -10.872 -6.807 -20.196 1640 HA HIS 104 HA HIS 104 -12.366 -5.263 -20.931 1641 HB2 HIS 104 HB2 HIS 104 -13.097 -7.445 -22.124 1642 HB3 HIS 104 HB1 HIS 104 -14.455 -7.425 -21.007 1643 HD1 HIS 104 HD1 HIS 104 -13.024 -5.599 -23.962 1644 HD2 HIS 104 HD2 HIS 104 -16.420 -5.512 -21.554 1645 HE1 HIS 104 HE1 HIS 104 -14.657 -4.091 -25.138 1646 HE2 HIS 104 HE2 HIS 104 -16.719 -4.081 -23.691 1647 H HIS 105 HN HIS 105 -12.176 -5.736 -18.041 1648 HA HIS 105 HA HIS 105 -14.901 -5.225 -17.113 1649 HB2 HIS 105 HB2 HIS 105 -13.040 -6.787 -16.015 1650 HB3 HIS 105 HB1 HIS 105 -12.584 -5.273 -15.236 1651 HD1 HIS 105 HD1 HIS 105 -13.667 -4.993 -13.031 1652 HD2 HIS 105 HD2 HIS 105 -16.049 -7.159 -15.666 1653 HE1 HIS 105 HE1 HIS 105 -15.738 -5.601 -11.736 1654 HE2 HIS 105 HE2 HIS 105 -17.256 -6.703 -13.425 1655 H HIS 106 HN HIS 106 -13.205 -3.385 -18.689 1656 HA HIS 106 HA HIS 106 -12.267 -1.205 -17.225 1657 HB2 HIS 106 HB2 HIS 106 -11.775 -1.560 -19.594 1658 HB3 HIS 106 HB1 HIS 106 -13.467 -1.342 -20.004 1659 HD1 HIS 106 HD1 HIS 106 -10.319 0.480 -19.512 1660 HD2 HIS 106 HD2 HIS 106 -14.370 1.399 -19.777 1661 HE1 HIS 106 HE1 HIS 106 -10.428 2.944 -19.989 1662 HE2 HIS 106 HE2 HIS 106 -12.876 3.460 -20.249 1663 H HIS 107 HN HIS 107 -13.347 0.083 -15.892 1664 HA HIS 107 HA HIS 107 -16.223 0.482 -16.257 1665 HB2 HIS 107 HB2 HIS 107 -14.357 1.374 -14.043 1666 HB3 HIS 107 HB1 HIS 107 -16.081 1.716 -14.086 1667 HD1 HIS 107 HD1 HIS 107 -17.637 -0.563 -14.138 1668 HD2 HIS 107 HD2 HIS 107 -13.727 -0.919 -12.751 1669 HE1 HIS 107 HE1 HIS 107 -17.582 -2.688 -12.789 1670 HE2 HIS 107 HE2 HIS 107 -15.272 -2.757 -11.780 1671 H HIS 108 HN HIS 108 -13.297 2.427 -15.775 1672 HA HIS 108 HA HIS 108 -13.889 4.184 -17.921 1673 HB2 HIS 108 HB2 HIS 108 -15.507 5.091 -16.268 1674 HB3 HIS 108 HB1 HIS 108 -14.183 5.347 -15.135 1675 HD1 HIS 108 HD1 HIS 108 -12.503 7.280 -15.685 1676 HD2 HIS 108 HD2 HIS 108 -15.759 7.010 -18.266 1677 HE1 HIS 108 HE1 HIS 108 -12.536 9.446 -16.967 1678 HE2 HIS 108 HE2 HIS 108 -14.626 9.332 -18.364 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 -13.827 14.504 -17.958 2 H2 MET 1 HT2 MET 1 -15.085 13.470 -18.432 3 H3 MET 1 HT3 MET 1 -14.317 14.450 -19.580 4 HA MET 1 HA MET 1 -12.270 13.257 -19.322 5 HB2 MET 1 HB2 MET 1 -13.862 11.665 -17.306 6 HB3 MET 1 HB1 MET 1 -12.330 11.127 -17.978 7 HG2 MET 1 HG2 MET 1 -11.222 13.078 -17.031 8 HG3 MET 1 HG1 MET 1 -12.758 13.639 -16.376 9 HE1 MET 1 HE1 MET 1 -10.705 12.479 -13.215 10 HE2 MET 1 HE2 MET 1 -11.538 13.826 -13.986 11 HE3 MET 1 HE3 MET 1 -10.044 13.198 -14.682 12 H ALA 2 HN ALA 2 -11.834 11.492 -20.671 13 HA ALA 2 HA ALA 2 -14.132 10.649 -22.260 14 HB1 ALA 2 HB1 ALA 2 -11.186 10.194 -22.729 15 HB2 ALA 2 HB2 ALA 2 -12.144 11.510 -23.406 16 HB3 ALA 2 HB3 ALA 2 -12.491 9.844 -23.861 17 H GLY 3 HN GLY 3 -14.310 8.377 -22.946 18 HA2 GLY 3 HA2 GLY 3 -14.303 6.672 -20.640 19 HA3 GLY 3 HA1 GLY 3 -14.875 6.255 -22.244 20 H GLN 4 HN GLN 4 -11.723 7.161 -20.899 21 HA GLN 4 HA GLN 4 -10.625 4.564 -21.017 22 HB2 GLN 4 HB2 GLN 4 -10.651 5.027 -23.462 23 HB3 GLN 4 HB1 GLN 4 -9.669 6.457 -23.183 24 HG2 GLN 4 HG2 GLN 4 -8.268 4.678 -23.961 25 HG3 GLN 4 HG1 GLN 4 -7.886 5.018 -22.276 26 HE21 GLN 4 HE21 GLN 4 -9.237 2.734 -24.505 27 HE22 GLN 4 HE22 GLN 4 -9.325 1.398 -23.402 28 H SER 5 HN SER 5 -9.206 7.714 -21.846 29 HA SER 5 HA SER 5 -7.730 9.073 -20.783 30 HB2 SER 5 HB2 SER 5 -8.997 7.968 -18.267 31 HB3 SER 5 HB1 SER 5 -8.123 9.492 -18.422 32 HG SER 5 HG SER 5 -10.680 8.790 -19.347 33 H ASP 6 HN ASP 6 -6.876 6.432 -21.458 34 HA ASP 6 HA ASP 6 -5.060 5.097 -21.308 35 HB2 ASP 6 HB2 ASP 6 -3.801 7.186 -20.716 36 HB3 ASP 6 HB1 ASP 6 -4.080 6.808 -19.018 37 H ARG 7 HN ARG 7 -4.873 3.136 -20.467 38 HA ARG 7 HA ARG 7 -6.731 2.474 -18.388 39 HB2 ARG 7 HB2 ARG 7 -6.043 0.129 -18.874 40 HB3 ARG 7 HB1 ARG 7 -6.608 1.018 -20.281 41 HG2 ARG 7 HG2 ARG 7 -4.303 1.390 -20.982 42 HG3 ARG 7 HG1 ARG 7 -3.729 0.507 -19.564 43 HD2 ARG 7 HD2 ARG 7 -5.477 -0.622 -21.746 44 HD3 ARG 7 HD1 ARG 7 -3.741 -0.889 -21.582 45 HE ARG 7 HE ARG 7 -4.710 -1.698 -19.189 46 HH11 ARG 7 HH11 ARG 7 -5.625 -2.452 -22.483 47 HH12 ARG 7 HH12 ARG 7 -6.070 -4.097 -22.122 48 HH21 ARG 7 HH21 ARG 7 -5.302 -3.847 -18.698 49 HH22 ARG 7 HH22 ARG 7 -5.905 -4.886 -19.961 50 H LYS 8 HN LYS 8 -3.366 3.177 -18.430 51 HA LYS 8 HA LYS 8 -2.780 1.579 -16.083 52 HB2 LYS 8 HB2 LYS 8 -1.031 2.032 -17.791 53 HB3 LYS 8 HB1 LYS 8 -1.095 3.739 -17.370 54 HG2 LYS 8 HG2 LYS 8 -0.329 3.247 -15.127 55 HG3 LYS 8 HG1 LYS 8 -0.350 1.518 -15.473 56 HD2 LYS 8 HD2 LYS 8 1.914 2.318 -15.613 57 HD3 LYS 8 HD1 LYS 8 1.358 1.903 -17.235 58 HE2 LYS 8 HE2 LYS 8 0.945 4.250 -17.714 59 HE3 LYS 8 HE1 LYS 8 1.415 4.688 -16.073 60 HZ1 LYS 8 HZ1 LYS 8 3.185 5.037 -17.736 61 HZ2 LYS 8 HZ2 LYS 8 3.212 3.366 -18.034 62 HZ3 LYS 8 HZ3 LYS 8 3.645 3.962 -16.503 63 H ALA 9 HN ALA 9 -3.769 4.813 -16.856 64 HA ALA 9 HA ALA 9 -3.241 6.065 -14.395 65 HB1 ALA 9 HB1 ALA 9 -3.911 7.320 -16.377 66 HB2 ALA 9 HB2 ALA 9 -4.992 7.658 -15.026 67 HB3 ALA 9 HB3 ALA 9 -5.511 6.578 -16.320 68 H ALA 10 HN ALA 10 -5.859 4.011 -15.500 69 HA ALA 10 HA ALA 10 -7.459 4.236 -13.156 70 HB1 ALA 10 HB1 ALA 10 -8.371 3.482 -15.300 71 HB2 ALA 10 HB2 ALA 10 -8.653 2.297 -14.026 72 HB3 ALA 10 HB3 ALA 10 -7.375 2.030 -15.213 73 H LEU 11 HN LEU 11 -4.736 2.255 -14.092 74 HA LEU 11 HA LEU 11 -5.003 0.309 -12.029 75 HB2 LEU 11 HB2 LEU 11 -2.585 1.172 -13.618 76 HB3 LEU 11 HB1 LEU 11 -2.613 -0.198 -12.526 77 HG LEU 11 HG LEU 11 -4.273 0.079 -15.032 78 HD11 LEU 11 HD11 LEU 11 -1.868 -1.627 -14.413 79 HD12 LEU 11 HD12 LEU 11 -1.924 -0.261 -15.528 80 HD13 LEU 11 HD13 LEU 11 -2.844 -1.725 -15.879 81 HD21 LEU 11 HD21 LEU 11 -5.431 -1.216 -13.324 82 HD22 LEU 11 HD22 LEU 11 -3.998 -2.219 -13.097 83 HD23 LEU 11 HD23 LEU 11 -4.870 -2.263 -14.628 84 H LEU 12 HN LEU 12 -3.197 3.330 -12.352 85 HA LEU 12 HA LEU 12 -1.846 3.183 -9.888 86 HB2 LEU 12 HB2 LEU 12 -2.688 5.593 -11.495 87 HB3 LEU 12 HB1 LEU 12 -1.614 5.653 -10.112 88 HG LEU 12 HG LEU 12 -1.067 4.228 -12.717 89 HD11 LEU 12 HD11 LEU 12 -0.907 6.663 -12.877 90 HD12 LEU 12 HD12 LEU 12 0.683 5.911 -12.996 91 HD13 LEU 12 HD13 LEU 12 0.183 6.685 -11.492 92 HD21 LEU 12 HD21 LEU 12 -0.095 3.010 -10.856 93 HD22 LEU 12 HD22 LEU 12 0.630 4.494 -10.238 94 HD23 LEU 12 HD23 LEU 12 1.171 3.825 -11.778 95 H ASP 13 HN ASP 13 -5.059 4.345 -10.742 96 HA ASP 13 HA ASP 13 -5.702 5.480 -8.233 97 HB2 ASP 13 HB2 ASP 13 -7.035 5.826 -10.316 98 HB3 ASP 13 HB1 ASP 13 -7.595 4.162 -10.203 99 H GLN 14 HN GLN 14 -6.050 2.232 -9.570 100 HA GLN 14 HA GLN 14 -7.338 1.100 -7.316 101 HB2 GLN 14 HB2 GLN 14 -5.865 -0.050 -9.664 102 HB3 GLN 14 HB1 GLN 14 -6.433 -1.082 -8.360 103 HG2 GLN 14 HG2 GLN 14 -8.202 0.763 -9.943 104 HG3 GLN 14 HG1 GLN 14 -7.969 -0.949 -10.300 105 HE21 GLN 14 HE21 GLN 14 -8.791 -2.495 -8.880 106 HE22 GLN 14 HE22 GLN 14 -10.001 -2.109 -7.705 107 H VAL 15 HN VAL 15 -3.931 1.368 -8.256 108 HA VAL 15 HA VAL 15 -2.865 -0.119 -6.107 109 HB VAL 15 HB VAL 15 -1.637 2.215 -7.598 110 HG11 VAL 15 HG11 VAL 15 -0.534 1.891 -5.450 111 HG12 VAL 15 HG12 VAL 15 0.517 1.380 -6.768 112 HG13 VAL 15 HG13 VAL 15 -0.328 0.174 -5.797 113 HG21 VAL 15 HG21 VAL 15 -0.454 0.507 -8.873 114 HG22 VAL 15 HG22 VAL 15 -2.200 0.302 -9.027 115 HG23 VAL 15 HG23 VAL 15 -1.278 -0.760 -7.964 116 H ALA 16 HN ALA 16 -3.567 3.342 -6.472 117 HA ALA 16 HA ALA 16 -2.819 4.083 -3.849 118 HB1 ALA 16 HB1 ALA 16 -4.779 5.413 -5.717 119 HB2 ALA 16 HB2 ALA 16 -3.042 5.708 -5.659 120 HB3 ALA 16 HB3 ALA 16 -4.056 6.144 -4.284 121 H ARG 17 HN ARG 17 -5.728 2.749 -5.224 122 HA ARG 17 HA ARG 17 -7.572 3.251 -3.184 123 HB2 ARG 17 HB2 ARG 17 -7.996 2.231 -5.478 124 HB3 ARG 17 HB1 ARG 17 -7.415 0.711 -4.815 125 HG2 ARG 17 HG2 ARG 17 -9.719 0.541 -4.666 126 HG3 ARG 17 HG1 ARG 17 -9.236 1.019 -3.036 127 HD2 ARG 17 HD2 ARG 17 -11.202 2.273 -3.852 128 HD3 ARG 17 HD1 ARG 17 -9.827 3.322 -3.500 129 HE ARG 17 HE ARG 17 -9.411 3.357 -5.938 130 HH11 ARG 17 HH11 ARG 17 -12.608 2.525 -4.763 131 HH12 ARG 17 HH12 ARG 17 -13.396 2.959 -6.253 132 HH21 ARG 17 HH21 ARG 17 -10.430 3.962 -7.864 133 HH22 ARG 17 HH22 ARG 17 -12.160 3.789 -8.013 134 H VAL 18 HN VAL 18 -5.523 0.386 -3.701 135 HA VAL 18 HA VAL 18 -6.115 -0.831 -1.218 136 HB VAL 18 HB VAL 18 -3.633 -1.188 -2.912 137 HG11 VAL 18 HG11 VAL 18 -3.397 -2.074 -0.646 138 HG12 VAL 18 HG12 VAL 18 -3.470 -3.374 -1.834 139 HG13 VAL 18 HG13 VAL 18 -4.884 -2.999 -0.848 140 HG21 VAL 18 HG21 VAL 18 -4.805 -3.099 -3.907 141 HG22 VAL 18 HG22 VAL 18 -5.657 -1.585 -4.217 142 HG23 VAL 18 HG23 VAL 18 -6.250 -2.693 -2.980 143 H GLY 19 HN GLY 19 -3.571 1.352 -2.308 144 HA2 GLY 19 HA2 GLY 19 -1.974 1.350 -0.019 145 HA3 GLY 19 HA1 GLY 19 -2.101 2.676 -1.163 146 H LYS 20 HN LYS 20 -4.804 3.371 -0.777 147 HA LYS 20 HA LYS 20 -4.504 4.936 1.596 148 HB2 LYS 20 HB2 LYS 20 -6.648 5.941 1.023 149 HB3 LYS 20 HB1 LYS 20 -5.606 5.859 -0.386 150 HG2 LYS 20 HG2 LYS 20 -6.847 3.794 -1.071 151 HG3 LYS 20 HG1 LYS 20 -7.977 4.122 0.242 152 HD2 LYS 20 HD2 LYS 20 -8.852 4.988 -1.854 153 HD3 LYS 20 HD1 LYS 20 -8.475 6.321 -0.760 154 HE2 LYS 20 HE2 LYS 20 -6.385 6.721 -1.934 155 HE3 LYS 20 HE1 LYS 20 -6.695 5.346 -2.991 156 HZ1 LYS 20 HZ1 LYS 20 -8.416 7.762 -2.825 157 HZ2 LYS 20 HZ2 LYS 20 -8.578 6.478 -3.927 158 HZ3 LYS 20 HZ3 LYS 20 -7.233 7.503 -4.012 159 H ALA 21 HN ALA 21 -6.085 1.939 0.844 160 HA ALA 21 HA ALA 21 -7.634 1.854 3.258 161 HB1 ALA 21 HB1 ALA 21 -7.987 -0.502 2.713 162 HB2 ALA 21 HB2 ALA 21 -6.766 -0.399 1.446 163 HB3 ALA 21 HB3 ALA 21 -8.265 0.520 1.303 164 H LEU 22 HN LEU 22 -4.401 0.888 2.292 165 HA LEU 22 HA LEU 22 -3.848 -0.565 4.712 166 HB2 LEU 22 HB2 LEU 22 -1.978 0.487 2.587 167 HB3 LEU 22 HB1 LEU 22 -1.519 -0.603 3.878 168 HG LEU 22 HG LEU 22 -3.457 -1.231 1.646 169 HD11 LEU 22 HD11 LEU 22 -0.661 -2.227 2.172 170 HD12 LEU 22 HD12 LEU 22 -1.135 -1.102 0.899 171 HD13 LEU 22 HD13 LEU 22 -1.727 -2.763 0.873 172 HD21 LEU 22 HD21 LEU 22 -2.393 -2.991 3.852 173 HD22 LEU 22 HD22 LEU 22 -3.429 -3.504 2.520 174 HD23 LEU 22 HD23 LEU 22 -4.040 -2.374 3.726 175 H ALA 23 HN ALA 23 -3.670 2.717 3.691 176 HA ALA 23 HA ALA 23 -1.578 3.571 5.428 177 HB1 ALA 23 HB1 ALA 23 -3.683 5.200 4.022 178 HB2 ALA 23 HB2 ALA 23 -2.120 4.736 3.352 179 HB3 ALA 23 HB3 ALA 23 -2.197 5.818 4.743 180 H ASN 24 HN ASN 24 -4.462 2.440 6.333 181 HA ASN 24 HA ASN 24 -5.295 4.574 8.097 182 HB2 ASN 24 HB2 ASN 24 -6.321 1.756 7.720 183 HB3 ASN 24 HB1 ASN 24 -7.005 2.896 8.873 184 HD21 ASN 24 HD21 ASN 24 -6.554 5.176 7.081 185 HD22 ASN 24 HD22 ASN 24 -7.764 5.057 5.846 186 H GLY 25 HN GLY 25 -3.573 1.519 8.358 187 HA2 GLY 25 HA2 GLY 25 -2.249 0.734 10.087 188 HA3 GLY 25 HA1 GLY 25 -2.567 2.230 10.952 189 H ARG 26 HN ARG 26 -4.993 2.384 11.618 190 HA ARG 26 HA ARG 26 -5.533 0.539 13.621 191 HB2 ARG 26 HB2 ARG 26 -7.433 2.343 12.114 192 HB3 ARG 26 HB1 ARG 26 -7.829 1.510 13.609 193 HG2 ARG 26 HG2 ARG 26 -5.482 3.355 13.469 194 HG3 ARG 26 HG1 ARG 26 -7.117 3.978 13.697 195 HD2 ARG 26 HD2 ARG 26 -5.671 2.002 15.456 196 HD3 ARG 26 HD1 ARG 26 -6.050 3.681 15.842 197 HE ARG 26 HE ARG 26 -7.761 1.451 16.175 198 HH11 ARG 26 HH11 ARG 26 -7.827 4.835 15.243 199 HH12 ARG 26 HH12 ARG 26 -9.511 5.032 15.627 200 HH21 ARG 26 HH21 ARG 26 -9.950 1.722 16.704 201 HH22 ARG 26 HH22 ARG 26 -10.722 3.263 16.452 202 H ARG 27 HN ARG 27 -6.813 0.697 10.332 203 HA ARG 27 HA ARG 27 -8.611 -1.498 10.761 204 HB2 ARG 27 HB2 ARG 27 -7.876 0.015 8.253 205 HB3 ARG 27 HB1 ARG 27 -9.142 -1.205 8.349 206 HG2 ARG 27 HG2 ARG 27 -10.361 0.138 9.950 207 HG3 ARG 27 HG1 ARG 27 -9.070 1.337 9.960 208 HD2 ARG 27 HD2 ARG 27 -9.488 1.799 7.593 209 HD3 ARG 27 HD1 ARG 27 -10.787 0.604 7.592 210 HE ARG 27 HE ARG 27 -11.787 2.088 9.412 211 HH11 ARG 27 HH11 ARG 27 -9.857 3.313 6.754 212 HH12 ARG 27 HH12 ARG 27 -10.591 4.883 6.793 213 HH21 ARG 27 HH21 ARG 27 -12.750 4.142 9.458 214 HH22 ARG 27 HH22 ARG 27 -12.232 5.363 8.330 215 H LEU 28 HN LEU 28 -5.334 -1.307 10.083 216 HA LEU 28 HA LEU 28 -5.058 -3.549 8.347 217 HB2 LEU 28 HB2 LEU 28 -3.088 -2.304 10.267 218 HB3 LEU 28 HB1 LEU 28 -2.686 -3.534 9.083 219 HG LEU 28 HG LEU 28 -3.728 -0.778 8.430 220 HD11 LEU 28 HD11 LEU 28 -0.963 -1.945 8.159 221 HD12 LEU 28 HD12 LEU 28 -1.462 -0.732 9.338 222 HD13 LEU 28 HD13 LEU 28 -1.476 -0.345 7.617 223 HD21 LEU 28 HD21 LEU 28 -3.102 -1.389 6.127 224 HD22 LEU 28 HD22 LEU 28 -4.393 -2.404 6.769 225 HD23 LEU 28 HD23 LEU 28 -2.744 -3.025 6.678 226 H GLN 29 HN GLN 29 -5.566 -3.143 11.730 227 HA GLN 29 HA GLN 29 -4.724 -5.619 12.715 228 HB2 GLN 29 HB2 GLN 29 -6.816 -3.644 13.545 229 HB3 GLN 29 HB1 GLN 29 -6.757 -5.213 14.337 230 HG2 GLN 29 HG2 GLN 29 -4.423 -3.330 14.143 231 HG3 GLN 29 HG1 GLN 29 -5.517 -3.429 15.525 232 HE21 GLN 29 HE21 GLN 29 -5.449 -5.228 16.856 233 HE22 GLN 29 HE22 GLN 29 -4.147 -6.369 16.818 234 H ILE 30 HN ILE 30 -7.610 -4.676 10.985 235 HA ILE 30 HA ILE 30 -9.023 -7.114 11.362 236 HB ILE 30 HB ILE 30 -9.343 -5.057 9.171 237 HG12 ILE 30 HG12 ILE 30 -10.782 -5.337 11.821 238 HG13 ILE 30 HG11 ILE 30 -9.591 -4.100 11.434 239 HG21 ILE 30 HG21 ILE 30 -11.608 -5.970 8.951 240 HG22 ILE 30 HG22 ILE 30 -11.221 -7.202 10.153 241 HG23 ILE 30 HG23 ILE 30 -10.375 -7.184 8.606 242 HD11 ILE 30 HD11 ILE 30 -11.840 -3.221 11.298 243 HD12 ILE 30 HD12 ILE 30 -12.269 -4.456 10.115 244 HD13 ILE 30 HD13 ILE 30 -11.078 -3.221 9.708 245 H LEU 31 HN LEU 31 -6.887 -5.841 8.848 246 HA LEU 31 HA LEU 31 -7.141 -7.984 7.043 247 HB2 LEU 31 HB2 LEU 31 -4.922 -6.000 7.505 248 HB3 LEU 31 HB1 LEU 31 -4.885 -7.181 6.209 249 HG LEU 31 HG LEU 31 -7.004 -5.057 6.546 250 HD11 LEU 31 HD11 LEU 31 -4.835 -4.094 5.983 251 HD12 LEU 31 HD12 LEU 31 -5.957 -3.984 4.626 252 HD13 LEU 31 HD13 LEU 31 -4.687 -5.209 4.625 253 HD21 LEU 31 HD21 LEU 31 -6.466 -7.011 4.315 254 HD22 LEU 31 HD22 LEU 31 -7.671 -5.724 4.286 255 HD23 LEU 31 HD23 LEU 31 -7.831 -7.054 5.431 256 H ASP 32 HN ASP 32 -4.846 -7.373 9.672 257 HA ASP 32 HA ASP 32 -3.294 -9.711 9.317 258 HB2 ASP 32 HB2 ASP 32 -2.489 -7.808 10.623 259 HB3 ASP 32 HB1 ASP 32 -3.783 -8.036 11.794 260 H LEU 33 HN LEU 33 -6.349 -9.110 10.830 261 HA LEU 33 HA LEU 33 -6.400 -11.608 12.282 262 HB2 LEU 33 HB2 LEU 33 -7.526 -9.393 12.937 263 HB3 LEU 33 HB1 LEU 33 -8.729 -9.777 11.728 264 HG LEU 33 HG LEU 33 -9.286 -10.316 14.156 265 HD11 LEU 33 HD11 LEU 33 -10.491 -12.329 13.579 266 HD12 LEU 33 HD12 LEU 33 -9.471 -12.560 12.159 267 HD13 LEU 33 HD13 LEU 33 -10.561 -11.176 12.246 268 HD21 LEU 33 HD21 LEU 33 -7.418 -12.616 13.621 269 HD22 LEU 33 HD22 LEU 33 -8.453 -12.419 15.037 270 HD23 LEU 33 HD23 LEU 33 -7.126 -11.292 14.750 271 H LEU 34 HN LEU 34 -7.740 -10.279 9.292 272 HA LEU 34 HA LEU 34 -9.305 -12.613 8.699 273 HB2 LEU 34 HB2 LEU 34 -8.481 -10.305 6.940 274 HB3 LEU 34 HB1 LEU 34 -9.619 -11.556 6.480 275 HG LEU 34 HG LEU 34 -9.978 -9.489 8.645 276 HD11 LEU 34 HD11 LEU 34 -11.462 -9.987 6.069 277 HD12 LEU 34 HD12 LEU 34 -10.315 -8.683 6.368 278 HD13 LEU 34 HD13 LEU 34 -11.834 -8.738 7.260 279 HD21 LEU 34 HD21 LEU 34 -12.182 -10.470 9.008 280 HD22 LEU 34 HD22 LEU 34 -10.901 -11.626 9.373 281 HD23 LEU 34 HD23 LEU 34 -11.804 -11.757 7.864 282 H ALA 35 HN ALA 35 -6.026 -11.911 8.467 283 HA ALA 35 HA ALA 35 -5.326 -13.381 6.148 284 HB1 ALA 35 HB1 ALA 35 -3.692 -12.807 8.620 285 HB2 ALA 35 HB2 ALA 35 -3.799 -11.788 7.185 286 HB3 ALA 35 HB3 ALA 35 -3.060 -13.385 7.077 287 H GLN 36 HN GLN 36 -6.439 -14.312 9.212 288 HA GLN 36 HA GLN 36 -5.235 -16.922 9.286 289 HB2 GLN 36 HB2 GLN 36 -7.634 -15.893 10.813 290 HB3 GLN 36 HB1 GLN 36 -6.675 -17.316 11.200 291 HG2 GLN 36 HG2 GLN 36 -4.776 -15.955 11.743 292 HG3 GLN 36 HG1 GLN 36 -5.611 -14.501 11.198 293 HE21 GLN 36 HE21 GLN 36 -4.460 -15.114 13.794 294 HE22 GLN 36 HE22 GLN 36 -5.752 -14.950 14.939 295 H GLY 37 HN GLY 37 -8.189 -15.502 8.066 296 HA2 GLY 37 HA2 GLY 37 -8.914 -17.295 6.216 297 HA3 GLY 37 HA1 GLY 37 -9.483 -18.069 7.690 298 H GLU 38 HN GLU 38 -11.642 -17.861 7.598 299 HA GLU 38 HA GLU 38 -12.744 -15.226 6.901 300 HB2 GLU 38 HB2 GLU 38 -14.876 -16.456 6.497 301 HB3 GLU 38 HB1 GLU 38 -13.562 -16.952 5.441 302 HG2 GLU 38 HG2 GLU 38 -13.172 -18.860 7.073 303 HG3 GLU 38 HG1 GLU 38 -14.727 -18.423 7.781 304 H ARG 39 HN ARG 39 -13.617 -14.022 8.443 305 HA ARG 39 HA ARG 39 -14.385 -15.338 10.975 306 HB2 ARG 39 HB2 ARG 39 -13.045 -12.642 10.654 307 HB3 ARG 39 HB1 ARG 39 -13.574 -13.350 12.172 308 HG2 ARG 39 HG2 ARG 39 -11.459 -14.509 10.373 309 HG3 ARG 39 HG1 ARG 39 -11.153 -13.534 11.809 310 HD2 ARG 39 HD2 ARG 39 -12.441 -15.253 13.116 311 HD3 ARG 39 HD1 ARG 39 -12.440 -16.253 11.665 312 HE ARG 39 HE ARG 39 -9.880 -15.311 12.726 313 HH11 ARG 39 HH11 ARG 39 -12.111 -17.957 12.170 314 HH12 ARG 39 HH12 ARG 39 -10.910 -19.187 12.455 315 HH21 ARG 39 HH21 ARG 39 -8.322 -16.902 13.129 316 HH22 ARG 39 HH22 ARG 39 -8.747 -18.587 12.996 317 H ALA 40 HN ALA 40 -16.223 -14.597 11.981 318 HA ALA 40 HA ALA 40 -18.126 -13.193 10.375 319 HB1 ALA 40 HB1 ALA 40 -19.619 -13.427 12.290 320 HB2 ALA 40 HB2 ALA 40 -18.265 -13.941 13.297 321 HB3 ALA 40 HB3 ALA 40 -18.796 -14.951 11.951 322 H VAL 41 HN VAL 41 -19.137 -11.181 10.889 323 HA VAL 41 HA VAL 41 -17.404 -9.063 11.333 324 HB VAL 41 HB VAL 41 -20.392 -9.012 11.810 325 HG11 VAL 41 HG11 VAL 41 -19.235 -7.020 12.612 326 HG12 VAL 41 HG12 VAL 41 -20.214 -6.649 11.195 327 HG13 VAL 41 HG13 VAL 41 -18.467 -6.819 11.039 328 HG21 VAL 41 HG21 VAL 41 -19.848 -9.977 9.619 329 HG22 VAL 41 HG22 VAL 41 -18.878 -8.553 9.241 330 HG23 VAL 41 HG23 VAL 41 -20.621 -8.399 9.469 331 H GLU 42 HN GLU 42 -19.621 -10.655 13.605 332 HA GLU 42 HA GLU 42 -19.151 -8.905 15.770 333 HB2 GLU 42 HB2 GLU 42 -19.803 -11.810 16.160 334 HB3 GLU 42 HB1 GLU 42 -20.311 -10.430 17.120 335 HG2 GLU 42 HG2 GLU 42 -22.250 -10.841 16.035 336 HG3 GLU 42 HG1 GLU 42 -21.504 -9.762 14.856 337 H ALA 43 HN ALA 43 -17.536 -11.827 14.688 338 HA ALA 43 HA ALA 43 -15.855 -12.131 16.951 339 HB1 ALA 43 HB1 ALA 43 -15.414 -13.084 14.124 340 HB2 ALA 43 HB2 ALA 43 -16.303 -13.956 15.372 341 HB3 ALA 43 HB3 ALA 43 -14.574 -13.664 15.564 342 H ILE 44 HN ILE 44 -15.433 -10.586 13.795 343 HA ILE 44 HA ILE 44 -12.768 -9.771 14.087 344 HB ILE 44 HB ILE 44 -14.992 -8.369 12.591 345 HG12 ILE 44 HG12 ILE 44 -12.933 -10.331 11.565 346 HG13 ILE 44 HG11 ILE 44 -14.597 -10.756 11.952 347 HG21 ILE 44 HG21 ILE 44 -13.100 -6.893 12.931 348 HG22 ILE 44 HG22 ILE 44 -13.186 -7.389 11.241 349 HG23 ILE 44 HG23 ILE 44 -11.998 -8.127 12.317 350 HD11 ILE 44 HD11 ILE 44 -13.706 -8.809 9.838 351 HD12 ILE 44 HD12 ILE 44 -15.381 -9.193 10.235 352 HD13 ILE 44 HD13 ILE 44 -14.323 -10.440 9.572 353 H ALA 45 HN ALA 45 -15.793 -8.089 14.877 354 HA ALA 45 HA ALA 45 -14.667 -5.703 15.828 355 HB1 ALA 45 HB1 ALA 45 -17.032 -5.939 15.272 356 HB2 ALA 45 HB2 ALA 45 -16.822 -5.328 16.911 357 HB3 ALA 45 HB3 ALA 45 -17.256 -7.017 16.650 358 H THR 46 HN THR 46 -15.671 -8.621 17.583 359 HA THR 46 HA THR 46 -15.022 -7.699 20.152 360 HB THR 46 HB THR 46 -15.052 -10.562 19.175 361 HG1 THR 46 HG1 THR 46 -17.065 -9.862 18.754 362 HG21 THR 46 HG21 THR 46 -15.451 -9.400 21.935 363 HG22 THR 46 HG22 THR 46 -14.046 -10.316 21.392 364 HG23 THR 46 HG23 THR 46 -15.623 -11.100 21.500 365 H ALA 47 HN ALA 47 -13.131 -9.617 17.818 366 HA ALA 47 HA ALA 47 -10.938 -10.116 19.510 367 HB1 ALA 47 HB1 ALA 47 -11.381 -11.393 17.466 368 HB2 ALA 47 HB2 ALA 47 -9.739 -10.749 17.490 369 HB3 ALA 47 HB3 ALA 47 -10.977 -9.976 16.497 370 H THR 48 HN THR 48 -11.658 -7.428 17.346 371 HA THR 48 HA THR 48 -9.027 -6.280 17.710 372 HB THR 48 HB THR 48 -10.005 -4.349 16.400 373 HG1 THR 48 HG1 THR 48 -12.143 -6.112 15.798 374 HG21 THR 48 HG21 THR 48 -9.986 -5.552 14.274 375 HG22 THR 48 HG22 THR 48 -10.179 -7.084 15.127 376 HG23 THR 48 HG23 THR 48 -8.702 -6.140 15.333 377 H GLY 49 HN GLY 49 -12.006 -6.204 19.358 378 HA2 GLY 49 HA2 GLY 49 -12.510 -5.129 21.349 379 HA3 GLY 49 HA1 GLY 49 -11.004 -4.233 21.218 380 H MET 50 HN MET 50 -13.490 -4.399 18.750 381 HA MET 50 HA MET 50 -14.198 -1.595 19.317 382 HB2 MET 50 HB2 MET 50 -13.664 -2.861 16.622 383 HB3 MET 50 HB1 MET 50 -14.462 -1.308 16.822 384 HG2 MET 50 HG2 MET 50 -12.459 -0.457 17.975 385 HG3 MET 50 HG1 MET 50 -11.659 -1.998 17.678 386 HE1 MET 50 HE1 MET 50 -11.251 -2.045 13.819 387 HE2 MET 50 HE2 MET 50 -12.504 -2.809 14.797 388 HE3 MET 50 HE3 MET 50 -10.826 -2.826 15.342 389 H ASN 51 HN ASN 51 -16.317 -1.031 18.041 390 HA ASN 51 HA ASN 51 -18.192 -3.140 18.789 391 HB2 ASN 51 HB2 ASN 51 -19.939 -1.426 18.611 392 HB3 ASN 51 HB1 ASN 51 -18.651 -0.932 19.697 393 HD21 ASN 51 HD21 ASN 51 -19.185 1.213 19.524 394 HD22 ASN 51 HD22 ASN 51 -18.871 2.149 18.101 395 H LEU 52 HN LEU 52 -20.202 -3.310 17.371 396 HA LEU 52 HA LEU 52 -19.355 -4.443 14.938 397 HB2 LEU 52 HB2 LEU 52 -22.018 -3.916 16.183 398 HB3 LEU 52 HB1 LEU 52 -21.942 -4.440 14.513 399 HG LEU 52 HG LEU 52 -22.341 -6.337 15.966 400 HD11 LEU 52 HD11 LEU 52 -20.503 -7.777 15.268 401 HD12 LEU 52 HD12 LEU 52 -19.538 -6.355 14.863 402 HD13 LEU 52 HD13 LEU 52 -21.016 -6.707 13.964 403 HD21 LEU 52 HD21 LEU 52 -19.721 -5.649 17.292 404 HD22 LEU 52 HD22 LEU 52 -20.717 -7.068 17.621 405 HD23 LEU 52 HD23 LEU 52 -21.319 -5.458 18.012 406 H THR 53 HN THR 53 -20.990 -1.371 15.620 407 HA THR 53 HA THR 53 -21.654 -0.747 12.965 408 HB THR 53 HB THR 53 -21.723 1.647 13.781 409 HG1 THR 53 HG1 THR 53 -20.532 1.948 15.511 410 HG21 THR 53 HG21 THR 53 -23.681 0.192 13.817 411 HG22 THR 53 HG22 THR 53 -23.665 1.262 15.219 412 HG23 THR 53 HG23 THR 53 -23.199 -0.430 15.395 413 H THR 54 HN THR 54 -18.796 0.184 14.880 414 HA THR 54 HA THR 54 -17.595 1.596 12.710 415 HB THR 54 HB THR 54 -16.274 0.498 15.203 416 HG1 THR 54 HG1 THR 54 -18.072 2.468 14.896 417 HG21 THR 54 HG21 THR 54 -14.596 2.258 14.788 418 HG22 THR 54 HG22 THR 54 -15.405 2.653 13.270 419 HG23 THR 54 HG23 THR 54 -14.650 1.073 13.483 420 H ALA 55 HN ALA 55 -17.280 -1.680 14.025 421 HA ALA 55 HA ALA 55 -15.079 -2.503 12.503 422 HB1 ALA 55 HB1 ALA 55 -15.754 -4.764 12.994 423 HB2 ALA 55 HB2 ALA 55 -17.373 -4.221 13.427 424 HB3 ALA 55 HB3 ALA 55 -15.992 -3.754 14.421 425 H SER 56 HN SER 56 -18.566 -2.801 11.791 426 HA SER 56 HA SER 56 -18.190 -4.102 9.308 427 HB2 SER 56 HB2 SER 56 -20.586 -3.399 8.878 428 HB3 SER 56 HB1 SER 56 -20.324 -4.310 10.362 429 HG SER 56 HG SER 56 -20.530 -2.460 11.547 430 H ALA 57 HN ALA 57 -18.434 -0.711 10.216 431 HA ALA 57 HA ALA 57 -18.505 0.366 7.613 432 HB1 ALA 57 HB1 ALA 57 -17.751 2.444 8.634 433 HB2 ALA 57 HB2 ALA 57 -17.315 1.577 10.107 434 HB3 ALA 57 HB3 ALA 57 -19.005 1.685 9.614 435 H ASN 58 HN ASN 58 -15.834 -0.557 9.732 436 HA ASN 58 HA ASN 58 -13.756 0.292 8.000 437 HB2 ASN 58 HB2 ASN 58 -13.792 -1.773 10.205 438 HB3 ASN 58 HB1 ASN 58 -12.333 -1.290 9.347 439 HD21 ASN 58 HD21 ASN 58 -12.885 -1.051 12.151 440 HD22 ASN 58 HD22 ASN 58 -12.788 0.632 12.537 441 H LEU 59 HN LEU 59 -15.464 -2.779 8.418 442 HA LEU 59 HA LEU 59 -14.002 -4.301 6.568 443 HB2 LEU 59 HB2 LEU 59 -16.916 -4.464 7.338 444 HB3 LEU 59 HB1 LEU 59 -16.076 -5.677 6.393 445 HG LEU 59 HG LEU 59 -15.370 -4.910 9.223 446 HD11 LEU 59 HD11 LEU 59 -16.327 -7.076 9.830 447 HD12 LEU 59 HD12 LEU 59 -16.836 -7.319 8.159 448 HD13 LEU 59 HD13 LEU 59 -17.536 -6.012 9.114 449 HD21 LEU 59 HD21 LEU 59 -14.372 -7.113 7.423 450 HD22 LEU 59 HD22 LEU 59 -13.985 -6.940 9.134 451 HD23 LEU 59 HD23 LEU 59 -13.456 -5.713 7.984 452 H GLN 60 HN GLN 60 -16.786 -2.169 6.166 453 HA GLN 60 HA GLN 60 -17.198 -2.579 3.420 454 HB2 GLN 60 HB2 GLN 60 -18.828 -1.409 4.797 455 HB3 GLN 60 HB1 GLN 60 -17.679 -0.113 5.106 456 HG2 GLN 60 HG2 GLN 60 -17.697 0.453 2.721 457 HG3 GLN 60 HG1 GLN 60 -18.877 -0.823 2.437 458 HE21 GLN 60 HE21 GLN 60 -20.992 -0.532 3.098 459 HE22 GLN 60 HE22 GLN 60 -21.613 1.008 3.583 460 H ALA 61 HN ALA 61 -15.038 -0.378 5.166 461 HA ALA 61 HA ALA 61 -14.083 1.032 2.917 462 HB1 ALA 61 HB1 ALA 61 -12.231 1.711 4.345 463 HB2 ALA 61 HB2 ALA 61 -12.667 0.469 5.518 464 HB3 ALA 61 HB3 ALA 61 -13.764 1.817 5.212 465 H LEU 62 HN LEU 62 -12.897 -1.873 4.563 466 HA LEU 62 HA LEU 62 -10.633 -2.318 2.950 467 HB2 LEU 62 HB2 LEU 62 -12.291 -3.942 4.792 468 HB3 LEU 62 HB1 LEU 62 -11.312 -4.828 3.641 469 HG LEU 62 HG LEU 62 -9.286 -3.764 4.514 470 HD11 LEU 62 HD11 LEU 62 -11.144 -2.431 6.476 471 HD12 LEU 62 HD12 LEU 62 -10.188 -1.631 5.226 472 HD13 LEU 62 HD13 LEU 62 -9.383 -2.441 6.574 473 HD21 LEU 62 HD21 LEU 62 -10.053 -5.868 5.471 474 HD22 LEU 62 HD22 LEU 62 -11.018 -4.987 6.656 475 HD23 LEU 62 HD23 LEU 62 -9.259 -4.868 6.685 476 H LYS 63 HN LYS 63 -14.014 -3.187 2.545 477 HA LYS 63 HA LYS 63 -13.510 -4.792 0.216 478 HB2 LYS 63 HB2 LYS 63 -15.459 -5.102 1.784 479 HB3 LYS 63 HB1 LYS 63 -16.152 -3.634 1.107 480 HG2 LYS 63 HG2 LYS 63 -16.341 -4.628 -1.051 481 HG3 LYS 63 HG1 LYS 63 -15.426 -6.046 -0.536 482 HD2 LYS 63 HD2 LYS 63 -17.213 -6.599 1.059 483 HD3 LYS 63 HD1 LYS 63 -18.133 -5.198 0.498 484 HE2 LYS 63 HE2 LYS 63 -18.924 -7.241 -0.564 485 HE3 LYS 63 HE1 LYS 63 -18.213 -6.150 -1.751 486 HZ1 LYS 63 HZ1 LYS 63 -16.092 -7.530 -1.345 487 HZ2 LYS 63 HZ2 LYS 63 -17.314 -8.184 -2.309 488 HZ3 LYS 63 HZ3 LYS 63 -17.147 -8.691 -0.705 489 H SER 64 HN SER 64 -14.227 -1.447 0.879 490 HA SER 64 HA SER 64 -14.860 -0.660 -1.767 491 HB2 SER 64 HB2 SER 64 -13.612 0.958 0.473 492 HB3 SER 64 HB1 SER 64 -14.320 1.625 -0.999 493 HG SER 64 HG SER 64 -15.707 0.059 0.936 494 H GLY 65 HN GLY 65 -11.808 -0.918 0.030 495 HA2 GLY 65 HA2 GLY 65 -10.120 -0.128 -2.111 496 HA3 GLY 65 HA1 GLY 65 -9.651 -1.132 -0.741 497 H GLY 66 HN GLY 66 -11.869 -3.017 -1.393 498 HA2 GLY 66 HA2 GLY 66 -12.381 -4.761 -2.797 499 HA3 GLY 66 HA1 GLY 66 -11.341 -4.038 -4.015 500 H LEU 67 HN LEU 67 -10.504 -5.098 -0.703 501 HA LEU 67 HA LEU 67 -8.826 -7.140 -1.995 502 HB2 LEU 67 HB2 LEU 67 -7.093 -6.816 -0.330 503 HB3 LEU 67 HB1 LEU 67 -7.379 -5.368 -1.269 504 HG LEU 67 HG LEU 67 -8.684 -5.663 1.407 505 HD11 LEU 67 HD11 LEU 67 -5.850 -4.772 0.895 506 HD12 LEU 67 HD12 LEU 67 -6.336 -6.245 1.732 507 HD13 LEU 67 HD13 LEU 67 -6.706 -4.670 2.435 508 HD21 LEU 67 HD21 LEU 67 -8.452 -3.234 1.406 509 HD22 LEU 67 HD22 LEU 67 -9.286 -3.773 -0.051 510 HD23 LEU 67 HD23 LEU 67 -7.589 -3.302 -0.130 511 H VAL 68 HN VAL 68 -11.466 -6.849 -0.179 512 HA VAL 68 HA VAL 68 -10.979 -9.448 1.079 513 HB VAL 68 HB VAL 68 -12.198 -8.833 3.111 514 HG11 VAL 68 HG11 VAL 68 -9.776 -8.688 3.145 515 HG12 VAL 68 HG12 VAL 68 -10.486 -7.435 4.163 516 HG13 VAL 68 HG13 VAL 68 -9.850 -7.022 2.571 517 HG21 VAL 68 HG21 VAL 68 -12.690 -6.492 3.635 518 HG22 VAL 68 HG22 VAL 68 -13.587 -7.044 2.220 519 HG23 VAL 68 HG23 VAL 68 -12.166 -6.020 2.018 520 H GLU 69 HN GLU 69 -12.803 -10.759 1.293 521 HA GLU 69 HA GLU 69 -15.201 -9.794 -0.115 522 HB2 GLU 69 HB2 GLU 69 -13.801 -12.447 -0.324 523 HB3 GLU 69 HB1 GLU 69 -15.503 -12.275 -0.737 524 HG2 GLU 69 HG2 GLU 69 -13.211 -10.788 -2.001 525 HG3 GLU 69 HG1 GLU 69 -14.113 -12.125 -2.715 526 H ALA 70 HN ALA 70 -17.198 -10.995 0.451 527 HA ALA 70 HA ALA 70 -17.164 -11.730 3.307 528 HB1 ALA 70 HB1 ALA 70 -19.260 -10.117 1.860 529 HB2 ALA 70 HB2 ALA 70 -18.069 -9.485 2.999 530 HB3 ALA 70 HB3 ALA 70 -19.315 -10.604 3.553 531 H ARG 71 HN ARG 71 -18.013 -13.623 3.761 532 HA ARG 71 HA ARG 71 -19.936 -14.831 1.886 533 HB2 ARG 71 HB2 ARG 71 -17.963 -16.215 2.132 534 HB3 ARG 71 HB1 ARG 71 -18.052 -16.105 3.884 535 HG2 ARG 71 HG2 ARG 71 -20.103 -17.403 3.888 536 HG3 ARG 71 HG1 ARG 71 -20.085 -17.461 2.123 537 HD2 ARG 71 HD2 ARG 71 -17.919 -18.575 3.900 538 HD3 ARG 71 HD1 ARG 71 -19.229 -19.527 3.201 539 HE ARG 71 HE ARG 71 -18.247 -18.565 0.992 540 HH11 ARG 71 HH11 ARG 71 -16.402 -19.550 3.807 541 HH12 ARG 71 HH12 ARG 71 -15.034 -20.073 2.873 542 HH21 ARG 71 HH21 ARG 71 -16.457 -19.257 -0.227 543 HH22 ARG 71 HH22 ARG 71 -15.060 -19.911 0.586 544 H ARG 72 HN ARG 72 -21.933 -14.338 2.603 545 HA ARG 72 HA ARG 72 -22.385 -14.103 5.465 546 HB2 ARG 72 HB2 ARG 72 -24.671 -13.323 4.789 547 HB3 ARG 72 HB1 ARG 72 -23.344 -12.325 4.217 548 HG2 ARG 72 HG2 ARG 72 -23.526 -13.310 2.006 549 HG3 ARG 72 HG1 ARG 72 -24.811 -14.378 2.575 550 HD2 ARG 72 HD2 ARG 72 -26.264 -12.520 2.990 551 HD3 ARG 72 HD1 ARG 72 -24.966 -11.371 2.672 552 HE ARG 72 HE ARG 72 -25.064 -11.999 0.345 553 HH11 ARG 72 HH11 ARG 72 -27.714 -13.097 2.346 554 HH12 ARG 72 HH12 ARG 72 -28.810 -13.299 1.020 555 HH21 ARG 72 HH21 ARG 72 -26.503 -12.243 -1.406 556 HH22 ARG 72 HH22 ARG 72 -28.125 -12.799 -1.125 557 H GLU 73 HN GLU 73 -23.594 -15.400 6.666 558 HA GLU 73 HA GLU 73 -24.960 -17.673 5.425 559 HB2 GLU 73 HB2 GLU 73 -22.647 -18.378 6.039 560 HB3 GLU 73 HB1 GLU 73 -22.978 -17.925 7.702 561 HG2 GLU 73 HG2 GLU 73 -23.166 -20.317 7.397 562 HG3 GLU 73 HG1 GLU 73 -24.726 -19.614 7.828 563 H GLY 74 HN GLY 74 -26.986 -17.541 6.143 564 HA2 GLY 74 HA2 GLY 74 -28.775 -17.252 7.565 565 HA3 GLY 74 HA1 GLY 74 -27.646 -17.346 8.912 566 H THR 75 HN THR 75 -27.255 -15.543 10.035 567 HA THR 75 HA THR 75 -27.911 -12.978 8.738 568 HB THR 75 HB THR 75 -29.502 -13.459 10.542 569 HG1 THR 75 HG1 THR 75 -27.616 -11.373 10.994 570 HG21 THR 75 HG21 THR 75 -28.098 -14.891 11.941 571 HG22 THR 75 HG22 THR 75 -28.762 -13.554 12.879 572 HG23 THR 75 HG23 THR 75 -27.081 -13.507 12.349 573 H ARG 76 HN ARG 76 -25.416 -14.803 9.407 574 HA ARG 76 HA ARG 76 -23.728 -12.687 10.549 575 HB2 ARG 76 HB2 ARG 76 -23.439 -15.665 10.338 576 HB3 ARG 76 HB1 ARG 76 -22.017 -14.651 10.537 577 HG2 ARG 76 HG2 ARG 76 -22.975 -13.733 12.600 578 HG3 ARG 76 HG1 ARG 76 -24.369 -14.802 12.407 579 HD2 ARG 76 HD2 ARG 76 -23.072 -16.731 12.743 580 HD3 ARG 76 HD1 ARG 76 -21.560 -15.860 12.487 581 HE ARG 76 HE ARG 76 -22.370 -14.623 14.642 582 HH11 ARG 76 HH11 ARG 76 -22.659 -18.043 13.923 583 HH12 ARG 76 HH12 ARG 76 -22.506 -18.532 15.584 584 HH21 ARG 76 HH21 ARG 76 -22.163 -15.282 16.836 585 HH22 ARG 76 HH22 ARG 76 -22.228 -16.977 17.228 586 H GLN 77 HN GLN 77 -21.876 -11.990 9.494 587 HA GLN 77 HA GLN 77 -21.558 -12.912 6.722 588 HB2 GLN 77 HB2 GLN 77 -21.194 -10.115 7.815 589 HB3 GLN 77 HB1 GLN 77 -20.699 -10.616 6.205 590 HG2 GLN 77 HG2 GLN 77 -23.042 -11.197 5.696 591 HG3 GLN 77 HG1 GLN 77 -23.506 -10.606 7.289 592 HE21 GLN 77 HE21 GLN 77 -21.046 -9.084 5.325 593 HE22 GLN 77 HE22 GLN 77 -21.936 -7.640 4.992 594 H TYR 78 HN TYR 78 -19.752 -14.003 6.497 595 HA TYR 78 HA TYR 78 -17.547 -13.550 8.361 596 HB2 TYR 78 HB2 TYR 78 -18.086 -15.758 6.364 597 HB3 TYR 78 HB1 TYR 78 -16.622 -15.652 7.338 598 HD1 TYR 78 HD1 TYR 78 -20.285 -16.161 7.477 599 HD2 TYR 78 HD2 TYR 78 -16.613 -16.306 9.626 600 HE1 TYR 78 HE1 TYR 78 -21.412 -17.347 9.314 601 HE2 TYR 78 HE2 TYR 78 -17.730 -17.495 11.465 602 HH TYR 78 HH TYR 78 -20.818 -18.865 11.175 603 H TYR 79 HN TYR 79 -15.977 -12.221 7.779 604 HA TYR 79 HA TYR 79 -15.574 -11.692 4.922 605 HB2 TYR 79 HB2 TYR 79 -14.977 -10.123 7.412 606 HB3 TYR 79 HB1 TYR 79 -14.100 -9.781 5.923 607 HD1 TYR 79 HD2 TYR 79 -17.501 -9.927 7.400 608 HD2 TYR 79 HD1 TYR 79 -15.072 -8.503 4.214 609 HE1 TYR 79 HE2 TYR 79 -19.361 -8.518 6.621 610 HE2 TYR 79 HE1 TYR 79 -16.919 -7.088 3.423 611 HH TYR 79 HH TYR 79 -19.452 -7.118 3.584 612 H ARG 80 HN ARG 80 -13.590 -11.833 3.968 613 HA ARG 80 HA ARG 80 -11.304 -12.785 5.454 614 HB2 ARG 80 HB2 ARG 80 -11.052 -14.815 3.998 615 HB3 ARG 80 HB1 ARG 80 -12.394 -14.899 5.129 616 HG2 ARG 80 HG2 ARG 80 -13.950 -14.331 3.331 617 HG3 ARG 80 HG1 ARG 80 -12.603 -14.247 2.194 618 HD2 ARG 80 HD2 ARG 80 -13.334 -16.703 3.786 619 HD3 ARG 80 HD1 ARG 80 -13.866 -16.402 2.132 620 HE ARG 80 HE ARG 80 -11.472 -16.403 1.507 621 HH11 ARG 80 HH11 ARG 80 -12.502 -18.011 4.441 622 HH12 ARG 80 HH12 ARG 80 -11.133 -19.076 4.508 623 HH21 ARG 80 HH21 ARG 80 -9.671 -17.810 1.561 624 HH22 ARG 80 HH22 ARG 80 -9.521 -18.967 2.843 625 H ILE 81 HN ILE 81 -9.404 -13.034 4.002 626 HA ILE 81 HA ILE 81 -9.098 -10.821 2.306 627 HB ILE 81 HB ILE 81 -7.427 -13.342 2.366 628 HG12 ILE 81 HG12 ILE 81 -7.591 -12.334 4.588 629 HG13 ILE 81 HG11 ILE 81 -5.976 -12.112 3.925 630 HG21 ILE 81 HG21 ILE 81 -5.635 -11.943 1.486 631 HG22 ILE 81 HG22 ILE 81 -6.736 -10.567 1.417 632 HG23 ILE 81 HG23 ILE 81 -7.015 -11.973 0.391 633 HD11 ILE 81 HD11 ILE 81 -6.746 -10.112 5.059 634 HD12 ILE 81 HD12 ILE 81 -8.151 -10.033 3.996 635 HD13 ILE 81 HD13 ILE 81 -6.531 -9.811 3.336 636 H ALA 82 HN ALA 82 -9.317 -10.555 0.132 637 HA ALA 82 HA ALA 82 -11.166 -12.150 -1.228 638 HB1 ALA 82 HB1 ALA 82 -10.807 -9.794 -1.727 639 HB2 ALA 82 HB2 ALA 82 -10.672 -10.786 -3.180 640 HB3 ALA 82 HB3 ALA 82 -9.218 -10.172 -2.393 641 H GLY 83 HN GLY 83 -7.634 -12.152 -1.383 642 HA2 GLY 83 HA2 GLY 83 -7.698 -14.766 -2.632 643 HA3 GLY 83 HA1 GLY 83 -7.038 -13.490 -3.644 644 H GLU 84 HN GLU 84 -5.449 -15.589 -3.052 645 HA GLU 84 HA GLU 84 -3.979 -15.339 -0.638 646 HB2 GLU 84 HB2 GLU 84 -4.099 -17.396 -2.072 647 HB3 GLU 84 HB1 GLU 84 -3.033 -16.592 -3.217 648 HG2 GLU 84 HG2 GLU 84 -1.375 -16.349 -1.355 649 HG3 GLU 84 HG1 GLU 84 -2.419 -17.391 -0.389 650 H ASP 85 HN ASP 85 -3.690 -13.846 -3.788 651 HA ASP 85 HA ASP 85 -1.008 -12.946 -3.509 652 HB2 ASP 85 HB2 ASP 85 -3.274 -11.866 -5.201 653 HB3 ASP 85 HB1 ASP 85 -1.607 -11.309 -5.310 654 H VAL 86 HN VAL 86 -4.085 -11.746 -2.435 655 HA VAL 86 HA VAL 86 -3.101 -9.169 -1.625 656 HB VAL 86 HB VAL 86 -5.614 -10.586 -0.719 657 HG11 VAL 86 HG11 VAL 86 -6.415 -8.339 -0.183 658 HG12 VAL 86 HG12 VAL 86 -4.864 -7.664 -0.687 659 HG13 VAL 86 HG13 VAL 86 -4.949 -8.728 0.717 660 HG21 VAL 86 HG21 VAL 86 -6.761 -9.279 -2.455 661 HG22 VAL 86 HG22 VAL 86 -5.584 -10.400 -3.142 662 HG23 VAL 86 HG23 VAL 86 -5.201 -8.682 -3.022 663 H ALA 87 HN ALA 87 -3.745 -12.284 -0.097 664 HA ALA 87 HA ALA 87 -3.110 -11.561 2.547 665 HB1 ALA 87 HB1 ALA 87 -2.763 -14.251 1.220 666 HB2 ALA 87 HB2 ALA 87 -4.250 -13.658 1.963 667 HB3 ALA 87 HB3 ALA 87 -2.822 -13.944 2.956 668 H ARG 88 HN ARG 88 -1.122 -12.880 -0.073 669 HA ARG 88 HA ARG 88 1.306 -12.859 1.383 670 HB2 ARG 88 HB2 ARG 88 0.589 -13.076 -1.512 671 HB3 ARG 88 HB1 ARG 88 2.266 -12.802 -1.062 672 HG2 ARG 88 HG2 ARG 88 2.182 -14.829 0.351 673 HG3 ARG 88 HG1 ARG 88 0.536 -15.116 -0.216 674 HD2 ARG 88 HD2 ARG 88 2.724 -14.750 -2.209 675 HD3 ARG 88 HD1 ARG 88 2.581 -16.291 -1.368 676 HE ARG 88 HE ARG 88 0.492 -16.651 -2.405 677 HH11 ARG 88 HH11 ARG 88 2.037 -13.690 -3.499 678 HH12 ARG 88 HH12 ARG 88 1.070 -13.578 -4.936 679 HH21 ARG 88 HH21 ARG 88 -0.736 -16.509 -4.311 680 HH22 ARG 88 HH22 ARG 88 -0.496 -15.176 -5.404 681 H LEU 89 HN LEU 89 -0.429 -10.388 -0.361 682 HA LEU 89 HA LEU 89 1.690 -8.529 -0.613 683 HB2 LEU 89 HB2 LEU 89 -0.449 -8.339 -1.830 684 HB3 LEU 89 HB1 LEU 89 -1.285 -8.044 -0.323 685 HG LEU 89 HG LEU 89 -0.791 -6.048 -1.865 686 HD11 LEU 89 HD11 LEU 89 -0.465 -4.540 0.019 687 HD12 LEU 89 HD12 LEU 89 0.026 -5.900 1.030 688 HD13 LEU 89 HD13 LEU 89 -1.624 -5.811 0.412 689 HD21 LEU 89 HD21 LEU 89 1.389 -4.979 -1.526 690 HD22 LEU 89 HD22 LEU 89 1.535 -6.537 -2.342 691 HD23 LEU 89 HD23 LEU 89 1.936 -6.398 -0.629 692 H PHE 90 HN PHE 90 -0.845 -8.905 1.876 693 HA PHE 90 HA PHE 90 0.184 -6.867 3.554 694 HB2 PHE 90 HB2 PHE 90 -2.151 -7.750 3.683 695 HB3 PHE 90 HB1 PHE 90 -1.509 -9.236 4.376 696 HD1 PHE 90 HD2 PHE 90 -1.574 -5.558 4.926 697 HD2 PHE 90 HD1 PHE 90 -1.284 -9.429 6.671 698 HE1 PHE 90 HE2 PHE 90 -1.685 -4.552 7.167 699 HE2 PHE 90 HE1 PHE 90 -1.392 -8.428 8.914 700 HZ PHE 90 HZ PHE 90 -1.590 -5.987 9.165 701 H ALA 91 HN ALA 91 0.775 -10.320 3.305 702 HA ALA 91 HA ALA 91 2.400 -10.571 5.602 703 HB1 ALA 91 HB1 ALA 91 2.517 -12.145 3.029 704 HB2 ALA 91 HB2 ALA 91 1.480 -12.503 4.411 705 HB3 ALA 91 HB3 ALA 91 3.233 -12.618 4.570 706 H LEU 92 HN LEU 92 3.125 -9.834 2.223 707 HA LEU 92 HA LEU 92 5.909 -9.740 2.396 708 HB2 LEU 92 HB2 LEU 92 4.488 -9.739 0.311 709 HB3 LEU 92 HB1 LEU 92 4.170 -8.042 0.600 710 HG LEU 92 HG LEU 92 6.993 -9.030 0.298 711 HD11 LEU 92 HD11 LEU 92 5.102 -8.254 -1.922 712 HD12 LEU 92 HD12 LEU 92 5.770 -9.863 -1.639 713 HD13 LEU 92 HD13 LEU 92 6.835 -8.533 -2.095 714 HD21 LEU 92 HD21 LEU 92 6.640 -6.743 1.107 715 HD22 LEU 92 HD22 LEU 92 5.652 -6.395 -0.312 716 HD23 LEU 92 HD23 LEU 92 7.369 -6.756 -0.500 717 H VAL 93 HN VAL 93 3.531 -7.085 2.691 718 HA VAL 93 HA VAL 93 5.477 -5.093 3.185 719 HB VAL 93 HB VAL 93 3.679 -3.634 3.882 720 HG11 VAL 93 HG11 VAL 93 2.838 -5.410 1.597 721 HG12 VAL 93 HG12 VAL 93 3.918 -4.018 1.501 722 HG13 VAL 93 HG13 VAL 93 2.218 -3.790 1.916 723 HG21 VAL 93 HG21 VAL 93 1.923 -6.087 3.901 724 HG22 VAL 93 HG22 VAL 93 1.372 -4.425 4.113 725 HG23 VAL 93 HG23 VAL 93 2.433 -5.161 5.312 726 H GLN 94 HN GLN 94 3.872 -7.381 5.262 727 HA GLN 94 HA GLN 94 4.577 -6.112 7.722 728 HB2 GLN 94 HB2 GLN 94 2.723 -7.810 7.384 729 HB3 GLN 94 HB1 GLN 94 3.976 -9.041 7.298 730 HG2 GLN 94 HG2 GLN 94 4.683 -8.527 9.552 731 HG3 GLN 94 HG1 GLN 94 3.503 -7.215 9.642 732 HE21 GLN 94 HE21 GLN 94 1.313 -7.716 9.811 733 HE22 GLN 94 HE22 GLN 94 0.756 -9.284 10.279 734 H VAL 95 HN VAL 95 6.010 -8.626 5.692 735 HA VAL 95 HA VAL 95 8.246 -9.186 7.318 736 HB VAL 95 HB VAL 95 7.940 -9.369 4.308 737 HG11 VAL 95 HG11 VAL 95 10.302 -9.232 4.899 738 HG12 VAL 95 HG12 VAL 95 9.890 -10.859 4.361 739 HG13 VAL 95 HG13 VAL 95 10.094 -10.524 6.079 740 HG21 VAL 95 HG21 VAL 95 7.748 -11.461 6.475 741 HG22 VAL 95 HG22 VAL 95 7.643 -11.770 4.741 742 HG23 VAL 95 HG23 VAL 95 6.406 -10.800 5.541 743 H VAL 96 HN VAL 96 7.633 -6.734 4.849 744 HA VAL 96 HA VAL 96 10.186 -5.558 4.779 745 HB VAL 96 HB VAL 96 7.470 -4.274 4.384 746 HG11 VAL 96 HG11 VAL 96 10.207 -3.230 3.656 747 HG12 VAL 96 HG12 VAL 96 9.150 -2.580 4.909 748 HG13 VAL 96 HG13 VAL 96 8.670 -2.484 3.213 749 HG21 VAL 96 HG21 VAL 96 8.000 -4.505 1.993 750 HG22 VAL 96 HG22 VAL 96 7.925 -6.066 2.809 751 HG23 VAL 96 HG23 VAL 96 9.488 -5.350 2.419 752 H ALA 97 HN ALA 97 7.373 -4.889 6.860 753 HA ALA 97 HA ALA 97 8.671 -2.821 8.335 754 HB1 ALA 97 HB1 ALA 97 6.276 -4.496 9.090 755 HB2 ALA 97 HB2 ALA 97 6.233 -2.971 8.202 756 HB3 ALA 97 HB3 ALA 97 6.783 -3.002 9.878 757 H ASP 98 HN ASP 98 8.934 -6.205 8.380 758 HA ASP 98 HA ASP 98 9.777 -6.357 11.160 759 HB2 ASP 98 HB2 ASP 98 8.401 -8.169 10.192 760 HB3 ASP 98 HB1 ASP 98 9.677 -8.504 9.026 761 H GLU 99 HN GLU 99 11.245 -7.577 8.135 762 HA GLU 99 HA GLU 99 13.844 -7.400 9.448 763 HB2 GLU 99 HB2 GLU 99 14.672 -8.778 7.596 764 HB3 GLU 99 HB1 GLU 99 13.293 -9.520 8.396 765 HG2 GLU 99 HG2 GLU 99 11.854 -9.003 6.605 766 HG3 GLU 99 HG1 GLU 99 13.028 -7.903 5.883 767 H HIS 100 HN HIS 100 12.107 -6.001 6.736 768 HA HIS 100 HA HIS 100 14.467 -4.894 5.533 769 HB2 HIS 100 HB2 HIS 100 12.404 -5.493 4.245 770 HB3 HIS 100 HB1 HIS 100 11.590 -4.130 5.004 771 HD1 HIS 100 HD1 HIS 100 11.751 -1.971 3.780 772 HD2 HIS 100 HD2 HIS 100 14.722 -4.641 2.663 773 HE1 HIS 100 HE1 HIS 100 12.995 -0.844 1.912 774 HE2 HIS 100 HE2 HIS 100 14.668 -2.561 1.131 775 H LEU 101 HN LEU 101 12.260 -3.930 7.977 776 HA LEU 101 HA LEU 101 12.913 -1.141 7.943 777 HB2 LEU 101 HB2 LEU 101 10.821 -2.031 8.918 778 HB3 LEU 101 HB1 LEU 101 11.757 -2.847 10.155 779 HG LEU 101 HG LEU 101 12.532 -0.644 10.984 780 HD11 LEU 101 HD11 LEU 101 10.606 0.422 8.928 781 HD12 LEU 101 HD12 LEU 101 12.356 0.638 8.946 782 HD13 LEU 101 HD13 LEU 101 11.364 1.375 10.203 783 HD21 LEU 101 HD21 LEU 101 10.603 -1.747 11.991 784 HD22 LEU 101 HD22 LEU 101 9.539 -0.962 10.823 785 HD23 LEU 101 HD23 LEU 101 10.415 0.007 12.009 786 H GLU 102 HN GLU 102 14.403 -3.987 8.992 787 HA GLU 102 HA GLU 102 16.432 -4.440 9.860 788 HB2 GLU 102 HB2 GLU 102 17.162 -2.398 8.620 789 HB3 GLU 102 HB1 GLU 102 16.861 -1.459 10.075 790 HG2 GLU 102 HG2 GLU 102 18.554 -2.704 11.267 791 HG3 GLU 102 HG1 GLU 102 18.814 -3.738 9.861 792 H HIS 103 HN HIS 103 17.163 -4.941 11.875 793 HA HIS 103 HA HIS 103 15.530 -3.890 14.076 794 HB2 HIS 103 HB2 HIS 103 15.509 -6.376 13.472 795 HB3 HIS 103 HB1 HIS 103 17.153 -6.435 14.093 796 HD1 HIS 103 HD1 HIS 103 17.215 -7.297 16.401 797 HD2 HIS 103 HD2 HIS 103 13.747 -5.124 15.663 798 HE1 HIS 103 HE1 HIS 103 15.900 -7.368 18.544 799 HE2 HIS 103 HE2 HIS 103 13.734 -6.187 18.028 800 H HIS 104 HN HIS 104 18.018 -2.705 12.921 801 HA HIS 104 HA HIS 104 20.113 -3.129 14.831 802 HB2 HIS 104 HB2 HIS 104 20.567 -2.427 12.502 803 HB3 HIS 104 HB1 HIS 104 19.775 -0.889 12.824 804 HD1 HIS 104 HD1 HIS 104 21.055 0.789 14.417 805 HD2 HIS 104 HD2 HIS 104 23.172 -2.642 13.385 806 HE1 HIS 104 HE1 HIS 104 23.450 1.270 14.996 807 HE2 HIS 104 HE2 HIS 104 24.730 -0.725 14.146 808 H HIS 105 HN HIS 105 17.651 -0.642 14.291 809 HA HIS 105 HA HIS 105 18.466 1.117 16.300 810 HB2 HIS 105 HB2 HIS 105 16.067 1.912 16.338 811 HB3 HIS 105 HB1 HIS 105 16.855 1.949 14.770 812 HD1 HIS 105 HD1 HIS 105 14.003 0.431 16.607 813 HD2 HIS 105 HD2 HIS 105 15.848 0.089 12.894 814 HE1 HIS 105 HE1 HIS 105 12.396 -0.858 15.164 815 HE2 HIS 105 HE2 HIS 105 13.638 -1.241 13.004 816 H HIS 106 HN HIS 106 19.024 0.342 18.175 817 HA HIS 106 HA HIS 106 16.984 -0.582 19.996 818 HB2 HIS 106 HB2 HIS 106 17.652 -2.718 19.030 819 HB3 HIS 106 HB1 HIS 106 19.353 -2.329 19.260 820 HD1 HIS 106 HD1 HIS 106 20.389 -2.933 21.469 821 HD2 HIS 106 HD2 HIS 106 16.241 -3.238 21.491 822 HE1 HIS 106 HE1 HIS 106 19.801 -4.030 23.648 823 HE2 HIS 106 HE2 HIS 106 17.290 -3.924 23.751 824 H HIS 107 HN HIS 107 17.329 0.712 21.686 825 HA HIS 107 HA HIS 107 20.127 1.286 22.436 826 HB2 HIS 107 HB2 HIS 107 18.876 3.172 21.251 827 HB3 HIS 107 HB1 HIS 107 17.874 3.275 22.693 828 HD1 HIS 107 HD1 HIS 107 18.607 5.219 24.022 829 HD2 HIS 107 HD2 HIS 107 21.824 3.211 22.308 830 HE1 HIS 107 HE1 HIS 107 20.670 6.436 24.806 831 HE2 HIS 107 HE2 HIS 107 22.607 5.176 23.800 832 H HIS 108 HN HIS 108 17.469 -0.289 23.378 833 HA HIS 108 HA HIS 108 18.137 0.060 26.206 834 HB2 HIS 108 HB2 HIS 108 15.994 1.322 25.558 835 HB3 HIS 108 HB1 HIS 108 15.268 -0.268 25.330 836 HD1 HIS 108 HD1 HIS 108 14.809 -1.686 27.464 837 HD2 HIS 108 HD2 HIS 108 16.468 2.060 28.200 838 HE1 HIS 108 HE1 HIS 108 14.570 -1.307 29.939 839 HE2 HIS 108 HE2 HIS 108 15.787 0.857 30.383 840 H1 MET 1 HT1 MET 1 4.834 4.109 25.739 841 H2 MET 1 HT2 MET 1 3.306 4.758 25.413 842 H3 MET 1 HT3 MET 1 4.117 5.184 26.835 843 HA MET 1 HA MET 1 4.942 5.838 24.068 844 HB2 MET 1 HB2 MET 1 4.483 8.164 24.691 845 HB3 MET 1 HB1 MET 1 3.040 7.168 24.819 846 HG2 MET 1 HG2 MET 1 3.321 7.054 27.234 847 HG3 MET 1 HG1 MET 1 4.785 8.028 27.115 848 HE1 MET 1 HE1 MET 1 2.067 10.374 28.790 849 HE2 MET 1 HE2 MET 1 3.647 9.621 29.001 850 HE3 MET 1 HE3 MET 1 2.194 8.624 28.965 851 H ALA 2 HN ALA 2 5.932 5.372 27.334 852 HA ALA 2 HA ALA 2 8.332 6.975 27.055 853 HB1 ALA 2 HB1 ALA 2 7.535 4.995 29.194 854 HB2 ALA 2 HB2 ALA 2 7.286 6.741 29.254 855 HB3 ALA 2 HB3 ALA 2 8.924 6.084 29.259 856 H GLY 3 HN GLY 3 7.368 3.598 27.026 857 HA2 GLY 3 HA2 GLY 3 9.904 2.969 25.657 858 HA3 GLY 3 HA1 GLY 3 9.203 1.882 26.853 859 H GLN 4 HN GLN 4 9.079 0.214 25.263 860 HA GLN 4 HA GLN 4 7.357 0.673 22.965 861 HB2 GLN 4 HB2 GLN 4 8.711 -1.867 23.895 862 HB3 GLN 4 HB1 GLN 4 7.876 -1.650 22.364 863 HG2 GLN 4 HG2 GLN 4 10.282 -0.047 23.188 864 HG3 GLN 4 HG1 GLN 4 10.378 -1.543 22.268 865 HE21 GLN 4 HE21 GLN 4 7.867 0.884 21.825 866 HE22 GLN 4 HE22 GLN 4 8.368 1.381 20.247 867 H SER 5 HN SER 5 5.420 1.135 24.002 868 HA SER 5 HA SER 5 4.241 -0.580 25.933 869 HB2 SER 5 HB2 SER 5 2.918 1.521 24.203 870 HB3 SER 5 HB1 SER 5 2.291 0.853 25.711 871 HG SER 5 HG SER 5 4.137 1.724 26.774 872 H ASP 6 HN ASP 6 4.063 -0.353 22.443 873 HA ASP 6 HA ASP 6 2.621 -2.887 22.390 874 HB2 ASP 6 HB2 ASP 6 0.929 -1.021 22.208 875 HB3 ASP 6 HB1 ASP 6 1.725 -0.524 20.719 876 H ARG 7 HN ARG 7 3.029 -4.096 20.502 877 HA ARG 7 HA ARG 7 5.509 -3.321 19.198 878 HB2 ARG 7 HB2 ARG 7 3.934 -5.889 19.268 879 HB3 ARG 7 HB1 ARG 7 5.359 -5.676 18.262 880 HG2 ARG 7 HG2 ARG 7 6.746 -5.337 20.187 881 HG3 ARG 7 HG1 ARG 7 5.340 -5.325 21.252 882 HD2 ARG 7 HD2 ARG 7 6.662 -7.468 21.213 883 HD3 ARG 7 HD1 ARG 7 4.935 -7.631 20.891 884 HE ARG 7 HE ARG 7 5.435 -8.016 18.601 885 HH11 ARG 7 HH11 ARG 7 8.270 -7.894 20.670 886 HH12 ARG 7 HH12 ARG 7 9.300 -8.658 19.498 887 HH21 ARG 7 HH21 ARG 7 6.784 -9.043 17.080 888 HH22 ARG 7 HH22 ARG 7 8.466 -9.297 17.459 889 H LYS 8 HN LYS 8 2.195 -4.197 18.307 890 HA LYS 8 HA LYS 8 2.631 -4.021 15.505 891 HB2 LYS 8 HB2 LYS 8 0.200 -4.145 17.249 892 HB3 LYS 8 HB1 LYS 8 0.037 -3.795 15.535 893 HG2 LYS 8 HG2 LYS 8 1.172 -5.905 15.008 894 HG3 LYS 8 HG1 LYS 8 1.287 -6.256 16.736 895 HD2 LYS 8 HD2 LYS 8 -1.046 -6.429 16.962 896 HD3 LYS 8 HD1 LYS 8 -1.337 -5.677 15.394 897 HE2 LYS 8 HE2 LYS 8 -0.339 -7.636 14.296 898 HE3 LYS 8 HE1 LYS 8 -0.109 -8.389 15.874 899 HZ1 LYS 8 HZ1 LYS 8 -2.741 -7.580 14.756 900 HZ2 LYS 8 HZ2 LYS 8 -2.475 -8.404 16.211 901 HZ3 LYS 8 HZ3 LYS 8 -2.129 -9.160 14.732 902 H ALA 9 HN ALA 9 1.534 -1.759 17.962 903 HA ALA 9 HA ALA 9 0.445 0.248 16.397 904 HB1 ALA 9 HB1 ALA 9 0.975 1.779 18.226 905 HB2 ALA 9 HB2 ALA 9 2.078 0.583 18.906 906 HB3 ALA 9 HB3 ALA 9 0.350 0.245 18.829 907 H ALA 10 HN ALA 10 3.801 -0.566 16.840 908 HA ALA 10 HA ALA 10 4.715 1.863 15.533 909 HB1 ALA 10 HB1 ALA 10 6.260 -0.557 16.461 910 HB2 ALA 10 HB2 ALA 10 6.027 0.937 17.372 911 HB3 ALA 10 HB3 ALA 10 6.957 0.952 15.872 912 H LEU 11 HN LEU 11 4.296 -1.559 14.827 913 HA LEU 11 HA LEU 11 5.762 -1.495 12.369 914 HB2 LEU 11 HB2 LEU 11 3.812 -3.544 13.427 915 HB3 LEU 11 HB1 LEU 11 4.854 -3.766 12.035 916 HG LEU 11 HG LEU 11 5.788 -3.377 14.878 917 HD11 LEU 11 HD11 LEU 11 5.737 -5.819 13.114 918 HD12 LEU 11 HD12 LEU 11 4.758 -5.542 14.555 919 HD13 LEU 11 HD13 LEU 11 6.508 -5.716 14.698 920 HD21 LEU 11 HD21 LEU 11 7.355 -2.440 13.268 921 HD22 LEU 11 HD22 LEU 11 7.339 -3.946 12.353 922 HD23 LEU 11 HD23 LEU 11 8.006 -3.913 13.985 923 H LEU 12 HN LEU 12 2.341 -1.433 13.250 924 HA LEU 12 HA LEU 12 1.383 -1.553 10.580 925 HB2 LEU 12 HB2 LEU 12 0.043 -0.616 13.116 926 HB3 LEU 12 HB1 LEU 12 -0.781 -0.817 11.581 927 HG LEU 12 HG LEU 12 0.534 -3.011 13.185 928 HD11 LEU 12 HD11 LEU 12 -2.369 -2.411 12.638 929 HD12 LEU 12 HD12 LEU 12 -1.538 -2.199 14.179 930 HD13 LEU 12 HD13 LEU 12 -1.750 -3.815 13.506 931 HD21 LEU 12 HD21 LEU 12 -0.429 -4.529 11.534 932 HD22 LEU 12 HD22 LEU 12 0.711 -3.415 10.780 933 HD23 LEU 12 HD23 LEU 12 -1.025 -3.155 10.605 934 H ASP 13 HN ASP 13 2.317 1.080 12.704 935 HA ASP 13 HA ASP 13 1.280 3.174 11.084 936 HB2 ASP 13 HB2 ASP 13 1.859 3.696 13.357 937 HB3 ASP 13 HB1 ASP 13 3.513 3.139 13.124 938 H GLN 14 HN GLN 14 4.331 1.412 11.149 939 HA GLN 14 HA GLN 14 5.689 3.053 9.295 940 HB2 GLN 14 HB2 GLN 14 6.754 1.375 10.835 941 HB3 GLN 14 HB1 GLN 14 6.157 0.108 9.770 942 HG2 GLN 14 HG2 GLN 14 8.499 0.642 9.338 943 HG3 GLN 14 HG1 GLN 14 7.477 0.971 7.940 944 HE21 GLN 14 HE21 GLN 14 9.420 2.363 10.467 945 HE22 GLN 14 HE22 GLN 14 9.502 3.956 9.798 946 H VAL 15 HN VAL 15 3.840 0.024 8.841 947 HA VAL 15 HA VAL 15 4.208 0.038 6.015 948 HB VAL 15 HB VAL 15 2.394 -1.653 5.930 949 HG11 VAL 15 HG11 VAL 15 4.531 -2.142 7.995 950 HG12 VAL 15 HG12 VAL 15 4.702 -2.328 6.248 951 HG13 VAL 15 HG13 VAL 15 3.616 -3.388 7.146 952 HG21 VAL 15 HG21 VAL 15 1.495 -2.554 8.020 953 HG22 VAL 15 HG22 VAL 15 1.018 -0.872 7.781 954 HG23 VAL 15 HG23 VAL 15 2.304 -1.273 8.919 955 H ALA 16 HN ALA 16 1.776 1.392 8.161 956 HA ALA 16 HA ALA 16 -0.074 2.153 6.158 957 HB1 ALA 16 HB1 ALA 16 0.435 3.463 8.829 958 HB2 ALA 16 HB2 ALA 16 -0.657 2.107 8.539 959 HB3 ALA 16 HB3 ALA 16 -0.991 3.679 7.813 960 H ARG 17 HN ARG 17 2.945 3.456 7.243 961 HA ARG 17 HA ARG 17 2.692 6.018 6.025 962 HB2 ARG 17 HB2 ARG 17 4.341 5.678 7.749 963 HB3 ARG 17 HB1 ARG 17 5.101 4.386 6.832 964 HG2 ARG 17 HG2 ARG 17 5.898 5.927 5.190 965 HG3 ARG 17 HG1 ARG 17 4.980 7.248 5.920 966 HD2 ARG 17 HD2 ARG 17 7.180 5.716 7.299 967 HD3 ARG 17 HD1 ARG 17 7.386 7.281 6.507 968 HE ARG 17 HE ARG 17 5.686 8.125 8.131 969 HH11 ARG 17 HH11 ARG 17 7.603 5.288 8.887 970 HH12 ARG 17 HH12 ARG 17 7.512 5.540 10.607 971 HH21 ARG 17 HH21 ARG 17 5.597 8.450 10.397 972 HH22 ARG 17 HH22 ARG 17 6.375 7.308 11.453 973 H VAL 18 HN VAL 18 4.053 2.912 5.006 974 HA VAL 18 HA VAL 18 4.963 3.663 2.470 975 HB VAL 18 HB VAL 18 3.756 0.996 3.244 976 HG11 VAL 18 HG11 VAL 18 5.687 1.709 1.039 977 HG12 VAL 18 HG12 VAL 18 3.988 1.280 0.832 978 HG13 VAL 18 HG13 VAL 18 5.131 0.084 1.445 979 HG21 VAL 18 HG21 VAL 18 6.041 0.294 3.741 980 HG22 VAL 18 HG22 VAL 18 5.554 1.641 4.768 981 HG23 VAL 18 HG23 VAL 18 6.624 1.921 3.397 982 H GLY 19 HN GLY 19 1.823 2.259 3.400 983 HA2 GLY 19 HA2 GLY 19 0.611 2.433 0.875 984 HA3 GLY 19 HA1 GLY 19 -0.244 2.376 2.408 985 H LYS 20 HN LYS 20 0.845 4.785 3.482 986 HA LYS 20 HA LYS 20 -0.939 6.679 2.383 987 HB2 LYS 20 HB2 LYS 20 -0.345 6.692 4.736 988 HB3 LYS 20 HB1 LYS 20 1.339 6.990 4.344 989 HG2 LYS 20 HG2 LYS 20 0.929 9.195 3.721 990 HG3 LYS 20 HG1 LYS 20 -0.804 8.921 3.550 991 HD2 LYS 20 HD2 LYS 20 -0.201 10.222 5.577 992 HD3 LYS 20 HD1 LYS 20 -1.067 8.729 5.929 993 HE2 LYS 20 HE2 LYS 20 1.913 8.677 5.947 994 HE3 LYS 20 HE1 LYS 20 1.083 9.447 7.298 995 HZ1 LYS 20 HZ1 LYS 20 -0.190 7.364 7.589 996 HZ2 LYS 20 HZ2 LYS 20 1.476 7.155 7.826 997 HZ3 LYS 20 HZ3 LYS 20 0.752 6.637 6.383 998 H ALA 21 HN ALA 21 2.450 5.996 1.836 999 HA ALA 21 HA ALA 21 2.927 8.424 0.359 1000 HB1 ALA 21 HB1 ALA 21 4.573 5.894 0.473 1001 HB2 ALA 21 HB2 ALA 21 4.752 7.285 1.545 1002 HB3 ALA 21 HB3 ALA 21 5.094 7.447 -0.178 1003 H LEU 22 HN LEU 22 1.635 5.307 -0.306 1004 HA LEU 22 HA LEU 22 1.998 5.491 -3.176 1005 HB2 LEU 22 HB2 LEU 22 0.323 3.580 -1.540 1006 HB3 LEU 22 HB1 LEU 22 0.675 3.425 -3.249 1007 HG LEU 22 HG LEU 22 2.712 3.273 -1.022 1008 HD11 LEU 22 HD11 LEU 22 2.849 0.902 -1.628 1009 HD12 LEU 22 HD12 LEU 22 1.534 1.126 -2.782 1010 HD13 LEU 22 HD13 LEU 22 1.239 1.338 -1.057 1011 HD21 LEU 22 HD21 LEU 22 3.006 2.813 -3.989 1012 HD22 LEU 22 HD22 LEU 22 4.260 2.569 -2.770 1013 HD23 LEU 22 HD23 LEU 22 3.641 4.192 -3.089 1014 H ALA 23 HN ALA 23 -0.462 6.215 -0.811 1015 HA ALA 23 HA ALA 23 -2.649 6.265 -2.643 1016 HB1 ALA 23 HB1 ALA 23 -2.498 7.450 0.122 1017 HB2 ALA 23 HB2 ALA 23 -2.911 5.775 -0.244 1018 HB3 ALA 23 HB3 ALA 23 -3.959 7.082 -0.795 1019 H ASN 24 HN ASN 24 -1.861 7.662 -4.288 1020 HA ASN 24 HA ASN 24 -2.892 10.285 -4.036 1021 HB2 ASN 24 HB2 ASN 24 -0.771 11.521 -4.587 1022 HB3 ASN 24 HB1 ASN 24 -0.840 10.879 -2.949 1023 HD21 ASN 24 HD21 ASN 24 0.636 9.431 -2.296 1024 HD22 ASN 24 HD22 ASN 24 1.935 8.843 -3.281 1025 H GLY 25 HN GLY 25 -0.651 8.234 -5.881 1026 HA2 GLY 25 HA2 GLY 25 -1.171 7.481 -8.088 1027 HA3 GLY 25 HA1 GLY 25 -2.189 8.898 -8.300 1028 H ARG 26 HN ARG 26 -0.615 10.983 -7.702 1029 HA ARG 26 HA ARG 26 0.890 11.356 -10.008 1030 HB2 ARG 26 HB2 ARG 26 0.226 12.863 -7.644 1031 HB3 ARG 26 HB1 ARG 26 1.897 13.153 -8.102 1032 HG2 ARG 26 HG2 ARG 26 0.480 14.791 -9.132 1033 HG3 ARG 26 HG1 ARG 26 1.151 13.732 -10.372 1034 HD2 ARG 26 HD2 ARG 26 -1.147 14.092 -10.886 1035 HD3 ARG 26 HD1 ARG 26 -0.980 12.437 -10.306 1036 HE ARG 26 HE ARG 26 -1.644 13.766 -8.058 1037 HH11 ARG 26 HH11 ARG 26 -3.036 13.761 -11.280 1038 HH12 ARG 26 HH12 ARG 26 -4.651 14.063 -10.707 1039 HH21 ARG 26 HH21 ARG 26 -3.767 14.165 -7.323 1040 HH22 ARG 26 HH22 ARG 26 -5.062 14.292 -8.473 1041 H ARG 27 HN ARG 27 1.952 10.406 -6.771 1042 HA ARG 27 HA ARG 27 4.742 10.588 -7.515 1043 HB2 ARG 27 HB2 ARG 27 3.558 9.415 -4.994 1044 HB3 ARG 27 HB1 ARG 27 5.206 9.989 -5.232 1045 HG2 ARG 27 HG2 ARG 27 4.423 12.264 -5.462 1046 HG3 ARG 27 HG1 ARG 27 2.748 11.725 -5.349 1047 HD2 ARG 27 HD2 ARG 27 3.330 10.810 -3.066 1048 HD3 ARG 27 HD1 ARG 27 4.856 11.688 -3.202 1049 HE ARG 27 HE ARG 27 2.306 13.127 -3.502 1050 HH11 ARG 27 HH11 ARG 27 5.267 12.581 -1.711 1051 HH12 ARG 27 HH12 ARG 27 5.103 14.029 -0.761 1052 HH21 ARG 27 HH21 ARG 27 2.086 14.996 -2.253 1053 HH22 ARG 27 HH22 ARG 27 3.296 15.402 -1.077 1054 H LEU 28 HN LEU 28 2.273 8.289 -7.750 1055 HA LEU 28 HA LEU 28 3.865 5.919 -7.599 1056 HB2 LEU 28 HB2 LEU 28 1.202 6.428 -8.928 1057 HB3 LEU 28 HB1 LEU 28 1.938 4.846 -8.757 1058 HG LEU 28 HG LEU 28 1.042 6.630 -6.493 1059 HD11 LEU 28 HD11 LEU 28 -0.096 4.041 -7.540 1060 HD12 LEU 28 HD12 LEU 28 -0.809 5.641 -7.750 1061 HD13 LEU 28 HD13 LEU 28 -0.675 4.941 -6.136 1062 HD21 LEU 28 HD21 LEU 28 2.212 3.848 -6.466 1063 HD22 LEU 28 HD22 LEU 28 1.537 4.692 -5.072 1064 HD23 LEU 28 HD23 LEU 28 2.986 5.316 -5.862 1065 H GLN 29 HN GLN 29 3.144 8.289 -10.012 1066 HA GLN 29 HA GLN 29 3.932 6.938 -12.338 1067 HB2 GLN 29 HB2 GLN 29 4.276 9.861 -11.637 1068 HB3 GLN 29 HB1 GLN 29 4.379 9.186 -13.257 1069 HG2 GLN 29 HG2 GLN 29 2.051 8.542 -13.178 1070 HG3 GLN 29 HG1 GLN 29 1.926 9.102 -11.512 1071 HE21 GLN 29 HE21 GLN 29 3.565 11.463 -11.984 1072 HE22 GLN 29 HE22 GLN 29 2.586 12.561 -12.887 1073 H ILE 30 HN ILE 30 5.743 8.435 -9.768 1074 HA ILE 30 HA ILE 30 8.275 8.452 -11.047 1075 HB ILE 30 HB ILE 30 7.651 8.378 -8.090 1076 HG12 ILE 30 HG12 ILE 30 8.162 10.750 -9.905 1077 HG13 ILE 30 HG11 ILE 30 6.582 10.268 -9.299 1078 HG21 ILE 30 HG21 ILE 30 9.869 9.327 -7.797 1079 HG22 ILE 30 HG22 ILE 30 10.137 9.281 -9.539 1080 HG23 ILE 30 HG23 ILE 30 9.966 7.777 -8.634 1081 HD11 ILE 30 HD11 ILE 30 8.914 11.192 -7.638 1082 HD12 ILE 30 HD12 ILE 30 7.346 10.681 -7.012 1083 HD13 ILE 30 HD13 ILE 30 7.465 12.118 -8.027 1084 H LEU 31 HN LEU 31 6.643 6.185 -8.870 1085 HA LEU 31 HA LEU 31 8.766 4.340 -8.650 1086 HB2 LEU 31 HB2 LEU 31 5.785 3.928 -8.393 1087 HB3 LEU 31 HB1 LEU 31 6.993 2.740 -7.939 1088 HG LEU 31 HG LEU 31 6.663 5.467 -6.682 1089 HD11 LEU 31 HD11 LEU 31 4.839 3.961 -6.102 1090 HD12 LEU 31 HD12 LEU 31 5.905 4.214 -4.719 1091 HD13 LEU 31 HD13 LEU 31 6.001 2.715 -5.643 1092 HD21 LEU 31 HD21 LEU 31 8.302 4.680 -5.056 1093 HD22 LEU 31 HD22 LEU 31 8.985 4.698 -6.682 1094 HD23 LEU 31 HD23 LEU 31 8.481 3.172 -5.954 1095 H ASP 32 HN ASP 32 6.018 4.561 -10.860 1096 HA ASP 32 HA ASP 32 6.491 2.182 -12.289 1097 HB2 ASP 32 HB2 ASP 32 4.376 3.413 -12.438 1098 HB3 ASP 32 HB1 ASP 32 5.202 4.763 -13.206 1099 H LEU 33 HN LEU 33 7.806 5.413 -12.566 1100 HA LEU 33 HA LEU 33 9.181 4.934 -15.029 1101 HB2 LEU 33 HB2 LEU 33 8.503 7.194 -14.201 1102 HB3 LEU 33 HB1 LEU 33 9.730 7.059 -12.957 1103 HG LEU 33 HG LEU 33 11.454 6.885 -14.756 1104 HD11 LEU 33 HD11 LEU 33 10.844 7.542 -17.022 1105 HD12 LEU 33 HD12 LEU 33 9.146 7.622 -16.553 1106 HD13 LEU 33 HD13 LEU 33 9.992 6.074 -16.541 1107 HD21 LEU 33 HD21 LEU 33 9.736 9.364 -14.808 1108 HD22 LEU 33 HD22 LEU 33 11.424 9.262 -15.308 1109 HD23 LEU 33 HD23 LEU 33 10.986 9.002 -13.619 1110 H LEU 34 HN LEU 34 10.173 5.045 -11.604 1111 HA LEU 34 HA LEU 34 12.916 4.515 -12.165 1112 HB2 LEU 34 HB2 LEU 34 11.363 4.253 -9.593 1113 HB3 LEU 34 HB1 LEU 34 13.107 4.142 -9.721 1114 HG LEU 34 HG LEU 34 11.424 6.577 -10.302 1115 HD11 LEU 34 HD11 LEU 34 11.644 6.127 -7.935 1116 HD12 LEU 34 HD12 LEU 34 12.628 7.522 -8.375 1117 HD13 LEU 34 HD13 LEU 34 13.390 5.956 -8.104 1118 HD21 LEU 34 HD21 LEU 34 13.298 6.500 -11.832 1119 HD22 LEU 34 HD22 LEU 34 14.405 6.174 -10.498 1120 HD23 LEU 34 HD23 LEU 34 13.581 7.730 -10.601 1121 H ALA 35 HN ALA 35 10.224 2.526 -12.207 1122 HA ALA 35 HA ALA 35 11.305 0.090 -11.293 1123 HB1 ALA 35 HB1 ALA 35 9.502 -0.975 -12.540 1124 HB2 ALA 35 HB2 ALA 35 9.183 0.537 -13.388 1125 HB3 ALA 35 HB3 ALA 35 8.910 0.428 -11.650 1126 H GLN 36 HN GLN 36 11.959 1.946 -14.094 1127 HA GLN 36 HA GLN 36 12.950 -0.309 -15.627 1128 HB2 GLN 36 HB2 GLN 36 13.445 1.261 -17.364 1129 HB3 GLN 36 HB1 GLN 36 11.871 1.683 -16.708 1130 HG2 GLN 36 HG2 GLN 36 13.027 3.417 -15.312 1131 HG3 GLN 36 HG1 GLN 36 14.491 3.075 -16.231 1132 HE21 GLN 36 HE21 GLN 36 12.918 2.596 -18.689 1133 HE22 GLN 36 HE22 GLN 36 12.465 4.165 -19.256 1134 H GLY 37 HN GLY 37 14.162 2.102 -13.443 1135 HA2 GLY 37 HA2 GLY 37 16.487 0.967 -12.702 1136 HA3 GLY 37 HA1 GLY 37 16.929 1.754 -14.212 1137 H GLU 38 HN GLU 38 18.393 2.813 -12.513 1138 HA GLU 38 HA GLU 38 17.145 4.774 -10.806 1139 HB2 GLU 38 HB2 GLU 38 20.059 4.345 -11.488 1140 HB3 GLU 38 HB1 GLU 38 19.454 5.427 -10.241 1141 HG2 GLU 38 HG2 GLU 38 18.419 3.451 -9.137 1142 HG3 GLU 38 HG1 GLU 38 19.250 2.433 -10.311 1143 H ARG 39 HN ARG 39 16.776 6.854 -11.242 1144 HA ARG 39 HA ARG 39 18.081 8.063 -13.578 1145 HB2 ARG 39 HB2 ARG 39 15.120 8.194 -12.983 1146 HB3 ARG 39 HB1 ARG 39 15.941 9.120 -14.233 1147 HG2 ARG 39 HG2 ARG 39 16.634 6.957 -15.271 1148 HG3 ARG 39 HG1 ARG 39 15.606 6.134 -14.095 1149 HD2 ARG 39 HD2 ARG 39 14.429 6.417 -16.193 1150 HD3 ARG 39 HD1 ARG 39 13.670 7.384 -14.929 1151 HE ARG 39 HE ARG 39 15.383 9.126 -16.098 1152 HH11 ARG 39 HH11 ARG 39 12.973 6.956 -17.426 1153 HH12 ARG 39 HH12 ARG 39 12.505 8.049 -18.700 1154 HH21 ARG 39 HH21 ARG 39 14.800 10.546 -17.797 1155 HH22 ARG 39 HH22 ARG 39 13.557 10.089 -18.920 1156 H ALA 40 HN ALA 40 17.983 10.430 -13.568 1157 HA ALA 40 HA ALA 40 18.523 11.378 -10.887 1158 HB1 ALA 40 HB1 ALA 40 20.043 11.912 -12.738 1159 HB2 ALA 40 HB2 ALA 40 19.394 13.364 -11.974 1160 HB3 ALA 40 HB3 ALA 40 18.750 12.821 -13.522 1161 H VAL 41 HN VAL 41 17.572 13.174 -9.913 1162 HA VAL 41 HA VAL 41 14.825 13.381 -9.923 1163 HB VAL 41 HB VAL 41 16.745 15.601 -9.196 1164 HG11 VAL 41 HG11 VAL 41 13.933 15.044 -8.259 1165 HG12 VAL 41 HG12 VAL 41 14.429 16.348 -9.341 1166 HG13 VAL 41 HG13 VAL 41 14.984 16.331 -7.665 1167 HG21 VAL 41 HG21 VAL 41 15.680 13.359 -7.481 1168 HG22 VAL 41 HG22 VAL 41 16.703 14.687 -6.937 1169 HG23 VAL 41 HG23 VAL 41 17.331 13.504 -8.083 1170 H GLU 42 HN GLU 42 17.154 15.415 -11.647 1171 HA GLU 42 HA GLU 42 15.407 17.318 -12.684 1172 HB2 GLU 42 HB2 GLU 42 18.088 16.897 -12.786 1173 HB3 GLU 42 HB1 GLU 42 17.639 16.458 -14.426 1174 HG2 GLU 42 HG2 GLU 42 17.012 19.083 -13.096 1175 HG3 GLU 42 HG1 GLU 42 18.336 18.797 -14.223 1176 H ALA 43 HN ALA 43 16.428 14.195 -13.988 1177 HA ALA 43 HA ALA 43 14.970 14.431 -16.421 1178 HB1 ALA 43 HB1 ALA 43 15.507 12.078 -16.751 1179 HB2 ALA 43 HB2 ALA 43 16.048 11.953 -15.076 1180 HB3 ALA 43 HB3 ALA 43 16.929 12.974 -16.215 1181 H ILE 44 HN ILE 44 14.345 12.880 -13.296 1182 HA ILE 44 HA ILE 44 11.943 11.593 -13.951 1183 HB ILE 44 HB ILE 44 12.782 12.775 -11.296 1184 HG12 ILE 44 HG12 ILE 44 12.983 9.940 -12.342 1185 HG13 ILE 44 HG11 ILE 44 14.326 11.070 -12.206 1186 HG21 ILE 44 HG21 ILE 44 10.390 12.427 -11.322 1187 HG22 ILE 44 HG22 ILE 44 11.158 11.209 -10.306 1188 HG23 ILE 44 HG23 ILE 44 10.605 10.785 -11.926 1189 HD11 ILE 44 HD11 ILE 44 14.039 11.123 -9.783 1190 HD12 ILE 44 HD12 ILE 44 14.325 9.486 -10.372 1191 HD13 ILE 44 HD13 ILE 44 12.696 9.988 -9.920 1192 H ALA 45 HN ALA 45 12.526 14.830 -12.620 1193 HA ALA 45 HA ALA 45 9.857 15.672 -12.469 1194 HB1 ALA 45 HB1 ALA 45 12.323 17.335 -12.975 1195 HB2 ALA 45 HB2 ALA 45 11.712 16.854 -11.391 1196 HB3 ALA 45 HB3 ALA 45 10.764 17.937 -12.412 1197 H THR 46 HN THR 46 12.256 16.104 -15.052 1198 HA THR 46 HA THR 46 10.654 17.543 -16.820 1199 HB THR 46 HB THR 46 12.876 15.616 -17.512 1200 HG1 THR 46 HG1 THR 46 13.764 17.120 -16.169 1201 HG21 THR 46 HG21 THR 46 11.557 16.267 -19.466 1202 HG22 THR 46 HG22 THR 46 13.152 17.023 -19.513 1203 HG23 THR 46 HG23 THR 46 11.742 17.967 -19.035 1204 H ALA 47 HN ALA 47 11.193 14.026 -16.603 1205 HA ALA 47 HA ALA 47 9.722 13.316 -18.888 1206 HB1 ALA 47 HB1 ALA 47 9.747 11.053 -18.007 1207 HB2 ALA 47 HB2 ALA 47 10.217 11.658 -16.417 1208 HB3 ALA 47 HB3 ALA 47 11.320 11.820 -17.783 1209 H THR 48 HN THR 48 8.711 13.805 -15.546 1210 HA THR 48 HA THR 48 6.042 12.814 -16.116 1211 HB THR 48 HB THR 48 5.620 13.456 -13.700 1212 HG1 THR 48 HG1 THR 48 8.445 13.627 -13.487 1213 HG21 THR 48 HG21 THR 48 7.860 11.521 -14.284 1214 HG22 THR 48 HG22 THR 48 6.134 11.166 -14.352 1215 HG23 THR 48 HG23 THR 48 6.894 11.555 -12.809 1216 H GLY 49 HN GLY 49 7.689 15.772 -16.282 1217 HA2 GLY 49 HA2 GLY 49 6.857 17.813 -17.025 1218 HA3 GLY 49 HA1 GLY 49 5.227 17.172 -16.875 1219 H MET 50 HN MET 50 7.423 16.928 -14.210 1220 HA MET 50 HA MET 50 5.864 18.971 -12.772 1221 HB2 MET 50 HB2 MET 50 7.574 16.722 -11.684 1222 HB3 MET 50 HB1 MET 50 6.700 17.892 -10.708 1223 HG2 MET 50 HG2 MET 50 4.584 17.058 -11.706 1224 HG3 MET 50 HG1 MET 50 5.517 15.818 -12.539 1225 HE1 MET 50 HE1 MET 50 6.955 13.756 -9.512 1226 HE2 MET 50 HE2 MET 50 7.727 15.151 -10.266 1227 HE3 MET 50 HE3 MET 50 6.925 13.939 -11.265 1228 H ASN 51 HN ASN 51 7.247 20.099 -11.015 1229 HA ASN 51 HA ASN 51 9.630 21.100 -12.364 1230 HB2 ASN 51 HB2 ASN 51 8.098 22.117 -9.968 1231 HB3 ASN 51 HB1 ASN 51 9.604 22.833 -10.528 1232 HD21 ASN 51 HD21 ASN 51 9.657 23.824 -12.580 1233 HD22 ASN 51 HD22 ASN 51 8.209 24.410 -13.325 1234 H LEU 52 HN LEU 52 11.578 21.544 -11.037 1235 HA LEU 52 HA LEU 52 12.554 19.210 -9.834 1236 HB2 LEU 52 HB2 LEU 52 13.544 22.052 -9.591 1237 HB3 LEU 52 HB1 LEU 52 14.443 20.638 -9.073 1238 HG LEU 52 HG LEU 52 13.638 21.285 -11.909 1239 HD11 LEU 52 HD11 LEU 52 15.434 22.705 -11.080 1240 HD12 LEU 52 HD12 LEU 52 16.036 21.556 -12.277 1241 HD13 LEU 52 HD13 LEU 52 16.333 21.278 -10.560 1242 HD21 LEU 52 HD21 LEU 52 13.624 18.880 -11.491 1243 HD22 LEU 52 HD22 LEU 52 15.254 18.985 -10.824 1244 HD23 LEU 52 HD23 LEU 52 14.975 19.343 -12.527 1245 H THR 53 HN THR 53 11.198 22.152 -8.438 1246 HA THR 53 HA THR 53 11.635 21.557 -5.731 1247 HB THR 53 HB THR 53 9.606 23.071 -5.379 1248 HG1 THR 53 HG1 THR 53 8.464 23.573 -7.092 1249 HG21 THR 53 HG21 THR 53 11.916 23.902 -5.360 1250 HG22 THR 53 HG22 THR 53 10.819 25.075 -6.088 1251 HG23 THR 53 HG23 THR 53 11.861 24.088 -7.113 1252 H THR 54 HN THR 54 8.959 20.799 -7.906 1253 HA THR 54 HA THR 54 7.286 19.516 -6.052 1254 HB THR 54 HB THR 54 7.463 18.676 -8.933 1255 HG1 THR 54 HG1 THR 54 6.166 21.043 -7.986 1256 HG21 THR 54 HG21 THR 54 5.024 18.546 -8.708 1257 HG22 THR 54 HG22 THR 54 5.146 19.121 -7.045 1258 HG23 THR 54 HG23 THR 54 5.831 17.559 -7.491 1259 H ALA 55 HN ALA 55 9.703 18.231 -8.307 1260 HA ALA 55 HA ALA 55 9.368 15.516 -7.681 1261 HB1 ALA 55 HB1 ALA 55 10.481 16.312 -9.714 1262 HB2 ALA 55 HB2 ALA 55 11.485 15.166 -8.825 1263 HB3 ALA 55 HB3 ALA 55 11.832 16.892 -8.742 1264 H SER 56 HN SER 56 11.742 17.883 -6.454 1265 HA SER 56 HA SER 56 13.124 16.064 -4.820 1266 HB2 SER 56 HB2 SER 56 13.883 18.141 -3.583 1267 HB3 SER 56 HB1 SER 56 14.175 18.147 -5.321 1268 HG SER 56 HG SER 56 12.473 19.528 -5.603 1269 H ALA 57 HN ALA 57 10.176 17.863 -4.323 1270 HA ALA 57 HA ALA 57 10.031 17.483 -1.508 1271 HB1 ALA 57 HB1 ALA 57 7.765 18.301 -1.691 1272 HB2 ALA 57 HB2 ALA 57 7.791 18.067 -3.437 1273 HB3 ALA 57 HB3 ALA 57 8.833 19.280 -2.696 1274 H ASN 58 HN ASN 58 8.298 15.891 -4.219 1275 HA ASN 58 HA ASN 58 7.021 14.106 -2.391 1276 HB2 ASN 58 HB2 ASN 58 6.137 12.961 -4.432 1277 HB3 ASN 58 HB1 ASN 58 5.757 14.671 -4.319 1278 HD21 ASN 58 HD21 ASN 58 5.364 14.866 -6.484 1279 HD22 ASN 58 HD22 ASN 58 6.621 14.815 -7.671 1280 H LEU 59 HN LEU 59 9.873 13.881 -4.430 1281 HA LEU 59 HA LEU 59 10.343 11.117 -4.098 1282 HB2 LEU 59 HB2 LEU 59 12.185 13.450 -4.553 1283 HB3 LEU 59 HB1 LEU 59 12.797 11.817 -4.378 1284 HG LEU 59 HG LEU 59 10.828 12.678 -6.497 1285 HD11 LEU 59 HD11 LEU 59 13.799 12.203 -6.685 1286 HD12 LEU 59 HD12 LEU 59 12.985 13.763 -6.825 1287 HD13 LEU 59 HD13 LEU 59 12.716 12.514 -8.043 1288 HD21 LEU 59 HD21 LEU 59 11.362 10.522 -7.504 1289 HD22 LEU 59 HD22 LEU 59 10.679 10.320 -5.890 1290 HD23 LEU 59 HD23 LEU 59 12.416 10.142 -6.143 1291 H GLN 60 HN GLN 60 11.250 13.922 -2.156 1292 HA GLN 60 HA GLN 60 12.744 12.627 -0.173 1293 HB2 GLN 60 HB2 GLN 60 12.620 15.066 -0.435 1294 HB3 GLN 60 HB1 GLN 60 10.930 15.043 0.039 1295 HG2 GLN 60 HG2 GLN 60 11.660 14.116 2.243 1296 HG3 GLN 60 HG1 GLN 60 13.321 14.430 1.740 1297 HE21 GLN 60 HE21 GLN 60 14.023 16.570 1.507 1298 HE22 GLN 60 HE22 GLN 60 13.152 17.900 2.193 1299 H ALA 61 HN ALA 61 9.264 13.244 -0.425 1300 HA ALA 61 HA ALA 61 8.568 12.092 2.068 1301 HB1 ALA 61 HB1 ALA 61 6.282 12.136 1.252 1302 HB2 ALA 61 HB2 ALA 61 6.857 12.437 -0.387 1303 HB3 ALA 61 HB3 ALA 61 7.105 13.649 0.870 1304 H LEU 62 HN LEU 62 8.792 10.779 -1.212 1305 HA LEU 62 HA LEU 62 7.755 8.222 -0.596 1306 HB2 LEU 62 HB2 LEU 62 9.674 9.110 -2.745 1307 HB3 LEU 62 HB1 LEU 62 9.023 7.487 -2.642 1308 HG LEU 62 HG LEU 62 7.417 10.008 -3.070 1309 HD11 LEU 62 HD11 LEU 62 8.151 7.748 -4.923 1310 HD12 LEU 62 HD12 LEU 62 8.689 9.425 -5.033 1311 HD13 LEU 62 HD13 LEU 62 6.991 9.024 -5.293 1312 HD21 LEU 62 HD21 LEU 62 5.526 8.502 -3.418 1313 HD22 LEU 62 HD22 LEU 62 6.175 8.342 -1.786 1314 HD23 LEU 62 HD23 LEU 62 6.543 7.122 -3.004 1315 H LYS 63 HN LYS 63 10.953 9.640 -0.326 1316 HA LYS 63 HA LYS 63 12.273 7.210 0.358 1317 HB2 LYS 63 HB2 LYS 63 13.359 9.370 -0.457 1318 HB3 LYS 63 HB1 LYS 63 13.151 9.975 1.181 1319 HG2 LYS 63 HG2 LYS 63 14.503 8.136 2.036 1320 HG3 LYS 63 HG1 LYS 63 14.717 7.531 0.395 1321 HD2 LYS 63 HD2 LYS 63 15.735 9.782 -0.153 1322 HD3 LYS 63 HD1 LYS 63 15.742 10.093 1.583 1323 HE2 LYS 63 HE2 LYS 63 17.123 7.807 0.184 1324 HE3 LYS 63 HE1 LYS 63 17.905 9.247 0.829 1325 HZ1 LYS 63 HZ1 LYS 63 16.386 7.301 2.482 1326 HZ2 LYS 63 HZ2 LYS 63 17.317 8.600 3.040 1327 HZ3 LYS 63 HZ3 LYS 63 18.070 7.278 2.292 1328 H SER 64 HN SER 64 10.563 9.691 2.134 1329 HA SER 64 HA SER 64 11.218 8.855 4.748 1330 HB2 SER 64 HB2 SER 64 10.190 11.032 4.311 1331 HB3 SER 64 HB1 SER 64 8.732 10.245 3.706 1332 HG SER 64 HG SER 64 9.642 10.570 6.327 1333 H GLY 65 HN GLY 65 8.693 7.883 2.477 1334 HA2 GLY 65 HA2 GLY 65 7.433 6.068 4.304 1335 HA3 GLY 65 HA1 GLY 65 7.138 6.182 2.577 1336 H GLY 66 HN GLY 66 10.268 5.910 2.446 1337 HA2 GLY 66 HA2 GLY 66 11.812 4.175 2.365 1338 HA3 GLY 66 HA1 GLY 66 10.625 3.116 3.113 1339 H LEU 67 HN LEU 67 9.804 4.985 0.305 1340 HA LEU 67 HA LEU 67 9.378 2.523 -1.180 1341 HB2 LEU 67 HB2 LEU 67 8.594 5.387 -1.619 1342 HB3 LEU 67 HB1 LEU 67 8.484 4.224 -2.923 1343 HG LEU 67 HG LEU 67 6.321 4.463 -1.927 1344 HD11 LEU 67 HD11 LEU 67 7.583 1.868 -1.072 1345 HD12 LEU 67 HD12 LEU 67 6.912 2.233 -2.661 1346 HD13 LEU 67 HD13 LEU 67 5.855 2.164 -1.252 1347 HD21 LEU 67 HD21 LEU 67 5.876 3.986 0.414 1348 HD22 LEU 67 HD22 LEU 67 7.009 5.327 0.250 1349 HD23 LEU 67 HD23 LEU 67 7.595 3.727 0.701 1350 H VAL 68 HN VAL 68 11.366 5.431 -1.354 1351 HA VAL 68 HA VAL 68 12.872 4.159 -3.534 1352 HB VAL 68 HB VAL 68 13.316 6.387 -4.504 1353 HG11 VAL 68 HG11 VAL 68 10.387 5.710 -4.283 1354 HG12 VAL 68 HG12 VAL 68 11.533 5.000 -5.418 1355 HG13 VAL 68 HG13 VAL 68 11.125 6.711 -5.532 1356 HG21 VAL 68 HG21 VAL 68 11.292 7.335 -2.479 1357 HG22 VAL 68 HG22 VAL 68 11.879 8.287 -3.842 1358 HG23 VAL 68 HG23 VAL 68 12.992 7.792 -2.568 1359 H GLU 69 HN GLU 69 15.071 4.660 -3.679 1360 HA GLU 69 HA GLU 69 16.258 5.883 -1.277 1361 HB2 GLU 69 HB2 GLU 69 16.950 3.427 -2.764 1362 HB3 GLU 69 HB1 GLU 69 18.314 4.446 -2.320 1363 HG2 GLU 69 HG2 GLU 69 16.252 3.311 -0.442 1364 HG3 GLU 69 HG1 GLU 69 17.916 2.758 -0.633 1365 H ALA 70 HN ALA 70 18.507 6.812 -1.766 1366 HA ALA 70 HA ALA 70 18.381 8.186 -4.363 1367 HB1 ALA 70 HB1 ALA 70 18.695 10.343 -3.315 1368 HB2 ALA 70 HB2 ALA 70 18.696 9.590 -1.718 1369 HB3 ALA 70 HB3 ALA 70 17.233 9.568 -2.703 1370 H ARG 71 HN ARG 71 20.229 8.525 -5.329 1371 HA ARG 71 HA ARG 71 22.782 8.155 -3.918 1372 HB2 ARG 71 HB2 ARG 71 22.416 8.800 -6.847 1373 HB3 ARG 71 HB1 ARG 71 23.804 8.062 -6.068 1374 HG2 ARG 71 HG2 ARG 71 21.168 6.663 -6.150 1375 HG3 ARG 71 HG1 ARG 71 22.265 6.620 -7.528 1376 HD2 ARG 71 HD2 ARG 71 24.033 5.840 -5.849 1377 HD3 ARG 71 HD1 ARG 71 22.677 5.543 -4.758 1378 HE ARG 71 HE ARG 71 21.848 4.247 -6.929 1379 HH11 ARG 71 HH11 ARG 71 24.979 4.247 -5.352 1380 HH12 ARG 71 HH12 ARG 71 25.394 2.647 -5.884 1381 HH21 ARG 71 HH21 ARG 71 22.388 2.191 -7.673 1382 HH22 ARG 71 HH22 ARG 71 23.904 1.462 -7.225 1383 H ARG 72 HN ARG 72 24.355 9.908 -3.951 1384 HA ARG 72 HA ARG 72 23.399 12.395 -5.166 1385 HB2 ARG 72 HB2 ARG 72 22.941 12.387 -2.657 1386 HB3 ARG 72 HB1 ARG 72 24.687 12.427 -2.439 1387 HG2 ARG 72 HG2 ARG 72 24.788 14.515 -3.720 1388 HG3 ARG 72 HG1 ARG 72 23.033 14.481 -3.898 1389 HD2 ARG 72 HD2 ARG 72 23.487 15.955 -2.108 1390 HD3 ARG 72 HD1 ARG 72 22.905 14.460 -1.379 1391 HE ARG 72 HE ARG 72 25.659 14.253 -1.457 1392 HH11 ARG 72 HH11 ARG 72 23.270 16.350 0.013 1393 HH12 ARG 72 HH12 ARG 72 24.291 16.785 1.356 1394 HH21 ARG 72 HH21 ARG 72 27.012 14.834 0.294 1395 HH22 ARG 72 HH22 ARG 72 26.405 15.896 1.532 1396 H GLU 73 HN GLU 73 24.820 12.617 -6.724 1397 HA GLU 73 HA GLU 73 27.674 12.438 -6.037 1398 HB2 GLU 73 HB2 GLU 73 26.327 11.551 -8.600 1399 HB3 GLU 73 HB1 GLU 73 28.068 11.606 -8.352 1400 HG2 GLU 73 HG2 GLU 73 27.911 9.948 -6.604 1401 HG3 GLU 73 HG1 GLU 73 26.154 9.949 -6.724 1402 H GLY 74 HN GLY 74 28.494 14.400 -6.080 1403 HA2 GLY 74 HA2 GLY 74 29.013 16.527 -6.834 1404 HA3 GLY 74 HA1 GLY 74 28.090 16.193 -8.297 1405 H THR 75 HN THR 75 26.316 17.364 -8.547 1406 HA THR 75 HA THR 75 24.916 18.318 -6.126 1407 HB THR 75 HB THR 75 24.621 19.482 -8.905 1408 HG1 THR 75 HG1 THR 75 26.111 20.935 -7.087 1409 HG21 THR 75 HG21 THR 75 22.848 20.048 -7.321 1410 HG22 THR 75 HG22 THR 75 23.843 21.464 -7.670 1411 HG23 THR 75 HG23 THR 75 24.053 20.590 -6.151 1412 H ARG 76 HN ARG 76 24.829 16.034 -8.518 1413 HA ARG 76 HA ARG 76 21.986 16.164 -9.044 1414 HB2 ARG 76 HB2 ARG 76 23.744 15.816 -10.827 1415 HB3 ARG 76 HB1 ARG 76 24.035 14.232 -10.116 1416 HG2 ARG 76 HG2 ARG 76 21.647 13.713 -10.474 1417 HG3 ARG 76 HG1 ARG 76 21.507 15.238 -11.345 1418 HD2 ARG 76 HD2 ARG 76 23.262 12.900 -12.064 1419 HD3 ARG 76 HD1 ARG 76 21.820 13.434 -12.922 1420 HE ARG 76 HE ARG 76 24.029 15.322 -12.693 1421 HH11 ARG 76 HH11 ARG 76 22.273 13.018 -14.651 1422 HH12 ARG 76 HH12 ARG 76 22.874 13.644 -16.156 1423 HH21 ARG 76 HH21 ARG 76 24.863 16.112 -14.657 1424 HH22 ARG 76 HH22 ARG 76 24.385 15.371 -16.154 1425 H GLN 77 HN GLN 77 20.543 14.658 -8.346 1426 HA GLN 77 HA GLN 77 21.589 12.456 -6.701 1427 HB2 GLN 77 HB2 GLN 77 18.951 13.906 -6.412 1428 HB3 GLN 77 HB1 GLN 77 19.460 12.525 -5.454 1429 HG2 GLN 77 HG2 GLN 77 21.365 13.870 -4.618 1430 HG3 GLN 77 HG1 GLN 77 20.722 15.255 -5.498 1431 HE21 GLN 77 HE21 GLN 77 18.768 12.857 -3.841 1432 HE22 GLN 77 HE22 GLN 77 18.172 13.919 -2.619 1433 H TYR 78 HN TYR 78 20.986 10.449 -7.205 1434 HA TYR 78 HA TYR 78 19.022 10.092 -9.366 1435 HB2 TYR 78 HB2 TYR 78 21.395 8.442 -8.502 1436 HB3 TYR 78 HB1 TYR 78 20.107 7.748 -9.481 1437 HD1 TYR 78 HD2 TYR 78 22.859 10.188 -9.427 1438 HD2 TYR 78 HD1 TYR 78 19.842 8.336 -11.783 1439 HE1 TYR 78 HE2 TYR 78 23.903 11.087 -11.464 1440 HE2 TYR 78 HE1 TYR 78 20.873 9.230 -13.825 1441 HH TYR 78 HH TYR 78 23.962 10.507 -13.933 1442 H TYR 79 HN TYR 79 17.343 8.625 -9.096 1443 HA TYR 79 HA TYR 79 17.052 7.572 -6.364 1444 HB2 TYR 79 HB2 TYR 79 15.085 9.052 -8.061 1445 HB3 TYR 79 HB1 TYR 79 14.500 7.855 -6.911 1446 HD1 TYR 79 HD2 TYR 79 16.542 10.961 -7.159 1447 HD2 TYR 79 HD1 TYR 79 14.262 8.395 -4.648 1448 HE1 TYR 79 HE2 TYR 79 16.682 12.618 -5.347 1449 HE2 TYR 79 HE1 TYR 79 14.397 10.042 -2.828 1450 HH TYR 79 HH TYR 79 15.782 11.897 -2.126 1451 H ARG 80 HN ARG 80 16.171 5.613 -6.086 1452 HA ARG 80 HA ARG 80 15.100 4.131 -8.358 1453 HB2 ARG 80 HB2 ARG 80 16.424 2.116 -7.714 1454 HB3 ARG 80 HB1 ARG 80 17.413 3.416 -8.362 1455 HG2 ARG 80 HG2 ARG 80 18.528 3.713 -6.427 1456 HG3 ARG 80 HG1 ARG 80 17.101 3.408 -5.436 1457 HD2 ARG 80 HD2 ARG 80 18.895 1.702 -5.181 1458 HD3 ARG 80 HD1 ARG 80 17.345 1.041 -5.694 1459 HE ARG 80 HE ARG 80 18.404 1.155 -8.024 1460 HH11 ARG 80 HH11 ARG 80 20.200 0.561 -5.087 1461 HH12 ARG 80 HH12 ARG 80 21.427 -0.393 -5.868 1462 HH21 ARG 80 HH21 ARG 80 19.990 -0.113 -9.068 1463 HH22 ARG 80 HH22 ARG 80 21.299 -0.787 -8.136 1464 H ILE 81 HN ILE 81 14.230 1.941 -7.444 1465 HA ILE 81 HA ILE 81 12.513 2.491 -5.251 1466 HB ILE 81 HB ILE 81 13.215 -0.200 -6.450 1467 HG12 ILE 81 HG12 ILE 81 10.954 1.693 -7.135 1468 HG13 ILE 81 HG11 ILE 81 12.381 1.429 -8.130 1469 HG21 ILE 81 HG21 ILE 81 11.070 -0.923 -5.550 1470 HG22 ILE 81 HG22 ILE 81 10.801 0.684 -4.874 1471 HG23 ILE 81 HG23 ILE 81 12.113 -0.322 -4.260 1472 HD11 ILE 81 HD11 ILE 81 10.473 0.210 -8.990 1473 HD12 ILE 81 HD12 ILE 81 10.291 -0.625 -7.448 1474 HD13 ILE 81 HD13 ILE 81 11.724 -0.905 -8.438 1475 H ALA 82 HN ALA 82 12.734 2.003 -3.113 1476 HA ALA 82 HA ALA 82 15.277 2.122 -2.028 1477 HB1 ALA 82 HB1 ALA 82 13.248 2.816 -0.857 1478 HB2 ALA 82 HB2 ALA 82 14.239 1.737 0.126 1479 HB3 ALA 82 HB3 ALA 82 12.785 1.125 -0.665 1480 H GLY 83 HN GLY 83 13.336 -0.742 -2.702 1481 HA2 GLY 83 HA2 GLY 83 15.705 -2.367 -2.309 1482 HA3 GLY 83 HA1 GLY 83 14.367 -2.716 -1.224 1483 H GLU 84 HN GLU 84 15.348 -4.634 -2.909 1484 HA GLU 84 HA GLU 84 13.866 -4.841 -5.331 1485 HB2 GLU 84 HB2 GLU 84 15.941 -6.118 -4.897 1486 HB3 GLU 84 HB1 GLU 84 15.114 -7.017 -3.632 1487 HG2 GLU 84 HG2 GLU 84 13.637 -8.019 -5.237 1488 HG3 GLU 84 HG1 GLU 84 14.311 -7.027 -6.530 1489 H ASP 85 HN ASP 85 13.299 -5.622 -2.002 1490 HA ASP 85 HA ASP 85 10.976 -7.204 -2.291 1491 HB2 ASP 85 HB2 ASP 85 10.550 -6.597 0.079 1492 HB3 ASP 85 HB1 ASP 85 12.205 -7.135 -0.188 1493 H VAL 86 HN VAL 86 11.482 -3.727 -1.869 1494 HA VAL 86 HA VAL 86 8.747 -3.001 -1.899 1495 HB VAL 86 HB VAL 86 11.094 -1.290 -2.734 1496 HG11 VAL 86 HG11 VAL 86 8.898 -0.365 -3.318 1497 HG12 VAL 86 HG12 VAL 86 9.703 0.586 -2.068 1498 HG13 VAL 86 HG13 VAL 86 8.395 -0.514 -1.634 1499 HG21 VAL 86 HG21 VAL 86 9.917 -1.676 0.016 1500 HG22 VAL 86 HG22 VAL 86 11.190 -0.532 -0.417 1501 HG23 VAL 86 HG23 VAL 86 11.487 -2.267 -0.530 1502 H ALA 87 HN ALA 87 11.145 -3.508 -4.406 1503 HA ALA 87 HA ALA 87 9.742 -2.388 -6.576 1504 HB1 ALA 87 HB1 ALA 87 11.687 -4.697 -6.597 1505 HB2 ALA 87 HB2 ALA 87 12.120 -2.989 -6.674 1506 HB3 ALA 87 HB3 ALA 87 11.208 -3.728 -7.991 1507 H ARG 88 HN ARG 88 9.784 -5.682 -5.253 1508 HA ARG 88 HA ARG 88 7.911 -6.696 -7.158 1509 HB2 ARG 88 HB2 ARG 88 8.592 -7.833 -4.439 1510 HB3 ARG 88 HB1 ARG 88 7.844 -8.689 -5.779 1511 HG2 ARG 88 HG2 ARG 88 10.655 -7.620 -5.668 1512 HG3 ARG 88 HG1 ARG 88 10.158 -9.310 -5.605 1513 HD2 ARG 88 HD2 ARG 88 9.274 -9.138 -7.880 1514 HD3 ARG 88 HD1 ARG 88 9.757 -7.441 -7.942 1515 HE ARG 88 HE ARG 88 11.857 -9.384 -7.375 1516 HH11 ARG 88 HH11 ARG 88 10.263 -7.393 -9.789 1517 HH12 ARG 88 HH12 ARG 88 11.621 -7.409 -10.875 1518 HH21 ARG 88 HH21 ARG 88 13.632 -9.388 -8.783 1519 HH22 ARG 88 HH22 ARG 88 13.554 -8.523 -10.289 1520 H LEU 89 HN LEU 89 7.707 -5.086 -4.098 1521 HA LEU 89 HA LEU 89 5.081 -5.728 -3.353 1522 HB2 LEU 89 HB2 LEU 89 6.919 -4.499 -2.047 1523 HB3 LEU 89 HB1 LEU 89 6.402 -3.059 -2.894 1524 HG LEU 89 HG LEU 89 4.549 -4.694 -1.160 1525 HD11 LEU 89 HD11 LEU 89 6.180 -2.265 -0.432 1526 HD12 LEU 89 HD12 LEU 89 6.416 -3.902 0.182 1527 HD13 LEU 89 HD13 LEU 89 4.944 -3.015 0.575 1528 HD21 LEU 89 HD21 LEU 89 4.378 -1.852 -2.169 1529 HD22 LEU 89 HD22 LEU 89 3.207 -2.655 -1.123 1530 HD23 LEU 89 HD23 LEU 89 3.443 -3.219 -2.779 1531 H PHE 90 HN PHE 90 6.314 -2.907 -5.166 1532 HA PHE 90 HA PHE 90 3.791 -1.801 -5.746 1533 HB2 PHE 90 HB2 PHE 90 5.895 -0.531 -5.933 1534 HB3 PHE 90 HB1 PHE 90 6.378 -1.530 -7.298 1535 HD1 PHE 90 HD2 PHE 90 3.633 0.748 -6.203 1536 HD2 PHE 90 HD1 PHE 90 5.911 -0.813 -9.442 1537 HE1 PHE 90 HE2 PHE 90 2.516 2.311 -7.740 1538 HE2 PHE 90 HE1 PHE 90 4.798 0.749 -10.982 1539 HZ PHE 90 HZ PHE 90 3.098 2.314 -10.131 1540 H ALA 91 HN ALA 91 5.763 -4.176 -7.431 1541 HA ALA 91 HA ALA 91 4.170 -4.348 -9.762 1542 HB1 ALA 91 HB1 ALA 91 6.446 -5.231 -9.661 1543 HB2 ALA 91 HB2 ALA 91 5.299 -6.483 -10.145 1544 HB3 ALA 91 HB3 ALA 91 5.926 -6.452 -8.496 1545 H LEU 92 HN LEU 92 4.174 -6.209 -6.736 1546 HA LEU 92 HA LEU 92 2.184 -8.050 -7.459 1547 HB2 LEU 92 HB2 LEU 92 3.716 -8.349 -5.561 1548 HB3 LEU 92 HB1 LEU 92 2.916 -7.043 -4.710 1549 HG LEU 92 HG LEU 92 0.836 -8.365 -4.636 1550 HD11 LEU 92 HD11 LEU 92 1.149 -9.704 -6.638 1551 HD12 LEU 92 HD12 LEU 92 0.897 -10.743 -5.235 1552 HD13 LEU 92 HD13 LEU 92 2.518 -10.529 -5.895 1553 HD21 LEU 92 HD21 LEU 92 3.268 -9.779 -3.541 1554 HD22 LEU 92 HD22 LEU 92 1.604 -10.030 -3.009 1555 HD23 LEU 92 HD23 LEU 92 2.381 -8.467 -2.762 1556 H VAL 93 HN VAL 93 1.928 -4.938 -5.733 1557 HA VAL 93 HA VAL 93 -0.858 -5.150 -5.280 1558 HB VAL 93 HB VAL 93 0.607 -3.594 -4.020 1559 HG11 VAL 93 HG11 VAL 93 1.179 -1.422 -4.970 1560 HG12 VAL 93 HG12 VAL 93 0.547 -1.938 -6.534 1561 HG13 VAL 93 HG13 VAL 93 1.960 -2.740 -5.845 1562 HG21 VAL 93 HG21 VAL 93 -0.996 -1.757 -3.887 1563 HG22 VAL 93 HG22 VAL 93 -1.807 -3.321 -3.969 1564 HG23 VAL 93 HG23 VAL 93 -1.732 -2.289 -5.397 1565 H GLN 94 HN GLN 94 1.029 -4.020 -8.007 1566 HA GLN 94 HA GLN 94 -1.153 -2.862 -9.423 1567 HB2 GLN 94 HB2 GLN 94 1.193 -2.351 -9.964 1568 HB3 GLN 94 HB1 GLN 94 1.434 -4.012 -10.489 1569 HG2 GLN 94 HG2 GLN 94 -0.159 -3.702 -12.288 1570 HG3 GLN 94 HG1 GLN 94 -0.487 -2.059 -11.743 1571 HE21 GLN 94 HE21 GLN 94 2.321 -1.540 -11.105 1572 HE22 GLN 94 HE22 GLN 94 3.118 -1.307 -12.624 1573 H VAL 95 HN VAL 95 0.307 -6.085 -9.340 1574 HA VAL 95 HA VAL 95 -1.300 -7.322 -11.280 1575 HB VAL 95 HB VAL 95 -0.082 -8.491 -8.771 1576 HG11 VAL 95 HG11 VAL 95 -0.350 -10.677 -9.863 1577 HG12 VAL 95 HG12 VAL 95 -1.258 -9.902 -11.164 1578 HG13 VAL 95 HG13 VAL 95 -1.901 -9.911 -9.521 1579 HG21 VAL 95 HG21 VAL 95 0.856 -8.496 -11.636 1580 HG22 VAL 95 HG22 VAL 95 1.639 -9.343 -10.301 1581 HG23 VAL 95 HG23 VAL 95 1.564 -7.581 -10.305 1582 H VAL 96 HN VAL 96 -1.742 -6.994 -7.777 1583 HA VAL 96 HA VAL 96 -4.222 -8.239 -7.537 1584 HB VAL 96 HB VAL 96 -3.135 -5.891 -5.963 1585 HG11 VAL 96 HG11 VAL 96 -5.402 -7.768 -5.291 1586 HG12 VAL 96 HG12 VAL 96 -5.552 -6.058 -5.694 1587 HG13 VAL 96 HG13 VAL 96 -4.726 -6.546 -4.215 1588 HG21 VAL 96 HG21 VAL 96 -1.693 -7.833 -5.835 1589 HG22 VAL 96 HG22 VAL 96 -3.069 -8.859 -5.429 1590 HG23 VAL 96 HG23 VAL 96 -2.533 -7.614 -4.301 1591 H ALA 97 HN ALA 97 -3.441 -4.852 -8.252 1592 HA ALA 97 HA ALA 97 -6.053 -3.858 -8.357 1593 HB1 ALA 97 HB1 ALA 97 -4.039 -2.447 -8.306 1594 HB2 ALA 97 HB2 ALA 97 -5.131 -2.007 -9.619 1595 HB3 ALA 97 HB3 ALA 97 -3.672 -2.935 -9.962 1596 H ASP 98 HN ASP 98 -4.025 -5.271 -10.902 1597 HA ASP 98 HA ASP 98 -5.674 -4.748 -13.091 1598 HB2 ASP 98 HB2 ASP 98 -3.381 -5.501 -13.368 1599 HB3 ASP 98 HB1 ASP 98 -3.772 -7.053 -12.637 1600 H GLU 99 HN GLU 99 -5.592 -7.633 -10.994 1601 HA GLU 99 HA GLU 99 -7.734 -8.822 -12.536 1602 HB2 GLU 99 HB2 GLU 99 -7.509 -10.733 -10.980 1603 HB3 GLU 99 HB1 GLU 99 -6.005 -10.305 -11.779 1604 HG2 GLU 99 HG2 GLU 99 -5.058 -9.474 -9.844 1605 HG3 GLU 99 HG1 GLU 99 -6.621 -9.229 -9.063 1606 H HIS 100 HN HIS 100 -7.514 -6.845 -9.744 1607 HA HIS 100 HA HIS 100 -10.095 -7.758 -8.729 1608 HB2 HIS 100 HB2 HIS 100 -8.040 -5.837 -7.668 1609 HB3 HIS 100 HB1 HIS 100 -9.665 -5.895 -6.997 1610 HD1 HIS 100 HD1 HIS 100 -9.298 -6.975 -4.785 1611 HD2 HIS 100 HD2 HIS 100 -7.415 -9.022 -7.875 1612 HE1 HIS 100 HE1 HIS 100 -8.437 -9.104 -3.765 1613 HE2 HIS 100 HE2 HIS 100 -7.469 -10.408 -5.694 1614 H LEU 101 HN LEU 101 -9.039 -5.683 -11.047 1615 HA LEU 101 HA LEU 101 -11.294 -3.848 -10.691 1616 HB2 LEU 101 HB2 LEU 101 -9.083 -2.857 -11.163 1617 HB3 LEU 101 HB1 LEU 101 -9.020 -3.743 -12.674 1618 HG LEU 101 HG LEU 101 -11.007 -2.494 -13.462 1619 HD11 LEU 101 HD11 LEU 101 -10.648 -0.958 -10.895 1620 HD12 LEU 101 HD12 LEU 101 -12.026 -1.970 -11.329 1621 HD13 LEU 101 HD13 LEU 101 -11.702 -0.487 -12.228 1622 HD21 LEU 101 HD21 LEU 101 -8.673 -0.817 -12.562 1623 HD22 LEU 101 HD22 LEU 101 -9.847 -0.360 -13.796 1624 HD23 LEU 101 HD23 LEU 101 -8.784 -1.743 -14.058 1625 H GLU 102 HN GLU 102 -13.011 -5.069 -11.291 1626 HA GLU 102 HA GLU 102 -13.032 -6.733 -13.607 1627 HB2 GLU 102 HB2 GLU 102 -14.493 -7.181 -11.691 1628 HB3 GLU 102 HB1 GLU 102 -15.315 -5.650 -11.945 1629 HG2 GLU 102 HG2 GLU 102 -16.568 -7.608 -12.776 1630 HG3 GLU 102 HG1 GLU 102 -16.232 -6.403 -14.017 1631 H HIS 103 HN HIS 103 -13.225 -6.097 -15.648 1632 HA HIS 103 HA HIS 103 -14.471 -3.500 -16.190 1633 HB2 HIS 103 HB2 HIS 103 -12.568 -2.826 -17.605 1634 HB3 HIS 103 HB1 HIS 103 -12.097 -3.033 -15.922 1635 HD1 HIS 103 HD1 HIS 103 -10.589 -5.120 -15.365 1636 HD2 HIS 103 HD2 HIS 103 -11.302 -4.491 -19.417 1637 HE1 HIS 103 HE1 HIS 103 -8.893 -6.525 -16.582 1638 HE2 HIS 103 HE2 HIS 103 -9.442 -6.244 -19.031 1639 H HIS 104 HN HIS 104 -15.009 -6.486 -16.771 1640 HA HIS 104 HA HIS 104 -14.841 -6.584 -19.640 1641 HB2 HIS 104 HB2 HIS 104 -15.666 -8.738 -19.537 1642 HB3 HIS 104 HB1 HIS 104 -14.940 -8.585 -17.946 1643 HD1 HIS 104 HD1 HIS 104 -18.185 -9.076 -19.684 1644 HD2 HIS 104 HD2 HIS 104 -16.805 -8.469 -15.802 1645 HE1 HIS 104 HE1 HIS 104 -20.108 -9.668 -18.174 1646 HE2 HIS 104 HE2 HIS 104 -19.194 -9.465 -15.837 1647 H HIS 105 HN HIS 105 -16.778 -4.892 -17.569 1648 HA HIS 105 HA HIS 105 -19.197 -4.938 -19.108 1649 HB2 HIS 105 HB2 HIS 105 -19.846 -2.945 -17.736 1650 HB3 HIS 105 HB1 HIS 105 -19.406 -4.352 -16.781 1651 HD1 HIS 105 HD1 HIS 105 -18.517 -0.810 -17.381 1652 HD2 HIS 105 HD2 HIS 105 -16.917 -4.088 -15.376 1653 HE1 HIS 105 HE1 HIS 105 -16.728 0.117 -15.878 1654 HE2 HIS 105 HE2 HIS 105 -15.757 -1.878 -14.690 1655 H HIS 106 HN HIS 106 -18.347 -4.603 -21.219 1656 HA HIS 106 HA HIS 106 -17.122 -1.998 -21.692 1657 HB2 HIS 106 HB2 HIS 106 -16.639 -2.852 -23.984 1658 HB3 HIS 106 HB1 HIS 106 -15.907 -3.795 -22.699 1659 HD1 HIS 106 HD1 HIS 106 -17.774 -4.157 -25.749 1660 HD2 HIS 106 HD2 HIS 106 -17.489 -6.278 -22.176 1661 HE1 HIS 106 HE1 HIS 106 -18.615 -6.477 -26.256 1662 HE2 HIS 106 HE2 HIS 106 -18.340 -7.769 -24.111 1663 H HIS 107 HN HIS 107 -20.124 -3.608 -22.121 1664 HA HIS 107 HA HIS 107 -22.157 -2.901 -22.831 1665 HB2 HIS 107 HB2 HIS 107 -20.782 -0.219 -23.008 1666 HB3 HIS 107 HB1 HIS 107 -22.480 -0.451 -23.407 1667 HD1 HIS 107 HD1 HIS 107 -21.042 1.173 -20.941 1668 HD2 HIS 107 HD2 HIS 107 -23.256 -2.345 -20.804 1669 HE1 HIS 107 HE1 HIS 107 -21.916 1.010 -18.586 1670 HE2 HIS 107 HE2 HIS 107 -23.059 -1.236 -18.475 1671 H HIS 108 HN HIS 108 -19.894 -1.063 -24.871 1672 HA HIS 108 HA HIS 108 -21.164 -2.087 -27.272 1673 HB2 HIS 108 HB2 HIS 108 -20.312 0.258 -27.162 1674 HB3 HIS 108 HB1 HIS 108 -18.681 -0.370 -26.951 1675 HD1 HIS 108 HD1 HIS 108 -20.413 1.214 -29.432 1676 HD2 HIS 108 HD2 HIS 108 -18.368 -2.404 -29.384 1677 HE1 HIS 108 HE1 HIS 108 -19.861 0.712 -31.834 1678 HE2 HIS 108 HE2 HIS 108 -18.787 -1.572 -31.792 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 2.124 3.281 -23.428 2 H2 MET 1 HT2 MET 1 0.589 2.857 -22.852 3 H3 MET 1 HT3 MET 1 1.482 4.063 -22.065 4 HA MET 1 HA MET 1 1.364 5.467 -24.021 5 HB2 MET 1 HB2 MET 1 1.155 3.755 -25.736 6 HB3 MET 1 HB1 MET 1 -0.396 3.243 -25.080 7 HG2 MET 1 HG2 MET 1 -1.340 5.439 -25.643 8 HG3 MET 1 HG1 MET 1 0.210 5.910 -26.339 9 HE1 MET 1 HE1 MET 1 1.216 4.901 -28.554 10 HE2 MET 1 HE2 MET 1 0.512 3.532 -29.415 11 HE3 MET 1 HE3 MET 1 1.187 3.308 -27.801 12 H ALA 2 HN ALA 2 0.195 7.108 -23.342 13 HA ALA 2 HA ALA 2 -2.616 6.712 -22.645 14 HB1 ALA 2 HB1 ALA 2 -2.378 8.007 -20.572 15 HB2 ALA 2 HB2 ALA 2 -0.632 8.055 -20.806 16 HB3 ALA 2 HB3 ALA 2 -1.440 6.515 -20.517 17 H GLY 3 HN GLY 3 -3.829 8.282 -23.474 18 HA2 GLY 3 HA2 GLY 3 -2.809 10.965 -23.823 19 HA3 GLY 3 HA1 GLY 3 -3.088 10.091 -25.324 20 H GLN 4 HN GLN 4 -4.439 12.124 -23.098 21 HA GLN 4 HA GLN 4 -6.503 12.991 -22.770 22 HB2 GLN 4 HB2 GLN 4 -7.334 11.184 -25.054 23 HB3 GLN 4 HB1 GLN 4 -8.379 12.379 -24.293 24 HG2 GLN 4 HG2 GLN 4 -6.899 14.162 -24.985 25 HG3 GLN 4 HG1 GLN 4 -5.778 12.992 -25.678 26 HE21 GLN 4 HE21 GLN 4 -7.942 11.323 -26.726 27 HE22 GLN 4 HE22 GLN 4 -8.560 12.163 -28.105 28 H SER 5 HN SER 5 -6.806 9.498 -23.429 29 HA SER 5 HA SER 5 -8.133 9.224 -20.824 30 HB2 SER 5 HB2 SER 5 -9.286 8.202 -22.794 31 HB3 SER 5 HB1 SER 5 -7.880 7.174 -23.046 32 HG SER 5 HG SER 5 -9.947 6.731 -21.462 33 H ASP 6 HN ASP 6 -6.435 9.288 -19.421 34 HA ASP 6 HA ASP 6 -4.009 7.808 -19.971 35 HB2 ASP 6 HB2 ASP 6 -4.869 9.545 -17.659 36 HB3 ASP 6 HB1 ASP 6 -3.369 8.626 -17.638 37 H ARG 7 HN ARG 7 -4.781 5.693 -20.048 38 HA ARG 7 HA ARG 7 -6.375 4.555 -18.005 39 HB2 ARG 7 HB2 ARG 7 -4.660 3.210 -20.093 40 HB3 ARG 7 HB1 ARG 7 -5.852 2.397 -19.088 41 HG2 ARG 7 HG2 ARG 7 -7.574 3.952 -20.057 42 HG3 ARG 7 HG1 ARG 7 -6.340 4.472 -21.205 43 HD2 ARG 7 HD2 ARG 7 -7.770 2.732 -22.158 44 HD3 ARG 7 HD1 ARG 7 -6.099 2.184 -22.003 45 HE ARG 7 HE ARG 7 -7.388 1.405 -19.680 46 HH11 ARG 7 HH11 ARG 7 -7.715 0.761 -23.113 47 HH12 ARG 7 HH12 ARG 7 -8.329 -0.854 -22.869 48 HH21 ARG 7 HH21 ARG 7 -8.212 -0.678 -19.371 49 HH22 ARG 7 HH22 ARG 7 -8.636 -1.659 -20.742 50 H LYS 8 HN LYS 8 -2.891 4.620 -18.583 51 HA LYS 8 HA LYS 8 -2.172 2.877 -16.497 52 HB2 LYS 8 HB2 LYS 8 0.053 3.880 -16.614 53 HB3 LYS 8 HB1 LYS 8 -0.575 3.578 -18.224 54 HG2 LYS 8 HG2 LYS 8 -0.046 5.662 -18.732 55 HG3 LYS 8 HG1 LYS 8 -1.334 6.192 -17.650 56 HD2 LYS 8 HD2 LYS 8 0.637 7.340 -16.982 57 HD3 LYS 8 HD1 LYS 8 0.349 6.086 -15.773 58 HE2 LYS 8 HE2 LYS 8 2.032 4.671 -16.790 59 HE3 LYS 8 HE1 LYS 8 2.257 5.830 -18.099 60 HZ1 LYS 8 HZ1 LYS 8 3.020 6.115 -15.247 61 HZ2 LYS 8 HZ2 LYS 8 2.902 7.453 -16.282 62 HZ3 LYS 8 HZ3 LYS 8 4.007 6.219 -16.624 63 H ALA 9 HN ALA 9 -2.770 6.363 -16.544 64 HA ALA 9 HA ALA 9 -2.060 6.851 -13.852 65 HB1 ALA 9 HB1 ALA 9 -2.250 8.636 -15.530 66 HB2 ALA 9 HB2 ALA 9 -3.235 8.965 -14.104 67 HB3 ALA 9 HB3 ALA 9 -3.996 8.387 -15.587 68 H ALA 10 HN ALA 10 -5.032 5.835 -15.421 69 HA ALA 10 HA ALA 10 -6.714 6.000 -13.152 70 HB1 ALA 10 HB1 ALA 10 -7.606 5.780 -15.417 71 HB2 ALA 10 HB2 ALA 10 -8.197 4.484 -14.375 72 HB3 ALA 10 HB3 ALA 10 -6.913 4.163 -15.540 73 H LEU 11 HN LEU 11 -4.456 3.575 -14.317 74 HA LEU 11 HA LEU 11 -5.285 1.545 -12.476 75 HB2 LEU 11 HB2 LEU 11 -2.726 1.864 -14.050 76 HB3 LEU 11 HB1 LEU 11 -3.136 0.445 -13.105 77 HG LEU 11 HG LEU 11 -4.683 1.451 -15.493 78 HD11 LEU 11 HD11 LEU 11 -3.795 -0.536 -16.618 79 HD12 LEU 11 HD12 LEU 11 -2.809 -0.891 -15.199 80 HD13 LEU 11 HD13 LEU 11 -2.514 0.574 -16.134 81 HD21 LEU 11 HD21 LEU 11 -6.100 0.310 -13.871 82 HD22 LEU 11 HD22 LEU 11 -4.988 -1.057 -13.848 83 HD23 LEU 11 HD23 LEU 11 -5.884 -0.676 -15.318 84 H LEU 12 HN LEU 12 -2.808 4.043 -12.542 85 HA LEU 12 HA LEU 12 -1.518 3.427 -10.133 86 HB2 LEU 12 HB2 LEU 12 -2.004 6.127 -11.403 87 HB3 LEU 12 HB1 LEU 12 -0.869 5.823 -10.104 88 HG LEU 12 HG LEU 12 -0.695 4.623 -12.869 89 HD11 LEU 12 HD11 LEU 12 1.207 6.124 -13.174 90 HD12 LEU 12 HD12 LEU 12 0.891 6.848 -11.597 91 HD13 LEU 12 HD13 LEU 12 -0.285 7.023 -12.898 92 HD21 LEU 12 HD21 LEU 12 1.528 3.897 -12.160 93 HD22 LEU 12 HD22 LEU 12 0.271 3.192 -11.144 94 HD23 LEU 12 HD23 LEU 12 1.231 4.546 -10.547 95 H ASP 13 HN ASP 13 -4.401 5.359 -10.814 96 HA ASP 13 HA ASP 13 -4.836 6.233 -8.160 97 HB2 ASP 13 HB2 ASP 13 -5.890 7.250 -10.176 98 HB3 ASP 13 HB1 ASP 13 -6.904 5.818 -10.331 99 H GLN 14 HN GLN 14 -5.747 3.337 -9.911 100 HA GLN 14 HA GLN 14 -7.458 2.272 -7.911 101 HB2 GLN 14 HB2 GLN 14 -5.878 0.908 -10.097 102 HB3 GLN 14 HB1 GLN 14 -7.044 0.087 -9.067 103 HG2 GLN 14 HG2 GLN 14 -7.611 2.339 -10.978 104 HG3 GLN 14 HG1 GLN 14 -8.052 0.642 -11.180 105 HE21 GLN 14 HE21 GLN 14 -9.715 3.059 -11.072 106 HE22 GLN 14 HE22 GLN 14 -10.855 2.795 -9.794 107 H VAL 15 HN VAL 15 -4.008 1.946 -8.600 108 HA VAL 15 HA VAL 15 -3.304 0.232 -6.501 109 HB VAL 15 HB VAL 15 -1.729 2.491 -7.766 110 HG11 VAL 15 HG11 VAL 15 0.271 1.458 -6.818 111 HG12 VAL 15 HG12 VAL 15 -0.737 0.285 -5.967 112 HG13 VAL 15 HG13 VAL 15 -0.833 1.997 -5.551 113 HG21 VAL 15 HG21 VAL 15 -0.603 0.687 -8.984 114 HG22 VAL 15 HG22 VAL 15 -2.335 0.715 -9.317 115 HG23 VAL 15 HG23 VAL 15 -1.664 -0.492 -8.218 116 H ALA 16 HN ALA 16 -3.659 3.747 -6.621 117 HA ALA 16 HA ALA 16 -2.912 4.351 -4.004 118 HB1 ALA 16 HB1 ALA 16 -4.974 5.744 -5.706 119 HB2 ALA 16 HB2 ALA 16 -3.236 6.048 -5.734 120 HB3 ALA 16 HB3 ALA 16 -4.176 6.415 -4.286 121 H ARG 17 HN ARG 17 -6.050 3.337 -5.311 122 HA ARG 17 HA ARG 17 -7.573 3.725 -2.995 123 HB2 ARG 17 HB2 ARG 17 -8.690 3.276 -5.072 124 HB3 ARG 17 HB1 ARG 17 -7.896 1.714 -5.228 125 HG2 ARG 17 HG2 ARG 17 -9.166 0.790 -3.453 126 HG3 ARG 17 HG1 ARG 17 -9.765 2.376 -2.967 127 HD2 ARG 17 HD2 ARG 17 -11.465 1.068 -4.158 128 HD3 ARG 17 HD1 ARG 17 -11.050 2.551 -5.010 129 HE ARG 17 HE ARG 17 -9.730 1.169 -6.544 130 HH11 ARG 17 HH11 ARG 17 -12.080 -0.469 -4.514 131 HH12 ARG 17 HH12 ARG 17 -12.343 -1.756 -5.653 132 HH21 ARG 17 HH21 ARG 17 -10.084 -0.527 -8.029 133 HH22 ARG 17 HH22 ARG 17 -11.207 -1.799 -7.635 134 H VAL 18 HN VAL 18 -5.696 0.923 -4.060 135 HA VAL 18 HA VAL 18 -6.327 -0.719 -1.830 136 HB VAL 18 HB VAL 18 -3.868 -0.834 -3.592 137 HG11 VAL 18 HG11 VAL 18 -3.635 -2.132 -1.542 138 HG12 VAL 18 HG12 VAL 18 -3.774 -3.190 -2.947 139 HG13 VAL 18 HG13 VAL 18 -5.159 -2.954 -1.881 140 HG21 VAL 18 HG21 VAL 18 -5.104 -2.495 -4.910 141 HG22 VAL 18 HG22 VAL 18 -5.897 -0.918 -4.935 142 HG23 VAL 18 HG23 VAL 18 -6.534 -2.208 -3.916 143 H GLY 19 HN GLY 19 -3.670 1.498 -2.566 144 HA2 GLY 19 HA2 GLY 19 -2.133 1.045 -0.258 145 HA3 GLY 19 HA1 GLY 19 -2.109 2.511 -1.226 146 H LYS 20 HN LYS 20 -4.768 3.335 -0.866 147 HA LYS 20 HA LYS 20 -4.605 4.737 1.561 148 HB2 LYS 20 HB2 LYS 20 -6.974 4.196 -0.237 149 HB3 LYS 20 HB1 LYS 20 -7.020 5.296 1.135 150 HG2 LYS 20 HG2 LYS 20 -5.324 6.691 0.102 151 HG3 LYS 20 HG1 LYS 20 -5.207 5.567 -1.255 152 HD2 LYS 20 HD2 LYS 20 -7.555 6.005 -1.810 153 HD3 LYS 20 HD1 LYS 20 -7.660 7.138 -0.461 154 HE2 LYS 20 HE2 LYS 20 -5.882 8.495 -1.516 155 HE3 LYS 20 HE1 LYS 20 -5.891 7.392 -2.889 156 HZ1 LYS 20 HZ1 LYS 20 -8.216 9.001 -1.979 157 HZ2 LYS 20 HZ2 LYS 20 -8.174 7.990 -3.341 158 HZ3 LYS 20 HZ3 LYS 20 -7.215 9.389 -3.292 159 H ALA 21 HN ALA 21 -6.408 1.822 0.676 160 HA ALA 21 HA ALA 21 -7.732 1.552 3.173 161 HB1 ALA 21 HB1 ALA 21 -8.303 -0.691 2.418 162 HB2 ALA 21 HB2 ALA 21 -7.140 -0.555 1.097 163 HB3 ALA 21 HB3 ALA 21 -8.560 0.490 1.136 164 H LEU 22 HN LEU 22 -4.630 0.506 1.947 165 HA LEU 22 HA LEU 22 -4.016 -1.152 4.211 166 HB2 LEU 22 HB2 LEU 22 -3.009 -1.424 1.933 167 HB3 LEU 22 HB1 LEU 22 -2.128 0.069 2.192 168 HG LEU 22 HG LEU 22 -1.005 -0.989 4.150 169 HD11 LEU 22 HD11 LEU 22 -1.114 -3.418 4.389 170 HD12 LEU 22 HD12 LEU 22 -2.354 -3.489 3.138 171 HD13 LEU 22 HD13 LEU 22 -2.689 -2.674 4.665 172 HD21 LEU 22 HD21 LEU 22 0.096 -0.900 1.989 173 HD22 LEU 22 HD22 LEU 22 -0.695 -2.401 1.506 174 HD23 LEU 22 HD23 LEU 22 0.484 -2.409 2.818 175 H ALA 23 HN ALA 23 -4.078 2.166 3.584 176 HA ALA 23 HA ALA 23 -2.212 2.825 5.743 177 HB1 ALA 23 HB1 ALA 23 -1.982 4.075 3.657 178 HB2 ALA 23 HB2 ALA 23 -2.472 5.141 4.976 179 HB3 ALA 23 HB3 ALA 23 -3.658 4.610 3.784 180 H ASN 24 HN ASN 24 -4.955 1.602 5.984 181 HA ASN 24 HA ASN 24 -6.585 3.634 7.211 182 HB2 ASN 24 HB2 ASN 24 -6.857 0.730 6.639 183 HB3 ASN 24 HB1 ASN 24 -7.857 1.402 7.921 184 HD21 ASN 24 HD21 ASN 24 -6.930 3.408 5.241 185 HD22 ASN 24 HD22 ASN 24 -8.489 3.450 4.490 186 H GLY 25 HN GLY 25 -3.923 2.022 8.264 187 HA2 GLY 25 HA2 GLY 25 -2.871 2.012 10.293 188 HA3 GLY 25 HA1 GLY 25 -4.073 3.178 10.816 189 H ARG 26 HN ARG 26 -5.840 2.501 11.986 190 HA ARG 26 HA ARG 26 -5.359 0.306 13.693 191 HB2 ARG 26 HB2 ARG 26 -7.871 1.949 13.332 192 HB3 ARG 26 HB1 ARG 26 -7.565 0.848 14.667 193 HG2 ARG 26 HG2 ARG 26 -5.651 2.219 15.346 194 HG3 ARG 26 HG1 ARG 26 -5.998 3.335 14.024 195 HD2 ARG 26 HD2 ARG 26 -6.898 4.181 16.117 196 HD3 ARG 26 HD1 ARG 26 -8.201 3.789 14.994 197 HE ARG 26 HE ARG 26 -8.370 1.634 16.305 198 HH11 ARG 26 HH11 ARG 26 -7.256 4.639 17.719 199 HH12 ARG 26 HH12 ARG 26 -7.754 4.214 19.331 200 HH21 ARG 26 HH21 ARG 26 -9.030 1.065 18.410 201 HH22 ARG 26 HH22 ARG 26 -8.776 2.184 19.725 202 H ARG 27 HN ARG 27 -7.234 0.661 10.782 203 HA ARG 27 HA ARG 27 -8.863 -1.642 11.174 204 HB2 ARG 27 HB2 ARG 27 -8.166 -0.137 8.650 205 HB3 ARG 27 HB1 ARG 27 -9.370 -1.416 8.752 206 HG2 ARG 27 HG2 ARG 27 -10.637 -0.077 10.371 207 HG3 ARG 27 HG1 ARG 27 -9.448 1.217 10.209 208 HD2 ARG 27 HD2 ARG 27 -9.972 1.379 7.818 209 HD3 ARG 27 HD1 ARG 27 -11.175 0.103 8.004 210 HE ARG 27 HE ARG 27 -12.100 1.834 9.763 211 HH11 ARG 27 HH11 ARG 27 -10.817 2.460 6.560 212 HH12 ARG 27 HH12 ARG 27 -11.834 3.846 6.285 213 HH21 ARG 27 HH21 ARG 27 -13.441 3.672 9.397 214 HH22 ARG 27 HH22 ARG 27 -13.303 4.536 7.896 215 H LEU 28 HN LEU 28 -5.594 -1.236 10.331 216 HA LEU 28 HA LEU 28 -5.255 -3.585 8.755 217 HB2 LEU 28 HB2 LEU 28 -3.260 -2.099 10.464 218 HB3 LEU 28 HB1 LEU 28 -2.858 -3.357 9.312 219 HG LEU 28 HG LEU 28 -4.027 -0.650 8.665 220 HD11 LEU 28 HD11 LEU 28 -1.325 -1.855 8.084 221 HD12 LEU 28 HD12 LEU 28 -1.664 -0.612 9.289 222 HD13 LEU 28 HD13 LEU 28 -1.884 -0.261 7.575 223 HD21 LEU 28 HD21 LEU 28 -3.767 -1.297 6.328 224 HD22 LEU 28 HD22 LEU 28 -4.890 -2.374 7.160 225 HD23 LEU 28 HD23 LEU 28 -3.241 -2.906 6.822 226 H GLN 29 HN GLN 29 -5.698 -2.981 12.106 227 HA GLN 29 HA GLN 29 -4.503 -5.279 13.210 228 HB2 GLN 29 HB2 GLN 29 -5.430 -3.268 14.468 229 HB3 GLN 29 HB1 GLN 29 -7.031 -3.960 14.223 230 HG2 GLN 29 HG2 GLN 29 -6.346 -5.966 15.439 231 HG3 GLN 29 HG1 GLN 29 -4.747 -5.267 15.689 232 HE21 GLN 29 HE21 GLN 29 -7.700 -3.401 15.813 233 HE22 GLN 29 HE22 GLN 29 -7.653 -3.081 17.508 234 H ILE 30 HN ILE 30 -7.599 -4.678 11.690 235 HA ILE 30 HA ILE 30 -8.782 -7.192 12.258 236 HB ILE 30 HB ILE 30 -9.354 -5.343 9.929 237 HG12 ILE 30 HG12 ILE 30 -10.658 -5.461 12.662 238 HG13 ILE 30 HG11 ILE 30 -9.538 -4.213 12.129 239 HG21 ILE 30 HG21 ILE 30 -10.279 -7.551 9.589 240 HG22 ILE 30 HG22 ILE 30 -11.579 -6.418 9.962 241 HG23 ILE 30 HG23 ILE 30 -10.998 -7.532 11.200 242 HD11 ILE 30 HD11 ILE 30 -12.231 -4.782 10.917 243 HD12 ILE 30 HD12 ILE 30 -11.111 -3.517 10.413 244 HD13 ILE 30 HD13 ILE 30 -11.845 -3.458 12.016 245 H LEU 31 HN LEU 31 -6.836 -5.933 9.594 246 HA LEU 31 HA LEU 31 -6.961 -8.216 7.951 247 HB2 LEU 31 HB2 LEU 31 -4.893 -6.034 8.174 248 HB3 LEU 31 HB1 LEU 31 -4.826 -7.298 6.961 249 HG LEU 31 HG LEU 31 -7.054 -5.283 7.249 250 HD11 LEU 31 HD11 LEU 31 -4.820 -5.491 5.238 251 HD12 LEU 31 HD12 LEU 31 -5.006 -4.244 6.471 252 HD13 LEU 31 HD13 LEU 31 -6.174 -4.364 5.156 253 HD21 LEU 31 HD21 LEU 31 -7.823 -7.420 6.355 254 HD22 LEU 31 HD22 LEU 31 -6.541 -7.384 5.147 255 HD23 LEU 31 HD23 LEU 31 -7.825 -6.176 5.106 256 H ASP 32 HN ASP 32 -4.800 -7.296 10.577 257 HA ASP 32 HA ASP 32 -2.926 -9.376 10.312 258 HB2 ASP 32 HB2 ASP 32 -2.582 -7.414 11.766 259 HB3 ASP 32 HB1 ASP 32 -3.861 -7.977 12.833 260 H LEU 33 HN LEU 33 -6.024 -9.202 11.976 261 HA LEU 33 HA LEU 33 -5.896 -11.847 13.060 262 HB2 LEU 33 HB2 LEU 33 -7.289 -10.123 14.078 263 HB3 LEU 33 HB1 LEU 33 -8.238 -9.992 12.611 264 HG LEU 33 HG LEU 33 -9.008 -12.339 12.949 265 HD11 LEU 33 HD11 LEU 33 -7.623 -12.067 15.614 266 HD12 LEU 33 HD12 LEU 33 -7.119 -13.123 14.293 267 HD13 LEU 33 HD13 LEU 33 -8.658 -13.402 15.108 268 HD21 LEU 33 HD21 LEU 33 -9.540 -10.447 15.236 269 HD22 LEU 33 HD22 LEU 33 -10.551 -11.814 14.765 270 HD23 LEU 33 HD23 LEU 33 -10.360 -10.442 13.674 271 H LEU 34 HN LEU 34 -7.257 -10.395 10.140 272 HA LEU 34 HA LEU 34 -8.625 -12.757 9.301 273 HB2 LEU 34 HB2 LEU 34 -7.798 -10.305 7.749 274 HB3 LEU 34 HB1 LEU 34 -8.826 -11.577 7.117 275 HG LEU 34 HG LEU 34 -9.465 -9.722 9.410 276 HD11 LEU 34 HD11 LEU 34 -9.631 -8.689 7.208 277 HD12 LEU 34 HD12 LEU 34 -11.221 -8.899 7.940 278 HD13 LEU 34 HD13 LEU 34 -10.684 -9.997 6.667 279 HD21 LEU 34 HD21 LEU 34 -11.645 -10.808 9.466 280 HD22 LEU 34 HD22 LEU 34 -10.353 -11.953 9.830 281 HD23 LEU 34 HD23 LEU 34 -11.113 -11.958 8.238 282 H ALA 35 HN ALA 35 -5.366 -11.699 9.109 283 HA ALA 35 HA ALA 35 -4.558 -13.338 6.919 284 HB1 ALA 35 HB1 ALA 35 -2.927 -12.248 9.212 285 HB2 ALA 35 HB2 ALA 35 -3.211 -11.443 7.669 286 HB3 ALA 35 HB3 ALA 35 -2.281 -12.942 7.726 287 H GLN 36 HN GLN 36 -5.328 -13.901 10.203 288 HA GLN 36 HA GLN 36 -4.004 -16.451 10.407 289 HB2 GLN 36 HB2 GLN 36 -4.392 -15.131 12.413 290 HB3 GLN 36 HB1 GLN 36 -6.118 -15.100 12.103 291 HG2 GLN 36 HG2 GLN 36 -4.726 -17.710 12.510 292 HG3 GLN 36 HG1 GLN 36 -5.131 -16.699 13.894 293 HE21 GLN 36 HE21 GLN 36 -7.562 -15.678 12.583 294 HE22 GLN 36 HE22 GLN 36 -8.716 -16.966 12.686 295 H GLY 37 HN GLY 37 -7.224 -15.232 9.698 296 HA2 GLY 37 HA2 GLY 37 -8.027 -17.198 7.969 297 HA3 GLY 37 HA1 GLY 37 -8.481 -17.794 9.561 298 H GLU 38 HN GLU 38 -10.565 -17.514 8.065 299 HA GLU 38 HA GLU 38 -11.627 -14.820 8.142 300 HB2 GLU 38 HB2 GLU 38 -13.631 -15.804 7.104 301 HB3 GLU 38 HB1 GLU 38 -12.170 -16.218 6.224 302 HG2 GLU 38 HG2 GLU 38 -13.295 -18.096 8.259 303 HG3 GLU 38 HG1 GLU 38 -13.972 -18.021 6.635 304 H ARG 39 HN ARG 39 -13.348 -14.120 9.370 305 HA ARG 39 HA ARG 39 -14.514 -15.918 11.344 306 HB2 ARG 39 HB2 ARG 39 -13.011 -13.398 12.058 307 HB3 ARG 39 HB1 ARG 39 -14.197 -14.127 13.128 308 HG2 ARG 39 HG2 ARG 39 -12.817 -16.216 13.100 309 HG3 ARG 39 HG1 ARG 39 -11.589 -15.316 12.205 310 HD2 ARG 39 HD2 ARG 39 -11.378 -13.735 14.027 311 HD3 ARG 39 HD1 ARG 39 -12.680 -14.530 14.907 312 HE ARG 39 HE ARG 39 -10.023 -15.713 14.397 313 HH11 ARG 39 HH11 ARG 39 -12.995 -15.544 16.206 314 HH12 ARG 39 HH12 ARG 39 -12.417 -16.502 17.533 315 HH21 ARG 39 HH21 ARG 39 -9.218 -16.985 16.154 316 HH22 ARG 39 HH22 ARG 39 -10.260 -17.295 17.514 317 H ALA 40 HN ALA 40 -16.383 -14.869 12.459 318 HA ALA 40 HA ALA 40 -17.945 -13.376 10.552 319 HB1 ALA 40 HB1 ALA 40 -19.749 -13.567 12.176 320 HB2 ALA 40 HB2 ALA 40 -18.618 -14.168 13.387 321 HB3 ALA 40 HB3 ALA 40 -18.962 -15.128 11.949 322 H VAL 41 HN VAL 41 -18.856 -11.317 10.894 323 HA VAL 41 HA VAL 41 -17.176 -9.295 11.698 324 HB VAL 41 HB VAL 41 -20.199 -9.178 11.743 325 HG11 VAL 41 HG11 VAL 41 -19.122 -7.274 12.855 326 HG12 VAL 41 HG12 VAL 41 -19.926 -6.794 11.362 327 HG13 VAL 41 HG13 VAL 41 -18.172 -6.970 11.400 328 HG21 VAL 41 HG21 VAL 41 -19.345 -10.008 9.610 329 HG22 VAL 41 HG22 VAL 41 -18.280 -8.607 9.488 330 HG23 VAL 41 HG23 VAL 41 -20.030 -8.393 9.441 331 H GLU 42 HN GLU 42 -19.662 -10.914 13.609 332 HA GLU 42 HA GLU 42 -19.649 -9.233 15.837 333 HB2 GLU 42 HB2 GLU 42 -21.350 -10.982 15.371 334 HB3 GLU 42 HB1 GLU 42 -20.163 -12.209 15.785 335 HG2 GLU 42 HG2 GLU 42 -20.021 -11.299 18.055 336 HG3 GLU 42 HG1 GLU 42 -21.241 -10.099 17.636 337 H ALA 43 HN ALA 43 -17.739 -12.143 15.150 338 HA ALA 43 HA ALA 43 -16.406 -12.188 17.652 339 HB1 ALA 43 HB1 ALA 43 -15.566 -13.406 15.023 340 HB2 ALA 43 HB2 ALA 43 -16.583 -14.175 16.242 341 HB3 ALA 43 HB3 ALA 43 -14.898 -13.801 16.607 342 H ILE 44 HN ILE 44 -15.604 -10.846 14.483 343 HA ILE 44 HA ILE 44 -12.991 -9.990 15.102 344 HB ILE 44 HB ILE 44 -14.937 -8.795 13.120 345 HG12 ILE 44 HG12 ILE 44 -12.750 -10.845 12.709 346 HG13 ILE 44 HG11 ILE 44 -14.473 -11.202 12.764 347 HG21 ILE 44 HG21 ILE 44 -11.945 -8.512 13.344 348 HG22 ILE 44 HG22 ILE 44 -13.145 -7.245 13.600 349 HG23 ILE 44 HG23 ILE 44 -12.919 -7.936 11.993 350 HD11 ILE 44 HD11 ILE 44 -13.112 -9.456 10.724 351 HD12 ILE 44 HD12 ILE 44 -14.829 -9.858 10.773 352 HD13 ILE 44 HD13 ILE 44 -13.636 -11.121 10.479 353 H ALA 45 HN ALA 45 -16.112 -8.316 15.222 354 HA ALA 45 HA ALA 45 -15.212 -5.808 16.048 355 HB1 ALA 45 HB1 ALA 45 -17.832 -7.147 16.711 356 HB2 ALA 45 HB2 ALA 45 -17.479 -6.258 15.230 357 HB3 ALA 45 HB3 ALA 45 -17.500 -5.417 16.780 358 H THR 46 HN THR 46 -16.377 -8.535 18.004 359 HA THR 46 HA THR 46 -16.136 -7.310 20.501 360 HB THR 46 HB THR 46 -15.797 -10.259 19.917 361 HG1 THR 46 HG1 THR 46 -17.742 -9.593 19.015 362 HG21 THR 46 HG21 THR 46 -15.211 -9.645 22.201 363 HG22 THR 46 HG22 THR 46 -16.730 -10.542 22.177 364 HG23 THR 46 HG23 THR 46 -16.743 -8.790 22.383 365 H ALA 47 HN ALA 47 -13.805 -9.307 18.705 366 HA ALA 47 HA ALA 47 -11.885 -9.429 20.774 367 HB1 ALA 47 HB1 ALA 47 -11.949 -11.040 18.949 368 HB2 ALA 47 HB2 ALA 47 -10.367 -10.266 19.057 369 HB3 ALA 47 HB3 ALA 47 -11.506 -9.772 17.806 370 H THR 48 HN THR 48 -12.492 -7.063 18.264 371 HA THR 48 HA THR 48 -9.949 -5.742 18.782 372 HB THR 48 HB THR 48 -10.768 -4.135 16.995 373 HG1 THR 48 HG1 THR 48 -12.652 -6.161 16.359 374 HG21 THR 48 HG21 THR 48 -10.500 -7.058 16.273 375 HG22 THR 48 HG22 THR 48 -9.174 -5.920 16.504 376 HG23 THR 48 HG23 THR 48 -10.297 -5.705 15.163 377 H GLY 49 HN GLY 49 -13.109 -5.643 19.967 378 HA2 GLY 49 HA2 GLY 49 -13.895 -4.315 21.711 379 HA3 GLY 49 HA1 GLY 49 -12.489 -3.280 21.525 380 H MET 50 HN MET 50 -14.718 -4.157 18.951 381 HA MET 50 HA MET 50 -15.762 -1.402 18.974 382 HB2 MET 50 HB2 MET 50 -14.821 -3.018 16.600 383 HB3 MET 50 HB1 MET 50 -15.843 -1.595 16.437 384 HG2 MET 50 HG2 MET 50 -14.118 -0.239 17.522 385 HG3 MET 50 HG1 MET 50 -13.094 -1.662 17.669 386 HE1 MET 50 HE1 MET 50 -13.292 -3.188 14.965 387 HE2 MET 50 HE2 MET 50 -11.762 -2.756 15.732 388 HE3 MET 50 HE3 MET 50 -12.023 -2.404 14.023 389 H ASN 51 HN ASN 51 -17.867 -1.198 17.831 390 HA ASN 51 HA ASN 51 -19.617 -3.343 18.628 391 HB2 ASN 51 HB2 ASN 51 -20.211 -0.775 17.133 392 HB3 ASN 51 HB1 ASN 51 -21.429 -1.894 17.734 393 HD21 ASN 51 HD21 ASN 51 -21.762 -2.064 19.974 394 HD22 ASN 51 HD22 ASN 51 -21.218 -0.838 21.069 395 H LEU 52 HN LEU 52 -21.162 -4.388 17.168 396 HA LEU 52 HA LEU 52 -19.933 -5.561 14.945 397 HB2 LEU 52 HB2 LEU 52 -22.735 -5.473 15.959 398 HB3 LEU 52 HB1 LEU 52 -22.450 -6.093 14.344 399 HG LEU 52 HG LEU 52 -20.868 -7.763 15.332 400 HD11 LEU 52 HD11 LEU 52 -20.335 -6.562 17.392 401 HD12 LEU 52 HD12 LEU 52 -20.945 -8.183 17.722 402 HD13 LEU 52 HD13 LEU 52 -21.994 -6.783 17.950 403 HD21 LEU 52 HD21 LEU 52 -22.620 -9.217 16.194 404 HD22 LEU 52 HD22 LEU 52 -23.180 -8.335 14.773 405 HD23 LEU 52 HD23 LEU 52 -23.693 -7.830 16.385 406 H THR 53 HN THR 53 -22.326 -2.947 15.104 407 HA THR 53 HA THR 53 -22.575 -2.512 12.345 408 HB THR 53 HB THR 53 -23.146 -0.104 13.156 409 HG1 THR 53 HG1 THR 53 -22.649 0.187 15.206 410 HG21 THR 53 HG21 THR 53 -24.805 -1.792 12.529 411 HG22 THR 53 HG22 THR 53 -25.343 -0.856 13.923 412 HG23 THR 53 HG23 THR 53 -24.711 -2.488 14.146 413 H THR 54 HN THR 54 -20.425 -1.076 14.747 414 HA THR 54 HA THR 54 -19.053 0.700 13.081 415 HB THR 54 HB THR 54 -17.948 -0.758 15.493 416 HG1 THR 54 HG1 THR 54 -18.720 1.242 16.553 417 HG21 THR 54 HG21 THR 54 -16.532 1.222 15.744 418 HG22 THR 54 HG22 THR 54 -17.223 1.912 14.275 419 HG23 THR 54 HG23 THR 54 -16.254 0.441 14.189 420 H ALA 55 HN ALA 55 -18.277 -2.652 13.995 421 HA ALA 55 HA ALA 55 -15.897 -2.886 12.543 422 HB1 ALA 55 HB1 ALA 55 -16.211 -5.292 12.717 423 HB2 ALA 55 HB2 ALA 55 -17.899 -5.054 13.171 424 HB3 ALA 55 HB3 ALA 55 -16.609 -4.502 14.241 425 H SER 56 HN SER 56 -19.247 -3.545 11.598 426 HA SER 56 HA SER 56 -18.726 -4.561 9.045 427 HB2 SER 56 HB2 SER 56 -21.123 -2.956 9.962 428 HB3 SER 56 HB1 SER 56 -21.058 -3.992 8.535 429 HG SER 56 HG SER 56 -20.848 -4.777 11.261 430 H ALA 57 HN ALA 57 -19.045 -1.235 10.188 431 HA ALA 57 HA ALA 57 -19.025 -0.041 7.608 432 HB1 ALA 57 HB1 ALA 57 -18.606 2.051 8.792 433 HB2 ALA 57 HB2 ALA 57 -18.270 1.154 10.272 434 HB3 ALA 57 HB3 ALA 57 -19.889 1.126 9.573 435 H ASN 58 HN ASN 58 -16.514 -0.676 10.026 436 HA ASN 58 HA ASN 58 -14.377 0.483 8.589 437 HB2 ASN 58 HB2 ASN 58 -14.514 -1.566 10.789 438 HB3 ASN 58 HB1 ASN 58 -12.977 -1.139 10.043 439 HD21 ASN 58 HD21 ASN 58 -15.634 0.014 11.995 440 HD22 ASN 58 HD22 ASN 58 -14.822 1.420 12.601 441 H LEU 59 HN LEU 59 -15.707 -2.782 8.666 442 HA LEU 59 HA LEU 59 -13.791 -3.960 6.955 443 HB2 LEU 59 HB2 LEU 59 -16.625 -4.714 7.642 444 HB3 LEU 59 HB1 LEU 59 -15.598 -5.699 6.617 445 HG LEU 59 HG LEU 59 -14.928 -4.966 9.467 446 HD11 LEU 59 HD11 LEU 59 -15.541 -7.265 10.016 447 HD12 LEU 59 HD12 LEU 59 -16.083 -7.518 8.356 448 HD13 LEU 59 HD13 LEU 59 -16.922 -6.364 9.393 449 HD21 LEU 59 HD21 LEU 59 -13.278 -6.776 9.235 450 HD22 LEU 59 HD22 LEU 59 -12.979 -5.446 8.114 451 HD23 LEU 59 HD23 LEU 59 -13.719 -6.939 7.535 452 H GLN 60 HN GLN 60 -16.846 -2.297 6.358 453 HA GLN 60 HA GLN 60 -17.138 -2.914 3.645 454 HB2 GLN 60 HB2 GLN 60 -18.892 -1.830 4.990 455 HB3 GLN 60 HB1 GLN 60 -17.923 -0.365 5.067 456 HG2 GLN 60 HG2 GLN 60 -18.070 -0.145 2.632 457 HG3 GLN 60 HG1 GLN 60 -19.064 -1.598 2.568 458 HE21 GLN 60 HE21 GLN 60 -19.276 0.839 5.070 459 HE22 GLN 60 HE22 GLN 60 -20.859 1.400 4.643 460 H ALA 61 HN ALA 61 -15.317 -0.355 5.253 461 HA ALA 61 HA ALA 61 -14.514 1.047 2.946 462 HB1 ALA 61 HB1 ALA 61 -13.133 0.803 5.617 463 HB2 ALA 61 HB2 ALA 61 -14.335 2.013 5.170 464 HB3 ALA 61 HB3 ALA 61 -12.759 2.002 4.378 465 H LEU 62 HN LEU 62 -12.894 -1.491 4.823 466 HA LEU 62 HA LEU 62 -10.596 -1.689 3.207 467 HB2 LEU 62 HB2 LEU 62 -11.922 -3.782 4.935 468 HB3 LEU 62 HB1 LEU 62 -10.307 -3.910 4.264 469 HG LEU 62 HG LEU 62 -11.193 -1.809 6.244 470 HD11 LEU 62 HD11 LEU 62 -9.486 -4.263 6.647 471 HD12 LEU 62 HD12 LEU 62 -11.142 -4.057 7.220 472 HD13 LEU 62 HD13 LEU 62 -9.853 -3.037 7.860 473 HD21 LEU 62 HD21 LEU 62 -8.791 -1.330 6.421 474 HD22 LEU 62 HD22 LEU 62 -9.405 -1.029 4.794 475 HD23 LEU 62 HD23 LEU 62 -8.472 -2.489 5.129 476 H LYS 63 HN LYS 63 -13.749 -3.218 3.046 477 HA LYS 63 HA LYS 63 -13.078 -5.165 1.093 478 HB2 LYS 63 HB2 LYS 63 -15.087 -5.119 2.686 479 HB3 LYS 63 HB1 LYS 63 -15.830 -4.024 1.531 480 HG2 LYS 63 HG2 LYS 63 -15.618 -5.733 -0.208 481 HG3 LYS 63 HG1 LYS 63 -14.912 -6.834 0.977 482 HD2 LYS 63 HD2 LYS 63 -17.011 -6.571 2.321 483 HD3 LYS 63 HD1 LYS 63 -17.695 -5.687 0.954 484 HE2 LYS 63 HE2 LYS 63 -16.648 -8.513 0.867 485 HE3 LYS 63 HE1 LYS 63 -18.349 -8.057 0.948 486 HZ1 LYS 63 HZ1 LYS 63 -18.324 -7.247 -1.197 487 HZ2 LYS 63 HZ2 LYS 63 -17.313 -8.607 -1.317 488 HZ3 LYS 63 HZ3 LYS 63 -16.639 -7.055 -1.237 489 H SER 64 HN SER 64 -14.299 -1.877 0.949 490 HA SER 64 HA SER 64 -14.766 -1.900 -1.873 491 HB2 SER 64 HB2 SER 64 -14.443 0.452 0.011 492 HB3 SER 64 HB1 SER 64 -15.126 0.505 -1.617 493 HG SER 64 HG SER 64 -16.181 -0.677 0.721 494 H GLY 65 HN GLY 65 -12.011 -1.454 0.142 495 HA2 GLY 65 HA2 GLY 65 -10.403 -0.169 -1.880 496 HA3 GLY 65 HA1 GLY 65 -9.832 -0.842 -0.358 497 H GLY 66 HN GLY 66 -11.414 -3.367 -1.225 498 HA2 GLY 66 HA2 GLY 66 -11.077 -5.172 -2.704 499 HA3 GLY 66 HA1 GLY 66 -9.669 -4.345 -3.354 500 H LEU 67 HN LEU 67 -9.797 -4.371 0.034 501 HA LEU 67 HA LEU 67 -7.492 -6.123 0.102 502 HB2 LEU 67 HB2 LEU 67 -8.766 -4.228 2.023 503 HB3 LEU 67 HB1 LEU 67 -7.734 -5.492 2.657 504 HG LEU 67 HG LEU 67 -6.532 -3.371 2.376 505 HD11 LEU 67 HD11 LEU 67 -4.618 -4.242 1.130 506 HD12 LEU 67 HD12 LEU 67 -5.625 -5.548 0.505 507 HD13 LEU 67 HD13 LEU 67 -5.290 -5.440 2.233 508 HD21 LEU 67 HD21 LEU 67 -6.027 -2.528 0.136 509 HD22 LEU 67 HD22 LEU 67 -7.754 -2.461 0.488 510 HD23 LEU 67 HD23 LEU 67 -7.116 -3.729 -0.557 511 H VAL 68 HN VAL 68 -10.805 -6.099 1.354 512 HA VAL 68 HA VAL 68 -10.378 -8.884 2.205 513 HB VAL 68 HB VAL 68 -11.987 -8.585 4.008 514 HG11 VAL 68 HG11 VAL 68 -9.792 -6.521 4.092 515 HG12 VAL 68 HG12 VAL 68 -9.620 -8.234 4.471 516 HG13 VAL 68 HG13 VAL 68 -10.629 -7.203 5.487 517 HG21 VAL 68 HG21 VAL 68 -12.788 -6.356 4.641 518 HG22 VAL 68 HG22 VAL 68 -13.373 -6.833 3.046 519 HG23 VAL 68 HG23 VAL 68 -12.044 -5.682 3.192 520 H GLU 69 HN GLU 69 -12.307 -10.200 2.286 521 HA GLU 69 HA GLU 69 -14.458 -9.341 0.478 522 HB2 GLU 69 HB2 GLU 69 -12.499 -11.316 -0.096 523 HB3 GLU 69 HB1 GLU 69 -14.006 -12.165 0.218 524 HG2 GLU 69 HG2 GLU 69 -13.733 -9.898 -1.739 525 HG3 GLU 69 HG1 GLU 69 -13.594 -11.601 -2.171 526 H ALA 70 HN ALA 70 -16.454 -10.546 0.824 527 HA ALA 70 HA ALA 70 -16.592 -11.669 3.548 528 HB1 ALA 70 HB1 ALA 70 -18.742 -10.549 3.868 529 HB2 ALA 70 HB2 ALA 70 -18.588 -9.790 2.283 530 HB3 ALA 70 HB3 ALA 70 -17.452 -9.384 3.572 531 H ARG 71 HN ARG 71 -17.457 -13.617 3.636 532 HA ARG 71 HA ARG 71 -19.001 -14.586 1.336 533 HB2 ARG 71 HB2 ARG 71 -18.017 -16.172 3.713 534 HB3 ARG 71 HB1 ARG 71 -18.635 -16.804 2.195 535 HG2 ARG 71 HG2 ARG 71 -16.676 -15.809 1.043 536 HG3 ARG 71 HG1 ARG 71 -16.045 -15.335 2.622 537 HD2 ARG 71 HD2 ARG 71 -16.504 -18.111 1.557 538 HD3 ARG 71 HD1 ARG 71 -14.982 -17.378 2.061 539 HE ARG 71 HE ARG 71 -17.130 -17.850 4.017 540 HH11 ARG 71 HH11 ARG 71 -13.841 -18.384 2.933 541 HH12 ARG 71 HH12 ARG 71 -13.360 -19.201 4.394 542 HH21 ARG 71 HH21 ARG 71 -16.542 -18.954 5.882 543 HH22 ARG 71 HH22 ARG 71 -14.923 -19.587 6.049 544 H ARG 72 HN ARG 72 -21.145 -14.720 1.455 545 HA ARG 72 HA ARG 72 -22.467 -14.136 3.961 546 HB2 ARG 72 HB2 ARG 72 -23.293 -13.173 1.847 547 HB3 ARG 72 HB1 ARG 72 -23.620 -14.788 1.241 548 HG2 ARG 72 HG2 ARG 72 -25.669 -13.788 1.970 549 HG3 ARG 72 HG1 ARG 72 -25.253 -15.107 3.065 550 HD2 ARG 72 HD2 ARG 72 -26.052 -13.192 4.314 551 HD3 ARG 72 HD1 ARG 72 -24.349 -13.477 4.662 552 HE ARG 72 HE ARG 72 -23.911 -11.619 3.020 553 HH11 ARG 72 HH11 ARG 72 -27.011 -11.853 4.634 554 HH12 ARG 72 HH12 ARG 72 -27.266 -10.133 4.675 555 HH21 ARG 72 HH21 ARG 72 -24.254 -9.347 3.065 556 HH22 ARG 72 HH22 ARG 72 -25.679 -8.708 3.821 557 H GLU 73 HN GLU 73 -22.163 -15.836 5.303 558 HA GLU 73 HA GLU 73 -23.131 -18.461 4.402 559 HB2 GLU 73 HB2 GLU 73 -21.313 -17.773 6.720 560 HB3 GLU 73 HB1 GLU 73 -21.851 -19.393 6.303 561 HG2 GLU 73 HG2 GLU 73 -20.713 -19.171 4.123 562 HG3 GLU 73 HG1 GLU 73 -20.110 -17.594 4.630 563 H GLY 74 HN GLY 74 -25.168 -18.768 4.943 564 HA2 GLY 74 HA2 GLY 74 -27.122 -18.780 6.142 565 HA3 GLY 74 HA1 GLY 74 -26.140 -18.586 7.589 566 H THR 75 HN THR 75 -26.802 -16.896 8.714 567 HA THR 75 HA THR 75 -27.713 -14.497 7.267 568 HB THR 75 HB THR 75 -28.099 -15.013 10.217 569 HG1 THR 75 HG1 THR 75 -29.097 -16.516 8.285 570 HG21 THR 75 HG21 THR 75 -28.535 -12.739 9.445 571 HG22 THR 75 HG22 THR 75 -30.043 -13.532 9.900 572 HG23 THR 75 HG23 THR 75 -29.617 -13.355 8.198 573 H ARG 76 HN ARG 76 -24.927 -15.594 8.164 574 HA ARG 76 HA ARG 76 -24.064 -13.201 9.643 575 HB2 ARG 76 HB2 ARG 76 -22.752 -15.922 9.519 576 HB3 ARG 76 HB1 ARG 76 -22.155 -14.539 10.424 577 HG2 ARG 76 HG2 ARG 76 -24.159 -14.586 11.821 578 HG3 ARG 76 HG1 ARG 76 -24.753 -15.981 10.911 579 HD2 ARG 76 HD2 ARG 76 -22.756 -17.241 11.592 580 HD3 ARG 76 HD1 ARG 76 -22.216 -15.853 12.535 581 HE ARG 76 HE ARG 76 -24.851 -16.912 13.178 582 HH11 ARG 76 HH11 ARG 76 -21.436 -16.856 13.916 583 HH12 ARG 76 HH12 ARG 76 -21.638 -17.371 15.561 584 HH21 ARG 76 HH21 ARG 76 -25.137 -17.635 15.341 585 HH22 ARG 76 HH22 ARG 76 -23.744 -17.820 16.369 586 H GLN 77 HN GLN 77 -22.249 -12.101 8.991 587 HA GLN 77 HA GLN 77 -21.283 -12.697 6.289 588 HB2 GLN 77 HB2 GLN 77 -20.963 -10.191 7.956 589 HB3 GLN 77 HB1 GLN 77 -20.368 -10.404 6.317 590 HG2 GLN 77 HG2 GLN 77 -22.676 -10.672 5.531 591 HG3 GLN 77 HG1 GLN 77 -23.250 -10.409 7.179 592 HE21 GLN 77 HE21 GLN 77 -21.824 -8.943 4.370 593 HE22 GLN 77 HE22 GLN 77 -22.057 -7.299 4.856 594 H TYR 78 HN TYR 78 -19.476 -13.844 6.204 595 HA TYR 78 HA TYR 78 -17.541 -13.590 8.397 596 HB2 TYR 78 HB2 TYR 78 -17.913 -15.722 6.285 597 HB3 TYR 78 HB1 TYR 78 -16.524 -15.667 7.367 598 HD1 TYR 78 HD2 TYR 78 -20.195 -16.064 7.237 599 HD2 TYR 78 HD1 TYR 78 -16.686 -16.430 9.613 600 HE1 TYR 78 HE2 TYR 78 -21.485 -17.267 8.947 601 HE2 TYR 78 HE1 TYR 78 -17.970 -17.632 11.330 602 HH TYR 78 HH TYR 78 -21.073 -18.864 10.781 603 H TYR 79 HN TYR 79 -15.882 -12.318 8.087 604 HA TYR 79 HA TYR 79 -15.178 -11.554 5.344 605 HB2 TYR 79 HB2 TYR 79 -14.839 -10.204 8.004 606 HB3 TYR 79 HB1 TYR 79 -13.849 -9.728 6.631 607 HD1 TYR 79 HD1 TYR 79 -17.396 -10.092 7.713 608 HD2 TYR 79 HD2 TYR 79 -14.659 -8.197 5.066 609 HE1 TYR 79 HE1 TYR 79 -19.186 -8.588 6.948 610 HE2 TYR 79 HE2 TYR 79 -16.438 -6.687 4.291 611 HH TYR 79 HH TYR 79 -19.418 -6.387 5.900 612 H ARG 80 HN ARG 80 -13.098 -11.528 4.637 613 HA ARG 80 HA ARG 80 -10.891 -12.380 6.285 614 HB2 ARG 80 HB2 ARG 80 -12.052 -14.523 5.490 615 HB3 ARG 80 HB1 ARG 80 -11.591 -14.054 3.859 616 HG2 ARG 80 HG2 ARG 80 -9.194 -13.921 4.884 617 HG3 ARG 80 HG1 ARG 80 -9.885 -14.975 6.121 618 HD2 ARG 80 HD2 ARG 80 -8.891 -16.352 4.433 619 HD3 ARG 80 HD1 ARG 80 -10.644 -16.498 4.306 620 HE ARG 80 HE ARG 80 -9.711 -14.461 2.577 621 HH11 ARG 80 HH11 ARG 80 -9.772 -17.956 2.889 622 HH12 ARG 80 HH12 ARG 80 -9.685 -18.230 1.178 623 HH21 ARG 80 HH21 ARG 80 -9.575 -14.828 0.335 624 HH22 ARG 80 HH22 ARG 80 -9.537 -16.459 -0.274 625 H ILE 81 HN ILE 81 -8.849 -12.371 4.818 626 HA ILE 81 HA ILE 81 -8.717 -10.125 3.163 627 HB ILE 81 HB ILE 81 -6.984 -12.601 2.994 628 HG12 ILE 81 HG12 ILE 81 -6.645 -10.086 4.651 629 HG13 ILE 81 HG11 ILE 81 -7.056 -11.680 5.276 630 HG21 ILE 81 HG21 ILE 81 -5.285 -11.021 2.120 631 HG22 ILE 81 HG22 ILE 81 -6.525 -9.766 2.080 632 HG23 ILE 81 HG23 ILE 81 -6.686 -11.198 1.063 633 HD11 ILE 81 HD11 ILE 81 -4.478 -10.897 3.936 634 HD12 ILE 81 HD12 ILE 81 -4.882 -12.518 4.500 635 HD13 ILE 81 HD13 ILE 81 -4.723 -11.196 5.656 636 H ALA 82 HN ALA 82 -9.010 -9.819 0.983 637 HA ALA 82 HA ALA 82 -11.094 -11.088 -0.253 638 HB1 ALA 82 HB1 ALA 82 -10.404 -9.994 -2.318 639 HB2 ALA 82 HB2 ALA 82 -8.807 -9.692 -1.633 640 HB3 ALA 82 HB3 ALA 82 -10.227 -8.912 -0.936 641 H GLY 83 HN GLY 83 -7.655 -11.698 -0.900 642 HA2 GLY 83 HA2 GLY 83 -8.285 -14.450 -1.565 643 HA3 GLY 83 HA1 GLY 83 -7.614 -13.487 -2.878 644 H GLU 84 HN GLU 84 -6.196 -15.663 -2.097 645 HA GLU 84 HA GLU 84 -4.366 -15.158 -0.005 646 HB2 GLU 84 HB2 GLU 84 -4.787 -17.415 -1.035 647 HB3 GLU 84 HB1 GLU 84 -3.839 -16.889 -2.423 648 HG2 GLU 84 HG2 GLU 84 -1.934 -16.469 -0.874 649 HG3 GLU 84 HG1 GLU 84 -2.892 -17.188 0.417 650 H ASP 85 HN ASP 85 -4.451 -14.250 -3.378 651 HA ASP 85 HA ASP 85 -1.775 -13.481 -3.719 652 HB2 ASP 85 HB2 ASP 85 -3.707 -13.593 -5.443 653 HB3 ASP 85 HB1 ASP 85 -4.071 -11.950 -4.924 654 H VAL 86 HN VAL 86 -4.570 -11.655 -2.559 655 HA VAL 86 HA VAL 86 -3.147 -9.276 -1.942 656 HB VAL 86 HB VAL 86 -5.755 -10.259 -0.752 657 HG11 VAL 86 HG11 VAL 86 -4.617 -7.473 -0.938 658 HG12 VAL 86 HG12 VAL 86 -4.747 -8.444 0.527 659 HG13 VAL 86 HG13 VAL 86 -6.206 -7.902 -0.300 660 HG21 VAL 86 HG21 VAL 86 -6.851 -8.907 -2.466 661 HG22 VAL 86 HG22 VAL 86 -5.865 -10.179 -3.187 662 HG23 VAL 86 HG23 VAL 86 -5.281 -8.516 -3.168 663 H ALA 87 HN ALA 87 -3.890 -12.224 -0.195 664 HA ALA 87 HA ALA 87 -3.094 -11.387 2.379 665 HB1 ALA 87 HB1 ALA 87 -2.959 -13.778 2.903 666 HB2 ALA 87 HB2 ALA 87 -3.102 -14.157 1.186 667 HB3 ALA 87 HB3 ALA 87 -4.440 -13.380 2.032 668 H ARG 88 HN ARG 88 -1.315 -12.758 -0.345 669 HA ARG 88 HA ARG 88 1.150 -13.063 1.049 670 HB2 ARG 88 HB2 ARG 88 0.850 -12.581 -1.920 671 HB3 ARG 88 HB1 ARG 88 2.190 -13.361 -1.097 672 HG2 ARG 88 HG2 ARG 88 -0.586 -14.426 -1.514 673 HG3 ARG 88 HG1 ARG 88 0.924 -15.048 -2.172 674 HD2 ARG 88 HD2 ARG 88 0.221 -14.990 0.759 675 HD3 ARG 88 HD1 ARG 88 0.013 -16.389 -0.292 676 HE ARG 88 HE ARG 88 2.626 -15.180 0.394 677 HH11 ARG 88 HH11 ARG 88 0.647 -17.928 -0.549 678 HH12 ARG 88 HH12 ARG 88 1.932 -19.082 -0.340 679 HH21 ARG 88 HH21 ARG 88 4.303 -16.718 0.710 680 HH22 ARG 88 HH22 ARG 88 4.001 -18.399 0.389 681 H LEU 89 HN LEU 89 -0.383 -10.455 -0.705 682 HA LEU 89 HA LEU 89 1.807 -8.676 -0.789 683 HB2 LEU 89 HB2 LEU 89 -0.374 -8.529 -2.070 684 HB3 LEU 89 HB1 LEU 89 -1.118 -7.941 -0.599 685 HG LEU 89 HG LEU 89 1.230 -6.511 -1.822 686 HD11 LEU 89 HD11 LEU 89 -1.689 -6.158 -2.496 687 HD12 LEU 89 HD12 LEU 89 -0.413 -6.696 -3.588 688 HD13 LEU 89 HD13 LEU 89 -0.398 -5.049 -2.957 689 HD21 LEU 89 HD21 LEU 89 -1.057 -5.614 -0.067 690 HD22 LEU 89 HD22 LEU 89 0.234 -4.582 -0.683 691 HD23 LEU 89 HD23 LEU 89 0.609 -5.879 0.450 692 H PHE 90 HN PHE 90 -0.846 -9.055 1.555 693 HA PHE 90 HA PHE 90 0.032 -7.021 3.306 694 HB2 PHE 90 HB2 PHE 90 -2.253 -7.933 3.377 695 HB3 PHE 90 HB1 PHE 90 -1.622 -9.477 3.940 696 HD1 PHE 90 HD1 PHE 90 -1.578 -5.857 4.868 697 HD2 PHE 90 HD2 PHE 90 -1.613 -9.900 6.196 698 HE1 PHE 90 HE1 PHE 90 -1.768 -5.087 7.193 699 HE2 PHE 90 HE2 PHE 90 -1.801 -9.135 8.530 700 HZ PHE 90 HZ PHE 90 -1.877 -6.724 9.029 701 H ALA 91 HN ALA 91 0.829 -10.438 3.032 702 HA ALA 91 HA ALA 91 2.364 -10.609 5.407 703 HB1 ALA 91 HB1 ALA 91 1.565 -12.593 4.212 704 HB2 ALA 91 HB2 ALA 91 3.317 -12.631 4.424 705 HB3 ALA 91 HB3 ALA 91 2.626 -12.203 2.858 706 H LEU 92 HN LEU 92 3.120 -9.755 2.074 707 HA LEU 92 HA LEU 92 5.906 -9.602 2.272 708 HB2 LEU 92 HB2 LEU 92 4.528 -9.560 0.176 709 HB3 LEU 92 HB1 LEU 92 4.108 -7.901 0.540 710 HG LEU 92 HG LEU 92 6.991 -8.698 0.228 711 HD11 LEU 92 HD11 LEU 92 5.812 -9.521 -1.756 712 HD12 LEU 92 HD12 LEU 92 6.841 -8.139 -2.140 713 HD13 LEU 92 HD13 LEU 92 5.097 -7.926 -1.989 714 HD21 LEU 92 HD21 LEU 92 5.486 -6.128 -0.278 715 HD22 LEU 92 HD22 LEU 92 7.222 -6.367 -0.476 716 HD23 LEU 92 HD23 LEU 92 6.494 -6.473 1.126 717 H VAL 93 HN VAL 93 3.462 -7.029 2.648 718 HA VAL 93 HA VAL 93 5.330 -4.997 3.230 719 HB VAL 93 HB VAL 93 3.449 -3.663 4.036 720 HG11 VAL 93 HG11 VAL 93 3.830 -3.842 1.637 721 HG12 VAL 93 HG12 VAL 93 2.111 -3.675 1.996 722 HG13 VAL 93 HG13 VAL 93 2.773 -5.252 1.567 723 HG21 VAL 93 HG21 VAL 93 1.804 -6.172 3.726 724 HG22 VAL 93 HG22 VAL 93 1.184 -4.565 4.105 725 HG23 VAL 93 HG23 VAL 93 2.234 -5.400 5.252 726 H GLN 94 HN GLN 94 3.770 -7.387 5.239 727 HA GLN 94 HA GLN 94 4.403 -6.145 7.727 728 HB2 GLN 94 HB2 GLN 94 2.605 -7.879 7.338 729 HB3 GLN 94 HB1 GLN 94 3.884 -9.080 7.236 730 HG2 GLN 94 HG2 GLN 94 4.587 -8.457 9.521 731 HG3 GLN 94 HG1 GLN 94 3.209 -7.361 9.610 732 HE21 GLN 94 HE21 GLN 94 1.120 -8.227 9.711 733 HE22 GLN 94 HE22 GLN 94 0.835 -9.874 10.157 734 H VAL 95 HN VAL 95 5.897 -8.664 5.736 735 HA VAL 95 HA VAL 95 7.978 -9.330 7.516 736 HB VAL 95 HB VAL 95 7.836 -9.603 4.510 737 HG11 VAL 95 HG11 VAL 95 9.858 -10.748 6.436 738 HG12 VAL 95 HG12 VAL 95 10.168 -9.566 5.165 739 HG13 VAL 95 HG13 VAL 95 9.695 -11.211 4.741 740 HG21 VAL 95 HG21 VAL 95 7.426 -11.588 6.743 741 HG22 VAL 95 HG22 VAL 95 7.414 -11.971 5.022 742 HG23 VAL 95 HG23 VAL 95 6.176 -10.913 5.699 743 H VAL 96 HN VAL 96 7.887 -7.022 4.795 744 HA VAL 96 HA VAL 96 10.614 -6.324 4.979 745 HB VAL 96 HB VAL 96 9.313 -5.854 2.959 746 HG11 VAL 96 HG11 VAL 96 7.944 -3.717 4.585 747 HG12 VAL 96 HG12 VAL 96 7.200 -5.191 3.968 748 HG13 VAL 96 HG13 VAL 96 7.777 -3.958 2.845 749 HG21 VAL 96 HG21 VAL 96 10.194 -3.626 2.492 750 HG22 VAL 96 HG22 VAL 96 11.366 -4.609 3.368 751 HG23 VAL 96 HG23 VAL 96 10.453 -3.363 4.217 752 H ALA 97 HN ALA 97 7.726 -5.015 6.546 753 HA ALA 97 HA ALA 97 9.028 -2.817 7.783 754 HB1 ALA 97 HB1 ALA 97 6.567 -4.331 8.659 755 HB2 ALA 97 HB2 ALA 97 6.597 -2.931 7.584 756 HB3 ALA 97 HB3 ALA 97 7.081 -2.759 9.273 757 H ASP 98 HN ASP 98 8.281 -6.094 8.839 758 HA ASP 98 HA ASP 98 9.147 -6.015 11.464 759 HB2 ASP 98 HB2 ASP 98 7.899 -7.880 10.588 760 HB3 ASP 98 HB1 ASP 98 9.184 -8.266 9.452 761 H GLU 99 HN GLU 99 11.050 -6.832 8.559 762 HA GLU 99 HA GLU 99 13.262 -7.806 9.971 763 HB2 GLU 99 HB2 GLU 99 14.484 -7.715 7.885 764 HB3 GLU 99 HB1 GLU 99 12.863 -8.341 7.629 765 HG2 GLU 99 HG2 GLU 99 12.161 -6.409 6.533 766 HG3 GLU 99 HG1 GLU 99 13.501 -5.453 7.167 767 H HIS 100 HN HIS 100 12.518 -4.485 8.994 768 HA HIS 100 HA HIS 100 15.212 -3.730 9.867 769 HB2 HIS 100 HB2 HIS 100 14.901 -1.580 8.829 770 HB3 HIS 100 HB1 HIS 100 14.459 -2.830 7.681 771 HD1 HIS 100 HD1 HIS 100 12.835 -0.268 9.969 772 HD2 HIS 100 HD2 HIS 100 11.973 -2.569 6.610 773 HE1 HIS 100 HE1 HIS 100 10.607 0.541 9.142 774 HE2 HIS 100 HE2 HIS 100 10.216 -0.705 6.990 775 H LEU 101 HN LEU 101 12.230 -4.074 11.204 776 HA LEU 101 HA LEU 101 12.405 -1.788 12.986 777 HB2 LEU 101 HB2 LEU 101 10.207 -2.686 12.222 778 HB3 LEU 101 HB1 LEU 101 10.537 -4.157 13.115 779 HG LEU 101 HG LEU 101 10.596 -2.848 15.214 780 HD11 LEU 101 HD11 LEU 101 9.767 -0.568 13.427 781 HD12 LEU 101 HD12 LEU 101 11.279 -0.701 14.329 782 HD13 LEU 101 HD13 LEU 101 9.747 -0.541 15.189 783 HD21 LEU 101 HD21 LEU 101 8.092 -2.536 13.562 784 HD22 LEU 101 HD22 LEU 101 8.179 -2.396 15.319 785 HD23 LEU 101 HD23 LEU 101 8.534 -3.939 14.538 786 H GLU 102 HN GLU 102 12.974 -5.263 13.015 787 HA GLU 102 HA GLU 102 13.866 -5.242 15.754 788 HB2 GLU 102 HB2 GLU 102 14.534 -7.540 15.389 789 HB3 GLU 102 HB1 GLU 102 12.926 -7.287 14.726 790 HG2 GLU 102 HG2 GLU 102 13.631 -7.505 12.556 791 HG3 GLU 102 HG1 GLU 102 15.282 -7.011 12.932 792 H HIS 103 HN HIS 103 16.147 -6.158 16.173 793 HA HIS 103 HA HIS 103 18.098 -4.936 14.350 794 HB2 HIS 103 HB2 HIS 103 17.377 -3.395 16.270 795 HB3 HIS 103 HB1 HIS 103 18.197 -4.523 17.341 796 HD1 HIS 103 HD1 HIS 103 19.053 -2.484 14.239 797 HD2 HIS 103 HD2 HIS 103 20.764 -3.832 17.782 798 HE1 HIS 103 HE1 HIS 103 21.331 -1.424 14.340 799 HE2 HIS 103 HE2 HIS 103 22.225 -2.050 16.611 800 H HIS 104 HN HIS 104 17.169 -7.692 15.275 801 HA HIS 104 HA HIS 104 19.532 -8.686 16.667 802 HB2 HIS 104 HB2 HIS 104 17.167 -9.342 17.316 803 HB3 HIS 104 HB1 HIS 104 17.102 -10.268 15.821 804 HD1 HIS 104 HD1 HIS 104 17.329 -12.663 16.430 805 HD2 HIS 104 HD2 HIS 104 19.881 -10.235 18.646 806 HE1 HIS 104 HE1 HIS 104 18.675 -14.223 17.868 807 HE2 HIS 104 HE2 HIS 104 20.023 -12.713 19.374 808 H HIS 105 HN HIS 105 17.714 -9.321 13.668 809 HA HIS 105 HA HIS 105 19.777 -11.012 12.599 810 HB2 HIS 105 HB2 HIS 105 17.343 -9.718 11.375 811 HB3 HIS 105 HB1 HIS 105 18.494 -10.636 10.412 812 HD1 HIS 105 HD1 HIS 105 15.748 -11.016 12.901 813 HD2 HIS 105 HD2 HIS 105 18.432 -13.414 10.814 814 HE1 HIS 105 HE1 HIS 105 14.894 -13.371 13.149 815 HE2 HIS 105 HE2 HIS 105 16.407 -14.766 11.687 816 H HIS 106 HN HIS 106 21.700 -9.941 12.568 817 HA HIS 106 HA HIS 106 21.835 -7.659 10.704 818 HB2 HIS 106 HB2 HIS 106 22.387 -7.113 13.105 819 HB3 HIS 106 HB1 HIS 106 23.766 -8.198 12.969 820 HD1 HIS 106 HD1 HIS 106 22.416 -5.075 11.265 821 HD2 HIS 106 HD2 HIS 106 26.022 -6.981 12.084 822 HE1 HIS 106 HE1 HIS 106 24.217 -3.512 10.447 823 HE2 HIS 106 HE2 HIS 106 26.375 -4.774 10.785 824 H HIS 107 HN HIS 107 22.483 -10.843 11.119 825 HA HIS 107 HA HIS 107 24.926 -10.865 9.521 826 HB2 HIS 107 HB2 HIS 107 23.367 -13.052 10.902 827 HB3 HIS 107 HB1 HIS 107 24.727 -13.379 9.834 828 HD1 HIS 107 HD1 HIS 107 23.890 -11.977 13.208 829 HD2 HIS 107 HD2 HIS 107 27.236 -12.836 10.898 830 HE1 HIS 107 HE1 HIS 107 25.859 -11.767 14.762 831 HE2 HIS 107 HE2 HIS 107 27.879 -12.127 13.299 832 H HIS 108 HN HIS 108 24.951 -12.474 7.664 833 HA HIS 108 HA HIS 108 22.372 -12.384 6.237 834 HB2 HIS 108 HB2 HIS 108 24.056 -10.707 5.398 835 HB3 HIS 108 HB1 HIS 108 25.095 -12.056 4.958 836 HD1 HIS 108 HD1 HIS 108 22.546 -9.903 3.623 837 HD2 HIS 108 HD2 HIS 108 23.731 -13.841 2.984 838 HE1 HIS 108 HE1 HIS 108 21.566 -10.559 1.399 839 HE2 HIS 108 HE2 HIS 108 22.141 -12.998 1.125 840 H1 MET 1 HT1 MET 1 5.398 -7.998 23.846 841 H2 MET 1 HT2 MET 1 5.558 -6.842 22.624 842 H3 MET 1 HT3 MET 1 6.205 -8.393 22.402 843 HA MET 1 HA MET 1 4.236 -8.301 21.145 844 HB2 MET 1 HB2 MET 1 4.567 -10.390 22.350 845 HB3 MET 1 HB1 MET 1 3.790 -9.725 23.778 846 HG2 MET 1 HG2 MET 1 1.682 -9.545 22.512 847 HG3 MET 1 HG1 MET 1 2.476 -10.297 21.129 848 HE1 MET 1 HE1 MET 1 0.398 -12.007 21.173 849 HE2 MET 1 HE2 MET 1 -0.253 -11.351 22.675 850 HE3 MET 1 HE3 MET 1 0.043 -13.082 22.525 851 H ALA 2 HN ALA 2 3.290 -7.734 24.546 852 HA ALA 2 HA ALA 2 1.333 -5.760 23.581 853 HB1 ALA 2 HB1 ALA 2 0.810 -7.881 25.665 854 HB2 ALA 2 HB2 ALA 2 0.163 -7.867 24.025 855 HB3 ALA 2 HB3 ALA 2 -0.314 -6.613 25.171 856 H GLY 3 HN GLY 3 0.297 -5.032 26.042 857 HA2 GLY 3 HA2 GLY 3 0.820 -4.211 28.180 858 HA3 GLY 3 HA1 GLY 3 2.515 -4.566 27.875 859 H GLN 4 HN GLN 4 3.799 -3.053 26.834 860 HA GLN 4 HA GLN 4 2.631 -0.369 26.692 861 HB2 GLN 4 HB2 GLN 4 5.517 -1.258 26.884 862 HB3 GLN 4 HB1 GLN 4 5.021 0.413 26.658 863 HG2 GLN 4 HG2 GLN 4 5.434 0.235 28.936 864 HG3 GLN 4 HG1 GLN 4 3.679 0.125 28.812 865 HE21 GLN 4 HE21 GLN 4 3.424 -0.976 30.728 866 HE22 GLN 4 HE22 GLN 4 3.955 -2.615 30.956 867 H SER 5 HN SER 5 2.358 0.609 24.855 868 HA SER 5 HA SER 5 2.372 1.241 22.718 869 HB2 SER 5 HB2 SER 5 4.312 0.989 21.315 870 HB3 SER 5 HB1 SER 5 4.838 1.350 22.953 871 HG SER 5 HG SER 5 4.942 -1.127 23.047 872 H ASP 6 HN ASP 6 2.861 -2.202 23.229 873 HA ASP 6 HA ASP 6 2.190 -4.055 22.116 874 HB2 ASP 6 HB2 ASP 6 0.089 -2.168 21.034 875 HB3 ASP 6 HB1 ASP 6 0.095 -3.902 20.727 876 H ARG 7 HN ARG 7 3.977 -4.431 20.932 877 HA ARG 7 HA ARG 7 4.840 -2.706 18.882 878 HB2 ARG 7 HB2 ARG 7 6.373 -3.998 20.279 879 HB3 ARG 7 HB1 ARG 7 5.796 -5.488 19.544 880 HG2 ARG 7 HG2 ARG 7 6.936 -5.142 17.609 881 HG3 ARG 7 HG1 ARG 7 6.846 -3.384 17.739 882 HD2 ARG 7 HD2 ARG 7 8.553 -5.134 19.499 883 HD3 ARG 7 HD1 ARG 7 9.137 -4.313 18.052 884 HE ARG 7 HE ARG 7 8.043 -2.300 19.506 885 HH11 ARG 7 HH11 ARG 7 10.358 -4.812 20.275 886 HH12 ARG 7 HH12 ARG 7 11.232 -3.833 21.420 887 HH21 ARG 7 HH21 ARG 7 9.212 -0.991 20.963 888 HH22 ARG 7 HH22 ARG 7 10.590 -1.649 21.796 889 H LYS 8 HN LYS 8 2.709 -5.432 18.766 890 HA LYS 8 HA LYS 8 3.084 -6.063 16.039 891 HB2 LYS 8 HB2 LYS 8 0.946 -7.166 16.112 892 HB3 LYS 8 HB1 LYS 8 1.832 -7.520 17.584 893 HG2 LYS 8 HG2 LYS 8 0.507 -5.821 18.763 894 HG3 LYS 8 HG1 LYS 8 -0.419 -5.554 17.284 895 HD2 LYS 8 HD2 LYS 8 -0.149 -8.253 18.549 896 HD3 LYS 8 HD1 LYS 8 -1.418 -7.127 19.019 897 HE2 LYS 8 HE2 LYS 8 -2.423 -8.527 17.432 898 HE3 LYS 8 HE1 LYS 8 -2.031 -7.064 16.538 899 HZ1 LYS 8 HZ1 LYS 8 -0.111 -8.158 15.611 900 HZ2 LYS 8 HZ2 LYS 8 -1.486 -9.100 15.314 901 HZ3 LYS 8 HZ3 LYS 8 -0.392 -9.548 16.534 902 H ALA 9 HN ALA 9 1.190 -3.641 17.723 903 HA ALA 9 HA ALA 9 -0.199 -2.676 15.424 904 HB1 ALA 9 HB1 ALA 9 -0.785 -0.766 16.857 905 HB2 ALA 9 HB2 ALA 9 0.353 -1.342 18.076 906 HB3 ALA 9 HB3 ALA 9 -1.066 -2.305 17.671 907 H ALA 10 HN ALA 10 2.882 -2.059 16.922 908 HA ALA 10 HA ALA 10 3.565 0.297 15.522 909 HB1 ALA 10 HB1 ALA 10 5.367 -1.857 16.627 910 HB2 ALA 10 HB2 ALA 10 4.800 -0.429 17.493 911 HB3 ALA 10 HB3 ALA 10 5.883 -0.253 16.112 912 H LEU 11 HN LEU 11 3.627 -3.103 14.682 913 HA LEU 11 HA LEU 11 5.200 -2.854 12.325 914 HB2 LEU 11 HB2 LEU 11 3.072 -4.865 13.085 915 HB3 LEU 11 HB1 LEU 11 4.103 -5.005 11.674 916 HG LEU 11 HG LEU 11 5.134 -4.932 14.508 917 HD11 LEU 11 HD11 LEU 11 3.752 -6.911 14.143 918 HD12 LEU 11 HD12 LEU 11 5.459 -7.335 14.272 919 HD13 LEU 11 HD13 LEU 11 4.678 -7.293 12.692 920 HD21 LEU 11 HD21 LEU 11 6.721 -4.195 12.792 921 HD22 LEU 11 HD22 LEU 11 6.458 -5.700 11.910 922 HD23 LEU 11 HD23 LEU 11 7.198 -5.733 13.510 923 H LEU 12 HN LEU 12 1.750 -2.742 13.016 924 HA LEU 12 HA LEU 12 0.853 -2.386 10.365 925 HB2 LEU 12 HB2 LEU 12 -0.446 -1.414 12.910 926 HB3 LEU 12 HB1 LEU 12 -1.237 -1.661 11.366 927 HG LEU 12 HG LEU 12 -0.041 -3.834 13.087 928 HD11 LEU 12 HD11 LEU 12 -2.359 -4.513 13.444 929 HD12 LEU 12 HD12 LEU 12 -2.913 -3.121 12.514 930 HD13 LEU 12 HD13 LEU 12 -2.071 -2.879 14.045 931 HD21 LEU 12 HD21 LEU 12 -1.098 -5.370 11.500 932 HD22 LEU 12 HD22 LEU 12 0.112 -4.357 10.708 933 HD23 LEU 12 HD23 LEU 12 -1.603 -3.999 10.513 934 H ASP 13 HN ASP 13 1.956 -0.169 12.850 935 HA ASP 13 HA ASP 13 1.218 2.244 11.588 936 HB2 ASP 13 HB2 ASP 13 1.836 2.241 13.918 937 HB3 ASP 13 HB1 ASP 13 3.440 1.622 13.541 938 H GLN 14 HN GLN 14 4.126 0.247 11.370 939 HA GLN 14 HA GLN 14 5.527 2.034 9.649 940 HB2 GLN 14 HB2 GLN 14 6.668 0.342 11.037 941 HB3 GLN 14 HB1 GLN 14 5.926 -0.932 10.081 942 HG2 GLN 14 HG2 GLN 14 8.222 -0.570 9.413 943 HG3 GLN 14 HG1 GLN 14 7.117 -0.158 8.105 944 HE21 GLN 14 HE21 GLN 14 7.664 1.891 10.891 945 HE22 GLN 14 HE22 GLN 14 8.485 3.153 10.031 946 H VAL 15 HN VAL 15 3.471 -0.796 9.144 947 HA VAL 15 HA VAL 15 3.714 -0.925 6.339 948 HB VAL 15 HB VAL 15 1.385 -1.726 8.105 949 HG11 VAL 15 HG11 VAL 15 0.675 -1.393 5.781 950 HG12 VAL 15 HG12 VAL 15 0.633 -3.097 6.241 951 HG13 VAL 15 HG13 VAL 15 1.951 -2.487 5.242 952 HG21 VAL 15 HG21 VAL 15 3.428 -2.922 8.627 953 HG22 VAL 15 HG22 VAL 15 3.653 -3.325 6.925 954 HG23 VAL 15 HG23 VAL 15 2.286 -3.994 7.818 955 H ALA 16 HN ALA 16 1.574 0.897 8.468 956 HA ALA 16 HA ALA 16 -0.051 2.073 6.508 957 HB1 ALA 16 HB1 ALA 16 -0.559 2.131 8.910 958 HB2 ALA 16 HB2 ALA 16 -0.602 3.739 8.186 959 HB3 ALA 16 HB3 ALA 16 0.784 3.246 9.160 960 H ARG 17 HN ARG 17 3.118 2.973 7.770 961 HA ARG 17 HA ARG 17 3.361 5.510 6.620 962 HB2 ARG 17 HB2 ARG 17 4.963 4.118 8.218 963 HB3 ARG 17 HB1 ARG 17 5.733 3.683 6.699 964 HG2 ARG 17 HG2 ARG 17 5.990 6.105 6.204 965 HG3 ARG 17 HG1 ARG 17 5.363 6.453 7.815 966 HD2 ARG 17 HD2 ARG 17 7.639 6.513 8.180 967 HD3 ARG 17 HD1 ARG 17 7.255 4.845 8.601 968 HE ARG 17 HE ARG 17 7.894 4.784 5.932 969 HH11 ARG 17 HH11 ARG 17 9.515 5.670 8.910 970 HH12 ARG 17 HH12 ARG 17 11.113 5.428 8.262 971 HH21 ARG 17 HH21 ARG 17 9.996 4.454 5.087 972 HH22 ARG 17 HH22 ARG 17 11.386 4.769 6.077 973 H VAL 18 HN VAL 18 4.260 2.319 5.367 974 HA VAL 18 HA VAL 18 5.084 3.156 2.808 975 HB VAL 18 HB VAL 18 3.901 0.492 3.621 976 HG11 VAL 18 HG11 VAL 18 5.607 1.200 1.236 977 HG12 VAL 18 HG12 VAL 18 3.885 0.822 1.196 978 HG13 VAL 18 HG13 VAL 18 5.050 -0.416 1.673 979 HG21 VAL 18 HG21 VAL 18 6.227 -0.246 3.848 980 HG22 VAL 18 HG22 VAL 18 5.848 1.068 4.961 981 HG23 VAL 18 HG23 VAL 18 6.778 1.394 3.497 982 H GLY 19 HN GLY 19 1.964 1.957 4.001 983 HA2 GLY 19 HA2 GLY 19 0.560 1.982 1.591 984 HA3 GLY 19 HA1 GLY 19 -0.164 2.166 3.180 985 H LYS 20 HN LYS 20 1.074 4.599 3.919 986 HA LYS 20 HA LYS 20 -0.687 6.424 2.633 987 HB2 LYS 20 HB2 LYS 20 1.543 6.860 4.622 988 HB3 LYS 20 HB1 LYS 20 0.466 8.137 4.067 989 HG2 LYS 20 HG2 LYS 20 -1.438 7.019 4.996 990 HG3 LYS 20 HG1 LYS 20 -0.466 5.608 5.405 991 HD2 LYS 20 HD2 LYS 20 -0.826 6.885 7.397 992 HD3 LYS 20 HD1 LYS 20 0.867 7.048 6.934 993 HE2 LYS 20 HE2 LYS 20 0.461 9.227 6.016 994 HE3 LYS 20 HE1 LYS 20 -1.277 9.055 6.266 995 HZ1 LYS 20 HZ1 LYS 20 -0.901 8.990 8.643 996 HZ2 LYS 20 HZ2 LYS 20 -0.257 10.414 7.986 997 HZ3 LYS 20 HZ3 LYS 20 0.773 9.133 8.414 998 H ALA 21 HN ALA 21 2.669 5.580 2.179 999 HA ALA 21 HA ALA 21 3.287 7.783 0.474 1000 HB1 ALA 21 HB1 ALA 21 4.573 5.056 0.667 1001 HB2 ALA 21 HB2 ALA 21 5.077 6.522 1.514 1002 HB3 ALA 21 HB3 ALA 21 5.219 6.424 -0.241 1003 H LEU 22 HN LEU 22 1.784 4.653 0.002 1004 HA LEU 22 HA LEU 22 1.751 4.876 -2.880 1005 HB2 LEU 22 HB2 LEU 22 0.676 2.922 -0.895 1006 HB3 LEU 22 HB1 LEU 22 -0.011 2.943 -2.505 1007 HG LEU 22 HG LEU 22 1.644 1.229 -2.417 1008 HD11 LEU 22 HD11 LEU 22 3.168 1.925 -4.184 1009 HD12 LEU 22 HD12 LEU 22 2.752 3.613 -3.884 1010 HD13 LEU 22 HD13 LEU 22 1.527 2.497 -4.488 1011 HD21 LEU 22 HD21 LEU 22 3.552 3.343 -1.439 1012 HD22 LEU 22 HD22 LEU 22 3.997 1.696 -1.893 1013 HD23 LEU 22 HD23 LEU 22 2.929 1.975 -0.515 1014 H ALA 23 HN ALA 23 -0.132 6.056 -0.311 1015 HA ALA 23 HA ALA 23 -2.664 6.088 -1.674 1016 HB1 ALA 23 HB1 ALA 23 -1.827 7.522 0.841 1017 HB2 ALA 23 HB2 ALA 23 -2.486 5.888 0.770 1018 HB3 ALA 23 HB3 ALA 23 -3.478 7.262 0.279 1019 H ASN 24 HN ASN 24 -0.972 7.260 -3.386 1020 HA ASN 24 HA ASN 24 -1.794 10.076 -3.347 1021 HB2 ASN 24 HB2 ASN 24 1.007 9.073 -3.920 1022 HB3 ASN 24 HB1 ASN 24 0.451 10.704 -4.278 1023 HD21 ASN 24 HD21 ASN 24 1.375 8.466 -1.802 1024 HD22 ASN 24 HD22 ASN 24 1.421 9.605 -0.501 1025 H GLY 25 HN GLY 25 -0.936 10.980 -5.688 1026 HA2 GLY 25 HA2 GLY 25 -1.684 8.925 -7.678 1027 HA3 GLY 25 HA1 GLY 25 -2.381 10.538 -7.726 1028 H ARG 26 HN ARG 26 -0.391 12.223 -7.382 1029 HA ARG 26 HA ARG 26 0.949 12.186 -9.886 1030 HB2 ARG 26 HB2 ARG 26 1.387 13.904 -7.437 1031 HB3 ARG 26 HB1 ARG 26 2.090 14.217 -9.016 1032 HG2 ARG 26 HG2 ARG 26 -0.856 13.939 -8.835 1033 HG3 ARG 26 HG1 ARG 26 -0.114 15.408 -8.197 1034 HD2 ARG 26 HD2 ARG 26 -0.728 15.810 -10.471 1035 HD3 ARG 26 HD1 ARG 26 1.027 15.699 -10.390 1036 HE ARG 26 HE ARG 26 -0.356 13.248 -11.095 1037 HH11 ARG 26 HH11 ARG 26 1.320 16.115 -12.223 1038 HH12 ARG 26 HH12 ARG 26 1.580 15.486 -13.815 1039 HH21 ARG 26 HH21 ARG 26 -0.014 12.424 -13.183 1040 HH22 ARG 26 HH22 ARG 26 0.809 13.396 -14.373 1041 H ARG 27 HN ARG 27 1.755 11.071 -6.725 1042 HA ARG 27 HA ARG 27 4.610 11.048 -7.176 1043 HB2 ARG 27 HB2 ARG 27 2.953 9.931 -4.906 1044 HB3 ARG 27 HB1 ARG 27 4.709 10.006 -4.932 1045 HG2 ARG 27 HG2 ARG 27 4.627 12.431 -5.010 1046 HG3 ARG 27 HG1 ARG 27 2.865 12.384 -5.046 1047 HD2 ARG 27 HD2 ARG 27 2.844 11.329 -2.843 1048 HD3 ARG 27 HD1 ARG 27 4.608 11.348 -2.811 1049 HE ARG 27 HE ARG 27 3.829 13.960 -3.233 1050 HH11 ARG 27 HH11 ARG 27 3.326 11.548 -0.738 1051 HH12 ARG 27 HH12 ARG 27 3.233 12.711 0.547 1052 HH21 ARG 27 HH21 ARG 27 3.691 15.491 -1.526 1053 HH22 ARG 27 HH22 ARG 27 3.430 14.936 0.100 1054 H LEU 28 HN LEU 28 1.995 8.950 -7.813 1055 HA LEU 28 HA LEU 28 3.489 6.512 -7.504 1056 HB2 LEU 28 HB2 LEU 28 0.786 7.016 -8.739 1057 HB3 LEU 28 HB1 LEU 28 1.498 5.430 -8.522 1058 HG LEU 28 HG LEU 28 0.566 7.336 -6.389 1059 HD11 LEU 28 HD11 LEU 28 -0.181 4.502 -7.084 1060 HD12 LEU 28 HD12 LEU 28 -1.148 5.943 -7.391 1061 HD13 LEU 28 HD13 LEU 28 -0.829 5.433 -5.734 1062 HD21 LEU 28 HD21 LEU 28 2.155 4.797 -6.040 1063 HD22 LEU 28 HD22 LEU 28 1.393 5.718 -4.743 1064 HD23 LEU 28 HD23 LEU 28 2.710 6.432 -5.676 1065 H GLN 29 HN GLN 29 2.740 8.711 -10.121 1066 HA GLN 29 HA GLN 29 3.546 6.980 -12.221 1067 HB2 GLN 29 HB2 GLN 29 2.235 9.111 -12.529 1068 HB3 GLN 29 HB1 GLN 29 3.723 10.000 -12.221 1069 HG2 GLN 29 HG2 GLN 29 4.771 8.975 -14.147 1070 HG3 GLN 29 HG1 GLN 29 3.336 7.999 -14.437 1071 HE21 GLN 29 HE21 GLN 29 3.307 11.383 -13.479 1072 HE22 GLN 29 HE22 GLN 29 2.667 11.978 -14.974 1073 H ILE 30 HN ILE 30 5.220 9.016 -9.970 1074 HA ILE 30 HA ILE 30 7.768 8.981 -11.198 1075 HB ILE 30 HB ILE 30 7.100 9.155 -8.249 1076 HG12 ILE 30 HG12 ILE 30 7.564 11.365 -10.266 1077 HG13 ILE 30 HG11 ILE 30 5.995 10.907 -9.613 1078 HG21 ILE 30 HG21 ILE 30 9.288 10.228 -8.030 1079 HG22 ILE 30 HG22 ILE 30 9.594 9.954 -9.747 1080 HG23 ILE 30 HG23 ILE 30 9.432 8.582 -8.648 1081 HD11 ILE 30 HD11 ILE 30 6.735 11.555 -7.384 1082 HD12 ILE 30 HD12 ILE 30 6.872 12.893 -8.526 1083 HD13 ILE 30 HD13 ILE 30 8.312 12.001 -8.035 1084 H LEU 31 HN LEU 31 6.092 6.851 -8.951 1085 HA LEU 31 HA LEU 31 8.278 5.129 -8.447 1086 HB2 LEU 31 HB2 LEU 31 5.308 4.769 -8.132 1087 HB3 LEU 31 HB1 LEU 31 6.466 3.534 -7.681 1088 HG LEU 31 HG LEU 31 6.358 6.312 -6.506 1089 HD11 LEU 31 HD11 LEU 31 5.552 5.197 -4.489 1090 HD12 LEU 31 HD12 LEU 31 5.517 3.658 -5.349 1091 HD13 LEU 31 HD13 LEU 31 4.440 4.966 -5.840 1092 HD21 LEU 31 HD21 LEU 31 8.026 3.902 -5.786 1093 HD22 LEU 31 HD22 LEU 31 7.975 5.424 -4.894 1094 HD23 LEU 31 HD23 LEU 31 8.609 5.385 -6.540 1095 H ASP 32 HN ASP 32 5.602 4.999 -10.797 1096 HA ASP 32 HA ASP 32 6.394 2.454 -11.810 1097 HB2 ASP 32 HB2 ASP 32 4.613 2.576 -13.228 1098 HB3 ASP 32 HB1 ASP 32 4.114 3.825 -12.102 1099 H LEU 33 HN LEU 33 7.378 5.704 -12.394 1100 HA LEU 33 HA LEU 33 8.784 5.232 -14.827 1101 HB2 LEU 33 HB2 LEU 33 8.057 7.472 -14.092 1102 HB3 LEU 33 HB1 LEU 33 9.181 7.390 -12.750 1103 HG LEU 33 HG LEU 33 11.049 7.250 -14.407 1104 HD11 LEU 33 HD11 LEU 33 8.851 7.878 -16.373 1105 HD12 LEU 33 HD12 LEU 33 9.787 6.385 -16.299 1106 HD13 LEU 33 HD13 LEU 33 10.580 7.904 -16.719 1107 HD21 LEU 33 HD21 LEU 33 10.996 9.619 -14.970 1108 HD22 LEU 33 HD22 LEU 33 10.422 9.352 -13.323 1109 HD23 LEU 33 HD23 LEU 33 9.269 9.672 -14.619 1110 H LEU 34 HN LEU 34 9.606 5.080 -11.408 1111 HA LEU 34 HA LEU 34 12.404 4.578 -11.948 1112 HB2 LEU 34 HB2 LEU 34 10.818 4.495 -9.384 1113 HB3 LEU 34 HB1 LEU 34 12.550 4.244 -9.481 1114 HG LEU 34 HG LEU 34 11.108 6.788 -10.237 1115 HD11 LEU 34 HD11 LEU 34 12.871 6.175 -7.872 1116 HD12 LEU 34 HD12 LEU 34 11.116 6.341 -7.821 1117 HD13 LEU 34 HD13 LEU 34 12.123 7.725 -8.249 1118 HD21 LEU 34 HD21 LEU 34 14.050 6.134 -10.111 1119 HD22 LEU 34 HD22 LEU 34 13.364 7.733 -10.390 1120 HD23 LEU 34 HD23 LEU 34 13.110 6.450 -11.571 1121 H ALA 35 HN ALA 35 9.592 2.737 -11.908 1122 HA ALA 35 HA ALA 35 10.521 0.290 -10.863 1123 HB1 ALA 35 HB1 ALA 35 8.654 -0.733 -12.034 1124 HB2 ALA 35 HB2 ALA 35 8.429 0.733 -12.991 1125 HB3 ALA 35 HB3 ALA 35 8.150 0.766 -11.250 1126 H GLN 36 HN GLN 36 10.954 1.837 -13.954 1127 HA GLN 36 HA GLN 36 12.148 -0.559 -15.106 1128 HB2 GLN 36 HB2 GLN 36 12.374 0.795 -17.161 1129 HB3 GLN 36 HB1 GLN 36 10.717 0.726 -16.578 1130 HG2 GLN 36 HG2 GLN 36 10.838 2.945 -15.738 1131 HG3 GLN 36 HG1 GLN 36 12.578 3.016 -16.016 1132 HE21 GLN 36 HE21 GLN 36 10.363 4.698 -17.007 1133 HE22 GLN 36 HE22 GLN 36 10.519 4.687 -18.733 1134 H GLY 37 HN GLY 37 13.246 1.329 -12.878 1135 HA2 GLY 37 HA2 GLY 37 15.698 0.789 -12.560 1136 HA3 GLY 37 HA1 GLY 37 15.919 1.611 -14.097 1137 H GLU 38 HN GLU 38 17.196 2.307 -11.701 1138 HA GLU 38 HA GLU 38 15.940 4.584 -10.527 1139 HB2 GLU 38 HB2 GLU 38 18.241 4.974 -9.576 1140 HB3 GLU 38 HB1 GLU 38 17.522 3.418 -9.196 1141 HG2 GLU 38 HG2 GLU 38 18.859 2.420 -11.039 1142 HG3 GLU 38 HG1 GLU 38 19.659 3.980 -11.236 1143 H ARG 39 HN ARG 39 16.205 6.738 -10.989 1144 HA ARG 39 HA ARG 39 17.830 7.390 -13.348 1145 HB2 ARG 39 HB2 ARG 39 15.108 8.608 -13.112 1146 HB3 ARG 39 HB1 ARG 39 16.087 8.332 -14.548 1147 HG2 ARG 39 HG2 ARG 39 15.652 5.845 -14.140 1148 HG3 ARG 39 HG1 ARG 39 14.385 6.382 -13.035 1149 HD2 ARG 39 HD2 ARG 39 13.257 6.073 -15.045 1150 HD3 ARG 39 HD1 ARG 39 13.567 7.808 -15.014 1151 HE ARG 39 HE ARG 39 15.691 6.498 -16.326 1152 HH11 ARG 39 HH11 ARG 39 12.325 7.342 -16.796 1153 HH12 ARG 39 HH12 ARG 39 12.422 7.352 -18.529 1154 HH21 ARG 39 HH21 ARG 39 15.835 6.487 -18.613 1155 HH22 ARG 39 HH22 ARG 39 14.428 6.868 -19.565 1156 H ALA 40 HN ALA 40 18.138 9.739 -13.616 1157 HA ALA 40 HA ALA 40 18.672 10.990 -11.077 1158 HB1 ALA 40 HB1 ALA 40 20.231 11.231 -12.945 1159 HB2 ALA 40 HB2 ALA 40 19.631 12.800 -12.407 1160 HB3 ALA 40 HB3 ALA 40 18.990 12.065 -13.877 1161 H VAL 41 HN VAL 41 17.946 13.182 -10.560 1162 HA VAL 41 HA VAL 41 15.185 13.396 -10.420 1163 HB VAL 41 HB VAL 41 17.163 15.679 -10.265 1164 HG11 VAL 41 HG11 VAL 41 14.880 16.471 -10.489 1165 HG12 VAL 41 HG12 VAL 41 15.466 16.755 -8.851 1166 HG13 VAL 41 HG13 VAL 41 14.364 15.417 -9.174 1167 HG21 VAL 41 HG21 VAL 41 17.156 15.286 -7.856 1168 HG22 VAL 41 HG22 VAL 41 17.745 13.873 -8.730 1169 HG23 VAL 41 HG23 VAL 41 16.106 13.888 -8.080 1170 H GLU 42 HN GLU 42 17.427 14.942 -12.698 1171 HA GLU 42 HA GLU 42 15.582 16.577 -14.015 1172 HB2 GLU 42 HB2 GLU 42 17.940 15.225 -15.325 1173 HB3 GLU 42 HB1 GLU 42 17.170 16.727 -15.814 1174 HG2 GLU 42 HG2 GLU 42 18.950 17.599 -14.732 1175 HG3 GLU 42 HG1 GLU 42 17.863 17.432 -13.353 1176 H ALA 43 HN ALA 43 16.499 13.224 -14.655 1177 HA ALA 43 HA ALA 43 14.924 12.940 -17.001 1178 HB1 ALA 43 HB1 ALA 43 15.351 10.560 -16.780 1179 HB2 ALA 43 HB2 ALA 43 15.921 10.795 -15.129 1180 HB3 ALA 43 HB3 ALA 43 16.828 11.472 -16.480 1181 H ILE 44 HN ILE 44 14.380 12.277 -13.585 1182 HA ILE 44 HA ILE 44 11.865 11.016 -13.858 1183 HB ILE 44 HB ILE 44 12.978 12.580 -11.522 1184 HG12 ILE 44 HG12 ILE 44 12.911 9.594 -12.015 1185 HG13 ILE 44 HG11 ILE 44 14.331 10.614 -12.225 1186 HG21 ILE 44 HG21 ILE 44 11.330 11.380 -10.162 1187 HG22 ILE 44 HG22 ILE 44 10.664 10.647 -11.623 1188 HG23 ILE 44 HG23 ILE 44 10.553 12.391 -11.382 1189 HD11 ILE 44 HD11 ILE 44 14.263 11.176 -9.844 1190 HD12 ILE 44 HD12 ILE 44 14.424 9.440 -10.117 1191 HD13 ILE 44 HD13 ILE 44 12.865 10.120 -9.646 1192 H ALA 45 HN ALA 45 12.754 14.362 -13.072 1193 HA ALA 45 HA ALA 45 10.189 15.405 -12.781 1194 HB1 ALA 45 HB1 ALA 45 12.202 16.593 -12.095 1195 HB2 ALA 45 HB2 ALA 45 11.220 17.591 -13.166 1196 HB3 ALA 45 HB3 ALA 45 12.669 16.797 -13.783 1197 H THR 46 HN THR 46 12.254 15.361 -15.676 1198 HA THR 46 HA THR 46 10.514 16.700 -17.392 1199 HB THR 46 HB THR 46 12.462 14.514 -18.171 1200 HG1 THR 46 HG1 THR 46 13.658 16.016 -17.071 1201 HG21 THR 46 HG21 THR 46 10.954 15.165 -19.976 1202 HG22 THR 46 HG22 THR 46 12.588 15.746 -20.298 1203 HG23 THR 46 HG23 THR 46 11.354 16.863 -19.715 1204 H ALA 47 HN ALA 47 10.880 13.199 -16.833 1205 HA ALA 47 HA ALA 47 9.019 12.420 -18.806 1206 HB1 ALA 47 HB1 ALA 47 10.751 10.929 -17.977 1207 HB2 ALA 47 HB2 ALA 47 9.152 10.209 -17.792 1208 HB3 ALA 47 HB3 ALA 47 9.977 10.896 -16.393 1209 H THR 48 HN THR 48 8.627 13.322 -15.449 1210 HA THR 48 HA THR 48 5.926 12.267 -15.364 1211 HB THR 48 HB THR 48 5.919 13.317 -13.048 1212 HG1 THR 48 HG1 THR 48 8.730 13.481 -13.437 1213 HG21 THR 48 HG21 THR 48 6.328 10.936 -13.400 1214 HG22 THR 48 HG22 THR 48 7.334 11.553 -12.091 1215 HG23 THR 48 HG23 THR 48 8.037 11.260 -13.680 1216 H GLY 49 HN GLY 49 7.484 15.211 -16.176 1217 HA2 GLY 49 HA2 GLY 49 6.436 17.040 -17.187 1218 HA3 GLY 49 HA1 GLY 49 4.885 16.435 -16.628 1219 H MET 50 HN MET 50 7.418 16.677 -14.299 1220 HA MET 50 HA MET 50 6.254 19.202 -13.313 1221 HB2 MET 50 HB2 MET 50 7.289 16.849 -11.722 1222 HB3 MET 50 HB1 MET 50 6.979 18.426 -11.014 1223 HG2 MET 50 HG2 MET 50 4.963 17.583 -10.563 1224 HG3 MET 50 HG1 MET 50 4.619 17.940 -12.252 1225 HE1 MET 50 HE1 MET 50 6.931 15.104 -10.731 1226 HE2 MET 50 HE2 MET 50 5.770 13.779 -10.624 1227 HE3 MET 50 HE3 MET 50 5.561 15.219 -9.627 1228 H ASN 51 HN ASN 51 7.734 20.596 -12.118 1229 HA ASN 51 HA ASN 51 10.313 20.684 -13.401 1230 HB2 ASN 51 HB2 ASN 51 8.980 22.741 -12.895 1231 HB3 ASN 51 HB1 ASN 51 9.256 22.454 -11.179 1232 HD21 ASN 51 HD21 ASN 51 10.358 24.402 -10.926 1233 HD22 ASN 51 HD22 ASN 51 11.958 24.646 -11.555 1234 H LEU 52 HN LEU 52 12.329 20.908 -12.183 1235 HA LEU 52 HA LEU 52 12.935 18.622 -10.780 1236 HB2 LEU 52 HB2 LEU 52 14.341 21.289 -10.630 1237 HB3 LEU 52 HB1 LEU 52 15.020 19.759 -10.114 1238 HG LEU 52 HG LEU 52 14.238 20.434 -12.952 1239 HD11 LEU 52 HD11 LEU 52 16.949 20.242 -11.648 1240 HD12 LEU 52 HD12 LEU 52 16.171 21.717 -12.225 1241 HD13 LEU 52 HD13 LEU 52 16.650 20.465 -13.371 1242 HD21 LEU 52 HD21 LEU 52 15.683 18.041 -11.824 1243 HD22 LEU 52 HD22 LEU 52 15.364 18.359 -13.529 1244 HD23 LEU 52 HD23 LEU 52 14.025 18.056 -12.424 1245 H THR 53 HN THR 53 12.230 21.830 -9.434 1246 HA THR 53 HA THR 53 12.798 21.258 -6.762 1247 HB THR 53 HB THR 53 10.664 23.197 -7.644 1248 HG1 THR 53 HG1 THR 53 12.604 24.647 -7.807 1249 HG21 THR 53 HG21 THR 53 11.522 24.517 -5.768 1250 HG22 THR 53 HG22 THR 53 12.728 23.275 -5.436 1251 HG23 THR 53 HG23 THR 53 11.014 22.918 -5.226 1252 H THR 54 HN THR 54 9.670 21.147 -8.475 1253 HA THR 54 HA THR 54 8.202 20.318 -6.189 1254 HB THR 54 HB THR 54 7.445 20.040 -9.105 1255 HG1 THR 54 HG1 THR 54 6.979 22.160 -7.236 1256 HG21 THR 54 HG21 THR 54 6.044 18.729 -7.558 1257 HG22 THR 54 HG22 THR 54 5.147 20.065 -8.277 1258 HG23 THR 54 HG23 THR 54 5.730 20.189 -6.618 1259 H ALA 55 HN ALA 55 9.745 18.623 -8.866 1260 HA ALA 55 HA ALA 55 8.684 16.063 -8.363 1261 HB1 ALA 55 HB1 ALA 55 11.345 16.769 -9.592 1262 HB2 ALA 55 HB2 ALA 55 9.811 16.658 -10.456 1263 HB3 ALA 55 HB3 ALA 55 10.516 15.219 -9.718 1264 H SER 56 HN SER 56 11.723 17.584 -7.288 1265 HA SER 56 HA SER 56 12.652 15.312 -5.889 1266 HB2 SER 56 HB2 SER 56 14.200 16.991 -4.766 1267 HB3 SER 56 HB1 SER 56 14.279 16.914 -6.525 1268 HG SER 56 HG SER 56 13.188 18.815 -6.670 1269 H ALA 57 HN ALA 57 10.638 18.028 -4.927 1270 HA ALA 57 HA ALA 57 10.621 17.580 -2.158 1271 HB1 ALA 57 HB1 ALA 57 8.388 18.645 -3.889 1272 HB2 ALA 57 HB2 ALA 57 9.699 19.597 -3.192 1273 HB3 ALA 57 HB3 ALA 57 8.517 18.819 -2.139 1274 H ASN 58 HN ASN 58 8.603 16.238 -4.735 1275 HA ASN 58 HA ASN 58 7.034 14.656 -2.940 1276 HB2 ASN 58 HB2 ASN 58 7.275 14.778 -5.935 1277 HB3 ASN 58 HB1 ASN 58 6.323 13.522 -5.150 1278 HD21 ASN 58 HD21 ASN 58 6.584 16.931 -5.818 1279 HD22 ASN 58 HD22 ASN 58 4.973 17.351 -5.325 1280 H LEU 59 HN LEU 59 9.926 14.156 -4.847 1281 HA LEU 59 HA LEU 59 10.170 11.371 -4.496 1282 HB2 LEU 59 HB2 LEU 59 12.191 13.567 -4.879 1283 HB3 LEU 59 HB1 LEU 59 12.670 11.888 -4.716 1284 HG LEU 59 HG LEU 59 10.753 12.829 -6.844 1285 HD11 LEU 59 HD11 LEU 59 12.659 12.781 -8.382 1286 HD12 LEU 59 HD12 LEU 59 13.746 12.484 -7.025 1287 HD13 LEU 59 HD13 LEU 59 12.864 14.010 -7.135 1288 HD21 LEU 59 HD21 LEU 59 11.392 10.727 -7.911 1289 HD22 LEU 59 HD22 LEU 59 10.699 10.448 -6.312 1290 HD23 LEU 59 HD23 LEU 59 12.445 10.350 -6.549 1291 H GLN 60 HN GLN 60 11.209 14.110 -2.526 1292 HA GLN 60 HA GLN 60 12.500 12.682 -0.486 1293 HB2 GLN 60 HB2 GLN 60 12.716 15.091 -0.706 1294 HB3 GLN 60 HB1 GLN 60 11.004 15.305 -0.385 1295 HG2 GLN 60 HG2 GLN 60 11.357 14.389 1.882 1296 HG3 GLN 60 HG1 GLN 60 13.086 14.303 1.541 1297 HE21 GLN 60 HE21 GLN 60 14.285 16.178 1.445 1298 HE22 GLN 60 HE22 GLN 60 13.682 17.700 2.016 1299 H ALA 61 HN ALA 61 9.109 13.476 -0.997 1300 HA ALA 61 HA ALA 61 8.135 12.595 1.502 1301 HB1 ALA 61 HB1 ALA 61 5.951 12.598 0.459 1302 HB2 ALA 61 HB2 ALA 61 6.688 12.640 -1.143 1303 HB3 ALA 61 HB3 ALA 61 6.861 14.020 -0.058 1304 H LEU 62 HN LEU 62 8.529 10.926 -1.612 1305 HA LEU 62 HA LEU 62 7.510 8.421 -0.723 1306 HB2 LEU 62 HB2 LEU 62 9.448 9.048 -2.956 1307 HB3 LEU 62 HB1 LEU 62 8.657 7.503 -2.719 1308 HG LEU 62 HG LEU 62 7.239 10.099 -3.327 1309 HD11 LEU 62 HD11 LEU 62 7.794 7.710 -5.080 1310 HD12 LEU 62 HD12 LEU 62 8.567 9.291 -5.212 1311 HD13 LEU 62 HD13 LEU 62 6.839 9.126 -5.523 1312 HD21 LEU 62 HD21 LEU 62 5.900 8.540 -1.984 1313 HD22 LEU 62 HD22 LEU 62 6.194 7.271 -3.175 1314 HD23 LEU 62 HD23 LEU 62 5.264 8.701 -3.623 1315 H LYS 63 HN LYS 63 10.624 9.973 -0.563 1316 HA LYS 63 HA LYS 63 12.136 7.708 0.226 1317 HB2 LYS 63 HB2 LYS 63 13.006 9.953 -0.623 1318 HB3 LYS 63 HB1 LYS 63 12.702 10.572 0.993 1319 HG2 LYS 63 HG2 LYS 63 14.238 8.876 1.906 1320 HG3 LYS 63 HG1 LYS 63 14.581 8.338 0.259 1321 HD2 LYS 63 HD2 LYS 63 15.336 10.659 -0.260 1322 HD3 LYS 63 HD1 LYS 63 15.149 11.051 1.449 1323 HE2 LYS 63 HE2 LYS 63 16.964 8.918 0.324 1324 HE3 LYS 63 HE1 LYS 63 17.474 10.514 0.863 1325 HZ1 LYS 63 HZ1 LYS 63 16.153 8.520 2.628 1326 HZ2 LYS 63 HZ2 LYS 63 16.879 9.980 3.095 1327 HZ3 LYS 63 HZ3 LYS 63 17.829 8.714 2.499 1328 H SER 64 HN SER 64 10.420 10.252 2.013 1329 HA SER 64 HA SER 64 11.078 9.220 4.579 1330 HB2 SER 64 HB2 SER 64 9.123 10.726 5.300 1331 HB3 SER 64 HB1 SER 64 10.517 11.500 4.546 1332 HG SER 64 HG SER 64 8.339 10.673 2.962 1333 H GLY 65 HN GLY 65 8.629 8.398 2.246 1334 HA2 GLY 65 HA2 GLY 65 7.009 6.883 4.057 1335 HA3 GLY 65 HA1 GLY 65 7.028 6.736 2.300 1336 H GLY 66 HN GLY 66 9.941 6.346 2.266 1337 HA2 GLY 66 HA2 GLY 66 11.542 4.726 2.944 1338 HA3 GLY 66 HA1 GLY 66 10.236 3.751 3.599 1339 H LEU 67 HN LEU 67 9.907 5.160 0.440 1340 HA LEU 67 HA LEU 67 9.942 2.445 -0.655 1341 HB2 LEU 67 HB2 LEU 67 8.902 4.976 -1.923 1342 HB3 LEU 67 HB1 LEU 67 8.743 3.356 -2.568 1343 HG LEU 67 HG LEU 67 7.278 4.641 -0.303 1344 HD11 LEU 67 HD11 LEU 67 6.430 2.845 -2.567 1345 HD12 LEU 67 HD12 LEU 67 6.329 4.609 -2.560 1346 HD13 LEU 67 HD13 LEU 67 5.365 3.665 -1.423 1347 HD21 LEU 67 HD21 LEU 67 8.195 2.623 0.695 1348 HD22 LEU 67 HD22 LEU 67 7.607 1.665 -0.663 1349 HD23 LEU 67 HD23 LEU 67 6.462 2.453 0.422 1350 H VAL 68 HN VAL 68 11.298 5.661 -1.232 1351 HA VAL 68 HA VAL 68 13.143 4.417 -3.156 1352 HB VAL 68 HB VAL 68 13.367 6.571 -4.280 1353 HG11 VAL 68 HG11 VAL 68 11.122 6.685 -5.285 1354 HG12 VAL 68 HG12 VAL 68 10.510 5.657 -3.987 1355 HG13 VAL 68 HG13 VAL 68 11.709 5.030 -5.120 1356 HG21 VAL 68 HG21 VAL 68 11.913 8.448 -3.753 1357 HG22 VAL 68 HG22 VAL 68 12.918 8.029 -2.366 1358 HG23 VAL 68 HG23 VAL 68 11.221 7.551 -2.402 1359 H GLU 69 HN GLU 69 15.242 5.402 -3.336 1360 HA GLU 69 HA GLU 69 16.173 6.782 -0.918 1361 HB2 GLU 69 HB2 GLU 69 16.959 4.159 -1.906 1362 HB3 GLU 69 HB1 GLU 69 18.334 5.249 -1.774 1363 HG2 GLU 69 HG2 GLU 69 16.408 4.486 0.402 1364 HG3 GLU 69 HG1 GLU 69 18.110 4.035 0.271 1365 H ALA 70 HN ALA 70 18.362 7.793 -1.307 1366 HA ALA 70 HA ALA 70 18.387 8.882 -4.045 1367 HB1 ALA 70 HB1 ALA 70 17.505 10.487 -2.406 1368 HB2 ALA 70 HB2 ALA 70 19.017 11.036 -3.131 1369 HB3 ALA 70 HB3 ALA 70 19.013 10.367 -1.498 1370 H ARG 71 HN ARG 71 20.268 9.006 -5.075 1371 HA ARG 71 HA ARG 71 22.750 8.519 -3.578 1372 HB2 ARG 71 HB2 ARG 71 22.246 6.424 -4.637 1373 HB3 ARG 71 HB1 ARG 71 21.865 7.218 -6.159 1374 HG2 ARG 71 HG2 ARG 71 24.235 7.917 -6.337 1375 HG3 ARG 71 HG1 ARG 71 24.579 7.001 -4.870 1376 HD2 ARG 71 HD2 ARG 71 23.898 4.948 -5.942 1377 HD3 ARG 71 HD1 ARG 71 23.412 5.832 -7.388 1378 HE ARG 71 HE ARG 71 25.975 6.505 -7.279 1379 HH11 ARG 71 HH11 ARG 71 24.450 3.383 -6.855 1380 HH12 ARG 71 HH12 ARG 71 25.860 2.486 -7.352 1381 HH21 ARG 71 HH21 ARG 71 27.799 5.357 -7.963 1382 HH22 ARG 71 HH22 ARG 71 27.775 3.615 -7.993 1383 H ARG 72 HN ARG 72 23.859 10.380 -3.761 1384 HA ARG 72 HA ARG 72 23.673 12.003 -6.127 1385 HB2 ARG 72 HB2 ARG 72 25.144 12.205 -3.550 1386 HB3 ARG 72 HB1 ARG 72 25.798 13.078 -4.930 1387 HG2 ARG 72 HG2 ARG 72 23.388 13.991 -5.180 1388 HG3 ARG 72 HG1 ARG 72 23.203 13.467 -3.503 1389 HD2 ARG 72 HD2 ARG 72 23.894 15.832 -3.696 1390 HD3 ARG 72 HD1 ARG 72 25.069 14.848 -2.825 1391 HE ARG 72 HE ARG 72 25.784 14.899 -5.531 1392 HH11 ARG 72 HH11 ARG 72 25.605 17.097 -2.816 1393 HH12 ARG 72 HH12 ARG 72 26.923 18.083 -3.376 1394 HH21 ARG 72 HH21 ARG 72 27.515 16.184 -6.268 1395 HH22 ARG 72 HH22 ARG 72 28.020 17.558 -5.325 1396 H GLU 73 HN GLU 73 24.856 11.900 -7.876 1397 HA GLU 73 HA GLU 73 27.461 10.549 -7.793 1398 HB2 GLU 73 HB2 GLU 73 25.485 9.144 -8.763 1399 HB3 GLU 73 HB1 GLU 73 25.610 10.227 -10.142 1400 HG2 GLU 73 HG2 GLU 73 26.840 8.210 -10.567 1401 HG3 GLU 73 HG1 GLU 73 27.956 9.567 -10.422 1402 H GLY 74 HN GLY 74 28.859 12.132 -8.253 1403 HA2 GLY 74 HA2 GLY 74 29.774 14.007 -9.226 1404 HA3 GLY 74 HA1 GLY 74 28.641 13.792 -10.556 1405 H THR 75 HN THR 75 27.407 15.543 -10.846 1406 HA THR 75 HA THR 75 26.630 17.106 -8.478 1407 HB THR 75 HB THR 75 26.136 17.957 -11.324 1408 HG1 THR 75 HG1 THR 75 28.449 17.401 -10.825 1409 HG21 THR 75 HG21 THR 75 26.301 20.203 -10.332 1410 HG22 THR 75 HG22 THR 75 26.599 19.477 -8.752 1411 HG23 THR 75 HG23 THR 75 25.046 19.239 -9.555 1412 H ARG 76 HN ARG 76 25.504 14.632 -10.339 1413 HA ARG 76 HA ARG 76 22.731 15.553 -10.410 1414 HB2 ARG 76 HB2 ARG 76 23.872 12.928 -11.383 1415 HB3 ARG 76 HB1 ARG 76 22.259 13.548 -11.693 1416 HG2 ARG 76 HG2 ARG 76 23.354 15.466 -12.899 1417 HG3 ARG 76 HG1 ARG 76 24.866 14.563 -12.772 1418 HD2 ARG 76 HD2 ARG 76 23.648 12.627 -13.845 1419 HD3 ARG 76 HD1 ARG 76 22.341 13.758 -14.190 1420 HE ARG 76 HE ARG 76 24.969 13.659 -15.434 1421 HH11 ARG 76 HH11 ARG 76 21.990 15.460 -14.986 1422 HH12 ARG 76 HH12 ARG 76 22.133 16.309 -16.502 1423 HH21 ARG 76 HH21 ARG 76 25.156 14.779 -17.416 1424 HH22 ARG 76 HH22 ARG 76 23.952 15.957 -17.855 1425 H GLN 77 HN GLN 77 21.055 14.424 -9.400 1426 HA GLN 77 HA GLN 77 21.911 12.598 -7.259 1427 HB2 GLN 77 HB2 GLN 77 20.988 14.791 -6.467 1428 HB3 GLN 77 HB1 GLN 77 19.469 14.389 -7.259 1429 HG2 GLN 77 HG2 GLN 77 19.215 12.447 -5.820 1430 HG3 GLN 77 HG1 GLN 77 20.753 12.811 -5.042 1431 HE21 GLN 77 HE21 GLN 77 18.459 15.255 -6.010 1432 HE22 GLN 77 HE22 GLN 77 18.000 15.731 -4.417 1433 H TYR 78 HN TYR 78 21.329 10.589 -7.639 1434 HA TYR 78 HA TYR 78 19.142 10.070 -9.516 1435 HB2 TYR 78 HB2 TYR 78 21.377 8.314 -8.480 1436 HB3 TYR 78 HB1 TYR 78 20.084 7.735 -9.526 1437 HD1 TYR 78 HD2 TYR 78 22.988 10.028 -9.352 1438 HD2 TYR 78 HD1 TYR 78 20.145 8.106 -11.861 1439 HE1 TYR 78 HE2 TYR 78 24.284 10.707 -11.329 1440 HE2 TYR 78 HE1 TYR 78 21.430 8.776 -13.843 1441 HH TYR 78 HH TYR 78 24.590 10.016 -13.661 1442 H TYR 79 HN TYR 79 17.284 9.145 -8.891 1443 HA TYR 79 HA TYR 79 17.109 8.254 -6.099 1444 HB2 TYR 79 HB2 TYR 79 15.089 9.451 -7.960 1445 HB3 TYR 79 HB1 TYR 79 14.563 8.459 -6.605 1446 HD1 TYR 79 HD2 TYR 79 16.324 11.570 -7.536 1447 HD2 TYR 79 HD1 TYR 79 14.629 9.285 -4.374 1448 HE1 TYR 79 HE2 TYR 79 16.507 13.511 -6.041 1449 HE2 TYR 79 HE1 TYR 79 14.808 11.222 -2.871 1450 HH TYR 79 HH TYR 79 16.138 13.293 -2.683 1451 H ARG 80 HN ARG 80 16.613 6.242 -5.636 1452 HA ARG 80 HA ARG 80 15.784 4.447 -7.806 1453 HB2 ARG 80 HB2 ARG 80 17.390 2.761 -7.028 1454 HB3 ARG 80 HB1 ARG 80 18.211 4.223 -7.556 1455 HG2 ARG 80 HG2 ARG 80 18.367 4.910 -5.163 1456 HG3 ARG 80 HG1 ARG 80 17.719 3.327 -4.726 1457 HD2 ARG 80 HD2 ARG 80 20.292 3.911 -6.181 1458 HD3 ARG 80 HD1 ARG 80 20.112 3.248 -4.557 1459 HE ARG 80 HE ARG 80 19.587 1.845 -7.090 1460 HH11 ARG 80 HH11 ARG 80 20.001 1.797 -3.608 1461 HH12 ARG 80 HH12 ARG 80 19.999 0.055 -3.502 1462 HH21 ARG 80 HH21 ARG 80 19.614 -0.442 -6.962 1463 HH22 ARG 80 HH22 ARG 80 19.801 -1.214 -5.419 1464 H ILE 81 HN ILE 81 14.996 2.329 -6.907 1465 HA ILE 81 HA ILE 81 13.231 2.811 -4.708 1466 HB ILE 81 HB ILE 81 13.837 0.235 -6.178 1467 HG12 ILE 81 HG12 ILE 81 11.612 2.265 -6.514 1468 HG13 ILE 81 HG11 ILE 81 12.925 1.965 -7.648 1469 HG21 ILE 81 HG21 ILE 81 11.725 -0.574 -5.242 1470 HG22 ILE 81 HG22 ILE 81 11.558 0.922 -4.322 1471 HG23 ILE 81 HG23 ILE 81 12.886 -0.187 -3.973 1472 HD11 ILE 81 HD11 ILE 81 10.738 0.034 -6.909 1473 HD12 ILE 81 HD12 ILE 81 12.063 -0.294 -8.028 1474 HD13 ILE 81 HD13 ILE 81 10.869 0.946 -8.412 1475 H ALA 82 HN ALA 82 13.411 2.137 -2.618 1476 HA ALA 82 HA ALA 82 15.948 2.018 -1.499 1477 HB1 ALA 82 HB1 ALA 82 13.959 2.728 -0.273 1478 HB2 ALA 82 HB2 ALA 82 14.841 1.477 0.603 1479 HB3 ALA 82 HB3 ALA 82 13.366 1.067 -0.270 1480 H GLY 83 HN GLY 83 13.790 -0.639 -2.374 1481 HA2 GLY 83 HA2 GLY 83 16.005 -2.445 -2.484 1482 HA3 GLY 83 HA1 GLY 83 14.966 -2.763 -1.104 1483 H GLU 84 HN GLU 84 15.200 -4.760 -2.784 1484 HA GLU 84 HA GLU 84 13.525 -4.847 -5.036 1485 HB2 GLU 84 HB2 GLU 84 15.293 -6.526 -4.376 1486 HB3 GLU 84 HB1 GLU 84 14.163 -7.148 -3.182 1487 HG2 GLU 84 HG2 GLU 84 14.060 -8.557 -5.084 1488 HG3 GLU 84 HG1 GLU 84 12.568 -7.618 -5.036 1489 H ASP 85 HN ASP 85 12.890 -5.109 -1.648 1490 HA ASP 85 HA ASP 85 10.420 -6.413 -1.629 1491 HB2 ASP 85 HB2 ASP 85 11.176 -4.186 0.262 1492 HB3 ASP 85 HB1 ASP 85 10.176 -5.599 0.589 1493 H VAL 86 HN VAL 86 11.162 -2.943 -1.774 1494 HA VAL 86 HA VAL 86 8.461 -2.072 -1.933 1495 HB VAL 86 HB VAL 86 10.950 -0.639 -2.873 1496 HG11 VAL 86 HG11 VAL 86 8.912 0.341 -3.762 1497 HG12 VAL 86 HG12 VAL 86 9.622 1.398 -2.540 1498 HG13 VAL 86 HG13 VAL 86 8.217 0.407 -2.142 1499 HG21 VAL 86 HG21 VAL 86 9.574 -0.572 -0.191 1500 HG22 VAL 86 HG22 VAL 86 10.923 0.454 -0.679 1501 HG23 VAL 86 HG23 VAL 86 11.148 -1.291 -0.536 1502 H ALA 87 HN ALA 87 10.931 -2.851 -4.326 1503 HA ALA 87 HA ALA 87 9.599 -1.958 -6.624 1504 HB1 ALA 87 HB1 ALA 87 11.501 -4.289 -6.366 1505 HB2 ALA 87 HB2 ALA 87 11.963 -2.605 -6.608 1506 HB3 ALA 87 HB3 ALA 87 11.068 -3.463 -7.864 1507 H ARG 88 HN ARG 88 9.692 -5.226 -5.197 1508 HA ARG 88 HA ARG 88 7.787 -6.344 -6.955 1509 HB2 ARG 88 HB2 ARG 88 8.862 -7.134 -4.274 1510 HB3 ARG 88 HB1 ARG 88 7.501 -8.009 -4.958 1511 HG2 ARG 88 HG2 ARG 88 8.868 -8.510 -6.951 1512 HG3 ARG 88 HG1 ARG 88 10.235 -7.703 -6.178 1513 HD2 ARG 88 HD2 ARG 88 10.349 -9.316 -4.465 1514 HD3 ARG 88 HD1 ARG 88 8.765 -9.973 -4.867 1515 HE ARG 88 HE ARG 88 10.911 -10.203 -6.854 1516 HH11 ARG 88 HH11 ARG 88 8.857 -11.710 -4.463 1517 HH12 ARG 88 HH12 ARG 88 9.155 -13.327 -5.012 1518 HH21 ARG 88 HH21 ARG 88 11.312 -12.336 -7.609 1519 HH22 ARG 88 HH22 ARG 88 10.563 -13.687 -6.809 1520 H LEU 89 HN LEU 89 7.481 -4.613 -3.920 1521 HA LEU 89 HA LEU 89 4.807 -5.204 -3.331 1522 HB2 LEU 89 HB2 LEU 89 6.568 -3.980 -1.923 1523 HB3 LEU 89 HB1 LEU 89 6.125 -2.543 -2.817 1524 HG LEU 89 HG LEU 89 4.128 -4.131 -1.206 1525 HD11 LEU 89 HD11 LEU 89 5.728 -1.722 -0.355 1526 HD12 LEU 89 HD12 LEU 89 5.959 -3.368 0.238 1527 HD13 LEU 89 HD13 LEU 89 4.453 -2.513 0.573 1528 HD21 LEU 89 HD21 LEU 89 2.890 -1.998 -1.230 1529 HD22 LEU 89 HD22 LEU 89 3.139 -2.647 -2.850 1530 HD23 LEU 89 HD23 LEU 89 4.133 -1.308 -2.274 1531 H PHE 90 HN PHE 90 6.183 -2.436 -5.103 1532 HA PHE 90 HA PHE 90 3.686 -1.322 -5.822 1533 HB2 PHE 90 HB2 PHE 90 5.803 -0.039 -5.835 1534 HB3 PHE 90 HB1 PHE 90 6.360 -0.996 -7.204 1535 HD1 PHE 90 HD2 PHE 90 3.712 1.365 -6.129 1536 HD2 PHE 90 HD1 PHE 90 5.821 -0.371 -9.394 1537 HE1 PHE 90 HE2 PHE 90 2.636 2.955 -7.665 1538 HE2 PHE 90 HE1 PHE 90 4.747 1.219 -10.934 1539 HZ PHE 90 HZ PHE 90 3.149 2.884 -10.071 1540 H ALA 91 HN ALA 91 5.833 -3.624 -7.411 1541 HA ALA 91 HA ALA 91 4.508 -3.723 -9.893 1542 HB1 ALA 91 HB1 ALA 91 6.100 -5.891 -8.524 1543 HB2 ALA 91 HB2 ALA 91 6.760 -4.618 -9.550 1544 HB3 ALA 91 HB3 ALA 91 5.682 -5.834 -10.237 1545 H LEU 92 HN LEU 92 4.136 -5.668 -6.943 1546 HA LEU 92 HA LEU 92 2.249 -7.474 -7.989 1547 HB2 LEU 92 HB2 LEU 92 3.542 -7.874 -5.935 1548 HB3 LEU 92 HB1 LEU 92 2.644 -6.605 -5.128 1549 HG LEU 92 HG LEU 92 0.576 -7.914 -5.336 1550 HD11 LEU 92 HD11 LEU 92 0.680 -10.244 -6.100 1551 HD12 LEU 92 HD12 LEU 92 2.358 -10.001 -6.585 1552 HD13 LEU 92 HD13 LEU 92 1.069 -9.108 -7.391 1553 HD21 LEU 92 HD21 LEU 92 1.949 -8.174 -3.339 1554 HD22 LEU 92 HD22 LEU 92 2.871 -9.455 -4.127 1555 HD23 LEU 92 HD23 LEU 92 1.161 -9.695 -3.762 1556 H VAL 93 HN VAL 93 1.774 -4.522 -6.025 1557 HA VAL 93 HA VAL 93 -1.038 -4.715 -5.977 1558 HB VAL 93 HB VAL 93 0.240 -3.316 -4.395 1559 HG11 VAL 93 HG11 VAL 93 0.999 -1.089 -5.049 1560 HG12 VAL 93 HG12 VAL 93 0.596 -1.444 -6.729 1561 HG13 VAL 93 HG13 VAL 93 1.871 -2.353 -5.916 1562 HG21 VAL 93 HG21 VAL 93 -1.315 -1.414 -4.352 1563 HG22 VAL 93 HG22 VAL 93 -2.136 -2.948 -4.634 1564 HG23 VAL 93 HG23 VAL 93 -1.855 -1.841 -5.976 1565 H GLN 94 HN GLN 94 1.182 -3.316 -8.306 1566 HA GLN 94 HA GLN 94 -0.678 -1.914 -9.883 1567 HB2 GLN 94 HB2 GLN 94 1.727 -1.629 -10.167 1568 HB3 GLN 94 HB1 GLN 94 1.889 -3.306 -10.667 1569 HG2 GLN 94 HG2 GLN 94 0.556 -2.846 -12.660 1570 HG3 GLN 94 HG1 GLN 94 0.385 -1.167 -12.158 1571 HE21 GLN 94 HE21 GLN 94 3.336 -2.949 -11.687 1572 HE22 GLN 94 HE22 GLN 94 4.278 -2.105 -12.867 1573 H VAL 95 HN VAL 95 0.456 -5.269 -9.984 1574 HA VAL 95 HA VAL 95 -1.079 -6.083 -12.205 1575 HB VAL 95 HB VAL 95 -0.103 -7.751 -9.874 1576 HG11 VAL 95 HG11 VAL 95 -0.313 -9.655 -11.436 1577 HG12 VAL 95 HG12 VAL 95 -1.087 -8.581 -12.601 1578 HG13 VAL 95 HG13 VAL 95 -1.865 -8.911 -11.055 1579 HG21 VAL 95 HG21 VAL 95 1.734 -8.366 -11.398 1580 HG22 VAL 95 HG22 VAL 95 1.725 -6.647 -11.007 1581 HG23 VAL 95 HG23 VAL 95 1.127 -7.199 -12.571 1582 H VAL 96 HN VAL 96 -1.724 -6.118 -8.725 1583 HA VAL 96 HA VAL 96 -4.175 -7.428 -8.720 1584 HB VAL 96 HB VAL 96 -3.256 -5.166 -6.933 1585 HG11 VAL 96 HG11 VAL 96 -5.531 -7.110 -6.554 1586 HG12 VAL 96 HG12 VAL 96 -5.671 -5.372 -6.818 1587 HG13 VAL 96 HG13 VAL 96 -4.936 -5.982 -5.335 1588 HG21 VAL 96 HG21 VAL 96 -2.693 -6.952 -5.363 1589 HG22 VAL 96 HG22 VAL 96 -1.798 -7.117 -6.873 1590 HG23 VAL 96 HG23 VAL 96 -3.188 -8.158 -6.552 1591 H ALA 97 HN ALA 97 -3.520 -3.949 -9.062 1592 HA ALA 97 HA ALA 97 -6.207 -3.161 -9.392 1593 HB1 ALA 97 HB1 ALA 97 -4.420 -1.595 -8.821 1594 HB2 ALA 97 HB2 ALA 97 -5.296 -1.075 -10.263 1595 HB3 ALA 97 HB3 ALA 97 -3.707 -1.827 -10.419 1596 H ASP 98 HN ASP 98 -3.668 -3.891 -11.755 1597 HA ASP 98 HA ASP 98 -5.083 -3.237 -14.073 1598 HB2 ASP 98 HB2 ASP 98 -2.672 -3.543 -14.051 1599 HB3 ASP 98 HB1 ASP 98 -2.862 -5.251 -13.672 1600 H GLU 99 HN GLU 99 -4.703 -6.420 -12.509 1601 HA GLU 99 HA GLU 99 -6.239 -7.772 -14.498 1602 HB2 GLU 99 HB2 GLU 99 -4.442 -8.742 -12.962 1603 HB3 GLU 99 HB1 GLU 99 -5.678 -8.779 -11.715 1604 HG2 GLU 99 HG2 GLU 99 -5.493 -10.944 -12.735 1605 HG3 GLU 99 HG1 GLU 99 -7.052 -10.231 -13.141 1606 H HIS 100 HN HIS 100 -7.118 -5.836 -11.841 1607 HA HIS 100 HA HIS 100 -9.690 -7.131 -11.455 1608 HB2 HIS 100 HB2 HIS 100 -8.363 -4.755 -10.195 1609 HB3 HIS 100 HB1 HIS 100 -10.085 -5.035 -9.980 1610 HD1 HIS 100 HD1 HIS 100 -9.001 -8.325 -10.017 1611 HD2 HIS 100 HD2 HIS 100 -8.438 -5.235 -7.298 1612 HE1 HIS 100 HE1 HIS 100 -8.486 -9.439 -7.828 1613 HE2 HIS 100 HE2 HIS 100 -8.396 -7.555 -6.155 1614 H LEU 101 HN LEU 101 -8.341 -4.679 -13.421 1615 HA LEU 101 HA LEU 101 -10.856 -3.363 -13.941 1616 HB2 LEU 101 HB2 LEU 101 -8.056 -3.039 -14.826 1617 HB3 LEU 101 HB1 LEU 101 -9.278 -2.564 -15.989 1618 HG LEU 101 HG LEU 101 -8.510 -0.653 -14.677 1619 HD11 LEU 101 HD11 LEU 101 -11.341 -1.454 -14.023 1620 HD12 LEU 101 HD12 LEU 101 -10.801 -0.657 -15.500 1621 HD13 LEU 101 HD13 LEU 101 -10.687 0.183 -13.954 1622 HD21 LEU 101 HD21 LEU 101 -8.994 -0.484 -12.291 1623 HD22 LEU 101 HD22 LEU 101 -7.893 -1.822 -12.628 1624 HD23 LEU 101 HD23 LEU 101 -9.593 -2.144 -12.293 1625 H GLU 102 HN GLU 102 -8.937 -5.919 -15.355 1626 HA GLU 102 HA GLU 102 -11.212 -6.896 -16.786 1627 HB2 GLU 102 HB2 GLU 102 -9.879 -5.022 -18.211 1628 HB3 GLU 102 HB1 GLU 102 -8.933 -6.441 -18.637 1629 HG2 GLU 102 HG2 GLU 102 -11.902 -6.094 -19.023 1630 HG3 GLU 102 HG1 GLU 102 -10.672 -6.029 -20.280 1631 H HIS 103 HN HIS 103 -11.065 -9.030 -16.576 1632 HA HIS 103 HA HIS 103 -8.545 -10.275 -15.905 1633 HB2 HIS 103 HB2 HIS 103 -11.359 -11.305 -16.150 1634 HB3 HIS 103 HB1 HIS 103 -9.999 -12.413 -15.999 1635 HD1 HIS 103 HD1 HIS 103 -8.726 -12.430 -13.728 1636 HD2 HIS 103 HD2 HIS 103 -12.089 -9.984 -13.821 1637 HE1 HIS 103 HE1 HIS 103 -9.248 -11.894 -11.321 1638 HE2 HIS 103 HE2 HIS 103 -11.423 -10.616 -11.409 1639 H HIS 104 HN HIS 104 -7.567 -9.611 -17.911 1640 HA HIS 104 HA HIS 104 -8.496 -10.621 -20.428 1641 HB2 HIS 104 HB2 HIS 104 -6.328 -9.647 -21.268 1642 HB3 HIS 104 HB1 HIS 104 -7.364 -8.509 -20.414 1643 HD1 HIS 104 HD1 HIS 104 -6.578 -7.762 -18.015 1644 HD2 HIS 104 HD2 HIS 104 -3.834 -10.075 -20.119 1645 HE1 HIS 104 HE1 HIS 104 -4.405 -7.517 -16.787 1646 HE2 HIS 104 HE2 HIS 104 -2.791 -9.036 -17.988 1647 H HIS 105 HN HIS 105 -8.254 -12.749 -18.797 1648 HA HIS 105 HA HIS 105 -6.494 -14.466 -20.227 1649 HB2 HIS 105 HB2 HIS 105 -5.587 -13.382 -17.652 1650 HB3 HIS 105 HB1 HIS 105 -5.568 -15.141 -17.727 1651 HD1 HIS 105 HD1 HIS 105 -3.222 -12.711 -17.949 1652 HD2 HIS 105 HD2 HIS 105 -4.376 -15.654 -20.656 1653 HE1 HIS 105 HE1 HIS 105 -1.260 -13.022 -19.502 1654 HE2 HIS 105 HE2 HIS 105 -1.903 -14.973 -20.965 1655 H HIS 106 HN HIS 106 -8.612 -13.871 -17.511 1656 HA HIS 106 HA HIS 106 -10.201 -15.091 -16.443 1657 HB2 HIS 106 HB2 HIS 106 -9.851 -17.159 -18.634 1658 HB3 HIS 106 HB1 HIS 106 -11.189 -17.060 -17.500 1659 HD1 HIS 106 HD1 HIS 106 -10.355 -16.252 -20.860 1660 HD2 HIS 106 HD2 HIS 106 -12.636 -14.425 -17.894 1661 HE1 HIS 106 HE1 HIS 106 -11.872 -14.642 -22.062 1662 HE2 HIS 106 HE2 HIS 106 -13.378 -13.704 -20.271 1663 H HIS 107 HN HIS 107 -8.258 -17.671 -17.832 1664 HA HIS 107 HA HIS 107 -6.426 -18.069 -15.821 1665 HB2 HIS 107 HB2 HIS 107 -7.240 -20.078 -14.653 1666 HB3 HIS 107 HB1 HIS 107 -8.271 -18.696 -14.326 1667 HD1 HIS 107 HD1 HIS 107 -8.336 -22.152 -15.518 1668 HD2 HIS 107 HD2 HIS 107 -10.807 -18.812 -15.741 1669 HE1 HIS 107 HE1 HIS 107 -10.598 -23.023 -16.183 1670 HE2 HIS 107 HE2 HIS 107 -11.999 -20.961 -16.546 1671 H HIS 108 HN HIS 108 -8.613 -19.734 -18.007 1672 HA HIS 108 HA HIS 108 -6.698 -20.260 -19.959 1673 HB2 HIS 108 HB2 HIS 108 -5.836 -21.948 -18.352 1674 HB3 HIS 108 HB1 HIS 108 -7.428 -22.698 -18.305 1675 HD1 HIS 108 HD1 HIS 108 -4.502 -22.161 -20.632 1676 HD2 HIS 108 HD2 HIS 108 -7.955 -24.467 -20.356 1677 HE1 HIS 108 HE1 HIS 108 -4.344 -23.855 -22.491 1678 HE2 HIS 108 HE2 HIS 108 -6.449 -25.235 -22.318 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 -7.142 6.020 -34.242 2 H2 MET 1 HT2 MET 1 -6.092 5.102 -35.204 3 H3 MET 1 HT3 MET 1 -5.969 6.791 -35.191 4 HA MET 1 HA MET 1 -5.458 5.008 -32.883 5 HB2 MET 1 HB2 MET 1 -3.573 6.486 -34.722 6 HB3 MET 1 HB1 MET 1 -3.088 5.834 -33.165 7 HG2 MET 1 HG2 MET 1 -2.423 4.299 -34.846 8 HG3 MET 1 HG1 MET 1 -3.767 3.584 -33.960 9 HE1 MET 1 HE1 MET 1 -2.701 2.539 -36.768 10 HE2 MET 1 HE2 MET 1 -4.211 2.235 -37.628 11 HE3 MET 1 HE3 MET 1 -4.057 1.786 -35.929 12 H ALA 2 HN ALA 2 -6.413 6.121 -31.270 13 HA ALA 2 HA ALA 2 -5.143 8.635 -30.557 14 HB1 ALA 2 HB1 ALA 2 -7.241 9.804 -30.129 15 HB2 ALA 2 HB2 ALA 2 -8.147 8.439 -30.782 16 HB3 ALA 2 HB3 ALA 2 -7.093 9.383 -31.836 17 H GLY 3 HN GLY 3 -4.334 7.987 -28.657 18 HA2 GLY 3 HA2 GLY 3 -5.788 6.239 -26.889 19 HA3 GLY 3 HA1 GLY 3 -4.242 7.015 -26.556 20 H GLN 4 HN GLN 4 -7.692 7.681 -26.869 21 HA GLN 4 HA GLN 4 -7.764 10.213 -25.749 22 HB2 GLN 4 HB2 GLN 4 -9.847 8.027 -25.576 23 HB3 GLN 4 HB1 GLN 4 -10.138 9.733 -25.255 24 HG2 GLN 4 HG2 GLN 4 -9.554 10.269 -27.566 25 HG3 GLN 4 HG1 GLN 4 -9.266 8.561 -27.891 26 HE21 GLN 4 HE21 GLN 4 -10.840 8.505 -29.495 27 HE22 GLN 4 HE22 GLN 4 -12.530 8.560 -29.131 28 H SER 5 HN SER 5 -7.765 11.017 -23.764 29 HA SER 5 HA SER 5 -7.199 11.264 -21.609 30 HB2 SER 5 HB2 SER 5 -8.274 9.864 -19.937 31 HB3 SER 5 HB1 SER 5 -9.413 10.245 -21.225 32 HG SER 5 HG SER 5 -8.389 8.039 -22.017 33 H ASP 6 HN ASP 6 -6.111 10.116 -19.632 34 HA ASP 6 HA ASP 6 -3.866 8.600 -20.724 35 HB2 ASP 6 HB2 ASP 6 -2.728 9.148 -18.569 36 HB3 ASP 6 HB1 ASP 6 -3.152 10.548 -19.540 37 H ARG 7 HN ARG 7 -3.744 6.502 -20.458 38 HA ARG 7 HA ARG 7 -6.056 5.280 -19.243 39 HB2 ARG 7 HB2 ARG 7 -5.109 4.739 -21.535 40 HB3 ARG 7 HB1 ARG 7 -3.820 3.886 -20.701 41 HG2 ARG 7 HG2 ARG 7 -5.427 2.373 -19.703 42 HG3 ARG 7 HG1 ARG 7 -6.756 3.254 -20.460 43 HD2 ARG 7 HD2 ARG 7 -5.779 2.713 -22.676 44 HD3 ARG 7 HD1 ARG 7 -4.557 1.736 -21.864 45 HE ARG 7 HE ARG 7 -7.185 0.936 -21.111 46 HH11 ARG 7 HH11 ARG 7 -4.876 0.721 -23.752 47 HH12 ARG 7 HH12 ARG 7 -5.502 -0.794 -24.326 48 HH21 ARG 7 HH21 ARG 7 -8.010 -1.032 -21.891 49 HH22 ARG 7 HH22 ARG 7 -7.274 -1.795 -23.274 50 H LYS 8 HN LYS 8 -2.636 5.491 -18.516 51 HA LYS 8 HA LYS 8 -2.580 3.183 -16.821 52 HB2 LYS 8 HB2 LYS 8 -0.540 4.144 -17.883 53 HB3 LYS 8 HB1 LYS 8 -0.685 5.545 -16.829 54 HG2 LYS 8 HG2 LYS 8 -0.401 4.108 -14.873 55 HG3 LYS 8 HG1 LYS 8 -0.267 2.700 -15.926 56 HD2 LYS 8 HD2 LYS 8 1.606 5.066 -15.885 57 HD3 LYS 8 HD1 LYS 8 1.930 3.483 -15.180 58 HE2 LYS 8 HE2 LYS 8 1.625 2.512 -17.477 59 HE3 LYS 8 HE1 LYS 8 1.560 4.163 -18.091 60 HZ1 LYS 8 HZ1 LYS 8 3.792 4.487 -17.035 61 HZ2 LYS 8 HZ2 LYS 8 3.770 3.416 -18.343 62 HZ3 LYS 8 HZ3 LYS 8 3.843 2.819 -16.757 63 H ALA 9 HN ALA 9 -3.580 6.446 -16.462 64 HA ALA 9 HA ALA 9 -3.284 6.844 -13.712 65 HB1 ALA 9 HB1 ALA 9 -4.976 8.558 -13.935 66 HB2 ALA 9 HB2 ALA 9 -5.493 7.885 -15.481 67 HB3 ALA 9 HB3 ALA 9 -3.891 8.606 -15.325 68 H ALA 10 HN ALA 10 -5.719 5.097 -15.536 69 HA ALA 10 HA ALA 10 -7.595 4.794 -13.438 70 HB1 ALA 10 HB1 ALA 10 -8.184 4.453 -15.792 71 HB2 ALA 10 HB2 ALA 10 -8.579 3.038 -14.816 72 HB3 ALA 10 HB3 ALA 10 -7.147 3.028 -15.844 73 H LEU 11 HN LEU 11 -4.783 2.942 -14.464 74 HA LEU 11 HA LEU 11 -5.258 0.788 -12.626 75 HB2 LEU 11 HB2 LEU 11 -4.002 0.454 -14.717 76 HB3 LEU 11 HB1 LEU 11 -2.765 1.558 -14.149 77 HG LEU 11 HG LEU 11 -2.270 -0.012 -12.287 78 HD11 LEU 11 HD11 LEU 11 -4.417 -1.123 -12.126 79 HD12 LEU 11 HD12 LEU 11 -3.144 -2.305 -12.431 80 HD13 LEU 11 HD13 LEU 11 -4.211 -1.800 -13.741 81 HD21 LEU 11 HD21 LEU 11 -2.081 -1.156 -15.068 82 HD22 LEU 11 HD22 LEU 11 -1.137 -1.684 -13.677 83 HD23 LEU 11 HD23 LEU 11 -0.932 -0.052 -14.312 84 H LEU 12 HN LEU 12 -3.364 3.743 -12.693 85 HA LEU 12 HA LEU 12 -1.897 3.270 -10.325 86 HB2 LEU 12 HB2 LEU 12 -2.663 5.870 -11.654 87 HB3 LEU 12 HB1 LEU 12 -1.532 5.733 -10.320 88 HG LEU 12 HG LEU 12 -1.178 4.521 -13.063 89 HD11 LEU 12 HD11 LEU 12 -0.934 6.946 -13.043 90 HD12 LEU 12 HD12 LEU 12 0.619 6.150 -13.303 91 HD13 LEU 12 HD13 LEU 12 0.224 6.825 -11.721 92 HD21 LEU 12 HD21 LEU 12 -0.180 3.138 -11.306 93 HD22 LEU 12 HD22 LEU 12 0.685 4.544 -10.687 94 HD23 LEU 12 HD23 LEU 12 1.058 3.917 -12.293 95 H ASP 13 HN ASP 13 -5.010 4.888 -10.922 96 HA ASP 13 HA ASP 13 -5.451 5.640 -8.228 97 HB2 ASP 13 HB2 ASP 13 -6.789 6.641 -9.992 98 HB3 ASP 13 HB1 ASP 13 -7.443 5.065 -10.434 99 H GLN 14 HN GLN 14 -6.136 2.716 -10.045 100 HA GLN 14 HA GLN 14 -7.702 1.340 -8.191 101 HB2 GLN 14 HB2 GLN 14 -7.367 0.570 -10.479 102 HB3 GLN 14 HB1 GLN 14 -5.661 0.295 -10.169 103 HG2 GLN 14 HG2 GLN 14 -6.823 -1.797 -10.184 104 HG3 GLN 14 HG1 GLN 14 -6.264 -1.451 -8.550 105 HE21 GLN 14 HE21 GLN 14 -9.026 -1.673 -10.648 106 HE22 GLN 14 HE22 GLN 14 -10.225 -1.732 -9.398 107 H VAL 15 HN VAL 15 -4.142 1.184 -8.624 108 HA VAL 15 HA VAL 15 -3.792 -0.436 -6.303 109 HB VAL 15 HB VAL 15 -1.384 -0.030 -6.557 110 HG11 VAL 15 HG11 VAL 15 -2.804 -0.626 -9.149 111 HG12 VAL 15 HG12 VAL 15 -2.442 -1.781 -7.866 112 HG13 VAL 15 HG13 VAL 15 -1.129 -1.035 -8.778 113 HG21 VAL 15 HG21 VAL 15 -0.533 1.320 -8.410 114 HG22 VAL 15 HG22 VAL 15 -1.444 2.307 -7.267 115 HG23 VAL 15 HG23 VAL 15 -2.176 1.829 -8.799 116 H ALA 16 HN ALA 16 -3.816 3.018 -6.867 117 HA ALA 16 HA ALA 16 -2.738 3.761 -4.336 118 HB1 ALA 16 HB1 ALA 16 -3.610 5.986 -4.816 119 HB2 ALA 16 HB2 ALA 16 -4.551 5.339 -6.161 120 HB3 ALA 16 HB3 ALA 16 -2.789 5.318 -6.227 121 H ARG 17 HN ARG 17 -5.952 3.018 -5.532 122 HA ARG 17 HA ARG 17 -7.435 3.866 -3.301 123 HB2 ARG 17 HB2 ARG 17 -8.635 3.376 -5.283 124 HB3 ARG 17 HB1 ARG 17 -7.923 1.776 -5.416 125 HG2 ARG 17 HG2 ARG 17 -9.328 0.868 -3.854 126 HG3 ARG 17 HG1 ARG 17 -9.616 2.412 -3.051 127 HD2 ARG 17 HD2 ARG 17 -11.564 1.541 -4.327 128 HD3 ARG 17 HD1 ARG 17 -11.032 3.145 -4.817 129 HE ARG 17 HE ARG 17 -10.058 2.142 -6.786 130 HH11 ARG 17 HH11 ARG 17 -12.144 0.019 -4.935 131 HH12 ARG 17 HH12 ARG 17 -12.619 -0.923 -6.313 132 HH21 ARG 17 HH21 ARG 17 -10.720 0.931 -8.603 133 HH22 ARG 17 HH22 ARG 17 -11.794 -0.423 -8.387 134 H VAL 18 HN VAL 18 -5.885 0.773 -4.048 135 HA VAL 18 HA VAL 18 -6.640 -0.608 -1.722 136 HB VAL 18 HB VAL 18 -4.063 -0.886 -3.282 137 HG11 VAL 18 HG11 VAL 18 -4.029 -3.178 -2.394 138 HG12 VAL 18 HG12 VAL 18 -5.439 -2.802 -1.406 139 HG13 VAL 18 HG13 VAL 18 -3.914 -1.966 -1.117 140 HG21 VAL 18 HG21 VAL 18 -6.002 -1.140 -4.727 141 HG22 VAL 18 HG22 VAL 18 -6.697 -2.319 -3.613 142 HG23 VAL 18 HG23 VAL 18 -5.207 -2.696 -4.479 143 H GLY 19 HN GLY 19 -3.698 1.276 -2.422 144 HA2 GLY 19 HA2 GLY 19 -2.563 0.994 0.153 145 HA3 GLY 19 HA1 GLY 19 -2.122 2.209 -1.035 146 H LYS 20 HN LYS 20 -4.962 3.171 -1.090 147 HA LYS 20 HA LYS 20 -4.663 5.175 0.913 148 HB2 LYS 20 HB2 LYS 20 -5.677 5.592 -1.301 149 HB3 LYS 20 HB1 LYS 20 -7.026 4.555 -0.870 150 HG2 LYS 20 HG2 LYS 20 -7.809 6.085 0.745 151 HG3 LYS 20 HG1 LYS 20 -6.319 7.028 0.680 152 HD2 LYS 20 HD2 LYS 20 -8.164 8.117 -0.540 153 HD3 LYS 20 HD1 LYS 20 -6.814 7.707 -1.599 154 HE2 LYS 20 HE2 LYS 20 -8.047 5.625 -2.227 155 HE3 LYS 20 HE1 LYS 20 -9.426 6.234 -1.312 156 HZ1 LYS 20 HZ1 LYS 20 -9.688 6.764 -3.628 157 HZ2 LYS 20 HZ2 LYS 20 -8.170 7.522 -3.680 158 HZ3 LYS 20 HZ3 LYS 20 -9.426 8.201 -2.765 159 H ALA 21 HN ALA 21 -6.617 2.263 0.594 160 HA ALA 21 HA ALA 21 -7.997 2.735 3.096 161 HB1 ALA 21 HB1 ALA 21 -9.129 1.511 1.320 162 HB2 ALA 21 HB2 ALA 21 -8.931 0.487 2.742 163 HB3 ALA 21 HB3 ALA 21 -7.873 0.275 1.347 164 H LEU 22 HN LEU 22 -5.139 1.169 1.959 165 HA LEU 22 HA LEU 22 -4.577 -0.430 4.241 166 HB2 LEU 22 HB2 LEU 22 -3.593 -0.359 1.772 167 HB3 LEU 22 HB1 LEU 22 -2.421 0.711 2.507 168 HG LEU 22 HG LEU 22 -1.652 -1.635 2.320 169 HD11 LEU 22 HD11 LEU 22 -1.944 -0.637 5.146 170 HD12 LEU 22 HD12 LEU 22 -0.669 -0.201 4.007 171 HD13 LEU 22 HD13 LEU 22 -0.799 -1.860 4.593 172 HD21 LEU 22 HD21 LEU 22 -3.851 -2.187 4.302 173 HD22 LEU 22 HD22 LEU 22 -2.591 -3.325 3.822 174 HD23 LEU 22 HD23 LEU 22 -3.770 -2.762 2.638 175 H ALA 23 HN ALA 23 -3.925 2.878 3.304 176 HA ALA 23 HA ALA 23 -2.068 3.402 5.438 177 HB1 ALA 23 HB1 ALA 23 -1.869 4.535 3.287 178 HB2 ALA 23 HB2 ALA 23 -2.098 5.698 4.593 179 HB3 ALA 23 HB3 ALA 23 -3.445 5.290 3.531 180 H ASN 24 HN ASN 24 -4.968 2.607 5.993 181 HA ASN 24 HA ASN 24 -6.027 4.939 7.343 182 HB2 ASN 24 HB2 ASN 24 -7.596 3.407 6.293 183 HB3 ASN 24 HB1 ASN 24 -6.988 2.072 7.267 184 HD21 ASN 24 HD21 ASN 24 -8.817 5.034 7.289 185 HD22 ASN 24 HD22 ASN 24 -9.605 4.776 8.811 186 H GLY 25 HN GLY 25 -4.410 1.934 8.192 187 HA2 GLY 25 HA2 GLY 25 -3.101 1.574 10.091 188 HA3 GLY 25 HA1 GLY 25 -3.739 3.056 10.783 189 H ARG 26 HN ARG 26 -6.276 2.837 11.126 190 HA ARG 26 HA ARG 26 -6.563 0.984 13.236 191 HB2 ARG 26 HB2 ARG 26 -8.636 2.623 11.770 192 HB3 ARG 26 HB1 ARG 26 -8.966 1.691 13.223 193 HG2 ARG 26 HG2 ARG 26 -7.350 3.052 14.459 194 HG3 ARG 26 HG1 ARG 26 -7.037 3.994 12.998 195 HD2 ARG 26 HD2 ARG 26 -9.372 4.691 12.941 196 HD3 ARG 26 HD1 ARG 26 -9.706 3.723 14.376 197 HE ARG 26 HE ARG 26 -7.758 5.358 15.238 198 HH11 ARG 26 HH11 ARG 26 -10.742 5.940 13.524 199 HH12 ARG 26 HH12 ARG 26 -10.986 7.521 14.191 200 HH21 ARG 26 HH21 ARG 26 -8.045 7.461 16.123 201 HH22 ARG 26 HH22 ARG 26 -9.436 8.399 15.658 202 H ARG 27 HN ARG 27 -7.825 0.999 9.927 203 HA ARG 27 HA ARG 27 -9.342 -1.388 10.251 204 HB2 ARG 27 HB2 ARG 27 -8.448 0.151 7.823 205 HB3 ARG 27 HB1 ARG 27 -9.366 -1.346 7.697 206 HG2 ARG 27 HG2 ARG 27 -11.115 -0.292 9.140 207 HG3 ARG 27 HG1 ARG 27 -10.223 1.224 8.999 208 HD2 ARG 27 HD2 ARG 27 -11.067 -0.307 6.565 209 HD3 ARG 27 HD1 ARG 27 -12.189 0.772 7.390 210 HE ARG 27 HE ARG 27 -9.669 1.601 6.102 211 HH11 ARG 27 HH11 ARG 27 -12.816 2.318 7.430 212 HH12 ARG 27 HH12 ARG 27 -12.914 3.901 6.722 213 HH21 ARG 27 HH21 ARG 27 -9.776 3.707 5.148 214 HH22 ARG 27 HH22 ARG 27 -11.195 4.682 5.409 215 H LEU 28 HN LEU 28 -6.026 -0.916 10.003 216 HA LEU 28 HA LEU 28 -5.346 -3.215 8.465 217 HB2 LEU 28 HB2 LEU 28 -3.725 -1.647 10.469 218 HB3 LEU 28 HB1 LEU 28 -3.082 -2.914 9.445 219 HG LEU 28 HG LEU 28 -4.239 -0.291 8.512 220 HD11 LEU 28 HD11 LEU 28 -1.426 -1.367 8.419 221 HD12 LEU 28 HD12 LEU 28 -2.013 -0.113 9.512 222 HD13 LEU 28 HD13 LEU 28 -1.974 0.182 7.773 223 HD21 LEU 28 HD21 LEU 28 -3.577 -1.008 6.278 224 HD22 LEU 28 HD22 LEU 28 -4.772 -2.108 6.969 225 HD23 LEU 28 HD23 LEU 28 -3.070 -2.570 6.923 226 H GLN 29 HN GLN 29 -6.172 -2.648 11.785 227 HA GLN 29 HA GLN 29 -5.167 -5.049 12.886 228 HB2 GLN 29 HB2 GLN 29 -7.563 -3.416 13.746 229 HB3 GLN 29 HB1 GLN 29 -6.776 -4.657 14.711 230 HG2 GLN 29 HG2 GLN 29 -4.713 -3.322 14.706 231 HG3 GLN 29 HG1 GLN 29 -5.549 -2.068 13.794 232 HE21 GLN 29 HE21 GLN 29 -8.050 -2.496 15.260 233 HE22 GLN 29 HE22 GLN 29 -7.822 -1.780 16.820 234 H ILE 30 HN ILE 30 -8.015 -4.271 11.042 235 HA ILE 30 HA ILE 30 -9.416 -6.705 11.564 236 HB ILE 30 HB ILE 30 -9.709 -4.826 9.209 237 HG12 ILE 30 HG12 ILE 30 -11.230 -4.924 11.827 238 HG13 ILE 30 HG11 ILE 30 -10.054 -3.693 11.375 239 HG21 ILE 30 HG21 ILE 30 -11.581 -6.924 10.304 240 HG22 ILE 30 HG22 ILE 30 -10.670 -7.025 8.796 241 HG23 ILE 30 HG23 ILE 30 -11.938 -5.812 8.981 242 HD11 ILE 30 HD11 ILE 30 -11.500 -2.977 9.549 243 HD12 ILE 30 HD12 ILE 30 -12.337 -2.902 11.101 244 HD13 ILE 30 HD13 ILE 30 -12.669 -4.226 9.983 245 H LEU 31 HN LEU 31 -7.329 -5.537 8.940 246 HA LEU 31 HA LEU 31 -7.391 -7.845 7.346 247 HB2 LEU 31 HB2 LEU 31 -5.261 -5.739 7.713 248 HB3 LEU 31 HB1 LEU 31 -5.143 -7.020 6.522 249 HG LEU 31 HG LEU 31 -7.356 -4.963 6.601 250 HD11 LEU 31 HD11 LEU 31 -4.921 -5.123 4.830 251 HD12 LEU 31 HD12 LEU 31 -5.214 -3.921 6.087 252 HD13 LEU 31 HD13 LEU 31 -6.249 -3.974 4.659 253 HD21 LEU 31 HD21 LEU 31 -7.872 -5.792 4.363 254 HD22 LEU 31 HD22 LEU 31 -8.013 -7.073 5.567 255 HD23 LEU 31 HD23 LEU 31 -6.600 -7.005 4.513 256 H ASP 32 HN ASP 32 -5.328 -6.922 10.055 257 HA ASP 32 HA ASP 32 -3.587 -9.118 10.048 258 HB2 ASP 32 HB2 ASP 32 -3.146 -7.155 11.398 259 HB3 ASP 32 HB1 ASP 32 -4.609 -7.423 12.337 260 H LEU 33 HN LEU 33 -6.804 -8.712 11.405 261 HA LEU 33 HA LEU 33 -6.814 -11.204 12.809 262 HB2 LEU 33 HB2 LEU 33 -8.223 -9.321 13.499 263 HB3 LEU 33 HB1 LEU 33 -9.094 -9.404 11.979 264 HG LEU 33 HG LEU 33 -9.892 -11.675 12.610 265 HD11 LEU 33 HD11 LEU 33 -8.635 -11.021 15.269 266 HD12 LEU 33 HD12 LEU 33 -8.083 -12.260 14.144 267 HD13 LEU 33 HD13 LEU 33 -9.660 -12.414 14.920 268 HD21 LEU 33 HD21 LEU 33 -10.530 -9.483 14.578 269 HD22 LEU 33 HD22 LEU 33 -11.523 -10.903 14.247 270 HD23 LEU 33 HD23 LEU 33 -11.268 -9.693 12.989 271 H LEU 34 HN LEU 34 -8.029 -10.081 9.681 272 HA LEU 34 HA LEU 34 -9.287 -12.614 9.100 273 HB2 LEU 34 HB2 LEU 34 -8.809 -10.222 7.322 274 HB3 LEU 34 HB1 LEU 34 -9.805 -11.608 6.915 275 HG LEU 34 HG LEU 34 -10.332 -9.602 9.108 276 HD11 LEU 34 HD11 LEU 34 -12.294 -9.028 7.768 277 HD12 LEU 34 HD12 LEU 34 -11.782 -10.170 6.526 278 HD13 LEU 34 HD13 LEU 34 -10.798 -8.749 6.879 279 HD21 LEU 34 HD21 LEU 34 -11.038 -11.808 9.819 280 HD22 LEU 34 HD22 LEU 34 -11.897 -12.050 8.299 281 HD23 LEU 34 HD23 LEU 34 -12.444 -10.817 9.434 282 H ALA 35 HN ALA 35 -6.147 -11.580 9.034 283 HA ALA 35 HA ALA 35 -5.210 -12.726 6.620 284 HB1 ALA 35 HB1 ALA 35 -3.915 -11.079 7.861 285 HB2 ALA 35 HB2 ALA 35 -2.990 -12.563 7.626 286 HB3 ALA 35 HB3 ALA 35 -3.725 -12.222 9.191 287 H GLN 36 HN GLN 36 -6.343 -14.126 9.494 288 HA GLN 36 HA GLN 36 -4.825 -16.590 9.059 289 HB2 GLN 36 HB2 GLN 36 -5.552 -17.293 11.241 290 HB3 GLN 36 HB1 GLN 36 -4.934 -15.651 11.358 291 HG2 GLN 36 HG2 GLN 36 -7.222 -14.792 11.360 292 HG3 GLN 36 HG1 GLN 36 -7.837 -16.440 11.243 293 HE21 GLN 36 HE21 GLN 36 -5.074 -15.451 13.151 294 HE22 GLN 36 HE22 GLN 36 -5.790 -15.776 14.693 295 H GLY 37 HN GLY 37 -7.748 -15.254 8.121 296 HA2 GLY 37 HA2 GLY 37 -8.755 -17.223 6.647 297 HA3 GLY 37 HA1 GLY 37 -9.236 -17.762 8.247 298 H GLU 38 HN GLU 38 -11.347 -17.442 8.405 299 HA GLU 38 HA GLU 38 -12.432 -14.844 7.535 300 HB2 GLU 38 HB2 GLU 38 -14.545 -16.091 6.982 301 HB3 GLU 38 HB1 GLU 38 -13.179 -16.434 5.930 302 HG2 GLU 38 HG2 GLU 38 -12.758 -18.509 7.100 303 HG3 GLU 38 HG1 GLU 38 -14.076 -18.164 8.218 304 H ARG 39 HN ARG 39 -13.762 -13.815 8.889 305 HA ARG 39 HA ARG 39 -14.780 -15.242 11.242 306 HB2 ARG 39 HB2 ARG 39 -13.228 -12.645 11.302 307 HB3 ARG 39 HB1 ARG 39 -14.195 -13.234 12.646 308 HG2 ARG 39 HG2 ARG 39 -11.858 -14.692 11.436 309 HG3 ARG 39 HG1 ARG 39 -11.801 -13.714 12.904 310 HD2 ARG 39 HD2 ARG 39 -13.479 -15.195 13.926 311 HD3 ARG 39 HD1 ARG 39 -13.476 -16.185 12.467 312 HE ARG 39 HE ARG 39 -11.070 -16.605 12.957 313 HH11 ARG 39 HH11 ARG 39 -13.323 -15.788 15.507 314 HH12 ARG 39 HH12 ARG 39 -12.345 -16.456 16.776 315 HH21 ARG 39 HH21 ARG 39 -9.774 -17.485 14.608 316 HH22 ARG 39 HH22 ARG 39 -10.303 -17.413 16.261 317 H ALA 40 HN ALA 40 -16.701 -14.415 12.078 318 HA ALA 40 HA ALA 40 -18.358 -12.995 10.246 319 HB1 ALA 40 HB1 ALA 40 -19.259 -14.672 11.775 320 HB2 ALA 40 HB2 ALA 40 -20.051 -13.114 12.011 321 HB3 ALA 40 HB3 ALA 40 -18.825 -13.661 13.155 322 H VAL 41 HN VAL 41 -19.327 -10.942 10.527 323 HA VAL 41 HA VAL 41 -17.652 -8.828 11.172 324 HB VAL 41 HB VAL 41 -20.677 -8.788 11.239 325 HG11 VAL 41 HG11 VAL 41 -19.734 -6.786 12.216 326 HG12 VAL 41 HG12 VAL 41 -20.423 -6.413 10.635 327 HG13 VAL 41 HG13 VAL 41 -18.675 -6.571 10.821 328 HG21 VAL 41 HG21 VAL 41 -18.820 -8.282 8.918 329 HG22 VAL 41 HG22 VAL 41 -20.581 -8.161 8.896 330 HG23 VAL 41 HG23 VAL 41 -19.806 -9.726 9.147 331 H GLU 42 HN GLU 42 -20.156 -10.376 13.096 332 HA GLU 42 HA GLU 42 -20.094 -8.720 15.341 333 HB2 GLU 42 HB2 GLU 42 -20.562 -11.702 15.432 334 HB3 GLU 42 HB1 GLU 42 -21.232 -10.473 16.494 335 HG2 GLU 42 HG2 GLU 42 -23.039 -10.881 15.176 336 HG3 GLU 42 HG1 GLU 42 -22.286 -9.576 14.261 337 H ALA 43 HN ALA 43 -18.103 -11.487 14.468 338 HA ALA 43 HA ALA 43 -16.740 -11.613 16.979 339 HB1 ALA 43 HB1 ALA 43 -16.948 -13.597 15.584 340 HB2 ALA 43 HB2 ALA 43 -15.251 -13.201 15.852 341 HB3 ALA 43 HB3 ALA 43 -16.013 -12.816 14.309 342 H ILE 44 HN ILE 44 -16.028 -10.268 13.783 343 HA ILE 44 HA ILE 44 -13.402 -9.406 14.272 344 HB ILE 44 HB ILE 44 -15.477 -8.158 12.456 345 HG12 ILE 44 HG12 ILE 44 -13.294 -10.158 11.820 346 HG13 ILE 44 HG11 ILE 44 -14.996 -10.565 12.018 347 HG21 ILE 44 HG21 ILE 44 -13.565 -7.223 11.235 348 HG22 ILE 44 HG22 ILE 44 -12.475 -7.869 12.463 349 HG23 ILE 44 HG23 ILE 44 -13.646 -6.621 12.893 350 HD11 ILE 44 HD11 ILE 44 -15.557 -9.164 10.108 351 HD12 ILE 44 HD12 ILE 44 -14.380 -10.405 9.676 352 HD13 ILE 44 HD13 ILE 44 -13.856 -8.739 9.919 353 H ALA 45 HN ALA 45 -16.508 -7.774 14.714 354 HA ALA 45 HA ALA 45 -15.593 -5.278 15.534 355 HB1 ALA 45 HB1 ALA 45 -17.933 -5.761 14.996 356 HB2 ALA 45 HB2 ALA 45 -17.780 -5.000 16.581 357 HB3 ALA 45 HB3 ALA 45 -18.067 -6.736 16.459 358 H THR 46 HN THR 46 -16.577 -8.017 17.599 359 HA THR 46 HA THR 46 -15.878 -6.781 20.018 360 HB THR 46 HB THR 46 -16.077 -9.737 19.406 361 HG1 THR 46 HG1 THR 46 -17.925 -7.706 19.655 362 HG21 THR 46 HG21 THR 46 -14.951 -9.269 21.546 363 HG22 THR 46 HG22 THR 46 -16.541 -9.993 21.792 364 HG23 THR 46 HG23 THR 46 -16.311 -8.262 22.035 365 H ALA 47 HN ALA 47 -14.018 -8.867 17.842 366 HA ALA 47 HA ALA 47 -11.853 -9.341 19.586 367 HB1 ALA 47 HB1 ALA 47 -11.823 -9.331 16.575 368 HB2 ALA 47 HB2 ALA 47 -12.305 -10.693 17.587 369 HB3 ALA 47 HB3 ALA 47 -10.644 -10.101 17.636 370 H THR 48 HN THR 48 -12.564 -6.675 17.415 371 HA THR 48 HA THR 48 -9.910 -5.539 17.881 372 HB THR 48 HB THR 48 -10.764 -3.710 16.316 373 HG1 THR 48 HG1 THR 48 -12.728 -5.662 15.649 374 HG21 THR 48 HG21 THR 48 -10.587 -6.538 15.271 375 HG22 THR 48 HG22 THR 48 -9.223 -5.462 15.586 376 HG23 THR 48 HG23 THR 48 -10.380 -5.070 14.313 377 H GLY 49 HN GLY 49 -12.950 -5.452 19.286 378 HA2 GLY 49 HA2 GLY 49 -13.646 -4.204 21.118 379 HA3 GLY 49 HA1 GLY 49 -12.216 -3.195 20.935 380 H MET 50 HN MET 50 -14.407 -3.826 18.304 381 HA MET 50 HA MET 50 -15.393 -1.051 18.497 382 HB2 MET 50 HB2 MET 50 -14.888 -2.747 16.038 383 HB3 MET 50 HB1 MET 50 -15.729 -1.203 16.008 384 HG2 MET 50 HG2 MET 50 -13.687 -0.143 16.949 385 HG3 MET 50 HG1 MET 50 -12.861 -1.689 16.789 386 HE1 MET 50 HE1 MET 50 -12.747 -2.191 12.916 387 HE2 MET 50 HE2 MET 50 -13.999 -2.803 13.999 388 HE3 MET 50 HE3 MET 50 -12.305 -2.846 14.494 389 H ASN 51 HN ASN 51 -17.576 -0.809 17.356 390 HA ASN 51 HA ASN 51 -19.300 -3.001 18.227 391 HB2 ASN 51 HB2 ASN 51 -19.855 -0.136 17.461 392 HB3 ASN 51 HB1 ASN 51 -21.145 -1.314 17.687 393 HD21 ASN 51 HD21 ASN 51 -21.608 -2.068 19.732 394 HD22 ASN 51 HD22 ASN 51 -20.983 -1.316 21.162 395 H LEU 52 HN LEU 52 -21.197 -3.509 16.785 396 HA LEU 52 HA LEU 52 -20.361 -4.571 14.368 397 HB2 LEU 52 HB2 LEU 52 -23.142 -3.759 15.216 398 HB3 LEU 52 HB1 LEU 52 -22.787 -4.752 13.816 399 HG LEU 52 HG LEU 52 -22.179 -5.497 16.677 400 HD11 LEU 52 HD11 LEU 52 -24.307 -6.508 14.798 401 HD12 LEU 52 HD12 LEU 52 -24.573 -5.483 16.208 402 HD13 LEU 52 HD13 LEU 52 -23.969 -7.128 16.415 403 HD21 LEU 52 HD21 LEU 52 -21.625 -7.684 15.768 404 HD22 LEU 52 HD22 LEU 52 -20.587 -6.439 15.071 405 HD23 LEU 52 HD23 LEU 52 -21.930 -7.095 14.134 406 H THR 53 HN THR 53 -21.987 -1.510 15.006 407 HA THR 53 HA THR 53 -22.355 -0.598 12.407 408 HB THR 53 HB THR 53 -22.063 1.712 13.545 409 HG1 THR 53 HG1 THR 53 -22.003 1.622 15.809 410 HG21 THR 53 HG21 THR 53 -24.239 1.490 14.663 411 HG22 THR 53 HG22 THR 53 -24.100 -0.266 14.583 412 HG23 THR 53 HG23 THR 53 -24.237 0.676 13.099 413 H THR 54 HN THR 54 -19.627 0.080 14.595 414 HA THR 54 HA THR 54 -18.105 1.560 12.755 415 HB THR 54 HB THR 54 -16.891 -0.052 14.991 416 HG1 THR 54 HG1 THR 54 -18.488 2.317 15.146 417 HG21 THR 54 HG21 THR 54 -15.384 1.261 13.568 418 HG22 THR 54 HG22 THR 54 -15.450 1.915 15.205 419 HG23 THR 54 HG23 THR 54 -16.335 2.710 13.903 420 H ALA 55 HN ALA 55 -18.078 -1.877 13.603 421 HA ALA 55 HA ALA 55 -15.793 -2.570 12.099 422 HB1 ALA 55 HB1 ALA 55 -16.699 -3.979 13.889 423 HB2 ALA 55 HB2 ALA 55 -16.515 -4.871 12.380 424 HB3 ALA 55 HB3 ALA 55 -18.112 -4.324 12.891 425 H SER 56 HN SER 56 -19.269 -2.832 11.341 426 HA SER 56 HA SER 56 -18.937 -4.041 8.830 427 HB2 SER 56 HB2 SER 56 -21.073 -3.996 10.079 428 HB3 SER 56 HB1 SER 56 -21.209 -2.268 9.754 429 HG SER 56 HG SER 56 -20.798 -3.387 7.427 430 H ALA 57 HN ALA 57 -19.077 -0.634 9.770 431 HA ALA 57 HA ALA 57 -19.162 0.445 7.165 432 HB1 ALA 57 HB1 ALA 57 -19.690 1.775 9.138 433 HB2 ALA 57 HB2 ALA 57 -18.400 2.529 8.202 434 HB3 ALA 57 HB3 ALA 57 -18.018 1.651 9.684 435 H ASN 58 HN ASN 58 -16.493 -0.404 9.304 436 HA ASN 58 HA ASN 58 -14.446 0.497 7.539 437 HB2 ASN 58 HB2 ASN 58 -14.472 -1.221 10.005 438 HB3 ASN 58 HB1 ASN 58 -13.002 -1.040 9.052 439 HD21 ASN 58 HD21 ASN 58 -13.597 -0.169 11.779 440 HD22 ASN 58 HD22 ASN 58 -13.323 1.535 11.800 441 H LEU 59 HN LEU 59 -16.068 -2.585 8.048 442 HA LEU 59 HA LEU 59 -14.387 -4.137 6.386 443 HB2 LEU 59 HB2 LEU 59 -17.267 -4.469 7.205 444 HB3 LEU 59 HB1 LEU 59 -16.402 -5.660 6.252 445 HG LEU 59 HG LEU 59 -15.614 -4.773 9.030 446 HD11 LEU 59 HD11 LEU 59 -16.978 -7.288 8.082 447 HD12 LEU 59 HD12 LEU 59 -17.696 -6.017 9.073 448 HD13 LEU 59 HD13 LEU 59 -16.380 -7.000 9.716 449 HD21 LEU 59 HD21 LEU 59 -13.706 -5.487 7.720 450 HD22 LEU 59 HD22 LEU 59 -14.555 -6.956 7.237 451 HD23 LEU 59 HD23 LEU 59 -14.100 -6.714 8.924 452 H GLN 60 HN GLN 60 -17.201 -2.134 5.738 453 HA GLN 60 HA GLN 60 -17.550 -2.840 3.031 454 HB2 GLN 60 HB2 GLN 60 -19.217 -1.561 4.336 455 HB3 GLN 60 HB1 GLN 60 -18.112 -0.195 4.388 456 HG2 GLN 60 HG2 GLN 60 -18.204 -0.128 1.893 457 HG3 GLN 60 HG1 GLN 60 -19.474 -1.349 1.969 458 HE21 GLN 60 HE21 GLN 60 -20.988 0.032 1.038 459 HE22 GLN 60 HE22 GLN 60 -21.673 1.358 1.920 460 H ALA 61 HN ALA 61 -15.562 -0.393 4.628 461 HA ALA 61 HA ALA 61 -14.531 0.769 2.259 462 HB1 ALA 61 HB1 ALA 61 -13.323 0.679 5.019 463 HB2 ALA 61 HB2 ALA 61 -14.426 1.911 4.409 464 HB3 ALA 61 HB3 ALA 61 -12.818 1.741 3.706 465 H LEU 62 HN LEU 62 -13.384 -1.827 4.379 466 HA LEU 62 HA LEU 62 -11.033 -2.337 2.829 467 HB2 LEU 62 HB2 LEU 62 -12.421 -4.091 4.847 468 HB3 LEU 62 HB1 LEU 62 -10.866 -4.432 4.105 469 HG LEU 62 HG LEU 62 -11.463 -2.065 5.888 470 HD11 LEU 62 HD11 LEU 62 -11.471 -4.202 7.083 471 HD12 LEU 62 HD12 LEU 62 -10.080 -3.211 7.523 472 HD13 LEU 62 HD13 LEU 62 -9.880 -4.573 6.422 473 HD21 LEU 62 HD21 LEU 62 -9.742 -1.624 4.182 474 HD22 LEU 62 HD22 LEU 62 -8.852 -3.044 4.732 475 HD23 LEU 62 HD23 LEU 62 -9.070 -1.667 5.811 476 H LYS 63 HN LYS 63 -14.304 -3.058 2.289 477 HA LYS 63 HA LYS 63 -13.686 -5.264 0.562 478 HB2 LYS 63 HB2 LYS 63 -15.976 -4.773 1.545 479 HB3 LYS 63 HB1 LYS 63 -16.095 -3.447 0.395 480 HG2 LYS 63 HG2 LYS 63 -16.093 -4.913 -1.449 481 HG3 LYS 63 HG1 LYS 63 -15.581 -6.280 -0.457 482 HD2 LYS 63 HD2 LYS 63 -18.233 -4.850 -0.311 483 HD3 LYS 63 HD1 LYS 63 -17.943 -6.456 -0.982 484 HE2 LYS 63 HE2 LYS 63 -17.155 -7.196 1.247 485 HE3 LYS 63 HE1 LYS 63 -17.575 -5.610 1.889 486 HZ1 LYS 63 HZ1 LYS 63 -19.892 -6.065 1.105 487 HZ2 LYS 63 HZ2 LYS 63 -19.358 -7.048 2.379 488 HZ3 LYS 63 HZ3 LYS 63 -19.412 -7.665 0.798 489 H SER 64 HN SER 64 -14.876 -2.002 -0.132 490 HA SER 64 HA SER 64 -14.413 -1.892 -2.813 491 HB2 SER 64 HB2 SER 64 -14.114 0.425 -0.894 492 HB3 SER 64 HB1 SER 64 -14.537 0.518 -2.605 493 HG SER 64 HG SER 64 -16.182 0.257 -0.574 494 H GLY 65 HN GLY 65 -12.037 -1.028 -0.274 495 HA2 GLY 65 HA2 GLY 65 -9.978 -1.227 -2.370 496 HA3 GLY 65 HA1 GLY 65 -10.009 0.182 -1.325 497 H GLY 66 HN GLY 66 -10.892 -2.895 0.009 498 HA2 GLY 66 HA2 GLY 66 -8.308 -2.837 1.479 499 HA3 GLY 66 HA1 GLY 66 -9.834 -3.310 2.216 500 H LEU 67 HN LEU 67 -10.547 -4.710 -0.319 501 HA LEU 67 HA LEU 67 -10.134 -6.531 -1.606 502 HB2 LEU 67 HB2 LEU 67 -7.503 -6.911 -0.224 503 HB3 LEU 67 HB1 LEU 67 -7.978 -7.448 -1.823 504 HG LEU 67 HG LEU 67 -7.193 -4.699 -0.919 505 HD11 LEU 67 HD11 LEU 67 -5.725 -4.823 -2.873 506 HD12 LEU 67 HD12 LEU 67 -6.331 -6.444 -3.215 507 HD13 LEU 67 HD13 LEU 67 -5.432 -6.135 -1.729 508 HD21 LEU 67 HD21 LEU 67 -9.272 -4.341 -2.065 509 HD22 LEU 67 HD22 LEU 67 -8.754 -5.371 -3.408 510 HD23 LEU 67 HD23 LEU 67 -7.939 -3.834 -3.113 511 H VAL 68 HN VAL 68 -11.548 -6.668 0.823 512 HA VAL 68 HA VAL 68 -11.059 -9.504 1.461 513 HB VAL 68 HB VAL 68 -12.229 -9.150 3.609 514 HG11 VAL 68 HG11 VAL 68 -10.415 -7.952 4.746 515 HG12 VAL 68 HG12 VAL 68 -9.836 -7.364 3.187 516 HG13 VAL 68 HG13 VAL 68 -9.800 -9.089 3.548 517 HG21 VAL 68 HG21 VAL 68 -12.566 -6.855 4.433 518 HG22 VAL 68 HG22 VAL 68 -13.579 -7.228 3.037 519 HG23 VAL 68 HG23 VAL 68 -12.131 -6.239 2.837 520 H GLU 69 HN GLU 69 -12.854 -10.867 1.586 521 HA GLU 69 HA GLU 69 -15.216 -9.868 0.136 522 HB2 GLU 69 HB2 GLU 69 -14.013 -12.624 0.342 523 HB3 GLU 69 HB1 GLU 69 -15.611 -12.330 -0.323 524 HG2 GLU 69 HG2 GLU 69 -14.649 -10.945 -2.071 525 HG3 GLU 69 HG1 GLU 69 -13.040 -11.192 -1.390 526 H ALA 70 HN ALA 70 -17.183 -11.398 0.639 527 HA ALA 70 HA ALA 70 -17.356 -11.942 3.507 528 HB1 ALA 70 HB1 ALA 70 -19.329 -10.218 2.014 529 HB2 ALA 70 HB2 ALA 70 -18.174 -9.661 3.224 530 HB3 ALA 70 HB3 ALA 70 -19.481 -10.752 3.688 531 H ARG 71 HN ARG 71 -18.709 -13.582 4.045 532 HA ARG 71 HA ARG 71 -20.285 -14.817 1.882 533 HB2 ARG 71 HB2 ARG 71 -18.281 -16.161 2.252 534 HB3 ARG 71 HB1 ARG 71 -18.618 -16.229 3.975 535 HG2 ARG 71 HG2 ARG 71 -20.591 -17.555 3.585 536 HG3 ARG 71 HG1 ARG 71 -20.391 -17.398 1.838 537 HD2 ARG 71 HD2 ARG 71 -18.320 -18.631 1.928 538 HD3 ARG 71 HD1 ARG 71 -18.393 -18.689 3.688 539 HE ARG 71 HE ARG 71 -20.642 -19.931 3.124 540 HH11 ARG 71 HH11 ARG 71 -17.549 -20.235 1.518 541 HH12 ARG 71 HH12 ARG 71 -17.772 -21.908 1.100 542 HH21 ARG 71 HH21 ARG 71 -20.954 -22.130 2.587 543 HH22 ARG 71 HH22 ARG 71 -19.705 -22.996 1.746 544 H ARG 72 HN ARG 72 -22.337 -15.352 2.390 545 HA ARG 72 HA ARG 72 -23.294 -14.519 5.007 546 HB2 ARG 72 HB2 ARG 72 -24.493 -13.782 2.999 547 HB3 ARG 72 HB1 ARG 72 -24.802 -15.455 2.559 548 HG2 ARG 72 HG2 ARG 72 -26.763 -14.403 3.552 549 HG3 ARG 72 HG1 ARG 72 -26.180 -15.743 4.540 550 HD2 ARG 72 HD2 ARG 72 -25.169 -14.240 6.101 551 HD3 ARG 72 HD1 ARG 72 -25.489 -12.857 5.054 552 HE ARG 72 HE ARG 72 -27.959 -13.716 5.458 553 HH11 ARG 72 HH11 ARG 72 -25.351 -13.405 7.781 554 HH12 ARG 72 HH12 ARG 72 -26.404 -13.000 9.097 555 HH21 ARG 72 HH21 ARG 72 -29.340 -13.192 7.179 556 HH22 ARG 72 HH22 ARG 72 -28.685 -12.877 8.753 557 H GLU 73 HN GLU 73 -23.023 -15.996 6.551 558 HA GLU 73 HA GLU 73 -23.645 -18.801 5.924 559 HB2 GLU 73 HB2 GLU 73 -21.306 -18.111 6.745 560 HB3 GLU 73 HB1 GLU 73 -22.064 -17.836 8.304 561 HG2 GLU 73 HG2 GLU 73 -22.020 -20.457 6.825 562 HG3 GLU 73 HG1 GLU 73 -20.947 -20.013 8.146 563 H GLY 74 HN GLY 74 -25.861 -18.585 6.237 564 HA2 GLY 74 HA2 GLY 74 -27.802 -18.762 7.427 565 HA3 GLY 74 HA1 GLY 74 -26.785 -19.357 8.727 566 H THR 75 HN THR 75 -26.238 -18.032 10.400 567 HA THR 75 HA THR 75 -28.058 -15.785 10.752 568 HB THR 75 HB THR 75 -27.352 -15.925 13.144 569 HG1 THR 75 HG1 THR 75 -25.883 -18.192 12.194 570 HG21 THR 75 HG21 THR 75 -28.478 -18.056 13.612 571 HG22 THR 75 HG22 THR 75 -28.308 -18.511 11.916 572 HG23 THR 75 HG23 THR 75 -29.322 -17.138 12.364 573 H ARG 76 HN ARG 76 -24.748 -16.359 10.083 574 HA ARG 76 HA ARG 76 -24.003 -13.714 11.162 575 HB2 ARG 76 HB2 ARG 76 -22.126 -16.007 10.618 576 HB3 ARG 76 HB1 ARG 76 -21.788 -14.537 11.518 577 HG2 ARG 76 HG2 ARG 76 -23.353 -15.260 13.264 578 HG3 ARG 76 HG1 ARG 76 -23.652 -16.746 12.359 579 HD2 ARG 76 HD2 ARG 76 -21.180 -17.187 12.476 580 HD3 ARG 76 HD1 ARG 76 -21.066 -15.839 13.606 581 HE ARG 76 HE ARG 76 -23.027 -17.718 14.449 582 HH11 ARG 76 HH11 ARG 76 -19.580 -17.179 14.289 583 HH12 ARG 76 HH12 ARG 76 -19.208 -18.229 15.616 584 HH21 ARG 76 HH21 ARG 76 -22.560 -19.125 16.185 585 HH22 ARG 76 HH22 ARG 76 -20.915 -19.353 16.697 586 H GLN 77 HN GLN 77 -22.181 -12.665 10.019 587 HA GLN 77 HA GLN 77 -22.053 -13.367 7.161 588 HB2 GLN 77 HB2 GLN 77 -23.323 -11.306 7.377 589 HB3 GLN 77 HB1 GLN 77 -22.076 -10.602 8.396 590 HG2 GLN 77 HG2 GLN 77 -20.528 -10.564 6.543 591 HG3 GLN 77 HG1 GLN 77 -21.699 -11.391 5.515 592 HE21 GLN 77 HE21 GLN 77 -23.398 -10.261 4.651 593 HE22 GLN 77 HE22 GLN 77 -23.506 -8.530 4.715 594 H TYR 78 HN TYR 78 -20.087 -14.072 6.680 595 HA TYR 78 HA TYR 78 -17.901 -13.458 8.523 596 HB2 TYR 78 HB2 TYR 78 -18.276 -15.621 6.452 597 HB3 TYR 78 HB1 TYR 78 -16.748 -15.351 7.282 598 HD1 TYR 78 HD2 TYR 78 -20.355 -15.985 8.000 599 HD2 TYR 78 HD1 TYR 78 -16.323 -16.479 9.253 600 HE1 TYR 78 HE2 TYR 78 -21.110 -17.421 9.843 601 HE2 TYR 78 HE1 TYR 78 -17.069 -17.919 11.098 602 HH TYR 78 HH TYR 78 -20.224 -19.177 11.284 603 H TYR 79 HN TYR 79 -16.198 -12.266 7.977 604 HA TYR 79 HA TYR 79 -15.821 -11.589 5.135 605 HB2 TYR 79 HB2 TYR 79 -15.381 -10.036 7.650 606 HB3 TYR 79 HB1 TYR 79 -14.319 -9.730 6.280 607 HD1 TYR 79 HD2 TYR 79 -17.903 -9.808 7.278 608 HD2 TYR 79 HD1 TYR 79 -15.006 -8.353 4.528 609 HE1 TYR 79 HE2 TYR 79 -19.600 -8.336 6.278 610 HE2 TYR 79 HE1 TYR 79 -16.692 -6.877 3.519 611 HH TYR 79 HH TYR 79 -19.706 -6.254 4.975 612 H ARG 80 HN ARG 80 -13.700 -11.610 4.306 613 HA ARG 80 HA ARG 80 -11.514 -12.658 5.850 614 HB2 ARG 80 HB2 ARG 80 -11.257 -14.754 4.644 615 HB3 ARG 80 HB1 ARG 80 -12.829 -14.722 5.436 616 HG2 ARG 80 HG2 ARG 80 -13.863 -14.084 3.300 617 HG3 ARG 80 HG1 ARG 80 -12.283 -14.185 2.523 618 HD2 ARG 80 HD2 ARG 80 -12.150 -16.560 3.175 619 HD3 ARG 80 HD1 ARG 80 -13.771 -16.441 3.863 620 HE ARG 80 HE ARG 80 -13.365 -15.758 1.036 621 HH11 ARG 80 HH11 ARG 80 -14.626 -17.988 3.440 622 HH12 ARG 80 HH12 ARG 80 -15.689 -18.778 2.317 623 HH21 ARG 80 HH21 ARG 80 -14.774 -16.789 -0.433 624 HH22 ARG 80 HH22 ARG 80 -15.789 -18.094 0.121 625 H ILE 81 HN ILE 81 -9.583 -13.001 4.422 626 HA ILE 81 HA ILE 81 -9.199 -10.865 2.636 627 HB ILE 81 HB ILE 81 -7.616 -13.438 2.842 628 HG12 ILE 81 HG12 ILE 81 -7.743 -12.248 4.983 629 HG13 ILE 81 HG11 ILE 81 -6.118 -12.167 4.314 630 HG21 ILE 81 HG21 ILE 81 -5.772 -12.147 1.866 631 HG22 ILE 81 HG22 ILE 81 -6.854 -10.769 1.665 632 HG23 ILE 81 HG23 ILE 81 -7.148 -12.259 0.770 633 HD11 ILE 81 HD11 ILE 81 -6.781 -10.043 5.282 634 HD12 ILE 81 HD12 ILE 81 -8.179 -9.976 4.211 635 HD13 ILE 81 HD13 ILE 81 -6.551 -9.892 3.541 636 H ALA 82 HN ALA 82 -9.461 -10.673 0.465 637 HA ALA 82 HA ALA 82 -11.220 -12.417 -0.870 638 HB1 ALA 82 HB1 ALA 82 -9.402 -10.327 -2.062 639 HB2 ALA 82 HB2 ALA 82 -11.023 -10.043 -1.428 640 HB3 ALA 82 HB3 ALA 82 -10.797 -11.063 -2.848 641 H GLY 83 HN GLY 83 -7.819 -11.730 -1.730 642 HA2 GLY 83 HA2 GLY 83 -7.672 -14.489 -2.764 643 HA3 GLY 83 HA1 GLY 83 -6.976 -13.128 -3.630 644 H GLU 84 HN GLU 84 -5.453 -15.301 -3.005 645 HA GLU 84 HA GLU 84 -4.044 -15.033 -0.549 646 HB2 GLU 84 HB2 GLU 84 -4.209 -17.144 -1.833 647 HB3 GLU 84 HB1 GLU 84 -3.232 -16.431 -3.107 648 HG2 GLU 84 HG2 GLU 84 -1.921 -16.237 -0.542 649 HG3 GLU 84 HG1 GLU 84 -2.344 -17.903 -0.933 650 H ASP 85 HN ASP 85 -3.755 -13.647 -3.733 651 HA ASP 85 HA ASP 85 -1.164 -12.552 -3.501 652 HB2 ASP 85 HB2 ASP 85 -3.583 -11.651 -5.070 653 HB3 ASP 85 HB1 ASP 85 -2.033 -10.822 -5.159 654 H VAL 86 HN VAL 86 -4.314 -11.472 -2.405 655 HA VAL 86 HA VAL 86 -3.547 -8.911 -1.484 656 HB VAL 86 HB VAL 86 -5.745 -10.687 -0.398 657 HG11 VAL 86 HG11 VAL 86 -6.752 -8.582 0.371 658 HG12 VAL 86 HG12 VAL 86 -5.328 -7.706 -0.189 659 HG13 VAL 86 HG13 VAL 86 -5.184 -8.877 1.123 660 HG21 VAL 86 HG21 VAL 86 -7.238 -9.402 -1.882 661 HG22 VAL 86 HG22 VAL 86 -6.036 -10.336 -2.778 662 HG23 VAL 86 HG23 VAL 86 -5.826 -8.598 -2.572 663 H ALA 87 HN ALA 87 -3.724 -12.076 0.085 664 HA ALA 87 HA ALA 87 -2.934 -11.277 2.655 665 HB1 ALA 87 HB1 ALA 87 -2.408 -13.626 3.040 666 HB2 ALA 87 HB2 ALA 87 -2.473 -13.939 1.304 667 HB3 ALA 87 HB3 ALA 87 -3.934 -13.464 2.173 668 H ARG 88 HN ARG 88 -1.073 -12.301 -0.169 669 HA ARG 88 HA ARG 88 1.463 -12.228 1.068 670 HB2 ARG 88 HB2 ARG 88 0.433 -12.440 -1.673 671 HB3 ARG 88 HB1 ARG 88 2.011 -11.672 -1.550 672 HG2 ARG 88 HG2 ARG 88 2.851 -13.614 -0.310 673 HG3 ARG 88 HG1 ARG 88 1.270 -14.382 -0.465 674 HD2 ARG 88 HD2 ARG 88 2.807 -13.464 -2.871 675 HD3 ARG 88 HD1 ARG 88 3.114 -15.035 -2.134 676 HE ARG 88 HE ARG 88 0.835 -15.651 -2.635 677 HH11 ARG 88 HH11 ARG 88 1.990 -12.737 -4.226 678 HH12 ARG 88 HH12 ARG 88 0.814 -12.833 -5.504 679 HH21 ARG 88 HH21 ARG 88 -0.646 -15.798 -4.345 680 HH22 ARG 88 HH22 ARG 88 -0.665 -14.561 -5.580 681 H LEU 89 HN LEU 89 -0.537 -9.728 -0.355 682 HA LEU 89 HA LEU 89 1.447 -7.740 -0.624 683 HB2 LEU 89 HB2 LEU 89 -0.871 -7.676 -1.592 684 HB3 LEU 89 HB1 LEU 89 -1.481 -7.336 0.014 685 HG LEU 89 HG LEU 89 0.547 -5.518 -1.254 686 HD11 LEU 89 HD11 LEU 89 -1.253 -5.775 -2.883 687 HD12 LEU 89 HD12 LEU 89 -1.284 -4.172 -2.145 688 HD13 LEU 89 HD13 LEU 89 -2.440 -5.402 -1.633 689 HD21 LEU 89 HD21 LEU 89 -1.672 -5.046 0.741 690 HD22 LEU 89 HD22 LEU 89 -0.516 -3.844 0.170 691 HD23 LEU 89 HD23 LEU 89 0.040 -5.214 1.130 692 H PHE 90 HN PHE 90 -0.832 -8.442 2.018 693 HA PHE 90 HA PHE 90 0.202 -6.437 3.752 694 HB2 PHE 90 HB2 PHE 90 -2.090 -7.526 3.872 695 HB3 PHE 90 HB1 PHE 90 -1.294 -8.918 4.594 696 HD1 PHE 90 HD2 PHE 90 -1.696 -5.245 5.036 697 HD2 PHE 90 HD1 PHE 90 -1.024 -9.020 6.892 698 HE1 PHE 90 HE2 PHE 90 -1.879 -4.188 7.251 699 HE2 PHE 90 HE1 PHE 90 -1.204 -7.965 9.109 700 HZ PHE 90 HZ PHE 90 -1.631 -5.547 9.289 701 H ALA 91 HN ALA 91 0.972 -9.798 3.179 702 HA ALA 91 HA ALA 91 2.680 -10.106 5.435 703 HB1 ALA 91 HB1 ALA 91 1.677 -12.018 4.273 704 HB2 ALA 91 HB2 ALA 91 3.432 -12.148 4.362 705 HB3 ALA 91 HB3 ALA 91 2.660 -11.663 2.853 706 H LEU 92 HN LEU 92 3.123 -8.977 2.145 707 HA LEU 92 HA LEU 92 5.959 -9.043 2.147 708 HB2 LEU 92 HB2 LEU 92 4.527 -8.965 0.103 709 HB3 LEU 92 HB1 LEU 92 4.126 -7.304 0.486 710 HG LEU 92 HG LEU 92 7.003 -8.065 0.130 711 HD11 LEU 92 HD11 LEU 92 5.864 -9.017 -1.806 712 HD12 LEU 92 HD12 LEU 92 6.813 -7.602 -2.264 713 HD13 LEU 92 HD13 LEU 92 5.061 -7.474 -2.101 714 HD21 LEU 92 HD21 LEU 92 5.385 -5.576 -0.406 715 HD22 LEU 92 HD22 LEU 92 7.107 -5.754 -0.744 716 HD23 LEU 92 HD23 LEU 92 6.524 -5.833 0.918 717 H VAL 93 HN VAL 93 3.603 -6.424 2.763 718 HA VAL 93 HA VAL 93 5.564 -4.464 3.314 719 HB VAL 93 HB VAL 93 3.803 -3.162 4.407 720 HG11 VAL 93 HG11 VAL 93 2.838 -4.534 1.903 721 HG12 VAL 93 HG12 VAL 93 3.927 -3.146 1.971 722 HG13 VAL 93 HG13 VAL 93 2.257 -2.988 2.522 723 HG21 VAL 93 HG21 VAL 93 1.533 -4.023 4.631 724 HG22 VAL 93 HG22 VAL 93 2.663 -4.978 5.594 725 HG23 VAL 93 HG23 VAL 93 2.065 -5.602 4.056 726 H GLN 94 HN GLN 94 4.102 -6.969 5.243 727 HA GLN 94 HA GLN 94 5.091 -6.188 7.763 728 HB2 GLN 94 HB2 GLN 94 3.373 -7.910 7.516 729 HB3 GLN 94 HB1 GLN 94 4.507 -8.953 6.674 730 HG2 GLN 94 HG2 GLN 94 5.867 -9.102 8.704 731 HG3 GLN 94 HG1 GLN 94 4.714 -8.067 9.545 732 HE21 GLN 94 HE21 GLN 94 5.269 -11.205 8.157 733 HE22 GLN 94 HE22 GLN 94 3.921 -11.996 8.900 734 H VAL 95 HN VAL 95 6.476 -8.164 5.162 735 HA VAL 95 HA VAL 95 8.870 -8.880 6.444 736 HB VAL 95 HB VAL 95 8.388 -8.389 3.494 737 HG11 VAL 95 HG11 VAL 95 10.771 -8.318 4.030 738 HG12 VAL 95 HG12 VAL 95 10.364 -9.760 3.100 739 HG13 VAL 95 HG13 VAL 95 10.641 -9.879 4.838 740 HG21 VAL 95 HG21 VAL 95 8.354 -10.947 5.088 741 HG22 VAL 95 HG22 VAL 95 8.148 -10.812 3.343 742 HG23 VAL 95 HG23 VAL 95 6.945 -10.119 4.430 743 H VAL 96 HN VAL 96 8.042 -6.083 4.434 744 HA VAL 96 HA VAL 96 10.523 -4.815 4.414 745 HB VAL 96 HB VAL 96 7.806 -3.493 4.482 746 HG11 VAL 96 HG11 VAL 96 10.473 -2.455 3.525 747 HG12 VAL 96 HG12 VAL 96 9.581 -1.907 4.945 748 HG13 VAL 96 HG13 VAL 96 8.927 -1.629 3.330 749 HG21 VAL 96 HG21 VAL 96 7.958 -3.476 2.042 750 HG22 VAL 96 HG22 VAL 96 7.969 -5.121 2.678 751 HG23 VAL 96 HG23 VAL 96 9.471 -4.378 2.130 752 H ALA 97 HN ALA 97 7.827 -4.471 6.689 753 HA ALA 97 HA ALA 97 9.069 -2.515 8.303 754 HB1 ALA 97 HB1 ALA 97 6.646 -2.862 8.221 755 HB2 ALA 97 HB2 ALA 97 7.266 -2.921 9.872 756 HB3 ALA 97 HB3 ALA 97 6.848 -4.415 9.031 757 H ASP 98 HN ASP 98 8.728 -6.039 8.748 758 HA ASP 98 HA ASP 98 10.018 -6.112 11.265 759 HB2 ASP 98 HB2 ASP 98 9.130 -8.102 9.271 760 HB3 ASP 98 HB1 ASP 98 10.435 -8.622 10.329 761 H GLU 99 HN GLU 99 11.228 -6.926 8.022 762 HA GLU 99 HA GLU 99 13.779 -7.711 9.095 763 HB2 GLU 99 HB2 GLU 99 12.772 -8.954 7.264 764 HB3 GLU 99 HB1 GLU 99 12.769 -7.512 6.258 765 HG2 GLU 99 HG2 GLU 99 15.220 -7.479 6.320 766 HG3 GLU 99 HG1 GLU 99 15.200 -8.952 7.289 767 H HIS 100 HN HIS 100 12.608 -5.043 7.055 768 HA HIS 100 HA HIS 100 15.321 -4.199 6.529 769 HB2 HIS 100 HB2 HIS 100 12.666 -3.076 5.636 770 HB3 HIS 100 HB1 HIS 100 14.224 -2.397 5.168 771 HD1 HIS 100 HD1 HIS 100 15.589 -3.652 3.409 772 HD2 HIS 100 HD2 HIS 100 12.091 -5.622 4.495 773 HE1 HIS 100 HE1 HIS 100 15.294 -5.497 1.725 774 HE2 HIS 100 HE2 HIS 100 13.082 -6.550 2.301 775 H LEU 101 HN LEU 101 13.261 -3.710 9.040 776 HA LEU 101 HA LEU 101 14.253 -1.061 9.723 777 HB2 LEU 101 HB2 LEU 101 11.936 -1.750 10.285 778 HB3 LEU 101 HB1 LEU 101 12.583 -3.000 11.329 779 HG LEU 101 HG LEU 101 13.650 -1.208 12.710 780 HD11 LEU 101 HD11 LEU 101 11.975 0.601 10.977 781 HD12 LEU 101 HD12 LEU 101 13.738 0.554 11.044 782 HD13 LEU 101 HD13 LEU 101 12.814 1.081 12.451 783 HD21 LEU 101 HD21 LEU 101 10.656 -1.062 12.407 784 HD22 LEU 101 HD22 LEU 101 11.583 -0.565 13.825 785 HD23 LEU 101 HD23 LEU 101 11.544 -2.263 13.345 786 H GLU 102 HN GLU 102 15.475 -4.050 9.674 787 HA GLU 102 HA GLU 102 17.352 -5.003 10.507 788 HB2 GLU 102 HB2 GLU 102 17.481 -2.437 11.977 789 HB3 GLU 102 HB1 GLU 102 18.322 -3.795 12.704 790 HG2 GLU 102 HG2 GLU 102 19.846 -2.545 11.350 791 HG3 GLU 102 HG1 GLU 102 19.566 -4.118 10.610 792 H HIS 103 HN HIS 103 17.073 -6.834 11.443 793 HA HIS 103 HA HIS 103 15.589 -6.947 13.988 794 HB2 HIS 103 HB2 HIS 103 14.365 -7.794 11.870 795 HB3 HIS 103 HB1 HIS 103 15.499 -9.138 11.912 796 HD1 HIS 103 HD1 HIS 103 12.686 -7.595 13.882 797 HD2 HIS 103 HD2 HIS 103 14.872 -11.129 13.734 798 HE1 HIS 103 HE1 HIS 103 11.467 -9.209 15.377 799 HE2 HIS 103 HE2 HIS 103 12.700 -11.392 15.122 800 H HIS 104 HN HIS 104 17.087 -9.517 12.121 801 HA HIS 104 HA HIS 104 19.560 -9.444 13.599 802 HB2 HIS 104 HB2 HIS 104 17.551 -11.646 14.002 803 HB3 HIS 104 HB1 HIS 104 19.271 -12.005 14.070 804 HD1 HIS 104 HD1 HIS 104 20.632 -10.518 15.930 805 HD2 HIS 104 HD2 HIS 104 16.503 -10.820 16.359 806 HE1 HIS 104 HE1 HIS 104 20.144 -9.852 18.304 807 HE2 HIS 104 HE2 HIS 104 17.671 -10.239 18.599 808 H HIS 105 HN HIS 105 21.198 -10.208 12.346 809 HA HIS 105 HA HIS 105 20.399 -11.546 9.843 810 HB2 HIS 105 HB2 HIS 105 22.068 -9.193 10.316 811 HB3 HIS 105 HB1 HIS 105 22.841 -10.395 9.289 812 HD1 HIS 105 HD1 HIS 105 22.538 -9.700 6.942 813 HD2 HIS 105 HD2 HIS 105 19.123 -9.008 9.224 814 HE1 HIS 105 HE1 HIS 105 20.807 -8.829 5.339 815 HE2 HIS 105 HE2 HIS 105 18.837 -8.202 6.779 816 H HIS 106 HN HIS 106 22.977 -11.209 12.248 817 HA HIS 106 HA HIS 106 24.743 -12.521 12.797 818 HB2 HIS 106 HB2 HIS 106 22.767 -14.606 11.904 819 HB3 HIS 106 HB1 HIS 106 24.392 -15.059 12.403 820 HD1 HIS 106 HD1 HIS 106 21.069 -14.295 13.718 821 HD2 HIS 106 HD2 HIS 106 24.972 -14.341 15.163 822 HE1 HIS 106 HE1 HIS 106 20.869 -14.298 16.223 823 HE2 HIS 106 HE2 HIS 106 23.240 -14.138 17.069 824 H HIS 107 HN HIS 107 25.888 -11.388 11.176 825 HA HIS 107 HA HIS 107 27.342 -11.200 9.465 826 HB2 HIS 107 HB2 HIS 107 26.843 -14.159 9.114 827 HB3 HIS 107 HB1 HIS 107 27.974 -13.241 8.123 828 HD1 HIS 107 HD1 HIS 107 28.151 -15.486 10.727 829 HD2 HIS 107 HD2 HIS 107 29.727 -11.666 10.218 830 HE1 HIS 107 HE1 HIS 107 30.071 -15.318 12.344 831 HE2 HIS 107 HE2 HIS 107 31.113 -13.063 11.900 832 H HIS 108 HN HIS 108 27.409 -11.676 6.929 833 HA HIS 108 HA HIS 108 26.484 -11.173 4.920 834 HB2 HIS 108 HB2 HIS 108 23.840 -12.050 6.103 835 HB3 HIS 108 HB1 HIS 108 24.217 -11.873 4.394 836 HD1 HIS 108 HD1 HIS 108 26.302 -13.560 3.615 837 HD2 HIS 108 HD2 HIS 108 24.081 -14.582 6.979 838 HE1 HIS 108 HE1 HIS 108 26.712 -16.012 3.980 839 HE2 HIS 108 HE2 HIS 108 25.181 -16.645 5.878 840 H1 MET 1 HT1 MET 1 4.294 -10.514 34.681 841 H2 MET 1 HT2 MET 1 3.865 -10.122 33.089 842 H3 MET 1 HT3 MET 1 4.796 -9.042 34.002 843 HA MET 1 HA MET 1 6.611 -10.609 34.078 844 HB2 MET 1 HB2 MET 1 4.788 -12.258 32.317 845 HB3 MET 1 HB1 MET 1 6.504 -12.575 32.523 846 HG2 MET 1 HG2 MET 1 6.177 -13.003 34.879 847 HG3 MET 1 HG1 MET 1 4.469 -12.591 34.741 848 HE1 MET 1 HE1 MET 1 6.653 -14.623 32.170 849 HE2 MET 1 HE2 MET 1 6.383 -16.276 32.720 850 HE3 MET 1 HE3 MET 1 7.281 -15.144 33.732 851 H ALA 2 HN ALA 2 4.541 -10.069 31.220 852 HA ALA 2 HA ALA 2 6.787 -9.524 29.522 853 HB1 ALA 2 HB1 ALA 2 4.684 -10.471 28.664 854 HB2 ALA 2 HB2 ALA 2 5.144 -8.988 27.827 855 HB3 ALA 2 HB3 ALA 2 3.864 -8.955 29.041 856 H GLY 3 HN GLY 3 4.132 -7.485 30.755 857 HA2 GLY 3 HA2 GLY 3 4.198 -5.265 31.423 858 HA3 GLY 3 HA1 GLY 3 5.926 -5.250 31.093 859 H GLN 4 HN GLN 4 6.597 -4.175 29.344 860 HA GLN 4 HA GLN 4 4.553 -3.408 27.380 861 HB2 GLN 4 HB2 GLN 4 7.122 -1.996 28.114 862 HB3 GLN 4 HB1 GLN 4 6.007 -1.471 26.860 863 HG2 GLN 4 HG2 GLN 4 4.252 -1.232 28.598 864 HG3 GLN 4 HG1 GLN 4 5.465 -1.622 29.817 865 HE21 GLN 4 HE21 GLN 4 7.114 -0.130 30.251 866 HE22 GLN 4 HE22 GLN 4 6.988 1.528 29.765 867 H SER 5 HN SER 5 4.687 -4.414 25.511 868 HA SER 5 HA SER 5 7.246 -4.630 24.182 869 HB2 SER 5 HB2 SER 5 5.543 -7.099 24.641 870 HB3 SER 5 HB1 SER 5 6.987 -7.021 23.633 871 HG SER 5 HG SER 5 7.524 -6.050 26.087 872 H ASP 6 HN ASP 6 4.322 -6.466 23.448 873 HA ASP 6 HA ASP 6 2.863 -6.388 21.702 874 HB2 ASP 6 HB2 ASP 6 3.008 -3.423 22.292 875 HB3 ASP 6 HB1 ASP 6 1.717 -4.233 21.408 876 H ARG 7 HN ARG 7 5.126 -6.857 20.569 877 HA ARG 7 HA ARG 7 6.350 -4.830 19.065 878 HB2 ARG 7 HB2 ARG 7 6.438 -7.831 18.840 879 HB3 ARG 7 HB1 ARG 7 7.419 -6.767 17.839 880 HG2 ARG 7 HG2 ARG 7 8.511 -5.866 19.800 881 HG3 ARG 7 HG1 ARG 7 7.467 -6.823 20.850 882 HD2 ARG 7 HD2 ARG 7 9.301 -8.036 18.797 883 HD3 ARG 7 HD1 ARG 7 9.783 -7.744 20.468 884 HE ARG 7 HE ARG 7 7.969 -9.274 21.131 885 HH11 ARG 7 HH11 ARG 7 9.193 -9.407 17.853 886 HH12 ARG 7 HH12 ARG 7 8.698 -11.051 17.591 887 HH21 ARG 7 HH21 ARG 7 7.320 -11.439 20.803 888 HH22 ARG 7 HH22 ARG 7 7.604 -12.202 19.268 889 H LYS 8 HN LYS 8 3.502 -6.668 18.379 890 HA LYS 8 HA LYS 8 3.579 -6.391 15.548 891 HB2 LYS 8 HB2 LYS 8 2.124 -8.047 16.581 892 HB3 LYS 8 HB1 LYS 8 1.217 -6.779 17.397 893 HG2 LYS 8 HG2 LYS 8 0.545 -5.897 15.176 894 HG3 LYS 8 HG1 LYS 8 1.353 -7.271 14.425 895 HD2 LYS 8 HD2 LYS 8 -0.827 -7.575 16.476 896 HD3 LYS 8 HD1 LYS 8 -1.146 -7.482 14.744 897 HE2 LYS 8 HE2 LYS 8 0.682 -9.510 16.014 898 HE3 LYS 8 HE1 LYS 8 -1.021 -9.803 15.669 899 HZ1 LYS 8 HZ1 LYS 8 -0.567 -9.385 13.317 900 HZ2 LYS 8 HZ2 LYS 8 0.364 -10.675 13.911 901 HZ3 LYS 8 HZ3 LYS 8 1.082 -9.164 13.662 902 H ALA 9 HN ALA 9 2.667 -4.263 18.151 903 HA ALA 9 HA ALA 9 0.955 -2.519 16.760 904 HB1 ALA 9 HB1 ALA 9 1.484 -0.885 18.517 905 HB2 ALA 9 HB2 ALA 9 2.798 -1.923 19.074 906 HB3 ALA 9 HB3 ALA 9 1.129 -2.481 19.180 907 H ALA 10 HN ALA 10 4.458 -2.578 17.122 908 HA ALA 10 HA ALA 10 4.998 -0.146 15.794 909 HB1 ALA 10 HB1 ALA 10 7.294 -0.959 15.639 910 HB2 ALA 10 HB2 ALA 10 6.758 -2.579 16.088 911 HB3 ALA 10 HB3 ALA 10 6.626 -1.254 17.244 912 H LEU 11 HN LEU 11 4.433 -3.408 14.696 913 HA LEU 11 HA LEU 11 5.378 -3.144 12.050 914 HB2 LEU 11 HB2 LEU 11 4.888 -5.320 13.033 915 HB3 LEU 11 HB1 LEU 11 3.195 -4.894 13.196 916 HG LEU 11 HG LEU 11 3.190 -4.659 10.642 917 HD11 LEU 11 HD11 LEU 11 5.727 -6.239 11.009 918 HD12 LEU 11 HD12 LEU 11 5.580 -4.635 10.289 919 HD13 LEU 11 HD13 LEU 11 4.862 -6.031 9.485 920 HD21 LEU 11 HD21 LEU 11 3.571 -7.359 11.923 921 HD22 LEU 11 HD22 LEU 11 2.829 -7.064 10.352 922 HD23 LEU 11 HD23 LEU 11 2.061 -6.455 11.818 923 H LEU 12 HN LEU 12 2.133 -2.850 13.444 924 HA LEU 12 HA LEU 12 0.814 -2.224 11.049 925 HB2 LEU 12 HB2 LEU 12 0.037 -1.565 13.892 926 HB3 LEU 12 HB1 LEU 12 -1.040 -1.503 12.508 927 HG LEU 12 HG LEU 12 0.332 -4.011 13.488 928 HD11 LEU 12 HD11 LEU 12 -1.303 -3.196 15.117 929 HD12 LEU 12 HD12 LEU 12 -1.839 -4.685 14.340 930 HD13 LEU 12 HD13 LEU 12 -2.529 -3.136 13.849 931 HD21 LEU 12 HD21 LEU 12 -1.854 -3.598 11.451 932 HD22 LEU 12 HD22 LEU 12 -1.216 -5.154 11.986 933 HD23 LEU 12 HD23 LEU 12 -0.179 -4.035 11.101 934 H ASP 13 HN ASP 13 2.369 -0.179 13.464 935 HA ASP 13 HA ASP 13 1.477 2.290 12.381 936 HB2 ASP 13 HB2 ASP 13 3.575 1.473 14.321 937 HB3 ASP 13 HB1 ASP 13 3.758 3.049 13.558 938 H GLN 14 HN GLN 14 4.410 0.368 11.892 939 HA GLN 14 HA GLN 14 5.664 2.303 10.237 940 HB2 GLN 14 HB2 GLN 14 6.923 0.607 11.500 941 HB3 GLN 14 HB1 GLN 14 6.233 -0.653 10.485 942 HG2 GLN 14 HG2 GLN 14 7.380 0.153 8.567 943 HG3 GLN 14 HG1 GLN 14 7.903 1.606 9.418 944 HE21 GLN 14 HE21 GLN 14 7.902 -1.505 10.964 945 HE22 GLN 14 HE22 GLN 14 9.617 -1.719 10.992 946 H VAL 15 HN VAL 15 3.692 -0.575 9.537 947 HA VAL 15 HA VAL 15 4.113 -0.444 6.727 948 HB VAL 15 HB VAL 15 2.196 -1.946 6.481 949 HG11 VAL 15 HG11 VAL 15 4.031 -2.685 8.754 950 HG12 VAL 15 HG12 VAL 15 4.343 -2.914 7.035 951 HG13 VAL 15 HG13 VAL 15 3.054 -3.819 7.826 952 HG21 VAL 15 HG21 VAL 15 0.950 -2.741 8.428 953 HG22 VAL 15 HG22 VAL 15 0.719 -1.009 8.184 954 HG23 VAL 15 HG23 VAL 15 1.804 -1.586 9.449 955 H ALA 16 HN ALA 16 1.842 1.096 8.906 956 HA ALA 16 HA ALA 16 0.145 2.199 6.933 957 HB1 ALA 16 HB1 ALA 16 0.820 3.241 9.684 958 HB2 ALA 16 HB2 ALA 16 -0.498 2.144 9.275 959 HB3 ALA 16 HB3 ALA 16 -0.515 3.803 8.675 960 H ARG 17 HN ARG 17 3.129 3.314 8.446 961 HA ARG 17 HA ARG 17 3.319 5.852 7.297 962 HB2 ARG 17 HB2 ARG 17 4.804 5.241 9.063 963 HB3 ARG 17 HB1 ARG 17 5.427 3.874 8.155 964 HG2 ARG 17 HG2 ARG 17 6.567 5.340 6.627 965 HG3 ARG 17 HG1 ARG 17 5.834 6.757 7.383 966 HD2 ARG 17 HD2 ARG 17 7.046 6.432 9.386 967 HD3 ARG 17 HD1 ARG 17 7.543 4.811 8.910 968 HE ARG 17 HE ARG 17 8.655 6.347 7.000 969 HH11 ARG 17 HH11 ARG 17 8.674 6.598 10.501 970 HH12 ARG 17 HH12 ARG 17 10.284 7.261 10.563 971 HH21 ARG 17 HH21 ARG 17 10.754 7.211 7.084 972 HH22 ARG 17 HH22 ARG 17 11.457 7.636 8.617 973 H VAL 18 HN VAL 18 4.522 2.738 6.097 974 HA VAL 18 HA VAL 18 5.600 3.661 3.678 975 HB VAL 18 HB VAL 18 4.355 0.959 4.246 976 HG11 VAL 18 HG11 VAL 18 6.307 1.813 2.110 977 HG12 VAL 18 HG12 VAL 18 4.626 1.338 1.865 978 HG13 VAL 18 HG13 VAL 18 5.802 0.154 2.433 979 HG21 VAL 18 HG21 VAL 18 6.118 1.509 5.838 980 HG22 VAL 18 HG22 VAL 18 7.218 1.875 4.508 981 HG23 VAL 18 HG23 VAL 18 6.634 0.226 4.742 982 H GLY 19 HN GLY 19 2.363 2.470 4.483 983 HA2 GLY 19 HA2 GLY 19 1.269 2.585 1.896 984 HA3 GLY 19 HA1 GLY 19 0.355 2.638 3.396 985 H LYS 20 HN LYS 20 1.267 4.996 4.506 986 HA LYS 20 HA LYS 20 -0.356 6.880 3.173 987 HB2 LYS 20 HB2 LYS 20 1.680 7.283 5.374 988 HB3 LYS 20 HB1 LYS 20 0.535 8.506 4.841 989 HG2 LYS 20 HG2 LYS 20 -1.321 7.086 5.508 990 HG3 LYS 20 HG1 LYS 20 -0.193 5.825 6.003 991 HD2 LYS 20 HD2 LYS 20 -0.931 7.022 7.952 992 HD3 LYS 20 HD1 LYS 20 0.766 7.405 7.659 993 HE2 LYS 20 HE2 LYS 20 0.191 9.527 6.712 994 HE3 LYS 20 HE1 LYS 20 -1.527 9.129 6.740 995 HZ1 LYS 20 HZ1 LYS 20 -0.904 10.594 8.562 996 HZ2 LYS 20 HZ2 LYS 20 0.200 9.441 9.140 997 HZ3 LYS 20 HZ3 LYS 20 -1.463 9.101 9.142 998 H ALA 21 HN ALA 21 3.045 6.175 2.944 999 HA ALA 21 HA ALA 21 3.751 8.610 1.618 1000 HB1 ALA 21 HB1 ALA 21 5.166 5.947 1.623 1001 HB2 ALA 21 HB2 ALA 21 5.425 7.254 2.777 1002 HB3 ALA 21 HB3 ALA 21 5.848 7.479 1.080 1003 H LEU 22 HN LEU 22 2.739 5.399 0.586 1004 HA LEU 22 HA LEU 22 3.217 5.930 -2.208 1005 HB2 LEU 22 HB2 LEU 22 3.508 3.694 -1.245 1006 HB3 LEU 22 HB1 LEU 22 1.810 3.642 -0.825 1007 HG LEU 22 HG LEU 22 2.534 3.996 -3.702 1008 HD11 LEU 22 HD11 LEU 22 2.644 1.370 -2.222 1009 HD12 LEU 22 HD12 LEU 22 4.015 2.206 -2.953 1010 HD13 LEU 22 HD13 LEU 22 2.721 1.572 -3.971 1011 HD21 LEU 22 HD21 LEU 22 0.188 4.053 -3.011 1012 HD22 LEU 22 HD22 LEU 22 0.364 2.468 -2.259 1013 HD23 LEU 22 HD23 LEU 22 0.519 2.636 -4.008 1014 H ALA 23 HN ALA 23 0.458 5.901 -0.039 1015 HA ALA 23 HA ALA 23 -1.570 5.991 -2.002 1016 HB1 ALA 23 HB1 ALA 23 -1.664 7.012 0.835 1017 HB2 ALA 23 HB2 ALA 23 -1.988 5.353 0.333 1018 HB3 ALA 23 HB3 ALA 23 -3.051 6.656 -0.196 1019 H ASN 24 HN ASN 24 -1.297 7.499 -3.537 1020 HA ASN 24 HA ASN 24 -1.964 10.208 -2.952 1021 HB2 ASN 24 HB2 ASN 24 0.404 10.307 -2.337 1022 HB3 ASN 24 HB1 ASN 24 0.852 9.616 -3.891 1023 HD21 ASN 24 HD21 ASN 24 -0.267 12.438 -2.223 1024 HD22 ASN 24 HD22 ASN 24 0.003 13.561 -3.515 1025 H GLY 25 HN GLY 25 -0.480 7.993 -5.277 1026 HA2 GLY 25 HA2 GLY 25 -1.540 7.389 -7.319 1027 HA3 GLY 25 HA1 GLY 25 -2.426 8.906 -7.274 1028 H ARG 26 HN ARG 26 -0.711 10.850 -7.155 1029 HA ARG 26 HA ARG 26 0.445 10.867 -9.748 1030 HB2 ARG 26 HB2 ARG 26 0.574 12.824 -7.457 1031 HB3 ARG 26 HB1 ARG 26 1.336 13.124 -9.013 1032 HG2 ARG 26 HG2 ARG 26 -0.749 13.126 -10.135 1033 HG3 ARG 26 HG1 ARG 26 -1.591 12.521 -8.708 1034 HD2 ARG 26 HD2 ARG 26 -1.212 14.583 -7.542 1035 HD3 ARG 26 HD1 ARG 26 -0.172 15.177 -8.837 1036 HE ARG 26 HE ARG 26 -2.055 15.588 -10.155 1037 HH11 ARG 26 HH11 ARG 26 -2.945 14.209 -7.062 1038 HH12 ARG 26 HH12 ARG 26 -4.637 14.574 -7.244 1039 HH21 ARG 26 HH21 ARG 26 -4.246 16.101 -10.380 1040 HH22 ARG 26 HH22 ARG 26 -5.376 15.662 -9.136 1041 H ARG 27 HN ARG 27 1.704 10.155 -6.602 1042 HA ARG 27 HA ARG 27 4.465 10.499 -7.281 1043 HB2 ARG 27 HB2 ARG 27 3.188 8.934 -5.029 1044 HB3 ARG 27 HB1 ARG 27 4.904 9.298 -5.162 1045 HG2 ARG 27 HG2 ARG 27 4.401 11.687 -5.045 1046 HG3 ARG 27 HG1 ARG 27 2.686 11.307 -4.881 1047 HD2 ARG 27 HD2 ARG 27 3.193 10.061 -2.814 1048 HD3 ARG 27 HD1 ARG 27 4.885 10.537 -2.968 1049 HE ARG 27 HE ARG 27 3.692 12.911 -3.005 1050 HH11 ARG 27 HH11 ARG 27 3.189 10.161 -0.891 1051 HH12 ARG 27 HH12 ARG 27 2.660 11.135 0.444 1052 HH21 ARG 27 HH21 ARG 27 2.991 14.186 -1.258 1053 HH22 ARG 27 HH22 ARG 27 2.566 13.427 0.252 1054 H LEU 28 HN LEU 28 2.146 8.119 -7.960 1055 HA LEU 28 HA LEU 28 3.881 5.848 -7.985 1056 HB2 LEU 28 HB2 LEU 28 1.208 6.255 -9.332 1057 HB3 LEU 28 HB1 LEU 28 2.027 4.717 -9.126 1058 HG LEU 28 HG LEU 28 1.019 6.461 -6.874 1059 HD11 LEU 28 HD11 LEU 28 -0.078 3.922 -8.065 1060 HD12 LEU 28 HD12 LEU 28 -0.828 5.518 -8.099 1061 HD13 LEU 28 HD13 LEU 28 -0.642 4.662 -6.569 1062 HD21 LEU 28 HD21 LEU 28 2.264 3.713 -6.888 1063 HD22 LEU 28 HD22 LEU 28 1.489 4.462 -5.491 1064 HD23 LEU 28 HD23 LEU 28 2.944 5.180 -6.182 1065 H GLN 29 HN GLN 29 3.114 8.393 -10.168 1066 HA GLN 29 HA GLN 29 4.006 7.276 -12.589 1067 HB2 GLN 29 HB2 GLN 29 4.031 10.124 -11.573 1068 HB3 GLN 29 HB1 GLN 29 4.459 9.678 -13.219 1069 HG2 GLN 29 HG2 GLN 29 2.256 8.855 -13.640 1070 HG3 GLN 29 HG1 GLN 29 1.802 9.071 -11.951 1071 HE21 GLN 29 HE21 GLN 29 3.762 11.405 -13.624 1072 HE22 GLN 29 HE22 GLN 29 2.563 12.645 -13.713 1073 H ILE 30 HN ILE 30 5.674 8.667 -9.859 1074 HA ILE 30 HA ILE 30 8.230 8.845 -11.097 1075 HB ILE 30 HB ILE 30 7.578 8.632 -8.150 1076 HG12 ILE 30 HG12 ILE 30 7.993 11.078 -9.890 1077 HG13 ILE 30 HG11 ILE 30 6.449 10.538 -9.240 1078 HG21 ILE 30 HG21 ILE 30 9.776 9.744 -7.856 1079 HG22 ILE 30 HG22 ILE 30 10.061 9.563 -9.589 1080 HG23 ILE 30 HG23 ILE 30 9.899 8.134 -8.568 1081 HD11 ILE 30 HD11 ILE 30 7.288 10.912 -6.971 1082 HD12 ILE 30 HD12 ILE 30 7.332 12.379 -7.946 1083 HD13 ILE 30 HD13 ILE 30 8.818 11.480 -7.640 1084 H LEU 31 HN LEU 31 6.623 6.431 -9.064 1085 HA LEU 31 HA LEU 31 8.796 4.643 -8.874 1086 HB2 LEU 31 HB2 LEU 31 5.826 4.110 -8.751 1087 HB3 LEU 31 HB1 LEU 31 7.064 2.950 -8.311 1088 HG LEU 31 HG LEU 31 6.593 5.598 -6.936 1089 HD11 LEU 31 HD11 LEU 31 4.781 4.022 -6.529 1090 HD12 LEU 31 HD12 LEU 31 5.764 4.243 -5.082 1091 HD13 LEU 31 HD13 LEU 31 5.949 2.787 -6.059 1092 HD21 LEU 31 HD21 LEU 31 8.451 3.313 -6.284 1093 HD22 LEU 31 HD22 LEU 31 8.155 4.714 -5.252 1094 HD23 LEU 31 HD23 LEU 31 8.923 4.923 -6.828 1095 H ASP 32 HN ASP 32 6.162 4.959 -11.194 1096 HA ASP 32 HA ASP 32 6.714 2.700 -12.767 1097 HB2 ASP 32 HB2 ASP 32 4.633 3.937 -12.985 1098 HB3 ASP 32 HB1 ASP 32 5.501 5.366 -13.527 1099 H LEU 33 HN LEU 33 8.105 5.908 -12.711 1100 HA LEU 33 HA LEU 33 9.700 5.538 -15.066 1101 HB2 LEU 33 HB2 LEU 33 9.020 7.766 -14.343 1102 HB3 LEU 33 HB1 LEU 33 9.885 7.559 -12.834 1103 HG LEU 33 HG LEU 33 12.010 7.413 -14.130 1104 HD11 LEU 33 HD11 LEU 33 10.259 8.241 -16.439 1105 HD12 LEU 33 HD12 LEU 33 11.088 6.694 -16.265 1106 HD13 LEU 33 HD13 LEU 33 12.022 8.180 -16.447 1107 HD21 LEU 33 HD21 LEU 33 10.380 9.925 -14.492 1108 HD22 LEU 33 HD22 LEU 33 12.138 9.813 -14.605 1109 HD23 LEU 33 HD23 LEU 33 11.330 9.490 -13.069 1110 H LEU 34 HN LEU 34 10.304 5.418 -11.564 1111 HA LEU 34 HA LEU 34 13.103 5.011 -11.818 1112 HB2 LEU 34 HB2 LEU 34 11.286 4.426 -9.482 1113 HB3 LEU 34 HB1 LEU 34 13.038 4.459 -9.418 1114 HG LEU 34 HG LEU 34 11.186 6.789 -9.898 1115 HD11 LEU 34 HD11 LEU 34 13.171 6.182 -7.714 1116 HD12 LEU 34 HD12 LEU 34 11.412 6.119 -7.577 1117 HD13 LEU 34 HD13 LEU 34 12.220 7.661 -7.861 1118 HD21 LEU 34 HD21 LEU 34 14.196 6.711 -10.023 1119 HD22 LEU 34 HD22 LEU 34 13.206 8.171 -10.044 1120 HD23 LEU 34 HD23 LEU 34 13.099 7.014 -11.370 1121 H ALA 35 HN ALA 35 10.440 2.892 -12.121 1122 HA ALA 35 HA ALA 35 11.760 0.453 -11.496 1123 HB1 ALA 35 HB1 ALA 35 9.937 -0.621 -12.719 1124 HB2 ALA 35 HB2 ALA 35 9.439 0.943 -13.365 1125 HB3 ALA 35 HB3 ALA 35 9.318 0.626 -11.635 1126 H GLN 36 HN GLN 36 11.928 2.647 -14.106 1127 HA GLN 36 HA GLN 36 13.002 0.695 -15.978 1128 HB2 GLN 36 HB2 GLN 36 12.441 3.653 -16.232 1129 HB3 GLN 36 HB1 GLN 36 13.083 2.654 -17.529 1130 HG2 GLN 36 HG2 GLN 36 11.098 1.385 -17.667 1131 HG3 GLN 36 HG1 GLN 36 10.484 2.048 -16.156 1132 HE21 GLN 36 HE21 GLN 36 9.555 4.066 -16.136 1133 HE22 GLN 36 HE22 GLN 36 9.135 4.919 -17.580 1134 H GLY 37 HN GLY 37 14.161 2.603 -13.497 1135 HA2 GLY 37 HA2 GLY 37 16.691 1.947 -13.361 1136 HA3 GLY 37 HA1 GLY 37 16.776 3.029 -14.744 1137 H GLU 38 HN GLU 38 18.336 3.889 -12.931 1138 HA GLU 38 HA GLU 38 16.939 5.581 -11.034 1139 HB2 GLU 38 HB2 GLU 38 19.180 6.244 -10.242 1140 HB3 GLU 38 HB1 GLU 38 18.949 4.505 -10.214 1141 HG2 GLU 38 HG2 GLU 38 20.410 5.968 -12.398 1142 HG3 GLU 38 HG1 GLU 38 21.193 5.271 -10.982 1143 H ARG 39 HN ARG 39 16.356 7.567 -11.415 1144 HA ARG 39 HA ARG 39 17.652 9.009 -13.632 1145 HB2 ARG 39 HB2 ARG 39 14.756 8.825 -12.870 1146 HB3 ARG 39 HB1 ARG 39 15.356 10.261 -13.684 1147 HG2 ARG 39 HG2 ARG 39 14.422 8.794 -15.319 1148 HG3 ARG 39 HG1 ARG 39 16.172 8.810 -15.528 1149 HD2 ARG 39 HD2 ARG 39 16.258 6.708 -14.167 1150 HD3 ARG 39 HD1 ARG 39 14.497 6.673 -14.228 1151 HE ARG 39 HE ARG 39 14.612 6.265 -16.566 1152 HH11 ARG 39 HH11 ARG 39 17.739 6.323 -14.997 1153 HH12 ARG 39 HH12 ARG 39 18.531 5.405 -16.242 1154 HH21 ARG 39 HH21 ARG 39 15.630 5.044 -18.198 1155 HH22 ARG 39 HH22 ARG 39 17.327 4.684 -18.077 1156 H ALA 40 HN ALA 40 18.233 11.098 -13.295 1157 HA ALA 40 HA ALA 40 18.526 12.008 -10.616 1158 HB1 ALA 40 HB1 ALA 40 20.136 12.626 -12.325 1159 HB2 ALA 40 HB2 ALA 40 19.402 14.072 -11.632 1160 HB3 ALA 40 HB3 ALA 40 18.887 13.497 -13.219 1161 H VAL 41 HN VAL 41 17.675 14.053 -9.781 1162 HA VAL 41 HA VAL 41 14.899 14.102 -9.709 1163 HB VAL 41 HB VAL 41 16.745 16.427 -9.117 1164 HG11 VAL 41 HG11 VAL 41 14.389 17.077 -9.284 1165 HG12 VAL 41 HG12 VAL 41 14.976 17.196 -7.626 1166 HG13 VAL 41 HG13 VAL 41 13.963 15.834 -8.107 1167 HG21 VAL 41 HG21 VAL 41 17.411 14.422 -7.899 1168 HG22 VAL 41 HG22 VAL 41 15.761 14.221 -7.308 1169 HG23 VAL 41 HG23 VAL 41 16.714 15.619 -6.806 1170 H GLU 42 HN GLU 42 17.131 16.029 -11.640 1171 HA GLU 42 HA GLU 42 15.296 17.769 -12.832 1172 HB2 GLU 42 HB2 GLU 42 17.703 16.644 -14.263 1173 HB3 GLU 42 HB1 GLU 42 16.958 18.219 -14.479 1174 HG2 GLU 42 HG2 GLU 42 18.839 18.750 -13.286 1175 HG3 GLU 42 HG1 GLU 42 17.641 18.588 -12.002 1176 H ALA 43 HN ALA 43 16.381 14.546 -13.813 1177 HA ALA 43 HA ALA 43 14.947 14.516 -16.271 1178 HB1 ALA 43 HB1 ALA 43 15.523 12.152 -16.361 1179 HB2 ALA 43 HB2 ALA 43 16.031 12.195 -14.673 1180 HB3 ALA 43 HB3 ALA 43 16.923 13.113 -15.886 1181 H ILE 44 HN ILE 44 14.318 13.226 -13.035 1182 HA ILE 44 HA ILE 44 11.922 11.879 -13.569 1183 HB ILE 44 HB ILE 44 12.754 13.306 -11.035 1184 HG12 ILE 44 HG12 ILE 44 12.971 10.397 -11.845 1185 HG13 ILE 44 HG11 ILE 44 14.310 11.538 -11.768 1186 HG21 ILE 44 HG21 ILE 44 10.352 12.945 -11.060 1187 HG22 ILE 44 HG22 ILE 44 11.118 11.852 -9.908 1188 HG23 ILE 44 HG23 ILE 44 10.591 11.250 -11.480 1189 HD11 ILE 44 HD11 ILE 44 13.929 11.777 -9.352 1190 HD12 ILE 44 HD12 ILE 44 14.312 10.122 -9.824 1191 HD13 ILE 44 HD13 ILE 44 12.647 10.570 -9.456 1192 H ALA 45 HN ALA 45 12.534 15.239 -12.668 1193 HA ALA 45 HA ALA 45 9.911 16.142 -12.458 1194 HB1 ALA 45 HB1 ALA 45 12.314 17.666 -13.461 1195 HB2 ALA 45 HB2 ALA 45 11.873 17.446 -11.767 1196 HB3 ALA 45 HB3 ALA 45 10.821 18.371 -12.839 1197 H THR 46 HN THR 46 12.025 15.981 -15.304 1198 HA THR 46 HA THR 46 10.255 17.184 -17.122 1199 HB THR 46 HB THR 46 12.341 15.086 -17.746 1200 HG1 THR 46 HG1 THR 46 12.514 17.833 -17.111 1201 HG21 THR 46 HG21 THR 46 10.861 15.592 -19.618 1202 HG22 THR 46 HG22 THR 46 12.476 16.239 -19.908 1203 HG23 THR 46 HG23 THR 46 11.173 17.317 -19.410 1204 H ALA 47 HN ALA 47 10.802 13.766 -16.321 1205 HA ALA 47 HA ALA 47 9.059 12.761 -18.321 1206 HB1 ALA 47 HB1 ALA 47 10.006 11.363 -15.829 1207 HB2 ALA 47 HB2 ALA 47 10.923 11.481 -17.330 1208 HB3 ALA 47 HB3 ALA 47 9.390 10.610 -17.300 1209 H THR 48 HN THR 48 8.534 13.846 -15.060 1210 HA THR 48 HA THR 48 5.882 12.637 -14.994 1211 HB THR 48 HB THR 48 5.774 13.684 -12.696 1212 HG1 THR 48 HG1 THR 48 8.576 14.038 -13.001 1213 HG21 THR 48 HG21 THR 48 7.276 12.036 -11.679 1214 HG22 THR 48 HG22 THR 48 8.056 11.781 -13.240 1215 HG23 THR 48 HG23 THR 48 6.365 11.333 -13.014 1216 H GLY 49 HN GLY 49 7.293 15.492 -16.054 1217 HA2 GLY 49 HA2 GLY 49 6.350 17.429 -16.872 1218 HA3 GLY 49 HA1 GLY 49 4.766 16.738 -16.540 1219 H MET 50 HN MET 50 7.336 17.211 -14.193 1220 HA MET 50 HA MET 50 5.745 19.318 -12.899 1221 HB2 MET 50 HB2 MET 50 6.902 16.832 -11.643 1222 HB3 MET 50 HB1 MET 50 6.487 18.251 -10.694 1223 HG2 MET 50 HG2 MET 50 4.352 17.688 -10.652 1224 HG3 MET 50 HG1 MET 50 4.299 17.514 -12.403 1225 HE1 MET 50 HE1 MET 50 5.199 15.717 -9.012 1226 HE2 MET 50 HE2 MET 50 6.639 15.414 -9.984 1227 HE3 MET 50 HE3 MET 50 5.560 14.080 -9.566 1228 H ASN 51 HN ASN 51 7.148 20.311 -11.034 1229 HA ASN 51 HA ASN 51 9.667 21.103 -12.224 1230 HB2 ASN 51 HB2 ASN 51 8.135 21.993 -9.789 1231 HB3 ASN 51 HB1 ASN 51 9.796 22.510 -10.056 1232 HD21 ASN 51 HD21 ASN 51 10.255 23.955 -11.668 1233 HD22 ASN 51 HD22 ASN 51 9.035 24.819 -12.537 1234 H LEU 52 HN LEU 52 11.664 21.136 -10.900 1235 HA LEU 52 HA LEU 52 12.357 18.575 -10.006 1236 HB2 LEU 52 HB2 LEU 52 13.657 21.262 -9.677 1237 HB3 LEU 52 HB1 LEU 52 14.334 19.841 -8.910 1238 HG LEU 52 HG LEU 52 14.473 18.789 -11.200 1239 HD11 LEU 52 HD11 LEU 52 12.871 20.204 -12.360 1240 HD12 LEU 52 HD12 LEU 52 14.459 20.290 -13.127 1241 HD13 LEU 52 HD13 LEU 52 13.904 21.608 -12.093 1242 HD21 LEU 52 HD21 LEU 52 16.037 21.312 -10.686 1243 HD22 LEU 52 HD22 LEU 52 16.498 20.025 -11.799 1244 HD23 LEU 52 HD23 LEU 52 16.413 19.704 -10.069 1245 H THR 53 HN THR 53 11.577 21.513 -8.190 1246 HA THR 53 HA THR 53 11.916 20.441 -5.627 1247 HB THR 53 HB THR 53 11.756 22.819 -5.881 1248 HG1 THR 53 HG1 THR 53 10.583 21.570 -4.013 1249 HG21 THR 53 HG21 THR 53 9.673 23.957 -6.515 1250 HG22 THR 53 HG22 THR 53 8.927 22.392 -6.842 1251 HG23 THR 53 HG23 THR 53 10.289 22.938 -7.819 1252 H THR 54 HN THR 54 9.047 20.557 -7.719 1253 HA THR 54 HA THR 54 7.225 19.410 -5.925 1254 HB THR 54 HB THR 54 7.138 18.951 -8.905 1255 HG1 THR 54 HG1 THR 54 6.509 21.339 -7.449 1256 HG21 THR 54 HG21 THR 54 5.389 17.898 -7.551 1257 HG22 THR 54 HG22 THR 54 4.722 19.186 -8.553 1258 HG23 THR 54 HG23 THR 54 4.997 19.460 -6.833 1259 H ALA 55 HN ALA 55 9.376 17.968 -8.342 1260 HA ALA 55 HA ALA 55 8.590 15.293 -7.972 1261 HB1 ALA 55 HB1 ALA 55 11.268 16.350 -8.872 1262 HB2 ALA 55 HB2 ALA 55 9.874 16.065 -9.913 1263 HB3 ALA 55 HB3 ALA 55 10.662 14.710 -9.106 1264 H SER 56 HN SER 56 11.292 17.147 -6.565 1265 HA SER 56 HA SER 56 12.299 15.005 -5.034 1266 HB2 SER 56 HB2 SER 56 13.563 16.765 -3.810 1267 HB3 SER 56 HB1 SER 56 13.707 16.897 -5.560 1268 HG SER 56 HG SER 56 11.592 18.329 -4.685 1269 H ALA 57 HN ALA 57 9.755 17.322 -4.414 1270 HA ALA 57 HA ALA 57 9.529 16.936 -1.628 1271 HB1 ALA 57 HB1 ALA 57 7.357 17.611 -3.613 1272 HB2 ALA 57 HB2 ALA 57 8.422 18.773 -2.819 1273 HB3 ALA 57 HB3 ALA 57 7.276 17.832 -1.864 1274 H ASN 58 HN ASN 58 7.923 15.370 -4.372 1275 HA ASN 58 HA ASN 58 6.492 13.477 -2.815 1276 HB2 ASN 58 HB2 ASN 58 7.268 13.552 -5.733 1277 HB3 ASN 58 HB1 ASN 58 6.339 12.229 -5.038 1278 HD21 ASN 58 HD21 ASN 58 5.644 14.212 -7.084 1279 HD22 ASN 58 HD22 ASN 58 4.202 14.991 -6.525 1280 H LEU 59 HN LEU 59 9.633 13.476 -4.395 1281 HA LEU 59 HA LEU 59 10.316 10.787 -3.945 1282 HB2 LEU 59 HB2 LEU 59 12.015 13.261 -4.226 1283 HB3 LEU 59 HB1 LEU 59 12.684 11.643 -4.117 1284 HG LEU 59 HG LEU 59 10.753 12.504 -6.270 1285 HD11 LEU 59 HD11 LEU 59 12.697 12.615 -7.746 1286 HD12 LEU 59 HD12 LEU 59 13.762 12.314 -6.373 1287 HD13 LEU 59 HD13 LEU 59 12.812 13.798 -6.443 1288 HD21 LEU 59 HD21 LEU 59 12.545 10.096 -5.979 1289 HD22 LEU 59 HD22 LEU 59 11.546 10.471 -7.385 1290 HD23 LEU 59 HD23 LEU 59 10.788 10.114 -5.832 1291 H GLN 60 HN GLN 60 10.704 13.688 -1.965 1292 HA GLN 60 HA GLN 60 12.195 12.533 0.112 1293 HB2 GLN 60 HB2 GLN 60 11.847 14.974 -0.190 1294 HB3 GLN 60 HB1 GLN 60 10.171 14.775 0.311 1295 HG2 GLN 60 HG2 GLN 60 10.932 13.979 2.498 1296 HG3 GLN 60 HG1 GLN 60 12.604 14.212 1.994 1297 HE21 GLN 60 HE21 GLN 60 13.041 15.698 3.576 1298 HE22 GLN 60 HE22 GLN 60 12.390 17.301 3.579 1299 H ALA 61 HN ALA 61 8.708 12.812 -0.395 1300 HA ALA 61 HA ALA 61 7.894 11.662 2.034 1301 HB1 ALA 61 HB1 ALA 61 6.477 11.577 -0.626 1302 HB2 ALA 61 HB2 ALA 61 6.387 12.894 0.544 1303 HB3 ALA 61 HB3 ALA 61 5.749 11.301 0.956 1304 H LEU 62 HN LEU 62 8.471 10.205 -1.154 1305 HA LEU 62 HA LEU 62 7.851 7.550 -0.396 1306 HB2 LEU 62 HB2 LEU 62 9.631 8.575 -2.610 1307 HB3 LEU 62 HB1 LEU 62 9.084 6.916 -2.453 1308 HG LEU 62 HG LEU 62 7.299 9.313 -2.901 1309 HD11 LEU 62 HD11 LEU 62 8.620 8.801 -4.869 1310 HD12 LEU 62 HD12 LEU 62 6.940 8.326 -5.120 1311 HD13 LEU 62 HD13 LEU 62 8.157 7.103 -4.762 1312 HD21 LEU 62 HD21 LEU 62 6.180 7.581 -1.608 1313 HD22 LEU 62 HD22 LEU 62 6.661 6.366 -2.793 1314 HD23 LEU 62 HD23 LEU 62 5.534 7.643 -3.248 1315 H LYS 63 HN LYS 63 10.825 9.436 -0.312 1316 HA LYS 63 HA LYS 63 12.543 7.281 0.379 1317 HB2 LYS 63 HB2 LYS 63 13.200 9.592 -0.503 1318 HB3 LYS 63 HB1 LYS 63 12.972 10.169 1.141 1319 HG2 LYS 63 HG2 LYS 63 14.675 8.591 1.924 1320 HG3 LYS 63 HG1 LYS 63 14.917 8.045 0.261 1321 HD2 LYS 63 HD2 LYS 63 15.504 10.401 -0.339 1322 HD3 LYS 63 HD1 LYS 63 15.440 10.797 1.381 1323 HE2 LYS 63 HE2 LYS 63 17.287 8.821 0.044 1324 HE3 LYS 63 HE1 LYS 63 17.730 10.386 0.726 1325 HZ1 LYS 63 HZ1 LYS 63 17.025 9.545 2.914 1326 HZ2 LYS 63 HZ2 LYS 63 18.307 8.651 2.258 1327 HZ3 LYS 63 HZ3 LYS 63 16.736 8.018 2.226 1328 H SER 64 HN SER 64 10.652 9.609 2.242 1329 HA SER 64 HA SER 64 11.536 8.797 4.802 1330 HB2 SER 64 HB2 SER 64 8.863 9.995 4.030 1331 HB3 SER 64 HB1 SER 64 9.556 9.955 5.652 1332 HG SER 64 HG SER 64 10.608 11.317 3.381 1333 H GLY 65 HN GLY 65 8.911 7.704 2.706 1334 HA2 GLY 65 HA2 GLY 65 7.877 5.767 4.519 1335 HA3 GLY 65 HA1 GLY 65 7.628 5.791 2.777 1336 H GLY 66 HN GLY 66 10.615 5.856 2.420 1337 HA2 GLY 66 HA2 GLY 66 12.458 4.418 2.632 1338 HA3 GLY 66 HA1 GLY 66 11.419 3.235 3.409 1339 H LEU 67 HN LEU 67 10.479 4.773 0.419 1340 HA LEU 67 HA LEU 67 10.561 2.119 -0.816 1341 HB2 LEU 67 HB2 LEU 67 9.086 4.594 -1.704 1342 HB3 LEU 67 HB1 LEU 67 8.985 3.016 -2.459 1343 HG LEU 67 HG LEU 67 7.920 3.861 0.225 1344 HD11 LEU 67 HD11 LEU 67 5.825 3.062 -0.676 1345 HD12 LEU 67 HD12 LEU 67 6.635 2.525 -2.148 1346 HD13 LEU 67 HD13 LEU 67 6.537 4.248 -1.772 1347 HD21 LEU 67 HD21 LEU 67 7.316 1.540 0.639 1348 HD22 LEU 67 HD22 LEU 67 9.067 1.714 0.516 1349 HD23 LEU 67 HD23 LEU 67 8.149 1.044 -0.834 1350 H VAL 68 HN VAL 68 11.988 5.277 -1.122 1351 HA VAL 68 HA VAL 68 13.380 4.306 -3.524 1352 HB VAL 68 HB VAL 68 13.423 6.568 -4.468 1353 HG11 VAL 68 HG11 VAL 68 11.061 6.694 -5.150 1354 HG12 VAL 68 HG12 VAL 68 10.652 5.543 -3.877 1355 HG13 VAL 68 HG13 VAL 68 11.695 5.047 -5.209 1356 HG21 VAL 68 HG21 VAL 68 11.589 7.280 -2.183 1357 HG22 VAL 68 HG22 VAL 68 11.940 8.315 -3.567 1358 HG23 VAL 68 HG23 VAL 68 13.226 7.881 -2.442 1359 H GLU 69 HN GLU 69 15.511 4.836 -3.746 1360 HA GLU 69 HA GLU 69 16.782 6.156 -1.439 1361 HB2 GLU 69 HB2 GLU 69 17.766 3.995 -3.296 1362 HB3 GLU 69 HB1 GLU 69 18.868 4.931 -2.296 1363 HG2 GLU 69 HG2 GLU 69 16.598 3.233 -1.289 1364 HG3 GLU 69 HG1 GLU 69 18.302 2.785 -1.286 1365 H ALA 70 HN ALA 70 18.502 7.592 -1.845 1366 HA ALA 70 HA ALA 70 18.505 8.717 -4.570 1367 HB1 ALA 70 HB1 ALA 70 18.909 10.901 -3.554 1368 HB2 ALA 70 HB2 ALA 70 18.848 10.174 -1.950 1369 HB3 ALA 70 HB3 ALA 70 17.405 10.197 -2.965 1370 H ARG 71 HN ARG 71 20.352 8.167 -5.522 1371 HA ARG 71 HA ARG 71 22.811 8.304 -3.913 1372 HB2 ARG 71 HB2 ARG 71 22.209 6.479 -6.244 1373 HB3 ARG 71 HB1 ARG 71 23.771 6.606 -5.444 1374 HG2 ARG 71 HG2 ARG 71 22.616 5.977 -3.306 1375 HG3 ARG 71 HG1 ARG 71 21.188 5.614 -4.272 1376 HD2 ARG 71 HD2 ARG 71 22.400 3.919 -5.493 1377 HD3 ARG 71 HD1 ARG 71 23.895 4.342 -4.656 1378 HE ARG 71 HE ARG 71 21.619 2.868 -3.553 1379 HH11 ARG 71 HH11 ARG 71 24.786 4.308 -3.066 1380 HH12 ARG 71 HH12 ARG 71 25.054 3.503 -1.546 1381 HH21 ARG 71 HH21 ARG 71 21.978 1.828 -1.527 1382 HH22 ARG 71 HH22 ARG 71 23.471 2.112 -0.685 1383 H ARG 72 HN ARG 72 24.426 9.535 -4.637 1384 HA ARG 72 HA ARG 72 23.656 11.335 -6.814 1385 HB2 ARG 72 HB2 ARG 72 24.022 12.159 -4.442 1386 HB3 ARG 72 HB1 ARG 72 25.725 11.797 -4.669 1387 HG2 ARG 72 HG2 ARG 72 25.801 13.379 -6.539 1388 HG3 ARG 72 HG1 ARG 72 24.099 13.763 -6.266 1389 HD2 ARG 72 HD2 ARG 72 24.733 14.384 -3.915 1390 HD3 ARG 72 HD1 ARG 72 26.417 14.240 -4.412 1391 HE ARG 72 HE ARG 72 24.511 16.160 -5.602 1392 HH11 ARG 72 HH11 ARG 72 27.720 15.267 -4.527 1393 HH12 ARG 72 HH12 ARG 72 28.396 16.842 -4.807 1394 HH21 ARG 72 HH21 ARG 72 25.402 18.261 -5.940 1395 HH22 ARG 72 HH22 ARG 72 27.084 18.541 -5.597 1396 H GLU 73 HN GLU 73 24.960 11.733 -8.528 1397 HA GLU 73 HA GLU 73 27.667 10.583 -8.522 1398 HB2 GLU 73 HB2 GLU 73 25.734 9.359 -9.919 1399 HB3 GLU 73 HB1 GLU 73 26.132 10.612 -11.086 1400 HG2 GLU 73 HG2 GLU 73 27.995 8.540 -9.946 1401 HG3 GLU 73 HG1 GLU 73 27.360 8.604 -11.586 1402 H GLY 74 HN GLY 74 29.167 12.028 -9.167 1403 HA2 GLY 74 HA2 GLY 74 30.080 14.028 -9.821 1404 HA3 GLY 74 HA1 GLY 74 28.752 14.156 -10.967 1405 H THR 75 HN THR 75 27.073 15.494 -10.550 1406 HA THR 75 HA THR 75 26.977 16.750 -7.888 1407 HB THR 75 HB THR 75 28.082 18.321 -9.406 1408 HG1 THR 75 HG1 THR 75 25.406 19.003 -8.699 1409 HG21 THR 75 HG21 THR 75 26.855 19.278 -11.320 1410 HG22 THR 75 HG22 THR 75 25.577 18.085 -11.075 1411 HG23 THR 75 HG23 THR 75 27.197 17.560 -11.531 1412 H ARG 76 HN ARG 76 25.390 14.783 -9.876 1413 HA ARG 76 HA ARG 76 22.763 16.069 -9.520 1414 HB2 ARG 76 HB2 ARG 76 23.532 13.808 -11.371 1415 HB3 ARG 76 HB1 ARG 76 21.941 14.546 -11.255 1416 HG2 ARG 76 HG2 ARG 76 22.963 16.700 -11.961 1417 HG3 ARG 76 HG1 ARG 76 24.477 15.832 -12.236 1418 HD2 ARG 76 HD2 ARG 76 23.267 14.326 -13.791 1419 HD3 ARG 76 HD1 ARG 76 21.829 15.324 -13.578 1420 HE ARG 76 HE ARG 76 24.344 16.213 -14.837 1421 HH11 ARG 76 HH11 ARG 76 20.911 16.611 -14.242 1422 HH12 ARG 76 HH12 ARG 76 20.682 17.693 -15.584 1423 HH21 ARG 76 HH21 ARG 76 24.050 17.678 -16.571 1424 HH22 ARG 76 HH22 ARG 76 22.457 18.288 -16.920 1425 H GLN 77 HN GLN 77 21.121 15.031 -8.485 1426 HA GLN 77 HA GLN 77 21.891 12.694 -6.896 1427 HB2 GLN 77 HB2 GLN 77 21.016 14.790 -5.790 1428 HB3 GLN 77 HB1 GLN 77 19.471 14.475 -6.565 1429 HG2 GLN 77 HG2 GLN 77 19.313 12.346 -5.380 1430 HG3 GLN 77 HG1 GLN 77 20.857 12.673 -4.594 1431 HE21 GLN 77 HE21 GLN 77 20.025 12.685 -2.534 1432 HE22 GLN 77 HE22 GLN 77 18.972 13.931 -1.956 1433 H TYR 78 HN TYR 78 21.346 10.810 -7.766 1434 HA TYR 78 HA TYR 78 19.047 10.646 -9.563 1435 HB2 TYR 78 HB2 TYR 78 21.286 8.688 -8.997 1436 HB3 TYR 78 HB1 TYR 78 19.969 8.395 -10.128 1437 HD1 TYR 78 HD2 TYR 78 23.011 10.368 -9.505 1438 HD2 TYR 78 HD1 TYR 78 19.937 9.429 -12.288 1439 HE1 TYR 78 HE2 TYR 78 24.309 11.449 -11.293 1440 HE2 TYR 78 HE1 TYR 78 21.226 10.504 -14.083 1441 HH TYR 78 HH TYR 78 24.478 11.317 -13.786 1442 H TYR 79 HN TYR 79 17.209 9.661 -9.017 1443 HA TYR 79 HA TYR 79 17.140 8.214 -6.463 1444 HB2 TYR 79 HB2 TYR 79 15.093 9.786 -7.976 1445 HB3 TYR 79 HB1 TYR 79 14.562 8.500 -6.900 1446 HD1 TYR 79 HD1 TYR 79 16.482 11.680 -7.007 1447 HD2 TYR 79 HD2 TYR 79 14.463 8.828 -4.581 1448 HE1 TYR 79 HE1 TYR 79 16.638 13.210 -5.087 1449 HE2 TYR 79 HE2 TYR 79 14.613 10.349 -2.656 1450 HH TYR 79 HH TYR 79 15.531 13.622 -2.969 1451 H ARG 80 HN ARG 80 16.241 6.199 -6.310 1452 HA ARG 80 HA ARG 80 15.080 4.895 -8.607 1453 HB2 ARG 80 HB2 ARG 80 17.716 4.732 -8.654 1454 HB3 ARG 80 HB1 ARG 80 17.465 3.524 -7.403 1455 HG2 ARG 80 HG2 ARG 80 15.840 3.227 -9.846 1456 HG3 ARG 80 HG1 ARG 80 17.574 2.960 -10.021 1457 HD2 ARG 80 HD2 ARG 80 15.766 1.578 -8.038 1458 HD3 ARG 80 HD1 ARG 80 16.357 0.882 -9.545 1459 HE ARG 80 HE ARG 80 17.995 1.516 -7.180 1460 HH11 ARG 80 HH11 ARG 80 17.653 -0.043 -10.296 1461 HH12 ARG 80 HH12 ARG 80 19.052 -1.053 -10.092 1462 HH21 ARG 80 HH21 ARG 80 19.838 0.217 -6.912 1463 HH22 ARG 80 HH22 ARG 80 20.287 -0.914 -8.155 1464 H ILE 81 HN ILE 81 14.241 2.734 -7.961 1465 HA ILE 81 HA ILE 81 12.908 2.699 -5.537 1466 HB ILE 81 HB ILE 81 13.775 0.293 -7.152 1467 HG12 ILE 81 HG12 ILE 81 11.232 1.931 -7.313 1468 HG13 ILE 81 HG11 ILE 81 12.544 1.984 -8.482 1469 HG21 ILE 81 HG21 ILE 81 11.853 -0.824 -6.142 1470 HG22 ILE 81 HG22 ILE 81 11.512 0.616 -5.185 1471 HG23 ILE 81 HG23 ILE 81 13.000 -0.292 -4.911 1472 HD11 ILE 81 HD11 ILE 81 12.141 -0.358 -9.038 1473 HD12 ILE 81 HD12 ILE 81 10.700 0.629 -9.286 1474 HD13 ILE 81 HD13 ILE 81 10.826 -0.408 -7.864 1475 H ALA 82 HN ALA 82 13.390 2.088 -3.512 1476 HA ALA 82 HA ALA 82 16.015 2.178 -2.625 1477 HB1 ALA 82 HB1 ALA 82 14.109 2.703 -1.209 1478 HB2 ALA 82 HB2 ALA 82 15.145 1.497 -0.447 1479 HB3 ALA 82 HB3 ALA 82 13.631 1.004 -1.205 1480 H GLY 83 HN GLY 83 13.938 -0.719 -2.914 1481 HA2 GLY 83 HA2 GLY 83 16.346 -2.332 -3.167 1482 HA3 GLY 83 HA1 GLY 83 15.346 -2.650 -1.759 1483 H GLU 84 HN GLU 84 15.586 -4.764 -3.045 1484 HA GLU 84 HA GLU 84 14.059 -5.165 -5.402 1485 HB2 GLU 84 HB2 GLU 84 15.951 -6.603 -4.591 1486 HB3 GLU 84 HB1 GLU 84 14.898 -7.193 -3.315 1487 HG2 GLU 84 HG2 GLU 84 14.998 -8.793 -5.104 1488 HG3 GLU 84 HG1 GLU 84 13.378 -8.103 -5.009 1489 H ASP 85 HN ASP 85 13.391 -5.293 -1.988 1490 HA ASP 85 HA ASP 85 10.898 -6.645 -2.140 1491 HB2 ASP 85 HB2 ASP 85 10.578 -5.838 0.186 1492 HB3 ASP 85 HB1 ASP 85 12.132 -6.625 -0.056 1493 H VAL 86 HN VAL 86 11.821 -3.233 -2.056 1494 HA VAL 86 HA VAL 86 9.176 -2.206 -2.049 1495 HB VAL 86 HB VAL 86 11.688 -0.899 -3.105 1496 HG11 VAL 86 HG11 VAL 86 9.055 0.289 -2.238 1497 HG12 VAL 86 HG12 VAL 86 9.646 0.173 -3.895 1498 HG13 VAL 86 HG13 VAL 86 10.485 1.197 -2.730 1499 HG21 VAL 86 HG21 VAL 86 10.429 -0.750 -0.366 1500 HG22 VAL 86 HG22 VAL 86 11.834 0.165 -0.910 1501 HG23 VAL 86 HG23 VAL 86 11.926 -1.589 -0.770 1502 H ALA 87 HN ALA 87 11.458 -3.036 -4.608 1503 HA ALA 87 HA ALA 87 10.055 -1.996 -6.793 1504 HB1 ALA 87 HB1 ALA 87 11.374 -3.536 -8.158 1505 HB2 ALA 87 HB2 ALA 87 11.849 -4.421 -6.707 1506 HB3 ALA 87 HB3 ALA 87 12.375 -2.752 -6.934 1507 H ARG 88 HN ARG 88 9.872 -5.154 -5.210 1508 HA ARG 88 HA ARG 88 7.848 -6.048 -7.080 1509 HB2 ARG 88 HB2 ARG 88 9.021 -7.439 -4.667 1510 HB3 ARG 88 HB1 ARG 88 7.967 -8.178 -5.871 1511 HG2 ARG 88 HG2 ARG 88 9.636 -7.732 -7.599 1512 HG3 ARG 88 HG1 ARG 88 10.691 -7.012 -6.386 1513 HD2 ARG 88 HD2 ARG 88 10.682 -9.198 -5.190 1514 HD3 ARG 88 HD1 ARG 88 9.798 -9.882 -6.558 1515 HE ARG 88 HE ARG 88 12.336 -8.526 -7.095 1516 HH11 ARG 88 HH11 ARG 88 10.541 -11.520 -6.831 1517 HH12 ARG 88 HH12 ARG 88 11.731 -12.463 -7.673 1518 HH21 ARG 88 HH21 ARG 88 13.895 -9.738 -8.196 1519 HH22 ARG 88 HH22 ARG 88 13.664 -11.441 -8.448 1520 H LEU 89 HN LEU 89 7.908 -4.314 -4.201 1521 HA LEU 89 HA LEU 89 5.381 -5.066 -3.139 1522 HB2 LEU 89 HB2 LEU 89 7.171 -3.717 -1.972 1523 HB3 LEU 89 HB1 LEU 89 6.734 -2.363 -2.990 1524 HG LEU 89 HG LEU 89 4.717 -3.670 -1.173 1525 HD11 LEU 89 HD11 LEU 89 6.617 -3.020 0.206 1526 HD12 LEU 89 HD12 LEU 89 5.247 -1.948 0.484 1527 HD13 LEU 89 HD13 LEU 89 6.601 -1.409 -0.509 1528 HD21 LEU 89 HD21 LEU 89 3.835 -2.178 -2.895 1529 HD22 LEU 89 HD22 LEU 89 4.927 -0.901 -2.362 1530 HD23 LEU 89 HD23 LEU 89 3.645 -1.469 -1.292 1531 H PHE 90 HN PHE 90 6.443 -2.427 -5.262 1532 HA PHE 90 HA PHE 90 3.852 -1.512 -5.938 1533 HB2 PHE 90 HB2 PHE 90 5.903 -0.161 -6.228 1534 HB3 PHE 90 HB1 PHE 90 6.442 -1.260 -7.491 1535 HD1 PHE 90 HD2 PHE 90 3.669 1.063 -6.615 1536 HD2 PHE 90 HD1 PHE 90 5.887 -0.850 -9.701 1537 HE1 PHE 90 HE2 PHE 90 2.510 2.437 -8.294 1538 HE2 PHE 90 HE1 PHE 90 4.732 0.521 -11.386 1539 HZ PHE 90 HZ PHE 90 3.039 2.166 -10.682 1540 H ALA 91 HN ALA 91 5.986 -3.955 -7.271 1541 HA ALA 91 HA ALA 91 4.503 -4.503 -9.611 1542 HB1 ALA 91 HB1 ALA 91 6.281 -6.372 -8.052 1543 HB2 ALA 91 HB2 ALA 91 6.827 -5.233 -9.280 1544 HB3 ALA 91 HB3 ALA 91 5.768 -6.568 -9.728 1545 H LEU 92 HN LEU 92 4.442 -5.959 -6.364 1546 HA LEU 92 HA LEU 92 2.580 -7.978 -6.977 1547 HB2 LEU 92 HB2 LEU 92 4.053 -8.018 -5.005 1548 HB3 LEU 92 HB1 LEU 92 3.150 -6.684 -4.314 1549 HG LEU 92 HG LEU 92 1.140 -8.104 -4.201 1550 HD11 LEU 92 HD11 LEU 92 1.318 -10.498 -4.612 1551 HD12 LEU 92 HD12 LEU 92 2.980 -10.291 -5.160 1552 HD13 LEU 92 HD13 LEU 92 1.653 -9.580 -6.079 1553 HD21 LEU 92 HD21 LEU 92 2.636 -7.958 -2.277 1554 HD22 LEU 92 HD22 LEU 92 3.577 -9.315 -2.898 1555 HD23 LEU 92 HD23 LEU 92 1.904 -9.559 -2.393 1556 H VAL 93 HN VAL 93 2.127 -4.736 -5.548 1557 HA VAL 93 HA VAL 93 -0.661 -5.001 -5.202 1558 HB VAL 93 HB VAL 93 0.695 -3.225 -4.101 1559 HG11 VAL 93 HG11 VAL 93 2.074 -2.519 -5.960 1560 HG12 VAL 93 HG12 VAL 93 1.167 -1.149 -5.317 1561 HG13 VAL 93 HG13 VAL 93 0.653 -1.922 -6.817 1562 HG21 VAL 93 HG21 VAL 93 -1.726 -3.069 -4.139 1563 HG22 VAL 93 HG22 VAL 93 -1.664 -2.243 -5.697 1564 HG23 VAL 93 HG23 VAL 93 -1.000 -1.464 -4.260 1565 H GLN 94 HN GLN 94 1.315 -4.137 -7.948 1566 HA GLN 94 HA GLN 94 -0.765 -3.270 -9.656 1567 HB2 GLN 94 HB2 GLN 94 1.578 -2.851 -10.192 1568 HB3 GLN 94 HB1 GLN 94 1.883 -4.579 -10.296 1569 HG2 GLN 94 HG2 GLN 94 0.284 -4.683 -12.196 1570 HG3 GLN 94 HG1 GLN 94 0.166 -2.925 -12.128 1571 HE21 GLN 94 HE21 GLN 94 3.136 -4.669 -11.516 1572 HE22 GLN 94 HE22 GLN 94 3.955 -4.155 -12.945 1573 H VAL 95 HN VAL 95 0.709 -6.438 -9.054 1574 HA VAL 95 HA VAL 95 -0.717 -7.862 -11.022 1575 HB VAL 95 HB VAL 95 0.510 -8.882 -8.455 1576 HG11 VAL 95 HG11 VAL 95 -0.387 -10.397 -10.904 1577 HG12 VAL 95 HG12 VAL 95 -1.141 -10.457 -9.312 1578 HG13 VAL 95 HG13 VAL 95 0.493 -11.083 -9.539 1579 HG21 VAL 95 HG21 VAL 95 1.578 -8.795 -11.275 1580 HG22 VAL 95 HG22 VAL 95 2.377 -9.558 -9.900 1581 HG23 VAL 95 HG23 VAL 95 2.131 -7.812 -9.921 1582 H VAL 96 HN VAL 96 -1.377 -7.395 -7.544 1583 HA VAL 96 HA VAL 96 -3.660 -9.064 -7.515 1584 HB VAL 96 HB VAL 96 -2.436 -8.412 -5.463 1585 HG11 VAL 96 HG11 VAL 96 -3.755 -5.733 -5.854 1586 HG12 VAL 96 HG12 VAL 96 -2.025 -6.075 -5.916 1587 HG13 VAL 96 HG13 VAL 96 -2.905 -6.253 -4.398 1588 HG21 VAL 96 HG21 VAL 96 -4.660 -9.347 -5.277 1589 HG22 VAL 96 HG22 VAL 96 -5.373 -7.742 -5.456 1590 HG23 VAL 96 HG23 VAL 96 -4.405 -8.123 -4.031 1591 H ALA 97 HN ALA 97 -3.207 -5.674 -8.287 1592 HA ALA 97 HA ALA 97 -5.997 -5.067 -8.492 1593 HB1 ALA 97 HB1 ALA 97 -4.364 -3.302 -8.148 1594 HB2 ALA 97 HB2 ALA 97 -5.233 -3.039 -9.660 1595 HB3 ALA 97 HB3 ALA 97 -3.594 -3.688 -9.686 1596 H ASP 98 HN ASP 98 -3.446 -5.987 -10.717 1597 HA ASP 98 HA ASP 98 -4.783 -5.847 -13.148 1598 HB2 ASP 98 HB2 ASP 98 -2.384 -6.145 -13.002 1599 HB3 ASP 98 HB1 ASP 98 -2.583 -7.702 -12.212 1600 H GLU 99 HN GLU 99 -4.424 -8.637 -10.967 1601 HA GLU 99 HA GLU 99 -5.763 -10.543 -12.447 1602 HB2 GLU 99 HB2 GLU 99 -5.150 -10.155 -9.588 1603 HB3 GLU 99 HB1 GLU 99 -6.455 -11.277 -9.941 1604 HG2 GLU 99 HG2 GLU 99 -3.680 -11.441 -11.090 1605 HG3 GLU 99 HG1 GLU 99 -4.269 -12.373 -9.714 1606 H HIS 100 HN HIS 100 -7.203 -8.326 -10.036 1607 HA HIS 100 HA HIS 100 -9.797 -9.487 -10.589 1608 HB2 HIS 100 HB2 HIS 100 -10.593 -8.476 -8.681 1609 HB3 HIS 100 HB1 HIS 100 -8.898 -8.670 -8.276 1610 HD1 HIS 100 HD1 HIS 100 -11.523 -6.116 -8.893 1611 HD2 HIS 100 HD2 HIS 100 -7.439 -6.236 -8.091 1612 HE1 HIS 100 HE1 HIS 100 -10.892 -3.774 -8.224 1613 HE2 HIS 100 HE2 HIS 100 -8.477 -3.927 -7.536 1614 H LEU 101 HN LEU 101 -7.975 -7.209 -12.111 1615 HA LEU 101 HA LEU 101 -10.239 -5.530 -12.868 1616 HB2 LEU 101 HB2 LEU 101 -7.965 -4.556 -12.426 1617 HB3 LEU 101 HB1 LEU 101 -7.397 -5.388 -13.863 1618 HG LEU 101 HG LEU 101 -9.142 -4.119 -15.164 1619 HD11 LEU 101 HD11 LEU 101 -10.044 -2.093 -14.160 1620 HD12 LEU 101 HD12 LEU 101 -9.302 -2.517 -12.618 1621 HD13 LEU 101 HD13 LEU 101 -10.584 -3.526 -13.285 1622 HD21 LEU 101 HD21 LEU 101 -6.785 -3.531 -15.167 1623 HD22 LEU 101 HD22 LEU 101 -7.030 -2.527 -13.737 1624 HD23 LEU 101 HD23 LEU 101 -7.808 -2.096 -15.262 1625 H GLU 102 HN GLU 102 -11.354 -7.258 -13.790 1626 HA GLU 102 HA GLU 102 -11.607 -9.158 -15.158 1627 HB2 GLU 102 HB2 GLU 102 -12.633 -8.336 -17.234 1628 HB3 GLU 102 HB1 GLU 102 -13.188 -7.485 -15.805 1629 HG2 GLU 102 HG2 GLU 102 -11.010 -6.365 -17.527 1630 HG3 GLU 102 HG1 GLU 102 -12.710 -6.151 -17.940 1631 H HIS 103 HN HIS 103 -9.090 -9.571 -15.018 1632 HA HIS 103 HA HIS 103 -8.028 -9.453 -17.761 1633 HB2 HIS 103 HB2 HIS 103 -6.730 -8.407 -15.793 1634 HB3 HIS 103 HB1 HIS 103 -6.377 -10.064 -15.316 1635 HD1 HIS 103 HD1 HIS 103 -3.839 -9.260 -15.755 1636 HD2 HIS 103 HD2 HIS 103 -6.274 -9.607 -19.114 1637 HE1 HIS 103 HE1 HIS 103 -2.278 -9.347 -17.724 1638 HE2 HIS 103 HE2 HIS 103 -3.771 -9.414 -19.752 1639 H HIS 104 HN HIS 104 -9.907 -11.417 -16.388 1640 HA HIS 104 HA HIS 104 -8.676 -13.940 -16.247 1641 HB2 HIS 104 HB2 HIS 104 -10.967 -13.519 -15.455 1642 HB3 HIS 104 HB1 HIS 104 -11.492 -13.210 -17.104 1643 HD1 HIS 104 HD1 HIS 104 -10.455 -15.993 -14.807 1644 HD2 HIS 104 HD2 HIS 104 -12.071 -15.471 -18.604 1645 HE1 HIS 104 HE1 HIS 104 -11.226 -18.272 -15.538 1646 HE2 HIS 104 HE2 HIS 104 -12.464 -17.861 -17.690 1647 H HIS 105 HN HIS 105 -7.337 -14.567 -17.829 1648 HA HIS 105 HA HIS 105 -7.511 -13.591 -20.469 1649 HB2 HIS 105 HB2 HIS 105 -5.408 -14.277 -19.297 1650 HB3 HIS 105 HB1 HIS 105 -5.891 -15.955 -19.517 1651 HD1 HIS 105 HD1 HIS 105 -4.987 -17.032 -21.557 1652 HD2 HIS 105 HD2 HIS 105 -5.210 -12.893 -21.938 1653 HE1 HIS 105 HE1 HIS 105 -3.951 -16.495 -23.786 1654 HE2 HIS 105 HE2 HIS 105 -4.021 -13.978 -23.962 1655 H HIS 106 HN HIS 106 -7.569 -17.055 -19.537 1656 HA HIS 106 HA HIS 106 -9.893 -17.529 -21.161 1657 HB2 HIS 106 HB2 HIS 106 -8.023 -17.267 -22.837 1658 HB3 HIS 106 HB1 HIS 106 -7.283 -18.703 -22.142 1659 HD1 HIS 106 HD1 HIS 106 -10.355 -17.616 -24.051 1660 HD2 HIS 106 HD2 HIS 106 -8.280 -21.087 -23.073 1661 HE1 HIS 106 HE1 HIS 106 -11.404 -19.446 -25.422 1662 HE2 HIS 106 HE2 HIS 106 -10.279 -21.559 -24.641 1663 H HIS 107 HN HIS 107 -6.986 -19.355 -20.202 1664 HA HIS 107 HA HIS 107 -6.663 -21.194 -18.918 1665 HB2 HIS 107 HB2 HIS 107 -9.412 -20.533 -17.867 1666 HB3 HIS 107 HB1 HIS 107 -8.474 -21.903 -17.287 1667 HD1 HIS 107 HD1 HIS 107 -6.028 -21.194 -16.266 1668 HD2 HIS 107 HD2 HIS 107 -8.924 -18.224 -16.540 1669 HE1 HIS 107 HE1 HIS 107 -5.276 -19.364 -14.707 1670 HE2 HIS 107 HE2 HIS 107 -6.959 -17.510 -15.025 1671 H HIS 108 HN HIS 108 -10.083 -21.357 -19.950 1672 HA HIS 108 HA HIS 108 -9.419 -23.801 -21.417 1673 HB2 HIS 108 HB2 HIS 108 -11.408 -24.961 -20.614 1674 HB3 HIS 108 HB1 HIS 108 -10.369 -24.533 -19.262 1675 HD1 HIS 108 HD1 HIS 108 -13.758 -24.047 -20.646 1676 HD2 HIS 108 HD2 HIS 108 -11.424 -22.461 -17.587 1677 HE1 HIS 108 HE1 HIS 108 -15.353 -22.799 -19.148 1678 HE2 HIS 108 HE2 HIS 108 -13.932 -21.910 -17.263 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 -4.145 12.187 -24.784 2 H2 MET 1 HT2 MET 1 -2.858 12.959 -23.991 3 H3 MET 1 HT3 MET 1 -2.768 11.305 -24.339 4 HA MET 1 HA MET 1 -2.790 11.775 -26.701 5 HB2 MET 1 HB2 MET 1 -3.977 14.032 -26.275 6 HB3 MET 1 HB1 MET 1 -2.367 14.666 -25.962 7 HG2 MET 1 HG2 MET 1 -3.091 15.085 -28.259 8 HG3 MET 1 HG1 MET 1 -1.661 14.055 -28.197 9 HE1 MET 1 HE1 MET 1 -2.032 13.301 -30.732 10 HE2 MET 1 HE2 MET 1 -3.433 14.368 -30.806 11 HE3 MET 1 HE3 MET 1 -3.569 12.693 -31.343 12 H ALA 2 HN ALA 2 -0.687 12.740 -27.807 13 HA ALA 2 HA ALA 2 1.568 12.514 -27.972 14 HB1 ALA 2 HB1 ALA 2 2.969 13.336 -26.162 15 HB2 ALA 2 HB2 ALA 2 1.593 13.309 -25.059 16 HB3 ALA 2 HB3 ALA 2 1.607 14.424 -26.427 17 H GLY 3 HN GLY 3 -0.164 10.338 -27.185 18 HA2 GLY 3 HA2 GLY 3 1.688 8.278 -26.761 19 HA3 GLY 3 HA1 GLY 3 0.894 8.650 -25.231 20 H GLN 4 HN GLN 4 0.163 6.319 -25.629 21 HA GLN 4 HA GLN 4 -2.456 6.482 -26.902 22 HB2 GLN 4 HB2 GLN 4 -2.151 4.329 -28.039 23 HB3 GLN 4 HB1 GLN 4 -1.029 5.545 -28.629 24 HG2 GLN 4 HG2 GLN 4 0.736 4.575 -27.230 25 HG3 GLN 4 HG1 GLN 4 -0.394 3.332 -26.692 26 HE21 GLN 4 HE21 GLN 4 0.757 1.633 -27.521 27 HE22 GLN 4 HE22 GLN 4 0.915 1.339 -29.228 28 H SER 5 HN SER 5 -4.009 5.222 -25.988 29 HA SER 5 HA SER 5 -5.097 4.036 -24.411 30 HB2 SER 5 HB2 SER 5 -2.457 2.582 -24.129 31 HB3 SER 5 HB1 SER 5 -4.007 2.028 -23.489 32 HG SER 5 HG SER 5 -4.718 2.248 -25.798 33 H ASP 6 HN ASP 6 -5.567 5.544 -22.923 34 HA ASP 6 HA ASP 6 -3.584 6.502 -21.047 35 HB2 ASP 6 HB2 ASP 6 -6.511 7.096 -21.463 36 HB3 ASP 6 HB1 ASP 6 -5.621 7.738 -20.088 37 H ARG 7 HN ARG 7 -4.512 3.631 -21.054 38 HA ARG 7 HA ARG 7 -6.017 3.283 -18.650 39 HB2 ARG 7 HB2 ARG 7 -5.845 0.988 -19.002 40 HB3 ARG 7 HB1 ARG 7 -5.779 1.636 -20.631 41 HG2 ARG 7 HG2 ARG 7 -3.413 1.309 -20.740 42 HG3 ARG 7 HG1 ARG 7 -3.350 0.866 -19.033 43 HD2 ARG 7 HD2 ARG 7 -5.097 -0.957 -19.802 44 HD3 ARG 7 HD1 ARG 7 -4.334 -0.693 -21.370 45 HE ARG 7 HE ARG 7 -2.196 -1.274 -20.262 46 HH11 ARG 7 HH11 ARG 7 -5.225 -2.335 -18.866 47 HH12 ARG 7 HH12 ARG 7 -4.509 -3.640 -17.964 48 HH21 ARG 7 HH21 ARG 7 -1.243 -2.996 -19.079 49 HH22 ARG 7 HH22 ARG 7 -2.258 -4.030 -18.100 50 H LYS 8 HN LYS 8 -2.823 4.087 -19.302 51 HA LYS 8 HA LYS 8 -1.378 2.877 -17.248 52 HB2 LYS 8 HB2 LYS 8 -0.394 4.254 -19.068 53 HB3 LYS 8 HB1 LYS 8 -1.058 5.693 -18.309 54 HG2 LYS 8 HG2 LYS 8 0.301 5.183 -16.291 55 HG3 LYS 8 HG1 LYS 8 1.051 3.862 -17.192 56 HD2 LYS 8 HD2 LYS 8 1.768 5.524 -18.905 57 HD3 LYS 8 HD1 LYS 8 1.145 6.804 -17.861 58 HE2 LYS 8 HE2 LYS 8 3.500 6.632 -17.489 59 HE3 LYS 8 HE1 LYS 8 2.673 5.989 -16.070 60 HZ1 LYS 8 HZ1 LYS 8 4.473 4.539 -16.649 61 HZ2 LYS 8 HZ2 LYS 8 3.931 4.419 -18.252 62 HZ3 LYS 8 HZ3 LYS 8 3.016 3.738 -16.999 63 H ALA 9 HN ALA 9 -2.911 6.100 -17.235 64 HA ALA 9 HA ALA 9 -2.543 6.557 -14.477 65 HB1 ALA 9 HB1 ALA 9 -4.097 8.408 -14.759 66 HB2 ALA 9 HB2 ALA 9 -4.596 7.768 -16.325 67 HB3 ALA 9 HB3 ALA 9 -2.949 8.355 -16.097 68 H ALA 10 HN ALA 10 -5.026 4.947 -16.311 69 HA ALA 10 HA ALA 10 -7.008 4.788 -14.322 70 HB1 ALA 10 HB1 ALA 10 -6.418 2.863 -16.569 71 HB2 ALA 10 HB2 ALA 10 -7.474 4.274 -16.656 72 HB3 ALA 10 HB3 ALA 10 -7.903 2.911 -15.619 73 H LEU 11 HN LEU 11 -4.172 2.812 -15.023 74 HA LEU 11 HA LEU 11 -4.788 0.826 -13.051 75 HB2 LEU 11 HB2 LEU 11 -2.186 1.492 -14.435 76 HB3 LEU 11 HB1 LEU 11 -2.435 0.101 -13.398 77 HG LEU 11 HG LEU 11 -3.834 0.622 -16.021 78 HD11 LEU 11 HD11 LEU 11 -1.509 0.019 -16.325 79 HD12 LEU 11 HD12 LEU 11 -2.551 -1.321 -16.798 80 HD13 LEU 11 HD13 LEU 11 -1.704 -1.365 -15.251 81 HD21 LEU 11 HD21 LEU 11 -4.013 -1.731 -14.139 82 HD22 LEU 11 HD22 LEU 11 -4.735 -1.640 -15.747 83 HD23 LEU 11 HD23 LEU 11 -5.288 -0.556 -14.469 84 H LEU 12 HN LEU 12 -2.802 3.734 -13.190 85 HA LEU 12 HA LEU 12 -1.618 3.520 -10.654 86 HB2 LEU 12 HB2 LEU 12 -2.387 6.001 -12.196 87 HB3 LEU 12 HB1 LEU 12 -1.333 5.980 -10.798 88 HG LEU 12 HG LEU 12 -0.763 4.684 -13.468 89 HD11 LEU 12 HD11 LEU 12 0.990 6.366 -13.642 90 HD12 LEU 12 HD12 LEU 12 0.471 7.074 -12.114 91 HD13 LEU 12 HD13 LEU 12 -0.602 7.113 -13.511 92 HD21 LEU 12 HD21 LEU 12 0.944 4.841 -10.986 93 HD22 LEU 12 HD22 LEU 12 1.442 4.191 -12.548 94 HD23 LEU 12 HD23 LEU 12 0.175 3.386 -11.619 95 H ASP 13 HN ASP 13 -4.663 4.979 -11.704 96 HA ASP 13 HA ASP 13 -5.568 5.934 -9.234 97 HB2 ASP 13 HB2 ASP 13 -6.753 6.561 -11.204 98 HB3 ASP 13 HB1 ASP 13 -7.044 4.884 -11.650 99 H GLN 14 HN GLN 14 -5.874 2.735 -10.700 100 HA GLN 14 HA GLN 14 -7.533 1.611 -8.713 101 HB2 GLN 14 HB2 GLN 14 -7.175 0.693 -11.003 102 HB3 GLN 14 HB1 GLN 14 -5.557 0.209 -10.522 103 HG2 GLN 14 HG2 GLN 14 -7.028 -1.681 -10.450 104 HG3 GLN 14 HG1 GLN 14 -6.522 -1.264 -8.816 105 HE21 GLN 14 HE21 GLN 14 -8.956 0.525 -10.592 106 HE22 GLN 14 HE22 GLN 14 -10.298 0.026 -9.623 107 H VAL 15 HN VAL 15 -4.006 1.610 -9.160 108 HA VAL 15 HA VAL 15 -3.389 0.096 -6.852 109 HB VAL 15 HB VAL 15 -1.704 2.127 -8.333 110 HG11 VAL 15 HG11 VAL 15 -0.825 1.861 -6.103 111 HG12 VAL 15 HG12 VAL 15 0.218 1.010 -7.244 112 HG13 VAL 15 HG13 VAL 15 -0.915 0.106 -6.240 113 HG21 VAL 15 HG21 VAL 15 -2.399 0.210 -9.694 114 HG22 VAL 15 HG22 VAL 15 -1.747 -0.888 -8.476 115 HG23 VAL 15 HG23 VAL 15 -0.665 0.180 -9.370 116 H ALA 16 HN ALA 16 -3.585 3.590 -7.432 117 HA ALA 16 HA ALA 16 -2.798 4.470 -4.895 118 HB1 ALA 16 HB1 ALA 16 -2.987 5.947 -6.838 119 HB2 ALA 16 HB2 ALA 16 -3.899 6.569 -5.464 120 HB3 ALA 16 HB3 ALA 16 -4.741 5.778 -6.796 121 H ARG 17 HN ARG 17 -5.951 3.502 -6.139 122 HA ARG 17 HA ARG 17 -7.540 4.169 -3.944 123 HB2 ARG 17 HB2 ARG 17 -8.532 3.466 -6.016 124 HB3 ARG 17 HB1 ARG 17 -7.739 1.902 -5.926 125 HG2 ARG 17 HG2 ARG 17 -9.122 1.278 -4.033 126 HG3 ARG 17 HG1 ARG 17 -9.874 2.876 -4.038 127 HD2 ARG 17 HD2 ARG 17 -9.939 1.082 -6.449 128 HD3 ARG 17 HD1 ARG 17 -11.144 0.960 -5.168 129 HE ARG 17 HE ARG 17 -12.008 3.035 -5.792 130 HH11 ARG 17 HH11 ARG 17 -9.229 2.222 -7.769 131 HH12 ARG 17 HH12 ARG 17 -9.565 3.439 -8.963 132 HH21 ARG 17 HH21 ARG 17 -12.469 4.590 -7.370 133 HH22 ARG 17 HH22 ARG 17 -11.427 4.761 -8.751 134 H VAL 18 HN VAL 18 -5.725 1.190 -4.611 135 HA VAL 18 HA VAL 18 -6.412 -0.175 -2.250 136 HB VAL 18 HB VAL 18 -3.843 -0.392 -3.836 137 HG11 VAL 18 HG11 VAL 18 -3.718 -2.668 -2.896 138 HG12 VAL 18 HG12 VAL 18 -5.123 -2.315 -1.891 139 HG13 VAL 18 HG13 VAL 18 -3.621 -1.422 -1.652 140 HG21 VAL 18 HG21 VAL 18 -6.447 -1.894 -4.100 141 HG22 VAL 18 HG22 VAL 18 -4.953 -2.292 -4.950 142 HG23 VAL 18 HG23 VAL 18 -5.762 -0.756 -5.262 143 H GLY 19 HN GLY 19 -3.573 1.855 -3.000 144 HA2 GLY 19 HA2 GLY 19 -2.383 1.657 -0.439 145 HA3 GLY 19 HA1 GLY 19 -2.055 2.911 -1.627 146 H LYS 20 HN LYS 20 -4.800 3.825 -1.749 147 HA LYS 20 HA LYS 20 -4.784 5.787 0.249 148 HB2 LYS 20 HB2 LYS 20 -5.946 5.893 -1.969 149 HB3 LYS 20 HB1 LYS 20 -7.166 4.806 -1.330 150 HG2 LYS 20 HG2 LYS 20 -7.832 6.448 0.305 151 HG3 LYS 20 HG1 LYS 20 -6.532 7.528 -0.213 152 HD2 LYS 20 HD2 LYS 20 -7.542 7.592 -2.470 153 HD3 LYS 20 HD1 LYS 20 -8.876 6.604 -1.875 154 HE2 LYS 20 HE2 LYS 20 -9.501 8.340 -0.307 155 HE3 LYS 20 HE1 LYS 20 -8.110 9.313 -0.791 156 HZ1 LYS 20 HZ1 LYS 20 -10.129 10.072 -1.871 157 HZ2 LYS 20 HZ2 LYS 20 -10.377 8.537 -2.551 158 HZ3 LYS 20 HZ3 LYS 20 -9.039 9.464 -3.019 159 H ALA 21 HN ALA 21 -6.459 2.683 0.043 160 HA ALA 21 HA ALA 21 -7.780 3.066 2.587 161 HB1 ALA 21 HB1 ALA 21 -7.538 0.603 0.861 162 HB2 ALA 21 HB2 ALA 21 -8.872 1.759 0.846 163 HB3 ALA 21 HB3 ALA 21 -8.576 0.772 2.277 164 H LEU 22 HN LEU 22 -4.770 1.890 1.466 165 HA LEU 22 HA LEU 22 -4.184 0.245 3.772 166 HB2 LEU 22 HB2 LEU 22 -3.229 0.428 1.174 167 HB3 LEU 22 HB1 LEU 22 -1.920 1.086 2.134 168 HG LEU 22 HG LEU 22 -3.152 -1.635 2.588 169 HD11 LEU 22 HD11 LEU 22 -2.069 -1.580 0.429 170 HD12 LEU 22 HD12 LEU 22 -1.087 -2.503 1.569 171 HD13 LEU 22 HD13 LEU 22 -0.627 -0.854 1.140 172 HD21 LEU 22 HD21 LEU 22 -0.650 -0.352 3.680 173 HD22 LEU 22 HD22 LEU 22 -1.142 -2.026 3.939 174 HD23 LEU 22 HD23 LEU 22 -2.122 -0.710 4.585 175 H ALA 23 HN ALA 23 -4.338 3.498 3.276 176 HA ALA 23 HA ALA 23 -1.960 4.297 4.708 177 HB1 ALA 23 HB1 ALA 23 -4.336 5.909 3.788 178 HB2 ALA 23 HB2 ALA 23 -2.831 5.678 2.898 179 HB3 ALA 23 HB3 ALA 23 -2.827 6.567 4.421 180 H ASN 24 HN ASN 24 -4.106 2.604 5.998 181 HA ASN 24 HA ASN 24 -4.718 4.372 8.282 182 HB2 ASN 24 HB2 ASN 24 -6.342 2.180 7.010 183 HB3 ASN 24 HB1 ASN 24 -6.579 2.596 8.702 184 HD21 ASN 24 HD21 ASN 24 -5.675 5.057 6.437 185 HD22 ASN 24 HD22 ASN 24 -7.215 5.847 6.372 186 H GLY 25 HN GLY 25 -4.432 3.507 10.369 187 HA2 GLY 25 HA2 GLY 25 -2.441 1.356 10.386 188 HA3 GLY 25 HA1 GLY 25 -2.744 2.494 11.688 189 H ARG 26 HN ARG 26 -5.223 2.276 12.411 190 HA ARG 26 HA ARG 26 -5.268 -0.238 13.726 191 HB2 ARG 26 HB2 ARG 26 -7.172 2.089 13.676 192 HB3 ARG 26 HB1 ARG 26 -7.497 0.631 14.608 193 HG2 ARG 26 HG2 ARG 26 -5.651 0.979 16.006 194 HG3 ARG 26 HG1 ARG 26 -4.944 2.172 14.917 195 HD2 ARG 26 HD2 ARG 26 -5.952 3.176 16.933 196 HD3 ARG 26 HD1 ARG 26 -6.683 3.749 15.437 197 HE ARG 26 HE ARG 26 -8.510 2.102 15.932 198 HH11 ARG 26 HH11 ARG 26 -6.522 3.428 18.490 199 HH12 ARG 26 HH12 ARG 26 -7.766 3.315 19.698 200 HH21 ARG 26 HH21 ARG 26 -10.155 1.969 17.504 201 HH22 ARG 26 HH22 ARG 26 -9.846 2.482 19.135 202 H ARG 27 HN ARG 27 -6.657 0.876 10.785 203 HA ARG 27 HA ARG 27 -8.741 -1.074 10.663 204 HB2 ARG 27 HB2 ARG 27 -9.016 0.884 9.327 205 HB3 ARG 27 HB1 ARG 27 -7.449 0.666 8.561 206 HG2 ARG 27 HG2 ARG 27 -8.241 -0.800 7.054 207 HG3 ARG 27 HG1 ARG 27 -9.340 -1.555 8.205 208 HD2 ARG 27 HD2 ARG 27 -10.510 -0.411 6.361 209 HD3 ARG 27 HD1 ARG 27 -10.923 0.236 7.945 210 HE ARG 27 HE ARG 27 -9.575 2.163 7.450 211 HH11 ARG 27 HH11 ARG 27 -10.114 0.023 4.725 212 HH12 ARG 27 HH12 ARG 27 -9.943 1.277 3.544 213 HH21 ARG 27 HH21 ARG 27 -9.354 3.812 5.899 214 HH22 ARG 27 HH22 ARG 27 -9.537 3.447 4.206 215 H LEU 28 HN LEU 28 -5.347 -1.118 10.097 216 HA LEU 28 HA LEU 28 -5.268 -3.306 8.281 217 HB2 LEU 28 HB2 LEU 28 -3.171 -2.243 10.169 218 HB3 LEU 28 HB1 LEU 28 -2.879 -3.479 8.961 219 HG LEU 28 HG LEU 28 -3.704 -0.628 8.408 220 HD11 LEU 28 HD11 LEU 28 -1.395 -0.840 9.182 221 HD12 LEU 28 HD12 LEU 28 -1.471 -0.392 7.478 222 HD13 LEU 28 HD13 LEU 28 -1.089 -2.052 7.939 223 HD21 LEU 28 HD21 LEU 28 -4.630 -2.156 6.758 224 HD22 LEU 28 HD22 LEU 28 -3.041 -2.879 6.515 225 HD23 LEU 28 HD23 LEU 28 -3.323 -1.199 6.058 226 H GLN 29 HN GLN 29 -5.707 -3.052 11.689 227 HA GLN 29 HA GLN 29 -4.829 -5.567 12.539 228 HB2 GLN 29 HB2 GLN 29 -7.098 -3.840 13.534 229 HB3 GLN 29 HB1 GLN 29 -6.591 -5.317 14.340 230 HG2 GLN 29 HG2 GLN 29 -4.342 -4.344 14.631 231 HG3 GLN 29 HG1 GLN 29 -4.932 -2.844 13.914 232 HE21 GLN 29 HE21 GLN 29 -5.120 -4.974 16.658 233 HE22 GLN 29 HE22 GLN 29 -5.865 -3.852 17.740 234 H ILE 30 HN ILE 30 -7.784 -4.565 10.937 235 HA ILE 30 HA ILE 30 -9.166 -7.026 11.296 236 HB ILE 30 HB ILE 30 -9.626 -4.899 9.198 237 HG12 ILE 30 HG12 ILE 30 -10.894 -5.283 11.920 238 HG13 ILE 30 HG11 ILE 30 -9.741 -4.021 11.498 239 HG21 ILE 30 HG21 ILE 30 -11.458 -7.063 10.229 240 HG22 ILE 30 HG22 ILE 30 -10.668 -7.051 8.654 241 HG23 ILE 30 HG23 ILE 30 -11.876 -5.827 9.043 242 HD11 ILE 30 HD11 ILE 30 -11.991 -3.148 11.527 243 HD12 ILE 30 HD12 ILE 30 -12.505 -4.361 10.353 244 HD13 ILE 30 HD13 ILE 30 -11.347 -3.115 9.885 245 H LEU 31 HN LEU 31 -7.205 -5.662 8.668 246 HA LEU 31 HA LEU 31 -7.553 -7.741 6.819 247 HB2 LEU 31 HB2 LEU 31 -5.271 -5.827 7.263 248 HB3 LEU 31 HB1 LEU 31 -5.274 -6.992 5.954 249 HG LEU 31 HG LEU 31 -7.336 -4.818 6.332 250 HD11 LEU 31 HD11 LEU 31 -5.018 -5.013 4.411 251 HD12 LEU 31 HD12 LEU 31 -5.157 -3.891 5.766 252 HD13 LEU 31 HD13 LEU 31 -6.264 -3.765 4.399 253 HD21 LEU 31 HD21 LEU 31 -6.861 -6.765 4.077 254 HD22 LEU 31 HD22 LEU 31 -8.010 -5.430 4.049 255 HD23 LEU 31 HD23 LEU 31 -8.233 -6.759 5.185 256 H ASP 32 HN ASP 32 -5.290 -7.338 9.486 257 HA ASP 32 HA ASP 32 -3.716 -9.623 8.995 258 HB2 ASP 32 HB2 ASP 32 -3.043 -7.841 10.559 259 HB3 ASP 32 HB1 ASP 32 -4.357 -8.293 11.640 260 H LEU 33 HN LEU 33 -6.579 -9.144 11.048 261 HA LEU 33 HA LEU 33 -6.750 -11.761 12.033 262 HB2 LEU 33 HB2 LEU 33 -8.995 -9.812 11.497 263 HB3 LEU 33 HB1 LEU 33 -9.122 -11.253 12.486 264 HG LEU 33 HG LEU 33 -7.454 -8.816 13.069 265 HD11 LEU 33 HD11 LEU 33 -8.957 -8.566 14.982 266 HD12 LEU 33 HD12 LEU 33 -9.888 -9.958 14.427 267 HD13 LEU 33 HD13 LEU 33 -9.827 -8.491 13.451 268 HD21 LEU 33 HD21 LEU 33 -6.298 -10.826 13.802 269 HD22 LEU 33 HD22 LEU 33 -7.744 -11.359 14.657 270 HD23 LEU 33 HD23 LEU 33 -6.895 -9.904 15.181 271 H LEU 34 HN LEU 34 -7.989 -10.311 9.066 272 HA LEU 34 HA LEU 34 -9.516 -12.630 8.339 273 HB2 LEU 34 HB2 LEU 34 -8.684 -10.286 6.628 274 HB3 LEU 34 HB1 LEU 34 -9.923 -11.463 6.237 275 HG LEU 34 HG LEU 34 -10.015 -9.401 8.435 276 HD11 LEU 34 HD11 LEU 34 -11.680 -9.763 5.951 277 HD12 LEU 34 HD12 LEU 34 -10.437 -8.538 6.198 278 HD13 LEU 34 HD13 LEU 34 -11.903 -8.516 7.180 279 HD21 LEU 34 HD21 LEU 34 -12.269 -10.248 8.899 280 HD22 LEU 34 HD22 LEU 34 -11.028 -11.455 9.229 281 HD23 LEU 34 HD23 LEU 34 -11.998 -11.567 7.761 282 H ALA 35 HN ALA 35 -6.247 -11.623 7.932 283 HA ALA 35 HA ALA 35 -5.668 -13.495 5.809 284 HB1 ALA 35 HB1 ALA 35 -4.340 -11.446 6.057 285 HB2 ALA 35 HB2 ALA 35 -3.331 -12.888 6.185 286 HB3 ALA 35 HB3 ALA 35 -3.788 -11.997 7.639 287 H GLN 36 HN GLN 36 -5.693 -13.412 9.264 288 HA GLN 36 HA GLN 36 -4.335 -15.900 9.649 289 HB2 GLN 36 HB2 GLN 36 -5.654 -13.875 11.318 290 HB3 GLN 36 HB1 GLN 36 -5.828 -15.516 11.920 291 HG2 GLN 36 HG2 GLN 36 -3.875 -14.200 12.801 292 HG3 GLN 36 HG1 GLN 36 -3.507 -15.794 12.149 293 HE21 GLN 36 HE21 GLN 36 -3.183 -12.361 11.704 294 HE22 GLN 36 HE22 GLN 36 -1.978 -12.442 10.459 295 H GLY 37 HN GLY 37 -7.713 -14.867 9.447 296 HA2 GLY 37 HA2 GLY 37 -8.544 -17.366 8.414 297 HA3 GLY 37 HA1 GLY 37 -8.956 -17.264 10.120 298 H GLU 38 HN GLU 38 -10.920 -17.532 8.219 299 HA GLU 38 HA GLU 38 -12.017 -14.950 7.581 300 HB2 GLU 38 HB2 GLU 38 -14.051 -16.302 6.901 301 HB3 GLU 38 HB1 GLU 38 -12.569 -16.643 6.024 302 HG2 GLU 38 HG2 GLU 38 -13.461 -18.302 8.359 303 HG3 GLU 38 HG1 GLU 38 -14.014 -18.615 6.716 304 H ARG 39 HN ARG 39 -12.836 -13.698 9.079 305 HA ARG 39 HA ARG 39 -14.073 -14.969 11.430 306 HB2 ARG 39 HB2 ARG 39 -12.580 -12.361 11.178 307 HB3 ARG 39 HB1 ARG 39 -13.523 -12.795 12.597 308 HG2 ARG 39 HG2 ARG 39 -12.096 -14.787 12.891 309 HG3 ARG 39 HG1 ARG 39 -11.115 -14.251 11.523 310 HD2 ARG 39 HD2 ARG 39 -10.547 -12.209 12.698 311 HD3 ARG 39 HD1 ARG 39 -11.594 -12.661 14.042 312 HE ARG 39 HE ARG 39 -9.514 -14.569 13.448 313 HH11 ARG 39 HH11 ARG 39 -10.372 -11.720 15.270 314 HH12 ARG 39 HH12 ARG 39 -9.153 -11.963 16.484 315 HH21 ARG 39 HH21 ARG 39 -7.928 -14.922 15.075 316 HH22 ARG 39 HH22 ARG 39 -7.783 -13.793 16.385 317 H ALA 40 HN ALA 40 -16.007 -14.257 12.191 318 HA ALA 40 HA ALA 40 -17.748 -12.914 10.377 319 HB1 ALA 40 HB1 ALA 40 -18.559 -14.650 11.897 320 HB2 ALA 40 HB2 ALA 40 -19.418 -13.130 12.148 321 HB3 ALA 40 HB3 ALA 40 -18.164 -13.631 13.281 322 H VAL 41 HN VAL 41 -18.803 -10.912 10.703 323 HA VAL 41 HA VAL 41 -17.245 -8.721 11.268 324 HB VAL 41 HB VAL 41 -20.247 -8.844 11.610 325 HG11 VAL 41 HG11 VAL 41 -20.213 -6.478 11.047 326 HG12 VAL 41 HG12 VAL 41 -18.453 -6.517 10.927 327 HG13 VAL 41 HG13 VAL 41 -19.238 -6.791 12.483 328 HG21 VAL 41 HG21 VAL 41 -19.590 -9.754 9.460 329 HG22 VAL 41 HG22 VAL 41 -18.603 -8.327 9.136 330 HG23 VAL 41 HG23 VAL 41 -20.357 -8.181 9.254 331 H GLU 42 HN GLU 42 -19.523 -10.337 13.456 332 HA GLU 42 HA GLU 42 -19.210 -8.583 15.629 333 HB2 GLU 42 HB2 GLU 42 -19.990 -11.504 15.618 334 HB3 GLU 42 HB1 GLU 42 -20.186 -10.410 16.983 335 HG2 GLU 42 HG2 GLU 42 -21.678 -9.013 15.605 336 HG3 GLU 42 HG1 GLU 42 -21.526 -10.189 14.299 337 H ALA 43 HN ALA 43 -17.508 -11.550 14.733 338 HA ALA 43 HA ALA 43 -15.936 -11.751 17.073 339 HB1 ALA 43 HB1 ALA 43 -14.527 -13.268 15.774 340 HB2 ALA 43 HB2 ALA 43 -15.341 -12.762 14.295 341 HB3 ALA 43 HB3 ALA 43 -16.238 -13.628 15.543 342 H ILE 44 HN ILE 44 -15.447 -10.143 13.977 343 HA ILE 44 HA ILE 44 -12.794 -9.299 14.369 344 HB ILE 44 HB ILE 44 -14.986 -7.965 12.763 345 HG12 ILE 44 HG12 ILE 44 -12.795 -9.855 11.874 346 HG13 ILE 44 HG11 ILE 44 -14.467 -10.334 12.148 347 HG21 ILE 44 HG21 ILE 44 -13.176 -6.875 11.538 348 HG22 ILE 44 HG22 ILE 44 -11.992 -7.632 12.602 349 HG23 ILE 44 HG23 ILE 44 -13.125 -6.446 13.249 350 HD11 ILE 44 HD11 ILE 44 -14.019 -10.009 9.790 351 HD12 ILE 44 HD12 ILE 44 -13.512 -8.349 10.101 352 HD13 ILE 44 HD13 ILE 44 -15.187 -8.824 10.375 353 H ALA 45 HN ALA 45 -15.894 -7.787 15.146 354 HA ALA 45 HA ALA 45 -14.896 -5.365 16.162 355 HB1 ALA 45 HB1 ALA 45 -17.247 -5.696 15.590 356 HB2 ALA 45 HB2 ALA 45 -17.072 -5.136 17.253 357 HB3 ALA 45 HB3 ALA 45 -17.418 -6.834 16.927 358 H THR 46 HN THR 46 -15.852 -8.351 17.868 359 HA THR 46 HA THR 46 -15.221 -7.510 20.455 360 HB THR 46 HB THR 46 -14.950 -10.343 19.431 361 HG1 THR 46 HG1 THR 46 -17.194 -8.723 19.866 362 HG21 THR 46 HG21 THR 46 -15.603 -10.946 21.719 363 HG22 THR 46 HG22 THR 46 -15.650 -9.238 22.155 364 HG23 THR 46 HG23 THR 46 -14.119 -9.992 21.707 365 H ALA 47 HN ALA 47 -13.228 -9.238 18.078 366 HA ALA 47 HA ALA 47 -11.026 -9.715 19.751 367 HB1 ALA 47 HB1 ALA 47 -11.430 -10.919 17.668 368 HB2 ALA 47 HB2 ALA 47 -9.810 -10.224 17.711 369 HB3 ALA 47 HB3 ALA 47 -11.074 -9.454 16.753 370 H THR 48 HN THR 48 -11.781 -6.971 17.656 371 HA THR 48 HA THR 48 -9.172 -5.793 18.065 372 HB THR 48 HB THR 48 -10.167 -3.853 16.784 373 HG1 THR 48 HG1 THR 48 -12.280 -5.612 16.116 374 HG21 THR 48 HG21 THR 48 -10.152 -5.036 14.635 375 HG22 THR 48 HG22 THR 48 -10.282 -6.576 15.484 376 HG23 THR 48 HG23 THR 48 -8.839 -5.581 15.680 377 H GLY 49 HN GLY 49 -12.176 -5.780 19.674 378 HA2 GLY 49 HA2 GLY 49 -12.679 -4.748 21.700 379 HA3 GLY 49 HA1 GLY 49 -11.213 -3.790 21.548 380 H MET 50 HN MET 50 -13.495 -3.999 18.949 381 HA MET 50 HA MET 50 -14.354 -1.234 19.503 382 HB2 MET 50 HB2 MET 50 -13.829 -2.551 16.829 383 HB3 MET 50 HB1 MET 50 -14.559 -0.963 17.026 384 HG2 MET 50 HG2 MET 50 -12.496 -0.225 18.194 385 HG3 MET 50 HG1 MET 50 -11.777 -1.789 17.819 386 HE1 MET 50 HE1 MET 50 -11.254 -2.633 15.388 387 HE2 MET 50 HE2 MET 50 -11.552 -1.701 13.921 388 HE3 MET 50 HE3 MET 50 -12.910 -2.338 14.852 389 H ASN 51 HN ASN 51 -16.448 -0.726 18.254 390 HA ASN 51 HA ASN 51 -18.340 -2.838 18.927 391 HB2 ASN 51 HB2 ASN 51 -18.690 0.079 18.243 392 HB3 ASN 51 HB1 ASN 51 -20.055 -1.021 18.415 393 HD21 ASN 51 HD21 ASN 51 -19.395 1.319 19.997 394 HD22 ASN 51 HD22 ASN 51 -19.199 0.762 21.629 395 H LEU 52 HN LEU 52 -20.220 -3.184 17.461 396 HA LEU 52 HA LEU 52 -19.354 -4.269 15.045 397 HB2 LEU 52 HB2 LEU 52 -22.008 -3.719 16.261 398 HB3 LEU 52 HB1 LEU 52 -21.968 -4.074 14.545 399 HG LEU 52 HG LEU 52 -22.443 -6.079 15.844 400 HD11 LEU 52 HD11 LEU 52 -21.232 -6.306 13.746 401 HD12 LEU 52 HD12 LEU 52 -20.726 -7.533 14.908 402 HD13 LEU 52 HD13 LEU 52 -19.700 -6.132 14.602 403 HD21 LEU 52 HD21 LEU 52 -20.744 -7.061 17.306 404 HD22 LEU 52 HD22 LEU 52 -21.315 -5.507 17.916 405 HD23 LEU 52 HD23 LEU 52 -19.747 -5.619 17.114 406 H THR 53 HN THR 53 -21.029 -1.205 15.658 407 HA THR 53 HA THR 53 -21.366 -0.377 13.021 408 HB THR 53 HB THR 53 -22.432 0.817 14.833 409 HG1 THR 53 HG1 THR 53 -21.758 1.994 12.857 410 HG21 THR 53 HG21 THR 53 -20.723 0.579 16.552 411 HG22 THR 53 HG22 THR 53 -21.177 2.272 16.365 412 HG23 THR 53 HG23 THR 53 -19.664 1.682 15.675 413 H THR 54 HN THR 54 -18.553 -0.106 15.127 414 HA THR 54 HA THR 54 -17.040 1.521 13.338 415 HB THR 54 HB THR 54 -15.866 -0.239 15.480 416 HG1 THR 54 HG1 THR 54 -16.672 2.335 16.184 417 HG21 THR 54 HG21 THR 54 -14.323 1.663 15.742 418 HG22 THR 54 HG22 THR 54 -15.171 2.521 14.454 419 HG23 THR 54 HG23 THR 54 -14.299 1.027 14.098 420 H ALA 55 HN ALA 55 -17.096 -1.928 14.150 421 HA ALA 55 HA ALA 55 -14.948 -2.708 12.512 422 HB1 ALA 55 HB1 ALA 55 -17.319 -4.352 13.390 423 HB2 ALA 55 HB2 ALA 55 -15.840 -4.101 14.317 424 HB3 ALA 55 HB3 ALA 55 -15.785 -4.976 12.786 425 H SER 56 HN SER 56 -18.456 -2.709 11.897 426 HA SER 56 HA SER 56 -18.272 -3.898 9.345 427 HB2 SER 56 HB2 SER 56 -20.613 -3.037 9.043 428 HB3 SER 56 HB1 SER 56 -20.366 -3.967 10.522 429 HG SER 56 HG SER 56 -20.453 -2.145 11.711 430 H ALA 57 HN ALA 57 -18.326 -0.508 10.377 431 HA ALA 57 HA ALA 57 -18.449 0.679 7.841 432 HB1 ALA 57 HB1 ALA 57 -17.469 2.655 8.899 433 HB2 ALA 57 HB2 ALA 57 -17.042 1.688 10.313 434 HB3 ALA 57 HB3 ALA 57 -18.738 1.945 9.900 435 H ASN 58 HN ASN 58 -15.668 -0.389 9.754 436 HA ASN 58 HA ASN 58 -13.713 0.409 7.863 437 HB2 ASN 58 HB2 ASN 58 -13.650 -1.538 10.161 438 HB3 ASN 58 HB1 ASN 58 -12.250 -1.260 9.131 439 HD21 ASN 58 HD21 ASN 58 -12.669 -0.728 11.984 440 HD22 ASN 58 HD22 ASN 58 -12.335 0.952 12.195 441 H LEU 59 HN LEU 59 -15.597 -2.514 8.308 442 HA LEU 59 HA LEU 59 -14.182 -4.129 6.471 443 HB2 LEU 59 HB2 LEU 59 -17.021 -4.233 7.475 444 HB3 LEU 59 HB1 LEU 59 -16.340 -5.445 6.403 445 HG LEU 59 HG LEU 59 -15.282 -4.790 9.155 446 HD11 LEU 59 HD11 LEU 59 -16.925 -7.128 8.200 447 HD12 LEU 59 HD12 LEU 59 -17.474 -5.836 9.269 448 HD13 LEU 59 HD13 LEU 59 -16.214 -6.950 9.806 449 HD21 LEU 59 HD21 LEU 59 -14.583 -7.001 7.229 450 HD22 LEU 59 HD22 LEU 59 -13.940 -6.806 8.859 451 HD23 LEU 59 HD23 LEU 59 -13.570 -5.611 7.616 452 H GLN 60 HN GLN 60 -16.899 -1.898 6.093 453 HA GLN 60 HA GLN 60 -17.400 -2.444 3.363 454 HB2 GLN 60 HB2 GLN 60 -17.840 0.106 4.933 455 HB3 GLN 60 HB1 GLN 60 -18.461 -0.190 3.315 456 HG2 GLN 60 HG2 GLN 60 -19.690 -2.159 4.237 457 HG3 GLN 60 HG1 GLN 60 -19.192 -1.637 5.845 458 HE21 GLN 60 HE21 GLN 60 -19.411 1.203 5.167 459 HE22 GLN 60 HE22 GLN 60 -21.103 1.551 5.105 460 H ALA 61 HN ALA 61 -15.131 -0.368 5.020 461 HA ALA 61 HA ALA 61 -14.153 0.934 2.680 462 HB1 ALA 61 HB1 ALA 61 -12.900 0.613 5.404 463 HB2 ALA 61 HB2 ALA 61 -13.914 1.953 4.869 464 HB3 ALA 61 HB3 ALA 61 -12.331 1.697 4.135 465 H LEU 62 HN LEU 62 -13.402 -2.038 4.363 466 HA LEU 62 HA LEU 62 -11.034 -2.500 2.756 467 HB2 LEU 62 HB2 LEU 62 -12.431 -4.307 4.721 468 HB3 LEU 62 HB1 LEU 62 -10.946 -4.695 3.865 469 HG LEU 62 HG LEU 62 -11.273 -2.412 5.819 470 HD11 LEU 62 HD11 LEU 62 -9.847 -3.763 7.286 471 HD12 LEU 62 HD12 LEU 62 -9.922 -5.090 6.124 472 HD13 LEU 62 HD13 LEU 62 -11.388 -4.554 6.949 473 HD21 LEU 62 HD21 LEU 62 -8.841 -2.238 5.661 474 HD22 LEU 62 HD22 LEU 62 -9.607 -1.957 4.096 475 HD23 LEU 62 HD23 LEU 62 -8.825 -3.503 4.433 476 H LYS 63 HN LYS 63 -14.362 -2.966 2.360 477 HA LYS 63 HA LYS 63 -14.017 -5.073 0.437 478 HB2 LYS 63 HB2 LYS 63 -16.206 -4.462 1.609 479 HB3 LYS 63 HB1 LYS 63 -16.291 -3.081 0.524 480 HG2 LYS 63 HG2 LYS 63 -17.637 -4.721 -0.454 481 HG3 LYS 63 HG1 LYS 63 -16.131 -4.768 -1.373 482 HD2 LYS 63 HD2 LYS 63 -15.383 -6.701 -0.140 483 HD3 LYS 63 HD1 LYS 63 -16.782 -6.607 0.930 484 HE2 LYS 63 HE2 LYS 63 -17.206 -8.333 -0.655 485 HE3 LYS 63 HE1 LYS 63 -18.233 -6.963 -1.075 486 HZ1 LYS 63 HZ1 LYS 63 -16.500 -6.332 -2.734 487 HZ2 LYS 63 HZ2 LYS 63 -17.288 -7.796 -3.061 488 HZ3 LYS 63 HZ3 LYS 63 -15.725 -7.812 -2.414 489 H SER 64 HN SER 64 -14.974 -1.680 0.098 490 HA SER 64 HA SER 64 -14.722 -1.395 -2.600 491 HB2 SER 64 HB2 SER 64 -14.286 1.082 -2.010 492 HB3 SER 64 HB1 SER 64 -15.783 0.336 -1.449 493 HG SER 64 HG SER 64 -15.112 0.464 0.562 494 H GLY 65 HN GLY 65 -12.129 -0.633 -0.235 495 HA2 GLY 65 HA2 GLY 65 -10.235 -1.064 -2.455 496 HA3 GLY 65 HA1 GLY 65 -10.080 0.341 -1.411 497 H GLY 66 HN GLY 66 -11.093 -2.768 -0.159 498 HA2 GLY 66 HA2 GLY 66 -8.544 -2.770 1.370 499 HA3 GLY 66 HA1 GLY 66 -10.080 -3.329 2.015 500 H LEU 67 HN LEU 67 -10.739 -4.644 -0.536 501 HA LEU 67 HA LEU 67 -10.229 -6.346 -1.956 502 HB2 LEU 67 HB2 LEU 67 -7.581 -6.677 -0.587 503 HB3 LEU 67 HB1 LEU 67 -8.031 -7.172 -2.208 504 HG LEU 67 HG LEU 67 -7.377 -4.425 -1.193 505 HD11 LEU 67 HD11 LEU 67 -5.563 -5.756 -2.072 506 HD12 LEU 67 HD12 LEU 67 -5.909 -4.401 -3.147 507 HD13 LEU 67 HD13 LEU 67 -6.455 -6.025 -3.569 508 HD21 LEU 67 HD21 LEU 67 -8.909 -5.070 -3.707 509 HD22 LEU 67 HD22 LEU 67 -8.176 -3.507 -3.341 510 HD23 LEU 67 HD23 LEU 67 -9.480 -4.132 -2.321 511 H VAL 68 HN VAL 68 -11.556 -6.639 0.565 512 HA VAL 68 HA VAL 68 -11.038 -9.512 0.966 513 HB VAL 68 HB VAL 68 -12.062 -9.328 3.193 514 HG11 VAL 68 HG11 VAL 68 -10.230 -8.126 4.298 515 HG12 VAL 68 HG12 VAL 68 -9.767 -7.418 2.751 516 HG13 VAL 68 HG13 VAL 68 -9.643 -9.160 2.996 517 HG21 VAL 68 HG21 VAL 68 -12.087 -6.358 2.664 518 HG22 VAL 68 HG22 VAL 68 -12.491 -7.143 4.193 519 HG23 VAL 68 HG23 VAL 68 -13.506 -7.399 2.774 520 H GLU 69 HN GLU 69 -12.986 -10.789 1.475 521 HA GLU 69 HA GLU 69 -15.377 -9.717 0.116 522 HB2 GLU 69 HB2 GLU 69 -14.162 -12.483 0.003 523 HB3 GLU 69 HB1 GLU 69 -15.820 -12.163 -0.483 524 HG2 GLU 69 HG2 GLU 69 -13.450 -10.771 -1.693 525 HG3 GLU 69 HG1 GLU 69 -14.139 -12.260 -2.338 526 H ALA 70 HN ALA 70 -17.397 -10.927 0.730 527 HA ALA 70 HA ALA 70 -17.320 -11.723 3.570 528 HB1 ALA 70 HB1 ALA 70 -19.453 -10.583 3.899 529 HB2 ALA 70 HB2 ALA 70 -19.426 -10.036 2.222 530 HB3 ALA 70 HB3 ALA 70 -18.206 -9.457 3.358 531 H ARG 71 HN ARG 71 -18.133 -13.663 3.947 532 HA ARG 71 HA ARG 71 -20.195 -14.731 2.122 533 HB2 ARG 71 HB2 ARG 71 -17.659 -15.830 2.741 534 HB3 ARG 71 HB1 ARG 71 -18.850 -16.825 3.567 535 HG2 ARG 71 HG2 ARG 71 -18.417 -17.758 1.403 536 HG3 ARG 71 HG1 ARG 71 -20.053 -17.091 1.419 537 HD2 ARG 71 HD2 ARG 71 -19.155 -15.029 0.356 538 HD3 ARG 71 HD1 ARG 71 -17.590 -15.831 0.223 539 HE ARG 71 HE ARG 71 -19.844 -17.222 -0.976 540 HH11 ARG 71 HH11 ARG 71 -17.090 -15.112 -1.418 541 HH12 ARG 71 HH12 ARG 71 -17.031 -15.314 -3.139 542 HH21 ARG 71 HH21 ARG 71 -19.795 -17.484 -3.256 543 HH22 ARG 71 HH22 ARG 71 -18.551 -16.689 -4.184 544 H ARG 72 HN ARG 72 -22.076 -15.325 3.072 545 HA ARG 72 HA ARG 72 -22.239 -14.843 5.943 546 HB2 ARG 72 HB2 ARG 72 -24.447 -15.210 3.919 547 HB3 ARG 72 HB1 ARG 72 -24.668 -14.782 5.609 548 HG2 ARG 72 HG2 ARG 72 -23.322 -12.724 5.177 549 HG3 ARG 72 HG1 ARG 72 -23.362 -13.133 3.461 550 HD2 ARG 72 HD2 ARG 72 -25.741 -12.628 5.239 551 HD3 ARG 72 HD1 ARG 72 -25.118 -11.541 4.001 552 HE ARG 72 HE ARG 72 -25.737 -13.293 2.359 553 HH11 ARG 72 HH11 ARG 72 -27.274 -13.225 5.496 554 HH12 ARG 72 HH12 ARG 72 -28.704 -14.052 4.967 555 HH21 ARG 72 HH21 ARG 72 -27.600 -14.391 1.643 556 HH22 ARG 72 HH22 ARG 72 -28.879 -14.741 2.767 557 H GLU 73 HN GLU 73 -22.525 -16.323 7.406 558 HA GLU 73 HA GLU 73 -23.407 -19.015 6.609 559 HB2 GLU 73 HB2 GLU 73 -21.182 -19.087 7.574 560 HB3 GLU 73 HB1 GLU 73 -21.709 -18.131 8.949 561 HG2 GLU 73 HG2 GLU 73 -23.278 -20.005 9.523 562 HG3 GLU 73 HG1 GLU 73 -22.472 -20.955 8.277 563 H GLY 74 HN GLY 74 -25.573 -18.827 6.820 564 HA2 GLY 74 HA2 GLY 74 -27.604 -18.730 7.880 565 HA3 GLY 74 HA1 GLY 74 -26.728 -18.820 9.402 566 H THR 75 HN THR 75 -26.366 -16.989 10.569 567 HA THR 75 HA THR 75 -27.845 -14.624 9.652 568 HB THR 75 HB THR 75 -26.933 -15.143 12.477 569 HG1 THR 75 HG1 THR 75 -29.548 -15.802 11.692 570 HG21 THR 75 HG21 THR 75 -27.741 -12.896 11.986 571 HG22 THR 75 HG22 THR 75 -28.888 -13.746 13.022 572 HG23 THR 75 HG23 THR 75 -29.223 -13.562 11.300 573 H ARG 76 HN ARG 76 -24.679 -15.755 10.214 574 HA ARG 76 HA ARG 76 -23.677 -13.084 10.896 575 HB2 ARG 76 HB2 ARG 76 -22.387 -15.801 11.087 576 HB3 ARG 76 HB1 ARG 76 -21.557 -14.291 11.438 577 HG2 ARG 76 HG2 ARG 76 -22.974 -13.849 13.291 578 HG3 ARG 76 HG1 ARG 76 -24.052 -15.181 12.859 579 HD2 ARG 76 HD2 ARG 76 -21.172 -15.432 13.711 580 HD3 ARG 76 HD1 ARG 76 -22.577 -15.781 14.719 581 HE ARG 76 HE ARG 76 -21.405 -17.480 12.739 582 HH11 ARG 76 HH11 ARG 76 -24.420 -16.661 14.329 583 HH12 ARG 76 HH12 ARG 76 -25.172 -18.189 13.970 584 HH21 ARG 76 HH21 ARG 76 -22.400 -19.503 12.275 585 HH22 ARG 76 HH22 ARG 76 -24.022 -19.793 12.836 586 H GLN 77 HN GLN 77 -21.918 -12.174 9.829 587 HA GLN 77 HA GLN 77 -21.471 -13.159 7.090 588 HB2 GLN 77 HB2 GLN 77 -21.043 -10.384 8.221 589 HB3 GLN 77 HB1 GLN 77 -20.746 -10.865 6.558 590 HG2 GLN 77 HG2 GLN 77 -23.104 -11.279 6.223 591 HG3 GLN 77 HG1 GLN 77 -23.432 -10.899 7.913 592 HE21 GLN 77 HE21 GLN 77 -22.597 -9.614 4.795 593 HE22 GLN 77 HE22 GLN 77 -22.877 -7.951 5.177 594 H TYR 78 HN TYR 78 -19.545 -14.059 6.732 595 HA TYR 78 HA TYR 78 -17.358 -13.472 8.610 596 HB2 TYR 78 HB2 TYR 78 -17.822 -15.820 6.761 597 HB3 TYR 78 HB1 TYR 78 -16.339 -15.577 7.678 598 HD1 TYR 78 HD1 TYR 78 -20.033 -15.826 8.188 599 HD2 TYR 78 HD2 TYR 78 -16.151 -16.565 9.767 600 HE1 TYR 78 HE1 TYR 78 -21.038 -16.996 10.097 601 HE2 TYR 78 HE2 TYR 78 -17.151 -17.745 11.681 602 HH TYR 78 HH TYR 78 -20.272 -18.843 11.734 603 H TYR 79 HN TYR 79 -15.671 -12.348 7.938 604 HA TYR 79 HA TYR 79 -15.456 -11.757 5.074 605 HB2 TYR 79 HB2 TYR 79 -14.725 -10.282 7.556 606 HB3 TYR 79 HB1 TYR 79 -13.751 -10.003 6.115 607 HD1 TYR 79 HD1 TYR 79 -17.216 -9.843 7.440 608 HD2 TYR 79 HD2 TYR 79 -14.536 -8.642 4.362 609 HE1 TYR 79 HE1 TYR 79 -18.903 -8.266 6.589 610 HE2 TYR 79 HE2 TYR 79 -16.209 -7.062 3.506 611 HH TYR 79 HH TYR 79 -18.688 -6.807 3.554 612 H ARG 80 HN ARG 80 -13.549 -11.958 3.976 613 HA ARG 80 HA ARG 80 -11.214 -13.096 5.272 614 HB2 ARG 80 HB2 ARG 80 -12.696 -15.044 4.726 615 HB3 ARG 80 HB1 ARG 80 -12.633 -14.568 3.036 616 HG2 ARG 80 HG2 ARG 80 -10.133 -14.844 3.170 617 HG3 ARG 80 HG1 ARG 80 -10.384 -15.583 4.752 618 HD2 ARG 80 HD2 ARG 80 -12.192 -16.806 2.966 619 HD3 ARG 80 HD1 ARG 80 -10.627 -16.749 2.155 620 HE ARG 80 HE ARG 80 -11.195 -18.082 4.724 621 HH11 ARG 80 HH11 ARG 80 -9.124 -17.580 1.937 622 HH12 ARG 80 HH12 ARG 80 -8.087 -18.927 2.315 623 HH21 ARG 80 HH21 ARG 80 -9.857 -19.834 5.218 624 HH22 ARG 80 HH22 ARG 80 -8.499 -20.212 4.194 625 H ILE 81 HN ILE 81 -9.332 -12.941 3.917 626 HA ILE 81 HA ILE 81 -9.243 -10.787 2.130 627 HB ILE 81 HB ILE 81 -7.328 -13.124 2.184 628 HG12 ILE 81 HG12 ILE 81 -7.660 -12.157 4.444 629 HG13 ILE 81 HG11 ILE 81 -6.034 -11.888 3.832 630 HG21 ILE 81 HG21 ILE 81 -6.997 -10.266 1.281 631 HG22 ILE 81 HG22 ILE 81 -7.020 -11.704 0.259 632 HG23 ILE 81 HG23 ILE 81 -5.695 -11.451 1.394 633 HD11 ILE 81 HD11 ILE 81 -6.919 -9.929 4.983 634 HD12 ILE 81 HD12 ILE 81 -8.257 -9.859 3.833 635 HD13 ILE 81 HD13 ILE 81 -6.604 -9.595 3.282 636 H ALA 82 HN ALA 82 -9.563 -10.615 -0.046 637 HA ALA 82 HA ALA 82 -11.236 -12.472 -1.301 638 HB1 ALA 82 HB1 ALA 82 -11.012 -11.118 -3.294 639 HB2 ALA 82 HB2 ALA 82 -9.583 -10.328 -2.626 640 HB3 ALA 82 HB3 ALA 82 -11.159 -10.086 -1.872 641 H GLY 83 HN GLY 83 -7.740 -11.999 -1.627 642 HA2 GLY 83 HA2 GLY 83 -7.597 -14.638 -2.880 643 HA3 GLY 83 HA1 GLY 83 -6.922 -13.280 -3.768 644 H GLU 84 HN GLU 84 -5.396 -15.475 -3.030 645 HA GLU 84 HA GLU 84 -3.937 -15.079 -0.635 646 HB2 GLU 84 HB2 GLU 84 -3.938 -17.204 -1.926 647 HB3 GLU 84 HB1 GLU 84 -3.027 -16.406 -3.200 648 HG2 GLU 84 HG2 GLU 84 -1.203 -15.992 -1.596 649 HG3 GLU 84 HG1 GLU 84 -2.109 -16.884 -0.375 650 H ASP 85 HN ASP 85 -3.757 -13.781 -3.836 651 HA ASP 85 HA ASP 85 -1.286 -12.542 -3.875 652 HB2 ASP 85 HB2 ASP 85 -2.627 -10.776 -5.281 653 HB3 ASP 85 HB1 ASP 85 -2.448 -12.422 -5.881 654 H VAL 86 HN VAL 86 -4.373 -11.038 -2.883 655 HA VAL 86 HA VAL 86 -3.287 -8.714 -1.786 656 HB VAL 86 HB VAL 86 -5.791 -10.147 -0.879 657 HG11 VAL 86 HG11 VAL 86 -5.058 -8.447 0.697 658 HG12 VAL 86 HG12 VAL 86 -6.529 -7.938 -0.134 659 HG13 VAL 86 HG13 VAL 86 -4.970 -7.260 -0.604 660 HG21 VAL 86 HG21 VAL 86 -6.964 -8.629 -2.439 661 HG22 VAL 86 HG22 VAL 86 -5.882 -9.754 -3.262 662 HG23 VAL 86 HG23 VAL 86 -5.399 -8.071 -3.036 663 H ALA 87 HN ALA 87 -3.958 -11.847 -0.287 664 HA ALA 87 HA ALA 87 -3.448 -11.143 2.374 665 HB1 ALA 87 HB1 ALA 87 -3.179 -13.524 2.793 666 HB2 ALA 87 HB2 ALA 87 -3.020 -13.823 1.062 667 HB3 ALA 87 HB3 ALA 87 -4.546 -13.230 1.718 668 H ARG 88 HN ARG 88 -1.253 -12.389 -0.128 669 HA ARG 88 HA ARG 88 0.993 -12.401 1.659 670 HB2 ARG 88 HB2 ARG 88 0.860 -12.695 -1.341 671 HB3 ARG 88 HB1 ARG 88 2.309 -12.933 -0.373 672 HG2 ARG 88 HG2 ARG 88 1.093 -14.726 0.864 673 HG3 ARG 88 HG1 ARG 88 -0.222 -14.555 -0.299 674 HD2 ARG 88 HD2 ARG 88 1.183 -16.375 -0.977 675 HD3 ARG 88 HD1 ARG 88 1.385 -15.042 -2.114 676 HE ARG 88 HE ARG 88 3.308 -15.199 0.067 677 HH11 ARG 88 HH11 ARG 88 2.565 -15.887 -3.296 678 HH12 ARG 88 HH12 ARG 88 4.240 -16.074 -3.753 679 HH21 ARG 88 HH21 ARG 88 5.502 -15.474 -0.534 680 HH22 ARG 88 HH22 ARG 88 5.894 -15.848 -2.185 681 H LEU 89 HN LEU 89 -0.459 -10.101 -0.484 682 HA LEU 89 HA LEU 89 1.700 -8.295 -0.693 683 HB2 LEU 89 HB2 LEU 89 -0.467 -8.202 -1.978 684 HB3 LEU 89 HB1 LEU 89 -1.243 -7.613 -0.523 685 HG LEU 89 HG LEU 89 1.072 -6.128 -1.750 686 HD11 LEU 89 HD11 LEU 89 -0.602 -6.436 -3.507 687 HD12 LEU 89 HD12 LEU 89 -0.540 -4.757 -2.966 688 HD13 LEU 89 HD13 LEU 89 -1.851 -5.810 -2.431 689 HD21 LEU 89 HD21 LEU 89 0.381 -5.499 0.520 690 HD22 LEU 89 HD22 LEU 89 -1.266 -5.240 -0.056 691 HD23 LEU 89 HD23 LEU 89 0.045 -4.214 -0.641 692 H PHE 90 HN PHE 90 -0.894 -8.660 1.680 693 HA PHE 90 HA PHE 90 -0.033 -6.561 3.381 694 HB2 PHE 90 HB2 PHE 90 -2.332 -7.533 3.397 695 HB3 PHE 90 HB1 PHE 90 -1.671 -9.000 4.112 696 HD1 PHE 90 HD2 PHE 90 -1.809 -5.323 4.696 697 HD2 PHE 90 HD1 PHE 90 -1.658 -9.217 6.406 698 HE1 PHE 90 HE2 PHE 90 -2.070 -4.344 6.939 699 HE2 PHE 90 HE1 PHE 90 -1.919 -8.245 8.650 700 HZ PHE 90 HZ PHE 90 -2.125 -5.806 8.921 701 H ALA 91 HN ALA 91 0.640 -10.027 3.260 702 HA ALA 91 HA ALA 91 2.168 -10.160 5.626 703 HB1 ALA 91 HB1 ALA 91 2.398 -11.839 3.129 704 HB2 ALA 91 HB2 ALA 91 1.325 -12.153 4.491 705 HB3 ALA 91 HB3 ALA 91 3.071 -12.239 4.709 706 H LEU 92 HN LEU 92 2.991 -9.366 2.294 707 HA LEU 92 HA LEU 92 5.776 -9.334 2.513 708 HB2 LEU 92 HB2 LEU 92 4.577 -9.229 0.376 709 HB3 LEU 92 HB1 LEU 92 3.987 -7.628 0.775 710 HG LEU 92 HG LEU 92 6.333 -6.799 0.756 711 HD11 LEU 92 HD11 LEU 92 8.076 -8.193 -0.221 712 HD12 LEU 92 HD12 LEU 92 6.955 -9.551 -0.307 713 HD13 LEU 92 HD13 LEU 92 7.450 -8.916 1.261 714 HD21 LEU 92 HD21 LEU 92 4.908 -6.566 -1.208 715 HD22 LEU 92 HD22 LEU 92 5.406 -8.162 -1.770 716 HD23 LEU 92 HD23 LEU 92 6.582 -6.852 -1.677 717 H VAL 93 HN VAL 93 3.420 -6.709 3.014 718 HA VAL 93 HA VAL 93 5.402 -4.755 3.561 719 HB VAL 93 HB VAL 93 3.587 -3.334 4.404 720 HG11 VAL 93 HG11 VAL 93 2.929 -4.813 1.864 721 HG12 VAL 93 HG12 VAL 93 3.986 -3.408 2.023 722 HG13 VAL 93 HG13 VAL 93 2.257 -3.252 2.336 723 HG21 VAL 93 HG21 VAL 93 1.837 -5.756 3.994 724 HG22 VAL 93 HG22 VAL 93 1.268 -4.125 4.358 725 HG23 VAL 93 HG23 VAL 93 2.237 -5.006 5.539 726 H GLN 94 HN GLN 94 3.723 -7.082 5.560 727 HA GLN 94 HA GLN 94 4.488 -5.995 8.063 728 HB2 GLN 94 HB2 GLN 94 3.835 -8.834 7.256 729 HB3 GLN 94 HB1 GLN 94 4.118 -8.331 8.916 730 HG2 GLN 94 HG2 GLN 94 2.221 -6.766 8.727 731 HG3 GLN 94 HG1 GLN 94 1.913 -7.382 7.104 732 HE21 GLN 94 HE21 GLN 94 1.825 -8.091 10.505 733 HE22 GLN 94 HE22 GLN 94 0.804 -9.483 10.388 734 H VAL 95 HN VAL 95 6.007 -8.285 5.849 735 HA VAL 95 HA VAL 95 8.193 -8.924 7.559 736 HB VAL 95 HB VAL 95 7.945 -9.212 4.556 737 HG11 VAL 95 HG11 VAL 95 9.772 -10.849 4.770 738 HG12 VAL 95 HG12 VAL 95 9.944 -10.412 6.471 739 HG13 VAL 95 HG13 VAL 95 10.277 -9.219 5.215 740 HG21 VAL 95 HG21 VAL 95 7.472 -11.577 5.076 741 HG22 VAL 95 HG22 VAL 95 6.258 -10.487 5.744 742 HG23 VAL 95 HG23 VAL 95 7.490 -11.184 6.797 743 H VAL 96 HN VAL 96 7.826 -6.690 4.809 744 HA VAL 96 HA VAL 96 10.514 -5.837 4.762 745 HB VAL 96 HB VAL 96 8.844 -5.492 2.923 746 HG11 VAL 96 HG11 VAL 96 7.469 -3.476 2.950 747 HG12 VAL 96 HG12 VAL 96 7.935 -3.181 4.625 748 HG13 VAL 96 HG13 VAL 96 6.991 -4.613 4.210 749 HG21 VAL 96 HG21 VAL 96 10.997 -4.431 2.814 750 HG22 VAL 96 HG22 VAL 96 10.439 -3.108 3.837 751 HG23 VAL 96 HG23 VAL 96 9.770 -3.312 2.219 752 H ALA 97 HN ALA 97 7.792 -4.833 6.721 753 HA ALA 97 HA ALA 97 9.066 -2.501 7.766 754 HB1 ALA 97 HB1 ALA 97 6.809 -4.123 8.935 755 HB2 ALA 97 HB2 ALA 97 6.627 -2.782 7.804 756 HB3 ALA 97 HB3 ALA 97 7.280 -2.493 9.418 757 H ASP 98 HN ASP 98 8.699 -5.841 8.873 758 HA ASP 98 HA ASP 98 9.818 -5.475 11.431 759 HB2 ASP 98 HB2 ASP 98 8.420 -7.399 10.887 760 HB3 ASP 98 HB1 ASP 98 9.623 -7.976 9.740 761 H GLU 99 HN GLU 99 11.295 -6.619 8.391 762 HA GLU 99 HA GLU 99 13.809 -7.108 9.671 763 HB2 GLU 99 HB2 GLU 99 14.617 -7.798 7.556 764 HB3 GLU 99 HB1 GLU 99 12.950 -8.340 7.650 765 HG2 GLU 99 HG2 GLU 99 12.659 -7.423 5.657 766 HG3 GLU 99 HG1 GLU 99 12.770 -5.855 6.456 767 H HIS 100 HN HIS 100 12.328 -4.312 8.382 768 HA HIS 100 HA HIS 100 14.828 -2.944 7.844 769 HB2 HIS 100 HB2 HIS 100 11.941 -2.143 7.696 770 HB3 HIS 100 HB1 HIS 100 13.203 -0.920 7.661 771 HD1 HIS 100 HD1 HIS 100 14.626 -3.668 5.900 772 HD2 HIS 100 HD2 HIS 100 11.694 -0.860 5.004 773 HE1 HIS 100 HE1 HIS 100 14.541 -3.546 3.392 774 HE2 HIS 100 HE2 HIS 100 12.933 -1.673 2.894 775 H LEU 101 HN LEU 101 12.661 -3.373 10.497 776 HA LEU 101 HA LEU 101 13.693 -1.103 11.972 777 HB2 LEU 101 HB2 LEU 101 11.593 -3.145 12.404 778 HB3 LEU 101 HB1 LEU 101 12.366 -2.520 13.846 779 HG LEU 101 HG LEU 101 11.711 -0.241 13.241 780 HD11 LEU 101 HD11 LEU 101 10.223 0.192 11.367 781 HD12 LEU 101 HD12 LEU 101 10.315 -1.502 10.886 782 HD13 LEU 101 HD13 LEU 101 11.752 -0.483 10.802 783 HD21 LEU 101 HD21 LEU 101 10.200 -1.543 14.615 784 HD22 LEU 101 HD22 LEU 101 9.442 -2.222 13.174 785 HD23 LEU 101 HD23 LEU 101 9.285 -0.501 13.524 786 H GLU 102 HN GLU 102 14.430 -4.403 11.523 787 HA GLU 102 HA GLU 102 15.999 -4.784 13.885 788 HB2 GLU 102 HB2 GLU 102 14.980 -6.431 11.976 789 HB3 GLU 102 HB1 GLU 102 16.646 -6.317 11.431 790 HG2 GLU 102 HG2 GLU 102 16.054 -6.975 14.281 791 HG3 GLU 102 HG1 GLU 102 15.918 -8.218 13.041 792 H HIS 103 HN HIS 103 18.484 -5.352 13.462 793 HA HIS 103 HA HIS 103 19.769 -2.944 12.854 794 HB2 HIS 103 HB2 HIS 103 20.918 -5.743 12.899 795 HB3 HIS 103 HB1 HIS 103 21.882 -4.272 12.828 796 HD1 HIS 103 HD1 HIS 103 20.954 -2.521 14.949 797 HD2 HIS 103 HD2 HIS 103 20.875 -6.652 15.431 798 HE1 HIS 103 HE1 HIS 103 20.879 -2.913 17.431 799 HE2 HIS 103 HE2 HIS 103 20.607 -5.408 17.683 800 H HIS 104 HN HIS 104 19.848 -1.963 10.985 801 HA HIS 104 HA HIS 104 19.428 -3.520 8.555 802 HB2 HIS 104 HB2 HIS 104 17.884 -1.685 8.986 803 HB3 HIS 104 HB1 HIS 104 19.225 -0.552 9.096 804 HD1 HIS 104 HD1 HIS 104 19.474 0.806 7.060 805 HD2 HIS 104 HD2 HIS 104 17.958 -2.978 6.219 806 HE1 HIS 104 HE1 HIS 104 19.093 0.759 4.567 807 HE2 HIS 104 HE2 HIS 104 18.289 -1.581 4.067 808 H HIS 105 HN HIS 105 21.440 -0.716 9.520 809 HA HIS 105 HA HIS 105 23.427 -1.683 7.569 810 HB2 HIS 105 HB2 HIS 105 22.258 0.372 6.793 811 HB3 HIS 105 HB1 HIS 105 22.836 1.211 8.228 812 HD1 HIS 105 HD1 HIS 105 24.350 2.884 7.129 813 HD2 HIS 105 HD2 HIS 105 25.148 -1.020 5.934 814 HE1 HIS 105 HE1 HIS 105 26.477 3.006 5.786 815 HE2 HIS 105 HE2 HIS 105 26.931 0.638 5.041 816 H HIS 106 HN HIS 106 25.394 -2.024 8.303 817 HA HIS 106 HA HIS 106 25.958 -1.822 11.078 818 HB2 HIS 106 HB2 HIS 106 26.857 -3.598 9.628 819 HB3 HIS 106 HB1 HIS 106 27.817 -2.407 8.761 820 HD1 HIS 106 HD1 HIS 106 27.487 -3.779 12.297 821 HD2 HIS 106 HD2 HIS 106 30.314 -2.117 9.741 822 HE1 HIS 106 HE1 HIS 106 29.681 -3.940 13.514 823 HE2 HIS 106 HE2 HIS 106 31.397 -3.171 11.833 824 H HIS 107 HN HIS 107 28.164 -0.558 8.597 825 HA HIS 107 HA HIS 107 27.992 2.154 9.502 826 HB2 HIS 107 HB2 HIS 107 30.115 0.385 10.588 827 HB3 HIS 107 HB1 HIS 107 30.639 1.961 10.011 828 HD1 HIS 107 HD1 HIS 107 29.241 4.044 11.121 829 HD2 HIS 107 HD2 HIS 107 29.198 0.404 13.138 830 HE1 HIS 107 HE1 HIS 107 28.537 4.580 13.477 831 HE2 HIS 107 HE2 HIS 107 28.535 2.366 14.691 832 H HIS 108 HN HIS 108 29.767 3.493 8.458 833 HA HIS 108 HA HIS 108 31.047 2.226 6.170 834 HB2 HIS 108 HB2 HIS 108 28.843 3.027 5.330 835 HB3 HIS 108 HB1 HIS 108 29.267 4.656 5.844 836 HD1 HIS 108 HD1 HIS 108 31.247 5.822 4.513 837 HD2 HIS 108 HD2 HIS 108 29.881 2.244 2.895 838 HE1 HIS 108 HE1 HIS 108 32.126 5.766 2.157 839 HE2 HIS 108 HE2 HIS 108 31.166 3.664 1.151 840 H1 MET 1 HT1 MET 1 -7.027 -3.564 32.278 841 H2 MET 1 HT2 MET 1 -5.880 -4.751 32.661 842 H3 MET 1 HT3 MET 1 -7.306 -5.183 31.854 843 HA MET 1 HA MET 1 -6.644 -3.836 29.952 844 HB2 MET 1 HB2 MET 1 -4.375 -2.975 29.814 845 HB3 MET 1 HB1 MET 1 -5.184 -2.284 31.213 846 HG2 MET 1 HG2 MET 1 -4.035 -3.950 32.641 847 HG3 MET 1 HG1 MET 1 -3.156 -4.509 31.220 848 HE1 MET 1 HE1 MET 1 -2.718 -0.296 33.060 849 HE2 MET 1 HE2 MET 1 -3.742 -1.564 33.733 850 HE3 MET 1 HE3 MET 1 -4.167 -0.811 32.196 851 H ALA 2 HN ALA 2 -5.347 -4.784 28.248 852 HA ALA 2 HA ALA 2 -5.149 -7.638 28.611 853 HB1 ALA 2 HB1 ALA 2 -4.641 -5.937 26.173 854 HB2 ALA 2 HB2 ALA 2 -6.170 -6.706 26.599 855 HB3 ALA 2 HB3 ALA 2 -4.767 -7.696 26.199 856 H GLY 3 HN GLY 3 -3.188 -8.506 27.045 857 HA2 GLY 3 HA2 GLY 3 -0.822 -7.891 28.604 858 HA3 GLY 3 HA1 GLY 3 -0.998 -9.192 27.435 859 H GLN 4 HN GLN 4 0.653 -8.901 26.069 860 HA GLN 4 HA GLN 4 1.265 -6.172 25.191 861 HB2 GLN 4 HB2 GLN 4 2.943 -8.686 25.113 862 HB3 GLN 4 HB1 GLN 4 3.452 -7.122 24.491 863 HG2 GLN 4 HG2 GLN 4 3.358 -6.158 26.691 864 HG3 GLN 4 HG1 GLN 4 2.686 -7.646 27.351 865 HE21 GLN 4 HE21 GLN 4 4.347 -7.865 28.823 866 HE22 GLN 4 HE22 GLN 4 5.945 -8.349 28.351 867 H SER 5 HN SER 5 0.002 -5.760 23.490 868 HA SER 5 HA SER 5 0.301 -7.531 21.144 869 HB2 SER 5 HB2 SER 5 -1.831 -5.426 21.599 870 HB3 SER 5 HB1 SER 5 -1.788 -6.641 20.322 871 HG SER 5 HG SER 5 -2.746 -6.836 22.841 872 H ASP 6 HN ASP 6 1.783 -5.145 22.479 873 HA ASP 6 HA ASP 6 1.597 -2.915 20.764 874 HB2 ASP 6 HB2 ASP 6 3.782 -3.741 22.688 875 HB3 ASP 6 HB1 ASP 6 3.663 -2.162 21.920 876 H ARG 7 HN ARG 7 3.389 -5.869 20.537 877 HA ARG 7 HA ARG 7 5.585 -5.022 19.026 878 HB2 ARG 7 HB2 ARG 7 4.163 -7.669 19.158 879 HB3 ARG 7 HB1 ARG 7 5.574 -7.414 18.143 880 HG2 ARG 7 HG2 ARG 7 6.702 -6.598 20.316 881 HG3 ARG 7 HG1 ARG 7 5.372 -7.436 21.121 882 HD2 ARG 7 HD2 ARG 7 7.327 -8.890 20.890 883 HD3 ARG 7 HD1 ARG 7 5.956 -9.501 19.962 884 HE ARG 7 HE ARG 7 7.402 -7.950 18.201 885 HH11 ARG 7 HH11 ARG 7 7.971 -10.827 20.126 886 HH12 ARG 7 HH12 ARG 7 9.216 -11.442 19.069 887 HH21 ARG 7 HH21 ARG 7 9.009 -8.761 16.794 888 HH22 ARG 7 HH22 ARG 7 9.797 -10.266 17.169 889 H LYS 8 HN LYS 8 2.584 -6.549 17.842 890 HA LYS 8 HA LYS 8 3.244 -6.078 15.123 891 HB2 LYS 8 HB2 LYS 8 0.566 -6.703 16.376 892 HB3 LYS 8 HB1 LYS 8 0.917 -6.760 14.654 893 HG2 LYS 8 HG2 LYS 8 2.602 -8.510 15.085 894 HG3 LYS 8 HG1 LYS 8 2.155 -8.484 16.791 895 HD2 LYS 8 HD2 LYS 8 1.019 -10.316 15.741 896 HD3 LYS 8 HD1 LYS 8 -0.174 -9.072 16.117 897 HE2 LYS 8 HE2 LYS 8 -0.161 -8.317 13.820 898 HE3 LYS 8 HE1 LYS 8 1.121 -9.459 13.421 899 HZ1 LYS 8 HZ1 LYS 8 -1.637 -10.148 14.276 900 HZ2 LYS 8 HZ2 LYS 8 -0.408 -11.273 13.984 901 HZ3 LYS 8 HZ3 LYS 8 -1.002 -10.311 12.714 902 H ALA 9 HN ALA 9 1.502 -4.261 17.543 903 HA ALA 9 HA ALA 9 0.130 -2.445 15.934 904 HB1 ALA 9 HB1 ALA 9 -0.179 -2.638 18.362 905 HB2 ALA 9 HB2 ALA 9 0.109 -0.971 17.861 906 HB3 ALA 9 HB3 ALA 9 1.404 -1.901 18.613 907 H ALA 10 HN ALA 10 3.468 -2.355 17.123 908 HA ALA 10 HA ALA 10 4.114 0.178 16.029 909 HB1 ALA 10 HB1 ALA 10 6.433 -0.441 16.439 910 HB2 ALA 10 HB2 ALA 10 5.953 -2.120 16.690 911 HB3 ALA 10 HB3 ALA 10 5.419 -0.874 17.817 912 H LEU 11 HN LEU 11 4.148 -3.083 14.752 913 HA LEU 11 HA LEU 11 5.716 -2.456 12.444 914 HB2 LEU 11 HB2 LEU 11 3.875 -4.789 12.994 915 HB3 LEU 11 HB1 LEU 11 4.981 -4.675 11.637 916 HG LEU 11 HG LEU 11 5.808 -4.729 14.541 917 HD11 LEU 11 HD11 LEU 11 6.657 -6.973 14.034 918 HD12 LEU 11 HD12 LEU 11 5.940 -6.872 12.427 919 HD13 LEU 11 HD13 LEU 11 4.907 -6.872 13.856 920 HD21 LEU 11 HD21 LEU 11 8.068 -5.011 13.657 921 HD22 LEU 11 HD22 LEU 11 7.361 -3.479 13.141 922 HD23 LEU 11 HD23 LEU 11 7.449 -4.835 12.015 923 H LEU 12 HN LEU 12 2.270 -2.769 13.143 924 HA LEU 12 HA LEU 12 1.309 -2.315 10.540 925 HB2 LEU 12 HB2 LEU 12 0.039 -1.663 13.197 926 HB3 LEU 12 HB1 LEU 12 -0.800 -1.642 11.657 927 HG LEU 12 HG LEU 12 0.436 -4.078 12.950 928 HD11 LEU 12 HD11 LEU 12 -1.565 -3.287 14.107 929 HD12 LEU 12 HD12 LEU 12 -1.865 -4.810 13.269 930 HD13 LEU 12 HD13 LEU 12 -2.452 -3.294 12.583 931 HD21 LEU 12 HD21 LEU 12 0.497 -4.143 10.490 932 HD22 LEU 12 HD22 LEU 12 -1.241 -3.845 10.452 933 HD23 LEU 12 HD23 LEU 12 -0.618 -5.335 11.160 934 H ASP 13 HN ASP 13 2.319 -0.120 13.091 935 HA ASP 13 HA ASP 13 1.394 2.284 11.981 936 HB2 ASP 13 HB2 ASP 13 2.219 2.230 14.253 937 HB3 ASP 13 HB1 ASP 13 3.821 1.746 13.706 938 H GLN 14 HN GLN 14 4.501 0.607 11.598 939 HA GLN 14 HA GLN 14 5.609 2.446 9.760 940 HB2 GLN 14 HB2 GLN 14 6.944 0.766 10.989 941 HB3 GLN 14 HB1 GLN 14 6.186 -0.513 10.050 942 HG2 GLN 14 HG2 GLN 14 8.370 -0.059 9.170 943 HG3 GLN 14 HG1 GLN 14 7.154 0.451 8.002 944 HE21 GLN 14 HE21 GLN 14 7.967 2.271 10.884 945 HE22 GLN 14 HE22 GLN 14 8.711 3.603 10.064 946 H VAL 15 HN VAL 15 3.722 -0.519 9.321 947 HA VAL 15 HA VAL 15 3.798 -0.654 6.529 948 HB VAL 15 HB VAL 15 1.648 -1.565 8.448 949 HG11 VAL 15 HG11 VAL 15 0.811 -2.972 6.642 950 HG12 VAL 15 HG12 VAL 15 1.996 -2.274 5.537 951 HG13 VAL 15 HG13 VAL 15 0.711 -1.268 6.203 952 HG21 VAL 15 HG21 VAL 15 3.859 -3.065 7.045 953 HG22 VAL 15 HG22 VAL 15 2.640 -3.776 8.103 954 HG23 VAL 15 HG23 VAL 15 3.818 -2.639 8.757 955 H ALA 16 HN ALA 16 1.421 0.914 8.662 956 HA ALA 16 HA ALA 16 -0.291 1.875 6.665 957 HB1 ALA 16 HB1 ALA 16 -1.122 3.418 8.359 958 HB2 ALA 16 HB2 ALA 16 0.281 3.079 9.370 959 HB3 ALA 16 HB3 ALA 16 -0.891 1.804 9.034 960 H ARG 17 HN ARG 17 2.731 3.113 7.899 961 HA ARG 17 HA ARG 17 2.505 5.723 6.779 962 HB2 ARG 17 HB2 ARG 17 4.049 4.963 8.656 963 HB3 ARG 17 HB1 ARG 17 5.064 4.255 7.409 964 HG2 ARG 17 HG2 ARG 17 5.591 6.355 6.497 965 HG3 ARG 17 HG1 ARG 17 4.301 7.157 7.397 966 HD2 ARG 17 HD2 ARG 17 6.815 5.937 8.525 967 HD3 ARG 17 HD1 ARG 17 6.410 7.651 8.448 968 HE ARG 17 HE ARG 17 4.422 6.230 9.881 969 HH11 ARG 17 HH11 ARG 17 7.672 7.509 10.215 970 HH12 ARG 17 HH12 ARG 17 7.588 7.570 11.953 971 HH21 ARG 17 HH21 ARG 17 4.318 6.340 12.143 972 HH22 ARG 17 HH22 ARG 17 5.684 6.919 13.041 973 H VAL 18 HN VAL 18 3.903 2.674 5.716 974 HA VAL 18 HA VAL 18 4.974 3.554 3.261 975 HB VAL 18 HB VAL 18 3.879 0.830 4.010 976 HG11 VAL 18 HG11 VAL 18 3.991 1.060 1.592 977 HG12 VAL 18 HG12 VAL 18 5.253 -0.031 2.163 978 HG13 VAL 18 HG13 VAL 18 5.657 1.624 1.705 979 HG21 VAL 18 HG21 VAL 18 6.205 0.234 4.422 980 HG22 VAL 18 HG22 VAL 18 5.710 1.582 5.446 981 HG23 VAL 18 HG23 VAL 18 6.707 1.875 4.022 982 H GLY 19 HN GLY 19 1.829 2.115 4.080 983 HA2 GLY 19 HA2 GLY 19 0.722 2.238 1.492 984 HA3 GLY 19 HA1 GLY 19 -0.190 2.148 2.992 985 H LYS 20 HN LYS 20 0.856 4.598 4.096 986 HA LYS 20 HA LYS 20 -0.999 6.420 2.998 987 HB2 LYS 20 HB2 LYS 20 -0.198 6.388 5.370 988 HB3 LYS 20 HB1 LYS 20 1.333 7.047 4.817 989 HG2 LYS 20 HG2 LYS 20 0.326 9.084 4.164 990 HG3 LYS 20 HG1 LYS 20 -1.297 8.419 4.346 991 HD2 LYS 20 HD2 LYS 20 0.677 8.827 6.592 992 HD3 LYS 20 HD1 LYS 20 -0.666 9.905 6.210 993 HE2 LYS 20 HE2 LYS 20 -2.240 8.058 6.602 994 HE3 LYS 20 HE1 LYS 20 -0.889 7.009 7.023 995 HZ1 LYS 20 HZ1 LYS 20 -1.910 7.855 9.012 996 HZ2 LYS 20 HZ2 LYS 20 -1.742 9.454 8.481 997 HZ3 LYS 20 HZ3 LYS 20 -0.364 8.539 8.860 998 H ALA 21 HN ALA 21 2.419 5.881 2.449 999 HA ALA 21 HA ALA 21 2.811 8.240 0.870 1000 HB1 ALA 21 HB1 ALA 21 4.908 7.167 0.173 1001 HB2 ALA 21 HB2 ALA 21 4.394 5.670 0.948 1002 HB3 ALA 21 HB3 ALA 21 4.699 7.107 1.923 1003 H LEU 22 HN LEU 22 1.707 5.000 0.298 1004 HA LEU 22 HA LEU 22 1.841 5.198 -2.599 1005 HB2 LEU 22 HB2 LEU 22 2.305 3.124 -1.149 1006 HB3 LEU 22 HB1 LEU 22 0.568 3.020 -0.951 1007 HG LEU 22 HG LEU 22 0.508 2.972 -3.547 1008 HD11 LEU 22 HD11 LEU 22 2.496 1.979 -4.557 1009 HD12 LEU 22 HD12 LEU 22 3.351 2.124 -3.022 1010 HD13 LEU 22 HD13 LEU 22 2.846 3.574 -3.888 1011 HD21 LEU 22 HD21 LEU 22 1.578 0.644 -1.957 1012 HD22 LEU 22 HD22 LEU 22 0.771 0.545 -3.521 1013 HD23 LEU 22 HD23 LEU 22 -0.117 1.103 -2.104 1014 H ALA 23 HN ALA 23 -0.004 6.938 -0.922 1015 HA ALA 23 HA ALA 23 -2.636 5.794 -1.445 1016 HB1 ALA 23 HB1 ALA 23 -1.901 8.202 0.200 1017 HB2 ALA 23 HB2 ALA 23 -2.099 6.560 0.816 1018 HB3 ALA 23 HB3 ALA 23 -3.478 7.416 0.129 1019 H ASN 24 HN ASN 24 -0.843 7.406 -3.474 1020 HA ASN 24 HA ASN 24 -3.151 8.665 -4.652 1021 HB2 ASN 24 HB2 ASN 24 -2.053 10.845 -5.074 1022 HB3 ASN 24 HB1 ASN 24 -2.384 10.548 -3.374 1023 HD21 ASN 24 HD21 ASN 24 -0.895 11.990 -2.668 1024 HD22 ASN 24 HD22 ASN 24 0.810 11.737 -2.810 1025 H GLY 25 HN GLY 25 -2.411 9.756 -6.855 1026 HA2 GLY 25 HA2 GLY 25 -1.495 7.343 -8.188 1027 HA3 GLY 25 HA1 GLY 25 -2.373 8.669 -8.921 1028 H ARG 26 HN ARG 26 -0.637 10.827 -8.294 1029 HA ARG 26 HA ARG 26 1.065 10.423 -10.514 1030 HB2 ARG 26 HB2 ARG 26 -0.036 12.577 -10.032 1031 HB3 ARG 26 HB1 ARG 26 1.001 12.773 -8.622 1032 HG2 ARG 26 HG2 ARG 26 2.818 13.260 -9.849 1033 HG3 ARG 26 HG1 ARG 26 2.335 12.215 -11.179 1034 HD2 ARG 26 HD2 ARG 26 2.205 14.407 -12.024 1035 HD3 ARG 26 HD1 ARG 26 0.544 13.928 -11.688 1036 HE ARG 26 HE ARG 26 1.340 15.218 -9.422 1037 HH11 ARG 26 HH11 ARG 26 1.240 16.012 -12.825 1038 HH12 ARG 26 HH12 ARG 26 1.077 17.724 -12.566 1039 HH21 ARG 26 HH21 ARG 26 1.098 17.476 -9.053 1040 HH22 ARG 26 HH22 ARG 26 0.968 18.557 -10.418 1041 H ARG 27 HN ARG 27 1.583 10.109 -7.084 1042 HA ARG 27 HA ARG 27 4.447 10.240 -7.316 1043 HB2 ARG 27 HB2 ARG 27 2.717 9.130 -5.096 1044 HB3 ARG 27 HB1 ARG 27 4.469 9.270 -5.020 1045 HG2 ARG 27 HG2 ARG 27 4.085 11.764 -5.509 1046 HG3 ARG 27 HG1 ARG 27 2.412 11.444 -5.056 1047 HD2 ARG 27 HD2 ARG 27 4.833 10.918 -3.333 1048 HD3 ARG 27 HD1 ARG 27 3.745 12.293 -3.173 1049 HE ARG 27 HE ARG 27 2.701 9.562 -2.885 1050 HH11 ARG 27 HH11 ARG 27 3.302 12.746 -1.563 1051 HH12 ARG 27 HH12 ARG 27 2.458 12.432 -0.082 1052 HH21 ARG 27 HH21 ARG 27 1.572 9.149 -0.949 1053 HH22 ARG 27 HH22 ARG 27 1.452 10.389 0.266 1054 H LEU 28 HN LEU 28 2.025 7.890 -7.910 1055 HA LEU 28 HA LEU 28 3.751 5.594 -7.828 1056 HB2 LEU 28 HB2 LEU 28 1.127 5.961 -9.279 1057 HB3 LEU 28 HB1 LEU 28 1.924 4.432 -8.961 1058 HG LEU 28 HG LEU 28 0.743 6.286 -6.897 1059 HD11 LEU 28 HD11 LEU 28 -0.127 3.575 -7.883 1060 HD12 LEU 28 HD12 LEU 28 -0.937 5.111 -8.197 1061 HD13 LEU 28 HD13 LEU 28 -0.862 4.474 -6.555 1062 HD21 LEU 28 HD21 LEU 28 2.059 3.595 -6.558 1063 HD22 LEU 28 HD22 LEU 28 1.264 4.532 -5.293 1064 HD23 LEU 28 HD23 LEU 28 2.731 5.146 -6.055 1065 H GLN 29 HN GLN 29 2.751 7.976 -10.174 1066 HA GLN 29 HA GLN 29 3.739 6.810 -12.522 1067 HB2 GLN 29 HB2 GLN 29 2.323 8.908 -12.294 1068 HB3 GLN 29 HB1 GLN 29 3.794 9.761 -11.849 1069 HG2 GLN 29 HG2 GLN 29 4.765 9.253 -14.014 1070 HG3 GLN 29 HG1 GLN 29 3.325 8.333 -14.458 1071 HE21 GLN 29 HE21 GLN 29 4.493 10.678 -15.737 1072 HE22 GLN 29 HE22 GLN 29 3.254 11.883 -15.747 1073 H ILE 30 HN ILE 30 5.275 8.637 -9.961 1074 HA ILE 30 HA ILE 30 7.857 8.839 -11.074 1075 HB ILE 30 HB ILE 30 7.036 8.672 -8.168 1076 HG12 ILE 30 HG12 ILE 30 7.617 11.081 -9.907 1077 HG13 ILE 30 HG11 ILE 30 6.012 10.548 -9.417 1078 HG21 ILE 30 HG21 ILE 30 9.624 9.581 -9.414 1079 HG22 ILE 30 HG22 ILE 30 9.382 8.151 -8.412 1080 HG23 ILE 30 HG23 ILE 30 9.198 9.759 -7.713 1081 HD11 ILE 30 HD11 ILE 30 6.587 10.960 -7.083 1082 HD12 ILE 30 HD12 ILE 30 6.781 12.412 -8.065 1083 HD13 ILE 30 HD13 ILE 30 8.198 11.484 -7.571 1084 H LEU 31 HN LEU 31 6.380 6.447 -8.903 1085 HA LEU 31 HA LEU 31 8.619 4.787 -8.596 1086 HB2 LEU 31 HB2 LEU 31 5.684 4.094 -8.482 1087 HB3 LEU 31 HB1 LEU 31 6.977 3.046 -7.935 1088 HG LEU 31 HG LEU 31 6.310 5.749 -6.767 1089 HD11 LEU 31 HD11 LEU 31 5.550 4.473 -4.828 1090 HD12 LEU 31 HD12 LEU 31 5.850 2.968 -5.697 1091 HD13 LEU 31 HD13 LEU 31 4.607 4.083 -6.266 1092 HD21 LEU 31 HD21 LEU 31 8.305 3.658 -5.899 1093 HD22 LEU 31 HD22 LEU 31 7.906 5.133 -5.018 1094 HD23 LEU 31 HD23 LEU 31 8.684 5.232 -6.597 1095 H ASP 32 HN ASP 32 6.086 4.851 -11.040 1096 HA ASP 32 HA ASP 32 6.708 2.460 -12.366 1097 HB2 ASP 32 HB2 ASP 32 4.662 3.656 -12.858 1098 HB3 ASP 32 HB1 ASP 32 5.570 5.049 -13.437 1099 H LEU 33 HN LEU 33 7.954 5.756 -12.831 1100 HA LEU 33 HA LEU 33 9.760 5.062 -14.911 1101 HB2 LEU 33 HB2 LEU 33 9.035 7.372 -14.495 1102 HB3 LEU 33 HB1 LEU 33 9.863 7.360 -12.950 1103 HG LEU 33 HG LEU 33 12.021 7.058 -14.155 1104 HD11 LEU 33 HD11 LEU 33 10.334 7.528 -16.606 1105 HD12 LEU 33 HD12 LEU 33 11.170 6.032 -16.190 1106 HD13 LEU 33 HD13 LEU 33 12.097 7.489 -16.557 1107 HD21 LEU 33 HD21 LEU 33 10.396 9.475 -14.929 1108 HD22 LEU 33 HD22 LEU 33 12.156 9.359 -14.973 1109 HD23 LEU 33 HD23 LEU 33 11.305 9.260 -13.432 1110 H LEU 34 HN LEU 34 9.949 5.034 -11.416 1111 HA LEU 34 HA LEU 34 12.790 4.587 -11.353 1112 HB2 LEU 34 HB2 LEU 34 10.700 4.358 -9.194 1113 HB3 LEU 34 HB1 LEU 34 12.427 4.205 -8.928 1114 HG LEU 34 HG LEU 34 10.973 6.677 -9.868 1115 HD11 LEU 34 HD11 LEU 34 10.698 6.191 -7.492 1116 HD12 LEU 34 HD12 LEU 34 11.705 7.617 -7.744 1117 HD13 LEU 34 HD13 LEU 34 12.450 6.078 -7.311 1118 HD21 LEU 34 HD21 LEU 34 13.915 6.222 -9.393 1119 HD22 LEU 34 HD22 LEU 34 13.156 7.779 -9.725 1120 HD23 LEU 34 HD23 LEU 34 13.142 6.513 -10.953 1121 H ALA 35 HN ALA 35 10.192 2.626 -12.086 1122 HA ALA 35 HA ALA 35 11.125 0.158 -11.007 1123 HB1 ALA 35 HB1 ALA 35 9.347 0.651 -13.396 1124 HB2 ALA 35 HB2 ALA 35 8.810 0.450 -11.728 1125 HB3 ALA 35 HB3 ALA 35 9.574 -0.895 -12.575 1126 H GLN 36 HN GLN 36 12.389 2.191 -13.284 1127 HA GLN 36 HA GLN 36 13.712 0.154 -14.876 1128 HB2 GLN 36 HB2 GLN 36 13.955 3.166 -14.793 1129 HB3 GLN 36 HB1 GLN 36 14.857 2.134 -15.896 1130 HG2 GLN 36 HG2 GLN 36 12.857 1.422 -16.980 1131 HG3 GLN 36 HG1 GLN 36 11.856 2.221 -15.768 1132 HE21 GLN 36 HE21 GLN 36 10.809 3.370 -17.393 1133 HE22 GLN 36 HE22 GLN 36 11.552 4.722 -18.179 1134 H GLY 37 HN GLY 37 14.148 1.656 -11.893 1135 HA2 GLY 37 HA2 GLY 37 16.001 0.612 -10.595 1136 HA3 GLY 37 HA1 GLY 37 17.039 1.063 -11.940 1137 H GLU 38 HN GLU 38 18.023 2.978 -11.873 1138 HA GLU 38 HA GLU 38 17.222 4.838 -9.732 1139 HB2 GLU 38 HB2 GLU 38 20.019 4.389 -10.789 1140 HB3 GLU 38 HB1 GLU 38 19.549 5.313 -9.366 1141 HG2 GLU 38 HG2 GLU 38 18.986 3.388 -8.160 1142 HG3 GLU 38 HG1 GLU 38 18.977 2.385 -9.607 1143 H ARG 39 HN ARG 39 16.392 6.652 -10.567 1144 HA ARG 39 HA ARG 39 17.552 7.672 -13.079 1145 HB2 ARG 39 HB2 ARG 39 14.671 7.718 -12.175 1146 HB3 ARG 39 HB1 ARG 39 15.278 8.679 -13.517 1147 HG2 ARG 39 HG2 ARG 39 15.282 5.670 -13.331 1148 HG3 ARG 39 HG1 ARG 39 14.223 6.663 -14.341 1149 HD2 ARG 39 HD2 ARG 39 16.091 7.450 -15.624 1150 HD3 ARG 39 HD1 ARG 39 17.229 6.656 -14.538 1151 HE ARG 39 HE ARG 39 15.443 5.294 -16.444 1152 HH11 ARG 39 HH11 ARG 39 18.177 5.241 -14.257 1153 HH12 ARG 39 HH12 ARG 39 18.876 3.808 -14.950 1154 HH21 ARG 39 HH21 ARG 39 16.364 3.396 -17.366 1155 HH22 ARG 39 HH22 ARG 39 17.842 2.755 -16.701 1156 H ALA 40 HN ALA 40 17.819 9.903 -13.272 1157 HA ALA 40 HA ALA 40 18.388 11.248 -10.824 1158 HB1 ALA 40 HB1 ALA 40 19.731 11.598 -12.847 1159 HB2 ALA 40 HB2 ALA 40 19.072 13.116 -12.233 1160 HB3 ALA 40 HB3 ALA 40 18.339 12.339 -13.636 1161 H VAL 41 HN VAL 41 17.432 13.137 -9.998 1162 HA VAL 41 HA VAL 41 14.652 13.109 -9.864 1163 HB VAL 41 HB VAL 41 16.441 15.471 -9.263 1164 HG11 VAL 41 HG11 VAL 41 13.703 14.757 -8.216 1165 HG12 VAL 41 HG12 VAL 41 14.068 16.054 -9.353 1166 HG13 VAL 41 HG13 VAL 41 14.679 16.133 -7.702 1167 HG21 VAL 41 HG21 VAL 41 17.210 13.479 -8.110 1168 HG22 VAL 41 HG22 VAL 41 15.583 13.195 -7.492 1169 HG23 VAL 41 HG23 VAL 41 16.488 14.618 -6.973 1170 H GLU 42 HN GLU 42 16.793 15.025 -11.908 1171 HA GLU 42 HA GLU 42 14.900 16.799 -12.958 1172 HB2 GLU 42 HB2 GLU 42 17.363 15.672 -14.302 1173 HB3 GLU 42 HB1 GLU 42 16.474 17.096 -14.828 1174 HG2 GLU 42 HG2 GLU 42 17.035 18.229 -12.753 1175 HG3 GLU 42 HG1 GLU 42 17.891 16.797 -12.189 1176 H ALA 43 HN ALA 43 15.840 13.548 -13.974 1177 HA ALA 43 HA ALA 43 14.278 13.531 -16.351 1178 HB1 ALA 43 HB1 ALA 43 15.326 11.213 -14.725 1179 HB2 ALA 43 HB2 ALA 43 16.171 12.015 -16.048 1180 HB3 ALA 43 HB3 ALA 43 14.688 11.117 -16.367 1181 H ILE 44 HN ILE 44 13.773 12.420 -13.048 1182 HA ILE 44 HA ILE 44 11.270 11.223 -13.350 1183 HB ILE 44 HB ILE 44 12.341 12.735 -10.960 1184 HG12 ILE 44 HG12 ILE 44 12.379 9.773 -11.574 1185 HG13 ILE 44 HG11 ILE 44 13.761 10.850 -11.749 1186 HG21 ILE 44 HG21 ILE 44 10.734 11.429 -9.650 1187 HG22 ILE 44 HG22 ILE 44 10.098 10.723 -11.137 1188 HG23 ILE 44 HG23 ILE 44 9.922 12.452 -10.836 1189 HD11 ILE 44 HD11 ILE 44 13.930 9.606 -9.701 1190 HD12 ILE 44 HD12 ILE 44 12.332 10.158 -9.195 1191 HD13 ILE 44 HD13 ILE 44 13.662 11.310 -9.333 1192 H ALA 45 HN ALA 45 12.090 14.568 -12.471 1193 HA ALA 45 HA ALA 45 9.487 15.555 -12.241 1194 HB1 ALA 45 HB1 ALA 45 10.485 17.769 -12.506 1195 HB2 ALA 45 HB2 ALA 45 11.976 17.031 -13.095 1196 HB3 ALA 45 HB3 ALA 45 11.451 16.754 -11.433 1197 H THR 46 HN THR 46 11.586 15.266 -15.058 1198 HA THR 46 HA THR 46 9.981 16.781 -16.824 1199 HB THR 46 HB THR 46 11.906 14.559 -17.542 1200 HG1 THR 46 HG1 THR 46 12.887 16.216 -16.253 1201 HG21 THR 46 HG21 THR 46 12.121 15.759 -19.670 1202 HG22 THR 46 HG22 THR 46 10.922 16.934 -19.132 1203 HG23 THR 46 HG23 THR 46 10.455 15.254 -19.394 1204 H ALA 47 HN ALA 47 10.197 13.278 -16.208 1205 HA ALA 47 HA ALA 47 8.363 12.546 -18.240 1206 HB1 ALA 47 HB1 ALA 47 9.144 11.000 -15.773 1207 HB2 ALA 47 HB2 ALA 47 10.023 11.000 -17.302 1208 HB3 ALA 47 HB3 ALA 47 8.387 10.344 -17.226 1209 H THR 48 HN THR 48 7.955 13.545 -14.928 1210 HA THR 48 HA THR 48 5.189 12.633 -14.874 1211 HB THR 48 HB THR 48 5.246 13.575 -12.524 1212 HG1 THR 48 HG1 THR 48 8.065 13.597 -12.865 1213 HG21 THR 48 HG21 THR 48 5.540 11.190 -12.978 1214 HG22 THR 48 HG22 THR 48 6.566 11.702 -11.637 1215 HG23 THR 48 HG23 THR 48 7.267 11.441 -13.236 1216 H GLY 49 HN GLY 49 6.810 15.322 -15.945 1217 HA2 GLY 49 HA2 GLY 49 6.057 17.369 -16.670 1218 HA3 GLY 49 HA1 GLY 49 4.426 16.819 -16.316 1219 H MET 50 HN MET 50 7.075 17.039 -14.021 1220 HA MET 50 HA MET 50 5.646 19.229 -12.661 1221 HB2 MET 50 HB2 MET 50 7.008 16.832 -11.409 1222 HB3 MET 50 HB1 MET 50 6.450 18.230 -10.502 1223 HG2 MET 50 HG2 MET 50 4.152 17.774 -11.321 1224 HG3 MET 50 HG1 MET 50 4.759 16.301 -12.072 1225 HE1 MET 50 HE1 MET 50 6.771 15.073 -10.067 1226 HE2 MET 50 HE2 MET 50 5.450 14.124 -10.753 1227 HE3 MET 50 HE3 MET 50 5.742 14.101 -9.014 1228 H ASN 51 HN ASN 51 7.213 20.231 -10.934 1229 HA ASN 51 HA ASN 51 9.649 20.966 -12.358 1230 HB2 ASN 51 HB2 ASN 51 8.370 22.072 -9.842 1231 HB3 ASN 51 HB1 ASN 51 9.868 22.680 -10.536 1232 HD21 ASN 51 HD21 ASN 51 9.807 23.876 -12.417 1233 HD22 ASN 51 HD22 ASN 51 8.333 24.529 -13.050 1234 H LEU 52 HN LEU 52 11.655 21.254 -10.951 1235 HA LEU 52 HA LEU 52 12.414 18.780 -9.838 1236 HB2 LEU 52 HB2 LEU 52 13.630 21.519 -9.843 1237 HB3 LEU 52 HB1 LEU 52 14.316 20.272 -8.823 1238 HG LEU 52 HG LEU 52 15.561 20.411 -10.880 1239 HD11 LEU 52 HD11 LEU 52 15.304 18.214 -9.880 1240 HD12 LEU 52 HD12 LEU 52 15.398 18.102 -11.637 1241 HD13 LEU 52 HD13 LEU 52 13.840 17.942 -10.824 1242 HD21 LEU 52 HD21 LEU 52 12.947 19.875 -12.280 1243 HD22 LEU 52 HD22 LEU 52 14.535 19.903 -13.048 1244 HD23 LEU 52 HD23 LEU 52 13.876 21.375 -12.330 1245 H THR 53 HN THR 53 11.348 21.812 -8.413 1246 HA THR 53 HA THR 53 11.640 21.150 -5.709 1247 HB THR 53 HB THR 53 9.729 22.823 -5.393 1248 HG1 THR 53 HG1 THR 53 8.940 23.828 -7.191 1249 HG21 THR 53 HG21 THR 53 12.121 23.663 -7.037 1250 HG22 THR 53 HG22 THR 53 12.084 23.470 -5.285 1251 HG23 THR 53 HG23 THR 53 11.119 24.730 -6.054 1252 H THR 54 HN THR 54 8.848 20.815 -7.867 1253 HA THR 54 HA THR 54 7.088 19.640 -6.035 1254 HB THR 54 HB THR 54 7.042 18.978 -8.965 1255 HG1 THR 54 HG1 THR 54 6.544 21.492 -7.706 1256 HG21 THR 54 HG21 THR 54 4.623 19.206 -8.652 1257 HG22 THR 54 HG22 THR 54 4.877 19.664 -6.968 1258 HG23 THR 54 HG23 THR 54 5.295 18.040 -7.514 1259 H ALA 55 HN ALA 55 9.321 18.178 -8.383 1260 HA ALA 55 HA ALA 55 8.647 15.499 -7.937 1261 HB1 ALA 55 HB1 ALA 55 10.807 14.960 -8.944 1262 HB2 ALA 55 HB2 ALA 55 11.309 16.640 -8.767 1263 HB3 ALA 55 HB3 ALA 55 9.978 16.228 -9.844 1264 H SER 56 HN SER 56 11.220 17.469 -6.461 1265 HA SER 56 HA SER 56 12.315 15.439 -4.873 1266 HB2 SER 56 HB2 SER 56 12.275 18.408 -4.283 1267 HB3 SER 56 HB1 SER 56 13.407 17.224 -3.628 1268 HG SER 56 HG SER 56 13.164 18.165 -6.285 1269 H ALA 57 HN ALA 57 9.677 17.700 -4.233 1270 HA ALA 57 HA ALA 57 9.377 17.093 -1.490 1271 HB1 ALA 57 HB1 ALA 57 7.325 18.114 -3.445 1272 HB2 ALA 57 HB2 ALA 57 8.429 19.101 -2.488 1273 HB3 ALA 57 HB3 ALA 57 7.181 18.144 -1.688 1274 H ASN 58 HN ASN 58 7.785 15.822 -4.390 1275 HA ASN 58 HA ASN 58 6.121 13.990 -2.990 1276 HB2 ASN 58 HB2 ASN 58 6.957 14.243 -5.871 1277 HB3 ASN 58 HB1 ASN 58 5.999 12.873 -5.322 1278 HD21 ASN 58 HD21 ASN 58 6.044 16.318 -5.844 1279 HD22 ASN 58 HD22 ASN 58 4.329 16.552 -5.731 1280 H LEU 59 HN LEU 59 9.306 13.755 -4.481 1281 HA LEU 59 HA LEU 59 9.691 10.991 -4.159 1282 HB2 LEU 59 HB2 LEU 59 11.590 13.315 -4.328 1283 HB3 LEU 59 HB1 LEU 59 12.171 11.676 -4.104 1284 HG LEU 59 HG LEU 59 10.470 12.549 -6.438 1285 HD11 LEU 59 HD11 LEU 59 12.596 13.701 -6.534 1286 HD12 LEU 59 HD12 LEU 59 12.561 12.413 -7.739 1287 HD13 LEU 59 HD13 LEU 59 13.457 12.190 -6.236 1288 HD21 LEU 59 HD21 LEU 59 10.299 10.184 -5.919 1289 HD22 LEU 59 HD22 LEU 59 12.058 10.042 -5.901 1290 HD23 LEU 59 HD23 LEU 59 11.218 10.423 -7.405 1291 H GLN 60 HN GLN 60 10.537 13.717 -2.043 1292 HA GLN 60 HA GLN 60 11.813 12.133 -0.088 1293 HB2 GLN 60 HB2 GLN 60 12.091 14.605 -0.405 1294 HB3 GLN 60 HB1 GLN 60 10.509 14.825 0.329 1295 HG2 GLN 60 HG2 GLN 60 11.277 13.942 2.408 1296 HG3 GLN 60 HG1 GLN 60 12.816 13.462 1.692 1297 HE21 GLN 60 HE21 GLN 60 10.893 16.099 2.855 1298 HE22 GLN 60 HE22 GLN 60 12.159 17.274 2.898 1299 H ALA 61 HN ALA 61 8.466 12.946 -0.634 1300 HA ALA 61 HA ALA 61 7.441 12.125 1.867 1301 HB1 ALA 61 HB1 ALA 61 6.133 13.379 0.185 1302 HB2 ALA 61 HB2 ALA 61 5.305 11.926 0.745 1303 HB3 ALA 61 HB3 ALA 61 6.098 11.937 -0.829 1304 H LEU 62 HN LEU 62 7.898 10.374 -1.193 1305 HA LEU 62 HA LEU 62 7.140 7.830 -0.194 1306 HB2 LEU 62 HB2 LEU 62 8.992 8.478 -2.490 1307 HB3 LEU 62 HB1 LEU 62 8.198 6.941 -2.211 1308 HG LEU 62 HG LEU 62 6.761 9.527 -2.818 1309 HD11 LEU 62 HD11 LEU 62 8.077 8.787 -4.726 1310 HD12 LEU 62 HD12 LEU 62 6.358 8.547 -5.026 1311 HD13 LEU 62 HD13 LEU 62 7.378 7.173 -4.599 1312 HD21 LEU 62 HD21 LEU 62 5.414 7.982 -1.516 1313 HD22 LEU 62 HD22 LEU 62 5.788 6.678 -2.642 1314 HD23 LEU 62 HD23 LEU 62 4.827 8.055 -3.178 1315 H LYS 63 HN LYS 63 10.113 9.631 -0.299 1316 HA LYS 63 HA LYS 63 11.925 7.626 0.472 1317 HB2 LYS 63 HB2 LYS 63 12.551 9.819 -0.459 1318 HB3 LYS 63 HB1 LYS 63 11.987 10.602 1.008 1319 HG2 LYS 63 HG2 LYS 63 13.724 9.480 2.288 1320 HG3 LYS 63 HG1 LYS 63 14.278 8.655 0.825 1321 HD2 LYS 63 HD2 LYS 63 14.753 10.828 -0.207 1322 HD3 LYS 63 HD1 LYS 63 14.223 11.639 1.267 1323 HE2 LYS 63 HE2 LYS 63 16.015 10.570 2.515 1324 HE3 LYS 63 HE1 LYS 63 16.524 9.706 1.063 1325 HZ1 LYS 63 HZ1 LYS 63 16.513 12.662 1.386 1326 HZ2 LYS 63 HZ2 LYS 63 17.043 11.811 0.021 1327 HZ3 LYS 63 HZ3 LYS 63 17.883 11.668 1.483 1328 H SER 64 HN SER 64 9.876 9.812 2.343 1329 HA SER 64 HA SER 64 10.870 9.006 4.892 1330 HB2 SER 64 HB2 SER 64 8.219 10.298 4.206 1331 HB3 SER 64 HB1 SER 64 8.975 10.247 5.798 1332 HG SER 64 HG SER 64 9.966 11.551 3.474 1333 H GLY 65 HN GLY 65 8.507 7.774 2.672 1334 HA2 GLY 65 HA2 GLY 65 7.326 5.973 4.616 1335 HA3 GLY 65 HA1 GLY 65 6.971 6.032 2.896 1336 H GLY 66 HN GLY 66 10.231 5.996 3.076 1337 HA2 GLY 66 HA2 GLY 66 11.871 4.375 3.045 1338 HA3 GLY 66 HA1 GLY 66 10.703 3.238 3.700 1339 H LEU 67 HN LEU 67 9.864 4.967 0.839 1340 HA LEU 67 HA LEU 67 9.849 2.458 -0.629 1341 HB2 LEU 67 HB2 LEU 67 8.474 5.058 -0.862 1342 HB3 LEU 67 HB1 LEU 67 8.821 4.244 -2.374 1343 HG LEU 67 HG LEU 67 7.519 2.326 -1.723 1344 HD11 LEU 67 HD11 LEU 67 6.303 2.259 0.414 1345 HD12 LEU 67 HD12 LEU 67 7.163 3.713 0.928 1346 HD13 LEU 67 HD13 LEU 67 8.053 2.220 0.632 1347 HD21 LEU 67 HD21 LEU 67 6.298 4.184 -2.698 1348 HD22 LEU 67 HD22 LEU 67 6.075 4.896 -1.101 1349 HD23 LEU 67 HD23 LEU 67 5.305 3.359 -1.495 1350 H VAL 68 HN VAL 68 11.253 5.707 -0.940 1351 HA VAL 68 HA VAL 68 13.092 4.581 -2.939 1352 HB VAL 68 HB VAL 68 13.072 6.691 -4.180 1353 HG11 VAL 68 HG11 VAL 68 11.615 4.903 -4.918 1354 HG12 VAL 68 HG12 VAL 68 10.852 6.469 -5.201 1355 HG13 VAL 68 HG13 VAL 68 10.339 5.470 -3.841 1356 HG21 VAL 68 HG21 VAL 68 12.439 8.199 -2.362 1357 HG22 VAL 68 HG22 VAL 68 10.819 7.499 -2.342 1358 HG23 VAL 68 HG23 VAL 68 11.376 8.395 -3.755 1359 H GLU 69 HN GLU 69 15.144 5.589 -3.088 1360 HA GLU 69 HA GLU 69 15.859 7.423 -0.920 1361 HB2 GLU 69 HB2 GLU 69 17.364 4.877 -1.567 1362 HB3 GLU 69 HB1 GLU 69 17.929 6.132 -0.470 1363 HG2 GLU 69 HG2 GLU 69 15.777 5.736 0.829 1364 HG3 GLU 69 HG1 GLU 69 15.605 4.271 -0.136 1365 H ALA 70 HN ALA 70 18.041 8.402 -1.289 1366 HA ALA 70 HA ALA 70 18.177 9.106 -4.127 1367 HB1 ALA 70 HB1 ALA 70 19.313 11.126 -3.390 1368 HB2 ALA 70 HB2 ALA 70 19.317 10.534 -1.729 1369 HB3 ALA 70 HB3 ALA 70 17.790 10.914 -2.525 1370 H ARG 71 HN ARG 71 20.008 9.046 -5.314 1371 HA ARG 71 HA ARG 71 22.364 7.753 -4.104 1372 HB2 ARG 71 HB2 ARG 71 21.314 6.275 -5.724 1373 HB3 ARG 71 HB1 ARG 71 21.297 7.554 -6.929 1374 HG2 ARG 71 HG2 ARG 71 23.741 7.536 -6.990 1375 HG3 ARG 71 HG1 ARG 71 23.760 6.251 -5.778 1376 HD2 ARG 71 HD2 ARG 71 22.597 4.760 -7.297 1377 HD3 ARG 71 HD1 ARG 71 22.454 6.047 -8.493 1378 HE ARG 71 HE ARG 71 24.935 5.986 -8.627 1379 HH11 ARG 71 HH11 ARG 71 23.146 3.166 -7.559 1380 HH12 ARG 71 HH12 ARG 71 24.436 2.063 -7.935 1381 HH21 ARG 71 HH21 ARG 71 26.571 4.553 -9.199 1382 HH22 ARG 71 HH22 ARG 71 26.391 2.847 -8.888 1383 H ARG 72 HN ARG 72 23.759 9.359 -3.706 1384 HA ARG 72 HA ARG 72 24.014 11.617 -5.501 1385 HB2 ARG 72 HB2 ARG 72 25.320 10.865 -2.901 1386 HB3 ARG 72 HB1 ARG 72 25.908 12.213 -3.864 1387 HG2 ARG 72 HG2 ARG 72 23.085 11.955 -2.852 1388 HG3 ARG 72 HG1 ARG 72 24.360 12.869 -2.041 1389 HD2 ARG 72 HD2 ARG 72 23.290 13.373 -4.820 1390 HD3 ARG 72 HD1 ARG 72 22.965 14.345 -3.383 1391 HE ARG 72 HE ARG 72 25.693 14.033 -4.470 1392 HH11 ARG 72 HH11 ARG 72 23.057 16.048 -3.346 1393 HH12 ARG 72 HH12 ARG 72 23.992 17.518 -3.423 1394 HH21 ARG 72 HH21 ARG 72 26.900 15.934 -4.584 1395 HH22 ARG 72 HH22 ARG 72 26.184 17.456 -4.133 1396 H GLU 73 HN GLU 73 24.905 11.013 -7.399 1397 HA GLU 73 HA GLU 73 27.522 9.664 -7.267 1398 HB2 GLU 73 HB2 GLU 73 25.719 8.298 -8.329 1399 HB3 GLU 73 HB1 GLU 73 25.547 9.547 -9.557 1400 HG2 GLU 73 HG2 GLU 73 27.814 9.168 -10.302 1401 HG3 GLU 73 HG1 GLU 73 28.064 7.985 -9.019 1402 H GLY 74 HN GLY 74 29.115 11.001 -7.710 1403 HA2 GLY 74 HA2 GLY 74 30.351 12.612 -8.813 1404 HA3 GLY 74 HA1 GLY 74 29.050 12.750 -9.990 1405 H THR 75 HN THR 75 27.672 14.426 -9.863 1406 HA THR 75 HA THR 75 27.661 16.004 -7.376 1407 HB THR 75 HB THR 75 29.039 17.153 -9.082 1408 HG1 THR 75 HG1 THR 75 28.268 18.986 -8.365 1409 HG21 THR 75 HG21 THR 75 27.949 16.340 -11.102 1410 HG22 THR 75 HG22 THR 75 27.961 18.103 -11.076 1411 HG23 THR 75 HG23 THR 75 26.482 17.227 -10.685 1412 H ARG 76 HN ARG 76 25.886 14.147 -9.426 1413 HA ARG 76 HA ARG 76 23.499 15.850 -9.262 1414 HB2 ARG 76 HB2 ARG 76 22.582 14.602 -11.095 1415 HB3 ARG 76 HB1 ARG 76 24.209 15.109 -11.522 1416 HG2 ARG 76 HG2 ARG 76 25.009 12.836 -10.893 1417 HG3 ARG 76 HG1 ARG 76 23.320 12.365 -10.675 1418 HD2 ARG 76 HD2 ARG 76 23.893 11.688 -12.863 1419 HD3 ARG 76 HD1 ARG 76 22.934 13.158 -13.047 1420 HE ARG 76 HE ARG 76 25.881 13.178 -13.145 1421 HH11 ARG 76 HH11 ARG 76 22.766 14.109 -14.461 1422 HH12 ARG 76 HH12 ARG 76 23.456 15.034 -15.762 1423 HH21 ARG 76 HH21 ARG 76 26.783 14.434 -14.810 1424 HH22 ARG 76 HH22 ARG 76 25.740 15.248 -15.942 1425 H GLN 77 HN GLN 77 21.456 14.857 -8.776 1426 HA GLN 77 HA GLN 77 21.779 12.758 -6.751 1427 HB2 GLN 77 HB2 GLN 77 20.900 14.976 -6.030 1428 HB3 GLN 77 HB1 GLN 77 19.521 14.734 -7.093 1429 HG2 GLN 77 HG2 GLN 77 18.910 12.728 -5.803 1430 HG3 GLN 77 HG1 GLN 77 20.251 13.050 -4.706 1431 HE21 GLN 77 HE21 GLN 77 18.945 13.330 -2.915 1432 HE22 GLN 77 HE22 GLN 77 17.914 14.701 -2.720 1433 H TYR 78 HN TYR 78 21.292 10.805 -7.502 1434 HA TYR 78 HA TYR 78 19.077 10.422 -9.361 1435 HB2 TYR 78 HB2 TYR 78 21.055 8.517 -8.098 1436 HB3 TYR 78 HB1 TYR 78 19.694 7.969 -9.065 1437 HD1 TYR 78 HD1 TYR 78 22.910 9.778 -9.153 1438 HD2 TYR 78 HD2 TYR 78 19.732 8.111 -11.439 1439 HE1 TYR 78 HE1 TYR 78 24.273 9.981 -11.189 1440 HE2 TYR 78 HE2 TYR 78 21.083 8.314 -13.481 1441 HH TYR 78 HH TYR 78 22.942 9.436 -14.356 1442 H TYR 79 HN TYR 79 17.279 9.082 -8.833 1443 HA TYR 79 HA TYR 79 17.007 8.383 -6.000 1444 HB2 TYR 79 HB2 TYR 79 15.198 10.030 -7.636 1445 HB3 TYR 79 HB1 TYR 79 14.402 8.727 -6.758 1446 HD1 TYR 79 HD2 TYR 79 16.304 11.845 -6.435 1447 HD2 TYR 79 HD1 TYR 79 14.315 8.726 -4.342 1448 HE1 TYR 79 HE2 TYR 79 16.372 13.193 -4.383 1449 HE2 TYR 79 HE1 TYR 79 14.379 10.056 -2.277 1450 HH TYR 79 HH TYR 79 15.244 13.375 -2.227 1451 H ARG 80 HN ARG 80 16.142 6.424 -5.586 1452 HA ARG 80 HA ARG 80 15.125 4.818 -7.805 1453 HB2 ARG 80 HB2 ARG 80 16.614 2.959 -7.305 1454 HB3 ARG 80 HB1 ARG 80 17.566 4.384 -7.703 1455 HG2 ARG 80 HG2 ARG 80 18.112 4.754 -5.411 1456 HG3 ARG 80 HG1 ARG 80 16.966 3.520 -4.885 1457 HD2 ARG 80 HD2 ARG 80 19.412 3.005 -6.571 1458 HD3 ARG 80 HD1 ARG 80 19.315 2.749 -4.831 1459 HE ARG 80 HE ARG 80 17.267 1.263 -5.738 1460 HH11 ARG 80 HH11 ARG 80 20.611 1.471 -6.755 1461 HH12 ARG 80 HH12 ARG 80 20.697 -0.199 -7.233 1462 HH21 ARG 80 HH21 ARG 80 17.385 -0.951 -6.379 1463 HH22 ARG 80 HH22 ARG 80 18.882 -1.558 -7.038 1464 H ILE 81 HN ILE 81 14.052 2.868 -7.047 1465 HA ILE 81 HA ILE 81 12.692 3.133 -4.579 1466 HB ILE 81 HB ILE 81 13.059 0.665 -6.295 1467 HG12 ILE 81 HG12 ILE 81 10.811 2.692 -6.212 1468 HG13 ILE 81 HG11 ILE 81 12.019 2.568 -7.486 1469 HG21 ILE 81 HG21 ILE 81 11.067 1.275 -4.116 1470 HG22 ILE 81 HG22 ILE 81 12.363 0.082 -4.050 1471 HG23 ILE 81 HG23 ILE 81 11.020 -0.138 -5.171 1472 HD11 ILE 81 HD11 ILE 81 11.184 0.355 -8.073 1473 HD12 ILE 81 HD12 ILE 81 9.902 1.564 -8.147 1474 HD13 ILE 81 HD13 ILE 81 9.992 0.458 -6.776 1475 H ALA 82 HN ALA 82 13.229 2.431 -2.591 1476 HA ALA 82 HA ALA 82 15.907 2.194 -1.916 1477 HB1 ALA 82 HB1 ALA 82 15.157 1.652 0.327 1478 HB2 ALA 82 HB2 ALA 82 13.550 1.259 -0.283 1479 HB3 ALA 82 HB3 ALA 82 14.144 2.917 -0.369 1480 H GLY 83 HN GLY 83 13.577 -0.442 -1.354 1481 HA2 GLY 83 HA2 GLY 83 15.790 -2.334 -1.806 1482 HA3 GLY 83 HA1 GLY 83 14.362 -2.662 -0.831 1483 H GLU 84 HN GLU 84 15.322 -4.332 -2.925 1484 HA GLU 84 HA GLU 84 13.828 -3.872 -5.312 1485 HB2 GLU 84 HB2 GLU 84 15.922 -5.309 -5.062 1486 HB3 GLU 84 HB1 GLU 84 14.882 -6.533 -4.348 1487 HG2 GLU 84 HG2 GLU 84 13.642 -6.771 -6.366 1488 HG3 GLU 84 HG1 GLU 84 14.442 -5.375 -7.087 1489 H ASP 85 HN ASP 85 13.215 -5.342 -2.243 1490 HA ASP 85 HA ASP 85 10.873 -6.784 -2.806 1491 HB2 ASP 85 HB2 ASP 85 11.637 -5.272 -0.291 1492 HB3 ASP 85 HB1 ASP 85 10.316 -6.430 -0.404 1493 H VAL 86 HN VAL 86 11.408 -3.377 -2.043 1494 HA VAL 86 HA VAL 86 8.679 -2.630 -1.906 1495 HB VAL 86 HB VAL 86 11.001 -0.845 -2.662 1496 HG11 VAL 86 HG11 VAL 86 8.314 -0.251 -1.425 1497 HG12 VAL 86 HG12 VAL 86 8.840 0.168 -3.055 1498 HG13 VAL 86 HG13 VAL 86 9.608 0.923 -1.660 1499 HG21 VAL 86 HG21 VAL 86 11.529 -2.026 -0.600 1500 HG22 VAL 86 HG22 VAL 86 9.971 -1.557 0.085 1501 HG23 VAL 86 HG23 VAL 86 11.186 -0.328 -0.269 1502 H ALA 87 HN ALA 87 11.058 -2.708 -4.514 1503 HA ALA 87 HA ALA 87 9.488 -1.516 -6.526 1504 HB1 ALA 87 HB1 ALA 87 11.897 -1.856 -6.758 1505 HB2 ALA 87 HB2 ALA 87 11.022 -2.588 -8.104 1506 HB3 ALA 87 HB3 ALA 87 11.650 -3.601 -6.805 1507 H ARG 88 HN ARG 88 9.854 -4.870 -5.490 1508 HA ARG 88 HA ARG 88 8.130 -5.990 -7.441 1509 HB2 ARG 88 HB2 ARG 88 9.045 -7.004 -4.745 1510 HB3 ARG 88 HB1 ARG 88 8.085 -7.957 -5.870 1511 HG2 ARG 88 HG2 ARG 88 9.838 -7.873 -7.513 1512 HG3 ARG 88 HG1 ARG 88 10.782 -6.782 -6.499 1513 HD2 ARG 88 HD2 ARG 88 11.070 -8.498 -4.838 1514 HD3 ARG 88 HD1 ARG 88 9.990 -9.583 -5.712 1515 HE ARG 88 HE ARG 88 12.030 -8.891 -7.465 1516 HH11 ARG 88 HH11 ARG 88 11.784 -10.528 -4.361 1517 HH12 ARG 88 HH12 ARG 88 13.103 -11.602 -4.698 1518 HH21 ARG 88 HH21 ARG 88 13.746 -10.302 -7.884 1519 HH22 ARG 88 HH22 ARG 88 14.224 -11.480 -6.696 1520 H LEU 89 HN LEU 89 7.601 -4.537 -4.319 1521 HA LEU 89 HA LEU 89 4.965 -5.397 -3.857 1522 HB2 LEU 89 HB2 LEU 89 6.474 -4.241 -2.225 1523 HB3 LEU 89 HB1 LEU 89 6.211 -2.748 -3.099 1524 HG LEU 89 HG LEU 89 3.893 -4.246 -1.905 1525 HD11 LEU 89 HD11 LEU 89 5.694 -2.266 -0.517 1526 HD12 LEU 89 HD12 LEU 89 5.488 -3.967 -0.101 1527 HD13 LEU 89 HD13 LEU 89 4.146 -2.839 0.098 1528 HD21 LEU 89 HD21 LEU 89 2.917 -2.000 -1.804 1529 HD22 LEU 89 HD22 LEU 89 3.388 -2.419 -3.451 1530 HD23 LEU 89 HD23 LEU 89 4.390 -1.327 -2.495 1531 H PHE 90 HN PHE 90 6.256 -2.583 -5.593 1532 HA PHE 90 HA PHE 90 3.775 -1.427 -6.262 1533 HB2 PHE 90 HB2 PHE 90 5.899 -0.193 -6.411 1534 HB3 PHE 90 HB1 PHE 90 6.420 -1.238 -7.727 1535 HD1 PHE 90 HD2 PHE 90 3.702 1.133 -6.797 1536 HD2 PHE 90 HD1 PHE 90 6.012 -0.610 -9.914 1537 HE1 PHE 90 HE2 PHE 90 2.661 2.663 -8.416 1538 HE2 PHE 90 HE1 PHE 90 4.978 0.920 -11.542 1539 HZ PHE 90 HZ PHE 90 3.298 2.559 -10.791 1540 H ALA 91 HN ALA 91 5.831 -3.752 -7.956 1541 HA ALA 91 HA ALA 91 4.199 -3.941 -10.271 1542 HB1 ALA 91 HB1 ALA 91 5.492 -5.938 -10.789 1543 HB2 ALA 91 HB2 ALA 91 6.147 -5.957 -9.151 1544 HB3 ALA 91 HB3 ALA 91 6.547 -4.634 -10.246 1545 H LEU 92 HN LEU 92 4.296 -5.680 -7.207 1546 HA LEU 92 HA LEU 92 2.554 -7.776 -7.862 1547 HB2 LEU 92 HB2 LEU 92 4.070 -7.526 -5.828 1548 HB3 LEU 92 HB1 LEU 92 2.821 -6.513 -5.136 1549 HG LEU 92 HG LEU 92 2.248 -9.343 -5.998 1550 HD11 LEU 92 HD11 LEU 92 4.120 -9.420 -4.437 1551 HD12 LEU 92 HD12 LEU 92 2.644 -10.025 -3.684 1552 HD13 LEU 92 HD13 LEU 92 3.227 -8.404 -3.304 1553 HD21 LEU 92 HD21 LEU 92 0.964 -7.511 -3.975 1554 HD22 LEU 92 HD22 LEU 92 0.450 -9.154 -4.359 1555 HD23 LEU 92 HD23 LEU 92 0.327 -7.884 -5.576 1556 H VAL 93 HN VAL 93 1.877 -4.645 -6.279 1557 HA VAL 93 HA VAL 93 -0.923 -5.068 -6.166 1558 HB VAL 93 HB VAL 93 0.200 -3.443 -4.707 1559 HG11 VAL 93 HG11 VAL 93 0.883 -1.256 -5.538 1560 HG12 VAL 93 HG12 VAL 93 0.539 -1.773 -7.188 1561 HG13 VAL 93 HG13 VAL 93 1.833 -2.550 -6.274 1562 HG21 VAL 93 HG21 VAL 93 -1.895 -2.200 -6.482 1563 HG22 VAL 93 HG22 VAL 93 -1.452 -1.646 -4.866 1564 HG23 VAL 93 HG23 VAL 93 -2.192 -3.233 -5.082 1565 H GLN 94 HN GLN 94 1.208 -3.689 -8.588 1566 HA GLN 94 HA GLN 94 -0.718 -2.618 -10.327 1567 HB2 GLN 94 HB2 GLN 94 1.659 -2.184 -10.627 1568 HB3 GLN 94 HB1 GLN 94 1.961 -3.888 -10.930 1569 HG2 GLN 94 HG2 GLN 94 0.515 -3.716 -12.948 1570 HG3 GLN 94 HG1 GLN 94 0.423 -1.978 -12.670 1571 HE21 GLN 94 HE21 GLN 94 1.552 -3.517 -14.914 1572 HE22 GLN 94 HE22 GLN 94 3.193 -2.981 -15.049 1573 H VAL 95 HN VAL 95 0.665 -5.867 -10.071 1574 HA VAL 95 HA VAL 95 -0.631 -7.069 -12.226 1575 HB VAL 95 HB VAL 95 0.248 -8.252 -9.587 1576 HG11 VAL 95 HG11 VAL 95 -1.504 -9.658 -10.550 1577 HG12 VAL 95 HG12 VAL 95 0.070 -10.448 -10.639 1578 HG13 VAL 95 HG13 VAL 95 -0.628 -9.709 -12.078 1579 HG21 VAL 95 HG21 VAL 95 2.114 -9.125 -10.919 1580 HG22 VAL 95 HG22 VAL 95 2.049 -7.362 -10.955 1581 HG23 VAL 95 HG23 VAL 95 1.479 -8.295 -12.340 1582 H VAL 96 HN VAL 96 -1.660 -6.993 -8.802 1583 HA VAL 96 HA VAL 96 -4.117 -8.285 -9.146 1584 HB VAL 96 HB VAL 96 -3.448 -6.123 -7.139 1585 HG11 VAL 96 HG11 VAL 96 -5.228 -7.093 -5.780 1586 HG12 VAL 96 HG12 VAL 96 -5.592 -8.245 -7.064 1587 HG13 VAL 96 HG13 VAL 96 -5.856 -6.522 -7.326 1588 HG21 VAL 96 HG21 VAL 96 -1.872 -7.975 -7.047 1589 HG22 VAL 96 HG22 VAL 96 -3.208 -9.119 -6.936 1590 HG23 VAL 96 HG23 VAL 96 -2.918 -7.972 -5.629 1591 H ALA 97 HN ALA 97 -3.319 -4.837 -9.242 1592 HA ALA 97 HA ALA 97 -5.876 -3.795 -9.570 1593 HB1 ALA 97 HB1 ALA 97 -3.296 -2.726 -10.711 1594 HB2 ALA 97 HB2 ALA 97 -3.890 -2.442 -9.075 1595 HB3 ALA 97 HB3 ALA 97 -4.783 -1.811 -10.459 1596 H ASP 98 HN ASP 98 -3.495 -4.627 -12.075 1597 HA ASP 98 HA ASP 98 -5.187 -3.882 -14.233 1598 HB2 ASP 98 HB2 ASP 98 -2.712 -3.889 -14.343 1599 HB3 ASP 98 HB1 ASP 98 -2.726 -5.645 -14.244 1600 H GLU 99 HN GLU 99 -4.278 -7.037 -12.854 1601 HA GLU 99 HA GLU 99 -5.527 -8.562 -14.870 1602 HB2 GLU 99 HB2 GLU 99 -4.623 -9.248 -12.090 1603 HB3 GLU 99 HB1 GLU 99 -5.398 -10.431 -13.136 1604 HG2 GLU 99 HG2 GLU 99 -3.597 -9.858 -14.840 1605 HG3 GLU 99 HG1 GLU 99 -2.770 -9.046 -13.511 1606 H HIS 100 HN HIS 100 -6.782 -7.357 -11.772 1607 HA HIS 100 HA HIS 100 -9.113 -9.034 -12.002 1608 HB2 HIS 100 HB2 HIS 100 -9.694 -8.390 -9.893 1609 HB3 HIS 100 HB1 HIS 100 -7.983 -8.014 -9.832 1610 HD1 HIS 100 HD1 HIS 100 -11.374 -6.400 -9.972 1611 HD2 HIS 100 HD2 HIS 100 -7.376 -5.323 -9.481 1612 HE1 HIS 100 HE1 HIS 100 -11.403 -4.001 -9.204 1613 HE2 HIS 100 HE2 HIS 100 -8.986 -3.394 -8.831 1614 H LEU 101 HN LEU 101 -8.177 -6.232 -13.507 1615 HA LEU 101 HA LEU 101 -10.787 -5.003 -13.663 1616 HB2 LEU 101 HB2 LEU 101 -8.076 -4.275 -14.365 1617 HB3 LEU 101 HB1 LEU 101 -9.185 -3.923 -15.676 1618 HG LEU 101 HG LEU 101 -8.883 -1.975 -14.234 1619 HD11 LEU 101 HD11 LEU 101 -11.022 -2.221 -15.344 1620 HD12 LEU 101 HD12 LEU 101 -11.248 -1.510 -13.745 1621 HD13 LEU 101 HD13 LEU 101 -11.624 -3.212 -14.015 1622 HD21 LEU 101 HD21 LEU 101 -10.022 -3.719 -12.053 1623 HD22 LEU 101 HD22 LEU 101 -9.706 -1.988 -11.928 1624 HD23 LEU 101 HD23 LEU 101 -8.367 -3.115 -12.145 1625 H GLU 102 HN GLU 102 -12.097 -6.547 -14.552 1626 HA GLU 102 HA GLU 102 -13.413 -7.224 -16.258 1627 HB2 GLU 102 HB2 GLU 102 -11.448 -5.740 -17.998 1628 HB3 GLU 102 HB1 GLU 102 -12.953 -6.447 -18.571 1629 HG2 GLU 102 HG2 GLU 102 -12.660 -4.243 -16.545 1630 HG3 GLU 102 HG1 GLU 102 -13.236 -4.087 -18.205 1631 H HIS 103 HN HIS 103 -10.262 -8.325 -15.896 1632 HA HIS 103 HA HIS 103 -10.311 -10.028 -18.225 1633 HB2 HIS 103 HB2 HIS 103 -8.201 -9.039 -17.116 1634 HB3 HIS 103 HB1 HIS 103 -8.361 -10.367 -15.968 1635 HD1 HIS 103 HD1 HIS 103 -7.664 -12.694 -16.750 1636 HD2 HIS 103 HD2 HIS 103 -7.639 -9.852 -19.791 1637 HE1 HIS 103 HE1 HIS 103 -6.565 -13.807 -18.714 1638 HE2 HIS 103 HE2 HIS 103 -6.772 -12.151 -20.602 1639 H HIS 104 HN HIS 104 -11.162 -10.320 -14.857 1640 HA HIS 104 HA HIS 104 -12.375 -12.859 -15.503 1641 HB2 HIS 104 HB2 HIS 104 -11.446 -14.038 -13.525 1642 HB3 HIS 104 HB1 HIS 104 -10.254 -13.685 -14.764 1643 HD1 HIS 104 HD1 HIS 104 -11.179 -12.899 -11.227 1644 HD2 HIS 104 HD2 HIS 104 -8.219 -11.910 -13.983 1645 HE1 HIS 104 HE1 HIS 104 -9.335 -11.827 -9.893 1646 HE2 HIS 104 HE2 HIS 104 -7.454 -11.518 -11.542 1647 H HIS 105 HN HIS 105 -14.366 -12.332 -15.108 1648 HA HIS 105 HA HIS 105 -15.361 -12.677 -12.563 1649 HB2 HIS 105 HB2 HIS 105 -16.281 -10.554 -11.886 1650 HB3 HIS 105 HB1 HIS 105 -14.551 -10.362 -12.095 1651 HD1 HIS 105 HD1 HIS 105 -17.832 -9.175 -13.351 1652 HD2 HIS 105 HD2 HIS 105 -13.801 -8.687 -14.273 1653 HE1 HIS 105 HE1 HIS 105 -17.715 -7.156 -14.846 1654 HE2 HIS 105 HE2 HIS 105 -15.254 -6.754 -15.215 1655 H HIS 106 HN HIS 106 -17.001 -13.861 -13.161 1656 HA HIS 106 HA HIS 106 -18.579 -13.059 -15.517 1657 HB2 HIS 106 HB2 HIS 106 -17.492 -15.509 -14.838 1658 HB3 HIS 106 HB1 HIS 106 -19.165 -15.674 -14.320 1659 HD1 HIS 106 HD1 HIS 106 -17.034 -15.898 -17.245 1660 HD2 HIS 106 HD2 HIS 106 -21.067 -15.173 -16.515 1661 HE1 HIS 106 HE1 HIS 106 -18.202 -16.278 -19.441 1662 HE2 HIS 106 HE2 HIS 106 -20.655 -16.064 -18.913 1663 H HIS 107 HN HIS 107 -19.295 -14.883 -12.584 1664 HA HIS 107 HA HIS 107 -21.084 -12.805 -11.635 1665 HB2 HIS 107 HB2 HIS 107 -22.003 -15.628 -12.223 1666 HB3 HIS 107 HB1 HIS 107 -22.834 -14.589 -11.071 1667 HD1 HIS 107 HD1 HIS 107 -22.792 -15.489 -14.566 1668 HD2 HIS 107 HD2 HIS 107 -23.811 -12.105 -12.368 1669 HE1 HIS 107 HE1 HIS 107 -24.211 -14.082 -16.099 1670 HE2 HIS 107 HE2 HIS 107 -24.935 -12.112 -14.701 1671 H HIS 108 HN HIS 108 -19.903 -16.105 -11.100 1672 HA HIS 108 HA HIS 108 -18.553 -15.151 -8.724 1673 HB2 HIS 108 HB2 HIS 108 -19.289 -17.144 -7.383 1674 HB3 HIS 108 HB1 HIS 108 -20.549 -15.959 -7.684 1675 HD1 HIS 108 HD1 HIS 108 -19.563 -19.483 -8.420 1676 HD2 HIS 108 HD2 HIS 108 -22.661 -16.856 -9.322 1677 HE1 HIS 108 HE1 HIS 108 -21.422 -20.911 -9.329 1678 HE2 HIS 108 HE2 HIS 108 -23.339 -19.326 -9.714 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -8.068 16.690 -16.022 2 H2 MET 1 HT2 MET 1 -9.217 17.863 -16.437 3 H3 MET 1 HT3 MET 1 -8.537 17.855 -14.882 4 HA MET 1 HA MET 1 -7.567 19.602 -16.185 5 HB2 MET 1 HB2 MET 1 -6.164 18.433 -14.534 6 HB3 MET 1 HB1 MET 1 -5.682 17.273 -15.763 7 HG2 MET 1 HG2 MET 1 -4.650 19.108 -17.044 8 HG3 MET 1 HG1 MET 1 -5.067 20.217 -15.738 9 HE1 MET 1 HE1 MET 1 -2.094 19.757 -16.934 10 HE2 MET 1 HE2 MET 1 -1.165 19.813 -15.436 11 HE3 MET 1 HE3 MET 1 -2.498 20.942 -15.696 12 H ALA 2 HN ALA 2 -5.999 16.715 -17.500 13 HA ALA 2 HA ALA 2 -6.862 17.072 -20.173 14 HB1 ALA 2 HB1 ALA 2 -4.086 18.080 -19.543 15 HB2 ALA 2 HB2 ALA 2 -5.448 19.061 -20.085 16 HB3 ALA 2 HB3 ALA 2 -4.751 17.848 -21.158 17 H GLY 3 HN GLY 3 -7.035 14.938 -20.475 18 HA2 GLY 3 HA2 GLY 3 -4.584 13.327 -20.181 19 HA3 GLY 3 HA1 GLY 3 -6.113 12.738 -19.546 20 H GLN 4 HN GLN 4 -7.947 12.952 -21.263 21 HA GLN 4 HA GLN 4 -8.874 12.262 -23.208 22 HB2 GLN 4 HB2 GLN 4 -6.222 13.221 -24.284 23 HB3 GLN 4 HB1 GLN 4 -7.488 12.590 -25.324 24 HG2 GLN 4 HG2 GLN 4 -7.620 14.960 -25.368 25 HG3 GLN 4 HG1 GLN 4 -9.002 14.365 -24.454 26 HE21 GLN 4 HE21 GLN 4 -5.958 16.043 -24.291 27 HE22 GLN 4 HE22 GLN 4 -6.188 16.707 -22.714 28 H SER 5 HN SER 5 -7.279 10.472 -21.495 29 HA SER 5 HA SER 5 -7.401 8.142 -23.153 30 HB2 SER 5 HB2 SER 5 -5.133 9.011 -23.738 31 HB3 SER 5 HB1 SER 5 -4.698 8.952 -22.031 32 HG SER 5 HG SER 5 -4.864 6.930 -23.895 33 H ASP 6 HN ASP 6 -5.355 8.824 -20.348 34 HA ASP 6 HA ASP 6 -5.562 8.448 -18.124 35 HB2 ASP 6 HB2 ASP 6 -8.515 8.441 -18.780 36 HB3 ASP 6 HB1 ASP 6 -7.847 8.521 -17.153 37 H ARG 7 HN ARG 7 -5.493 6.174 -20.088 38 HA ARG 7 HA ARG 7 -6.980 3.999 -19.066 39 HB2 ARG 7 HB2 ARG 7 -5.892 4.041 -21.296 40 HB3 ARG 7 HB1 ARG 7 -4.323 3.962 -20.511 41 HG2 ARG 7 HG2 ARG 7 -4.946 1.771 -19.558 42 HG3 ARG 7 HG1 ARG 7 -6.467 1.849 -20.449 43 HD2 ARG 7 HD2 ARG 7 -3.690 1.819 -21.620 44 HD3 ARG 7 HD1 ARG 7 -4.868 0.508 -21.671 45 HE ARG 7 HE ARG 7 -6.234 1.916 -23.114 46 HH11 ARG 7 HH11 ARG 7 -2.875 2.852 -22.698 47 HH12 ARG 7 HH12 ARG 7 -2.806 3.732 -24.202 48 HH21 ARG 7 HH21 ARG 7 -6.152 3.075 -25.072 49 HH22 ARG 7 HH22 ARG 7 -4.673 3.865 -25.549 50 H LYS 8 HN LYS 8 -3.660 5.088 -18.518 51 HA LYS 8 HA LYS 8 -3.033 3.099 -16.578 52 HB2 LYS 8 HB2 LYS 8 -1.356 4.376 -17.931 53 HB3 LYS 8 HB1 LYS 8 -1.739 5.805 -16.983 54 HG2 LYS 8 HG2 LYS 8 -1.038 4.530 -14.943 55 HG3 LYS 8 HG1 LYS 8 -0.467 3.257 -16.023 56 HD2 LYS 8 HD2 LYS 8 0.488 6.117 -15.942 57 HD3 LYS 8 HD1 LYS 8 1.376 4.691 -15.404 58 HE2 LYS 8 HE2 LYS 8 1.376 3.831 -17.696 59 HE3 LYS 8 HE1 LYS 8 0.494 5.259 -18.234 60 HZ1 LYS 8 HZ1 LYS 8 2.804 5.555 -18.705 61 HZ2 LYS 8 HZ2 LYS 8 3.241 5.175 -17.111 62 HZ3 LYS 8 HZ3 LYS 8 2.390 6.609 -17.439 63 H ALA 9 HN ALA 9 -4.456 6.276 -16.488 64 HA ALA 9 HA ALA 9 -4.049 6.941 -13.803 65 HB1 ALA 9 HB1 ALA 9 -4.817 8.537 -15.499 66 HB2 ALA 9 HB2 ALA 9 -5.866 8.529 -14.081 67 HB3 ALA 9 HB3 ALA 9 -6.375 7.714 -15.558 68 H ALA 10 HN ALA 10 -6.704 5.167 -15.356 69 HA ALA 10 HA ALA 10 -8.279 4.825 -13.054 70 HB1 ALA 10 HB1 ALA 10 -9.362 3.008 -14.279 71 HB2 ALA 10 HB2 ALA 10 -8.059 3.031 -15.469 72 HB3 ALA 10 HB3 ALA 10 -9.130 4.424 -15.304 73 H LEU 11 HN LEU 11 -5.531 3.055 -14.313 74 HA LEU 11 HA LEU 11 -5.798 0.828 -12.541 75 HB2 LEU 11 HB2 LEU 11 -3.417 1.788 -14.130 76 HB3 LEU 11 HB1 LEU 11 -3.524 0.245 -13.305 77 HG LEU 11 HG LEU 11 -5.274 1.120 -15.605 78 HD11 LEU 11 HD11 LEU 11 -2.986 0.714 -16.310 79 HD12 LEU 11 HD12 LEU 11 -4.049 -0.573 -16.881 80 HD13 LEU 11 HD13 LEU 11 -2.996 -0.850 -15.493 81 HD21 LEU 11 HD21 LEU 11 -5.087 -1.521 -14.157 82 HD22 LEU 11 HD22 LEU 11 -6.048 -1.205 -15.603 83 HD23 LEU 11 HD23 LEU 11 -6.438 -0.389 -14.089 84 H LEU 12 HN LEU 12 -3.890 3.806 -12.581 85 HA LEU 12 HA LEU 12 -2.455 3.195 -10.205 86 HB2 LEU 12 HB2 LEU 12 -2.927 5.800 -11.640 87 HB3 LEU 12 HB1 LEU 12 -1.917 5.657 -10.215 88 HG LEU 12 HG LEU 12 -1.443 4.336 -12.889 89 HD11 LEU 12 HD11 LEU 12 0.578 5.733 -12.909 90 HD12 LEU 12 HD12 LEU 12 0.047 6.501 -11.412 91 HD13 LEU 12 HD13 LEU 12 -0.901 6.695 -12.888 92 HD21 LEU 12 HD21 LEU 12 -0.766 2.859 -11.071 93 HD22 LEU 12 HD22 LEU 12 0.172 4.165 -10.346 94 HD23 LEU 12 HD23 LEU 12 0.640 3.509 -11.916 95 H ASP 13 HN ASP 13 -5.540 4.738 -10.853 96 HA ASP 13 HA ASP 13 -5.987 5.779 -8.272 97 HB2 ASP 13 HB2 ASP 13 -7.495 6.425 -10.026 98 HB3 ASP 13 HB1 ASP 13 -7.937 4.749 -10.339 99 H GLN 14 HN GLN 14 -6.644 2.599 -9.683 100 HA GLN 14 HA GLN 14 -7.786 1.455 -7.376 101 HB2 GLN 14 HB2 GLN 14 -7.093 0.604 -9.976 102 HB3 GLN 14 HB1 GLN 14 -6.294 -0.496 -8.861 103 HG2 GLN 14 HG2 GLN 14 -8.442 -1.377 -9.451 104 HG3 GLN 14 HG1 GLN 14 -8.454 -0.900 -7.753 105 HE21 GLN 14 HE21 GLN 14 -10.696 -0.708 -7.718 106 HE22 GLN 14 HE22 GLN 14 -11.521 0.594 -8.499 107 H VAL 15 HN VAL 15 -4.436 1.635 -8.513 108 HA VAL 15 HA VAL 15 -3.258 0.112 -6.460 109 HB VAL 15 HB VAL 15 -2.093 2.403 -8.063 110 HG11 VAL 15 HG11 VAL 15 -0.682 0.343 -6.364 111 HG12 VAL 15 HG12 VAL 15 -0.804 2.070 -6.023 112 HG13 VAL 15 HG13 VAL 15 0.104 1.512 -7.427 113 HG21 VAL 15 HG21 VAL 15 -1.054 0.614 -9.390 114 HG22 VAL 15 HG22 VAL 15 -2.815 0.534 -9.440 115 HG23 VAL 15 HG23 VAL 15 -1.909 -0.588 -8.424 116 H ALA 16 HN ALA 16 -3.654 3.638 -6.763 117 HA ALA 16 HA ALA 16 -2.638 4.279 -4.215 118 HB1 ALA 16 HB1 ALA 16 -2.876 5.918 -6.034 119 HB2 ALA 16 HB2 ALA 16 -3.653 6.464 -4.547 120 HB3 ALA 16 HB3 ALA 16 -4.630 5.830 -5.872 121 H ARG 17 HN ARG 17 -5.748 3.191 -5.298 122 HA ARG 17 HA ARG 17 -7.318 3.982 -3.101 123 HB2 ARG 17 HB2 ARG 17 -8.193 3.171 -5.286 124 HB3 ARG 17 HB1 ARG 17 -7.669 1.550 -4.861 125 HG2 ARG 17 HG2 ARG 17 -9.243 1.424 -3.083 126 HG3 ARG 17 HG1 ARG 17 -9.644 3.136 -3.243 127 HD2 ARG 17 HD2 ARG 17 -10.173 0.968 -5.271 128 HD3 ARG 17 HD1 ARG 17 -11.372 1.780 -4.264 129 HE ARG 17 HE ARG 17 -9.818 3.088 -6.410 130 HH11 ARG 17 HH11 ARG 17 -12.672 2.826 -4.419 131 HH12 ARG 17 HH12 ARG 17 -13.531 4.095 -5.242 132 HH21 ARG 17 HH21 ARG 17 -10.911 4.766 -7.505 133 HH22 ARG 17 HH22 ARG 17 -12.514 5.211 -6.984 134 H VAL 18 HN VAL 18 -5.421 1.073 -3.736 135 HA VAL 18 HA VAL 18 -6.121 -0.306 -1.376 136 HB VAL 18 HB VAL 18 -3.561 -0.485 -2.981 137 HG11 VAL 18 HG11 VAL 18 -3.323 -2.711 -1.977 138 HG12 VAL 18 HG12 VAL 18 -4.743 -2.402 -0.974 139 HG13 VAL 18 HG13 VAL 18 -3.284 -1.434 -0.760 140 HG21 VAL 18 HG21 VAL 18 -5.553 -0.942 -4.321 141 HG22 VAL 18 HG22 VAL 18 -6.083 -2.135 -3.137 142 HG23 VAL 18 HG23 VAL 18 -4.609 -2.407 -4.063 143 H GLY 19 HN GLY 19 -3.354 1.802 -2.148 144 HA2 GLY 19 HA2 GLY 19 -2.162 1.728 0.405 145 HA3 GLY 19 HA1 GLY 19 -1.947 3.003 -0.786 146 H LYS 20 HN LYS 20 -4.562 3.908 -0.981 147 HA LYS 20 HA LYS 20 -4.748 5.672 1.205 148 HB2 LYS 20 HB2 LYS 20 -5.531 6.284 -0.993 149 HB3 LYS 20 HB1 LYS 20 -6.695 4.972 -0.996 150 HG2 LYS 20 HG2 LYS 20 -7.975 6.072 0.742 151 HG3 LYS 20 HG1 LYS 20 -6.769 7.357 0.840 152 HD2 LYS 20 HD2 LYS 20 -8.789 7.947 -0.516 153 HD3 LYS 20 HD1 LYS 20 -7.265 8.083 -1.391 154 HE2 LYS 20 HE2 LYS 20 -7.663 5.868 -2.388 155 HE3 LYS 20 HE1 LYS 20 -9.207 5.780 -1.545 156 HZ1 LYS 20 HZ1 LYS 20 -10.094 7.484 -2.847 157 HZ2 LYS 20 HZ2 LYS 20 -9.229 6.531 -3.954 158 HZ3 LYS 20 HZ3 LYS 20 -8.575 7.993 -3.405 159 H ALA 21 HN ALA 21 -6.166 2.545 0.588 160 HA ALA 21 HA ALA 21 -8.007 2.781 2.833 161 HB1 ALA 21 HB1 ALA 21 -8.743 1.583 0.827 162 HB2 ALA 21 HB2 ALA 21 -8.723 0.520 2.233 163 HB3 ALA 21 HB3 ALA 21 -7.433 0.422 1.037 164 H LEU 22 HN LEU 22 -4.793 1.992 2.338 165 HA LEU 22 HA LEU 22 -4.632 0.088 4.558 166 HB2 LEU 22 HB2 LEU 22 -3.467 -0.236 2.312 167 HB3 LEU 22 HB1 LEU 22 -2.403 1.074 2.779 168 HG LEU 22 HG LEU 22 -1.870 -0.359 4.854 169 HD11 LEU 22 HD11 LEU 22 -2.136 -2.759 4.538 170 HD12 LEU 22 HD12 LEU 22 -3.020 -2.473 3.039 171 HD13 LEU 22 HD13 LEU 22 -3.702 -1.947 4.581 172 HD21 LEU 22 HD21 LEU 22 -0.159 -1.595 3.621 173 HD22 LEU 22 HD22 LEU 22 -0.286 0.070 3.054 174 HD23 LEU 22 HD23 LEU 22 -0.992 -1.241 2.109 175 H ALA 23 HN ALA 23 -4.460 3.401 4.074 176 HA ALA 23 HA ALA 23 -2.143 3.962 5.698 177 HB1 ALA 23 HB1 ALA 23 -2.612 6.291 5.231 178 HB2 ALA 23 HB2 ALA 23 -4.184 5.863 4.559 179 HB3 ALA 23 HB3 ALA 23 -2.708 5.338 3.749 180 H ASN 24 HN ASN 24 -3.629 2.570 7.384 181 HA ASN 24 HA ASN 24 -3.944 4.355 9.562 182 HB2 ASN 24 HB2 ASN 24 -6.089 4.904 8.613 183 HB3 ASN 24 HB1 ASN 24 -6.479 3.203 8.385 184 HD21 ASN 24 HD21 ASN 24 -6.011 5.734 10.773 185 HD22 ASN 24 HD22 ASN 24 -6.934 4.963 12.016 186 H GLY 25 HN GLY 25 -2.973 3.170 11.074 187 HA2 GLY 25 HA2 GLY 25 -2.682 0.361 10.877 188 HA3 GLY 25 HA1 GLY 25 -2.211 1.354 12.245 189 H ARG 26 HN ARG 26 -4.956 2.358 12.666 190 HA ARG 26 HA ARG 26 -5.798 0.433 14.521 191 HB2 ARG 26 HB2 ARG 26 -7.280 2.780 13.339 192 HB3 ARG 26 HB1 ARG 26 -7.927 1.782 14.634 193 HG2 ARG 26 HG2 ARG 26 -5.925 2.359 15.995 194 HG3 ARG 26 HG1 ARG 26 -5.444 3.478 14.719 195 HD2 ARG 26 HD2 ARG 26 -8.029 3.594 16.272 196 HD3 ARG 26 HD1 ARG 26 -6.615 4.601 16.569 197 HE ARG 26 HE ARG 26 -7.946 4.680 13.944 198 HH11 ARG 26 HH11 ARG 26 -7.078 6.255 16.955 199 HH12 ARG 26 HH12 ARG 26 -7.480 7.849 16.389 200 HH21 ARG 26 HH21 ARG 26 -8.441 6.784 13.173 201 HH22 ARG 26 HH22 ARG 26 -8.217 8.154 14.222 202 H ARG 27 HN ARG 27 -6.897 1.039 11.209 203 HA ARG 27 HA ARG 27 -8.979 -0.954 11.388 204 HB2 ARG 27 HB2 ARG 27 -9.462 -0.467 9.104 205 HB3 ARG 27 HB1 ARG 27 -9.074 1.068 9.871 206 HG2 ARG 27 HG2 ARG 27 -6.867 1.041 8.908 207 HG3 ARG 27 HG1 ARG 27 -7.151 -0.561 8.227 208 HD2 ARG 27 HD2 ARG 27 -7.437 1.038 6.481 209 HD3 ARG 27 HD1 ARG 27 -9.028 0.414 6.910 210 HE ARG 27 HE ARG 27 -8.812 2.648 8.424 211 HH11 ARG 27 HH11 ARG 27 -8.413 1.990 5.019 212 HH12 ARG 27 HH12 ARG 27 -8.905 3.585 4.517 213 HH21 ARG 27 HH21 ARG 27 -9.449 4.763 7.776 214 HH22 ARG 27 HH22 ARG 27 -9.489 5.148 6.080 215 H LEU 28 HN LEU 28 -5.622 -0.889 10.608 216 HA LEU 28 HA LEU 28 -5.615 -3.204 8.934 217 HB2 LEU 28 HB2 LEU 28 -3.354 -1.848 10.399 218 HB3 LEU 28 HB1 LEU 28 -3.159 -3.114 9.202 219 HG LEU 28 HG LEU 28 -4.240 -0.339 8.732 220 HD11 LEU 28 HD11 LEU 28 -1.821 -0.462 8.963 221 HD12 LEU 28 HD12 LEU 28 -2.291 -0.089 7.304 222 HD13 LEU 28 HD13 LEU 28 -1.762 -1.719 7.726 223 HD21 LEU 28 HD21 LEU 28 -4.386 -0.983 6.374 224 HD22 LEU 28 HD22 LEU 28 -5.481 -1.925 7.386 225 HD23 LEU 28 HD23 LEU 28 -3.977 -2.642 6.809 226 H GLN 29 HN GLN 29 -5.816 -2.738 12.280 227 HA GLN 29 HA GLN 29 -4.627 -5.078 13.265 228 HB2 GLN 29 HB2 GLN 29 -7.112 -3.662 14.259 229 HB3 GLN 29 HB1 GLN 29 -6.175 -4.841 15.168 230 HG2 GLN 29 HG2 GLN 29 -4.242 -3.337 15.101 231 HG3 GLN 29 HG1 GLN 29 -5.208 -2.152 14.223 232 HE21 GLN 29 HE21 GLN 29 -4.928 -0.620 15.842 233 HE22 GLN 29 HE22 GLN 29 -5.748 -0.724 17.359 234 H ILE 30 HN ILE 30 -7.689 -4.464 11.700 235 HA ILE 30 HA ILE 30 -8.863 -6.993 12.167 236 HB ILE 30 HB ILE 30 -9.336 -5.031 9.917 237 HG12 ILE 30 HG12 ILE 30 -10.813 -5.488 12.520 238 HG13 ILE 30 HG11 ILE 30 -9.786 -4.107 12.146 239 HG21 ILE 30 HG21 ILE 30 -11.024 -7.367 10.809 240 HG22 ILE 30 HG22 ILE 30 -10.091 -7.273 9.315 241 HG23 ILE 30 HG23 ILE 30 -11.456 -6.187 9.568 242 HD11 ILE 30 HD11 ILE 30 -12.371 -4.821 10.786 243 HD12 ILE 30 HD12 ILE 30 -11.337 -3.456 10.363 244 HD13 ILE 30 HD13 ILE 30 -12.117 -3.516 11.945 245 H LEU 31 HN LEU 31 -6.856 -5.708 9.544 246 HA LEU 31 HA LEU 31 -6.942 -8.039 7.943 247 HB2 LEU 31 HB2 LEU 31 -4.965 -5.770 8.069 248 HB3 LEU 31 HB1 LEU 31 -4.860 -7.067 6.894 249 HG LEU 31 HG LEU 31 -7.149 -5.117 7.163 250 HD11 LEU 31 HD11 LEU 31 -6.367 -4.256 5.015 251 HD12 LEU 31 HD12 LEU 31 -5.001 -5.368 5.064 252 HD13 LEU 31 HD13 LEU 31 -5.136 -4.085 6.266 253 HD21 LEU 31 HD21 LEU 31 -6.666 -7.306 5.140 254 HD22 LEU 31 HD22 LEU 31 -7.983 -6.131 5.102 255 HD23 LEU 31 HD23 LEU 31 -7.895 -7.316 6.406 256 H ASP 32 HN ASP 32 -4.928 -7.041 10.620 257 HA ASP 32 HA ASP 32 -2.950 -9.036 10.438 258 HB2 ASP 32 HB2 ASP 32 -2.621 -7.172 11.919 259 HB3 ASP 32 HB1 ASP 32 -4.091 -7.545 12.810 260 H LEU 33 HN LEU 33 -6.165 -9.000 11.870 261 HA LEU 33 HA LEU 33 -5.987 -11.687 12.872 262 HB2 LEU 33 HB2 LEU 33 -7.466 -10.003 13.887 263 HB3 LEU 33 HB1 LEU 33 -8.394 -9.923 12.404 264 HG LEU 33 HG LEU 33 -9.028 -12.307 12.717 265 HD11 LEU 33 HD11 LEU 33 -7.142 -13.019 14.076 266 HD12 LEU 33 HD12 LEU 33 -8.663 -13.335 14.909 267 HD13 LEU 33 HD13 LEU 33 -7.665 -11.962 15.383 268 HD21 LEU 33 HD21 LEU 33 -10.608 -11.882 14.547 269 HD22 LEU 33 HD22 LEU 33 -10.521 -10.528 13.420 270 HD23 LEU 33 HD23 LEU 33 -9.702 -10.430 14.980 271 H LEU 34 HN LEU 34 -7.208 -10.126 9.970 272 HA LEU 34 HA LEU 34 -8.567 -12.390 8.914 273 HB2 LEU 34 HB2 LEU 34 -7.883 -9.686 8.028 274 HB3 LEU 34 HB1 LEU 34 -7.943 -10.858 6.726 275 HG LEU 34 HG LEU 34 -10.079 -9.691 7.003 276 HD11 LEU 34 HD11 LEU 34 -10.084 -11.952 6.125 277 HD12 LEU 34 HD12 LEU 34 -11.520 -11.666 7.110 278 HD13 LEU 34 HD13 LEU 34 -10.177 -12.606 7.760 279 HD21 LEU 34 HD21 LEU 34 -9.967 -9.249 9.399 280 HD22 LEU 34 HD22 LEU 34 -10.133 -10.972 9.733 281 HD23 LEU 34 HD23 LEU 34 -11.460 -10.089 8.979 282 H ALA 35 HN ALA 35 -5.251 -11.313 8.781 283 HA ALA 35 HA ALA 35 -4.401 -12.869 6.587 284 HB1 ALA 35 HB1 ALA 35 -2.800 -11.997 8.993 285 HB2 ALA 35 HB2 ALA 35 -3.065 -11.043 7.534 286 HB3 ALA 35 HB3 ALA 35 -2.148 -12.545 7.448 287 H GLN 36 HN GLN 36 -5.364 -13.733 9.729 288 HA GLN 36 HA GLN 36 -3.876 -16.208 9.847 289 HB2 GLN 36 HB2 GLN 36 -6.178 -15.244 11.555 290 HB3 GLN 36 HB1 GLN 36 -5.107 -16.593 11.915 291 HG2 GLN 36 HG2 GLN 36 -3.241 -15.116 12.191 292 HG3 GLN 36 HG1 GLN 36 -4.198 -13.739 11.642 293 HE21 GLN 36 HE21 GLN 36 -3.858 -12.594 13.536 294 HE22 GLN 36 HE22 GLN 36 -4.623 -13.031 15.030 295 H GLY 37 HN GLY 37 -6.882 -15.073 8.607 296 HA2 GLY 37 HA2 GLY 37 -7.617 -17.061 7.008 297 HA3 GLY 37 HA1 GLY 37 -8.101 -17.714 8.567 298 H GLU 38 HN GLU 38 -10.173 -17.604 7.179 299 HA GLU 38 HA GLU 38 -11.421 -15.055 6.886 300 HB2 GLU 38 HB2 GLU 38 -13.451 -16.343 6.320 301 HB3 GLU 38 HB1 GLU 38 -12.053 -16.869 5.402 302 HG2 GLU 38 HG2 GLU 38 -13.144 -18.281 7.832 303 HG3 GLU 38 HG1 GLU 38 -13.505 -18.715 6.164 304 H ARG 39 HN ARG 39 -12.612 -13.929 8.300 305 HA ARG 39 HA ARG 39 -13.081 -15.183 10.934 306 HB2 ARG 39 HB2 ARG 39 -12.423 -12.280 10.406 307 HB3 ARG 39 HB1 ARG 39 -12.590 -13.053 11.972 308 HG2 ARG 39 HG2 ARG 39 -10.469 -13.824 9.991 309 HG3 ARG 39 HG1 ARG 39 -10.245 -12.561 11.200 310 HD2 ARG 39 HD2 ARG 39 -9.334 -14.418 12.234 311 HD3 ARG 39 HD1 ARG 39 -10.966 -14.376 12.890 312 HE ARG 39 HE ARG 39 -11.473 -16.099 11.104 313 HH11 ARG 39 HH11 ARG 39 -8.285 -15.724 12.495 314 HH12 ARG 39 HH12 ARG 39 -7.843 -17.390 12.267 315 HH21 ARG 39 HH21 ARG 39 -10.902 -18.294 10.801 316 HH22 ARG 39 HH22 ARG 39 -9.336 -18.851 11.307 317 H ALA 40 HN ALA 40 -15.031 -14.812 11.915 318 HA ALA 40 HA ALA 40 -17.163 -13.638 10.377 319 HB1 ALA 40 HB1 ALA 40 -18.564 -14.164 12.311 320 HB2 ALA 40 HB2 ALA 40 -17.127 -14.560 13.253 321 HB3 ALA 40 HB3 ALA 40 -17.568 -15.549 11.861 322 H VAL 41 HN VAL 41 -18.326 -11.735 10.882 323 HA VAL 41 HA VAL 41 -16.849 -9.492 11.566 324 HB VAL 41 HB VAL 41 -19.845 -9.818 11.848 325 HG11 VAL 41 HG11 VAL 41 -19.930 -7.387 11.545 326 HG12 VAL 41 HG12 VAL 41 -18.168 -7.327 11.536 327 HG13 VAL 41 HG13 VAL 41 -19.027 -7.825 12.995 328 HG21 VAL 41 HG21 VAL 41 -18.177 -8.907 9.508 329 HG22 VAL 41 HG22 VAL 41 -19.936 -8.847 9.591 330 HG23 VAL 41 HG23 VAL 41 -19.106 -10.403 9.616 331 H GLU 42 HN GLU 42 -18.852 -11.533 13.619 332 HA GLU 42 HA GLU 42 -18.801 -9.967 15.939 333 HB2 GLU 42 HB2 GLU 42 -18.985 -12.971 15.658 334 HB3 GLU 42 HB1 GLU 42 -19.367 -12.065 17.116 335 HG2 GLU 42 HG2 GLU 42 -21.182 -10.938 15.974 336 HG3 GLU 42 HG1 GLU 42 -20.774 -11.770 14.473 337 H ALA 43 HN ALA 43 -16.694 -12.649 14.934 338 HA ALA 43 HA ALA 43 -15.028 -12.628 17.200 339 HB1 ALA 43 HB1 ALA 43 -13.476 -13.938 15.844 340 HB2 ALA 43 HB2 ALA 43 -14.381 -13.516 14.391 341 HB3 ALA 43 HB3 ALA 43 -15.134 -14.508 15.640 342 H ILE 44 HN ILE 44 -14.875 -10.922 14.122 343 HA ILE 44 HA ILE 44 -12.353 -9.725 14.442 344 HB ILE 44 HB ILE 44 -14.776 -8.688 12.958 345 HG12 ILE 44 HG12 ILE 44 -12.358 -10.203 11.948 346 HG13 ILE 44 HG11 ILE 44 -13.943 -10.915 12.228 347 HG21 ILE 44 HG21 ILE 44 -13.166 -7.331 11.685 348 HG22 ILE 44 HG22 ILE 44 -11.883 -7.860 12.772 349 HG23 ILE 44 HG23 ILE 44 -13.216 -6.885 13.392 350 HD11 ILE 44 HD11 ILE 44 -13.562 -10.438 9.873 351 HD12 ILE 44 HD12 ILE 44 -13.327 -8.732 10.252 352 HD13 ILE 44 HD13 ILE 44 -14.901 -9.484 10.512 353 H ALA 45 HN ALA 45 -15.604 -8.551 15.252 354 HA ALA 45 HA ALA 45 -14.856 -6.052 16.268 355 HB1 ALA 45 HB1 ALA 45 -17.154 -6.662 15.669 356 HB2 ALA 45 HB2 ALA 45 -17.049 -6.004 17.301 357 HB3 ALA 45 HB3 ALA 45 -17.223 -7.743 17.061 358 H THR 46 HN THR 46 -15.413 -9.135 17.954 359 HA THR 46 HA THR 46 -14.929 -8.267 20.552 360 HB THR 46 HB THR 46 -14.332 -10.979 19.352 361 HG1 THR 46 HG1 THR 46 -16.644 -10.034 20.751 362 HG21 THR 46 HG21 THR 46 -14.769 -10.180 22.232 363 HG22 THR 46 HG22 THR 46 -13.231 -10.670 21.521 364 HG23 THR 46 HG23 THR 46 -14.558 -11.827 21.638 365 H ALA 47 HN ALA 47 -12.636 -9.667 18.206 366 HA ALA 47 HA ALA 47 -10.409 -9.666 19.921 367 HB1 ALA 47 HB1 ALA 47 -9.084 -10.049 17.930 368 HB2 ALA 47 HB2 ALA 47 -10.432 -9.542 16.911 369 HB3 ALA 47 HB3 ALA 47 -10.561 -11.011 17.878 370 H THR 48 HN THR 48 -11.559 -7.236 17.605 371 HA THR 48 HA THR 48 -9.239 -5.573 18.032 372 HB THR 48 HB THR 48 -10.524 -3.919 16.606 373 HG1 THR 48 HG1 THR 48 -12.236 -6.117 16.045 374 HG21 THR 48 HG21 THR 48 -8.836 -5.395 15.656 375 HG22 THR 48 HG22 THR 48 -10.187 -5.204 14.538 376 HG23 THR 48 HG23 THR 48 -10.033 -6.681 15.491 377 H GLY 49 HN GLY 49 -12.171 -6.066 19.642 378 HA2 GLY 49 HA2 GLY 49 -12.896 -5.090 21.608 379 HA3 GLY 49 HA1 GLY 49 -11.555 -3.960 21.497 380 H MET 50 HN MET 50 -14.034 -4.485 19.039 381 HA MET 50 HA MET 50 -15.148 -1.843 19.685 382 HB2 MET 50 HB2 MET 50 -15.249 -1.269 17.294 383 HB3 MET 50 HB1 MET 50 -13.595 -1.478 17.847 384 HG2 MET 50 HG2 MET 50 -13.586 -3.736 16.860 385 HG3 MET 50 HG1 MET 50 -15.215 -3.449 16.252 386 HE1 MET 50 HE1 MET 50 -11.413 -2.450 15.975 387 HE2 MET 50 HE2 MET 50 -12.196 -0.969 16.527 388 HE3 MET 50 HE3 MET 50 -11.506 -1.049 14.907 389 H ASN 51 HN ASN 51 -17.196 -1.503 18.213 390 HA ASN 51 HA ASN 51 -18.928 -3.728 18.820 391 HB2 ASN 51 HB2 ASN 51 -19.460 -0.998 17.640 392 HB3 ASN 51 HB1 ASN 51 -20.720 -2.198 17.907 393 HD21 ASN 51 HD21 ASN 51 -21.359 -2.684 19.989 394 HD22 ASN 51 HD22 ASN 51 -20.927 -1.698 21.348 395 H LEU 52 HN LEU 52 -20.564 -4.451 17.186 396 HA LEU 52 HA LEU 52 -19.251 -5.630 14.996 397 HB2 LEU 52 HB2 LEU 52 -22.210 -5.218 15.439 398 HB3 LEU 52 HB1 LEU 52 -21.510 -6.299 14.249 399 HG LEU 52 HG LEU 52 -21.245 -6.565 17.245 400 HD11 LEU 52 HD11 LEU 52 -22.833 -8.145 15.230 401 HD12 LEU 52 HD12 LEU 52 -23.483 -7.082 16.478 402 HD13 LEU 52 HD13 LEU 52 -22.639 -8.561 16.932 403 HD21 LEU 52 HD21 LEU 52 -20.272 -8.348 15.014 404 HD22 LEU 52 HD22 LEU 52 -20.219 -8.733 16.735 405 HD23 LEU 52 HD23 LEU 52 -19.264 -7.392 16.100 406 H THR 53 HN THR 53 -21.428 -2.858 15.201 407 HA THR 53 HA THR 53 -21.500 -2.308 12.430 408 HB THR 53 HB THR 53 -21.924 -0.342 14.688 409 HG1 THR 53 HG1 THR 53 -24.205 -1.057 14.325 410 HG21 THR 53 HG21 THR 53 -23.018 -0.450 11.868 411 HG22 THR 53 HG22 THR 53 -21.805 0.683 12.466 412 HG23 THR 53 HG23 THR 53 -23.453 0.743 13.093 413 H THR 54 HN THR 54 -19.311 -1.380 15.011 414 HA THR 54 HA THR 54 -17.925 0.631 13.552 415 HB THR 54 HB THR 54 -16.739 -1.020 15.780 416 HG1 THR 54 HG1 THR 54 -17.983 1.293 16.553 417 HG21 THR 54 HG21 THR 54 -15.608 1.097 16.324 418 HG22 THR 54 HG22 THR 54 -16.408 1.869 14.955 419 HG23 THR 54 HG23 THR 54 -15.246 0.572 14.680 420 H ALA 55 HN ALA 55 -17.339 -2.803 14.206 421 HA ALA 55 HA ALA 55 -14.884 -2.983 12.828 422 HB1 ALA 55 HB1 ALA 55 -16.885 -5.165 13.404 423 HB2 ALA 55 HB2 ALA 55 -15.612 -4.620 14.496 424 HB3 ALA 55 HB3 ALA 55 -15.191 -5.392 12.965 425 H SER 56 HN SER 56 -18.226 -3.614 11.813 426 HA SER 56 HA SER 56 -17.530 -4.559 9.236 427 HB2 SER 56 HB2 SER 56 -19.966 -4.076 8.717 428 HB3 SER 56 HB1 SER 56 -19.672 -5.170 10.066 429 HG SER 56 HG SER 56 -20.233 -3.615 11.481 430 H ALA 57 HN ALA 57 -17.998 -1.352 10.551 431 HA ALA 57 HA ALA 57 -18.219 0.036 8.094 432 HB1 ALA 57 HB1 ALA 57 -17.577 2.018 9.358 433 HB2 ALA 57 HB2 ALA 57 -17.055 1.006 10.705 434 HB3 ALA 57 HB3 ALA 57 -18.760 1.064 10.254 435 H ASN 58 HN ASN 58 -15.449 -0.854 10.106 436 HA ASN 58 HA ASN 58 -13.461 0.238 8.409 437 HB2 ASN 58 HB2 ASN 58 -13.388 -1.920 10.521 438 HB3 ASN 58 HB1 ASN 58 -11.952 -1.429 9.630 439 HD21 ASN 58 HD21 ASN 58 -12.719 -1.228 12.498 440 HD22 ASN 58 HD22 ASN 58 -12.493 0.438 12.900 441 H LEU 59 HN LEU 59 -14.888 -2.989 8.702 442 HA LEU 59 HA LEU 59 -13.427 -4.279 6.687 443 HB2 LEU 59 HB2 LEU 59 -16.243 -4.706 7.680 444 HB3 LEU 59 HB1 LEU 59 -15.460 -5.772 6.530 445 HG LEU 59 HG LEU 59 -14.370 -5.228 9.291 446 HD11 LEU 59 HD11 LEU 59 -16.048 -7.542 8.327 447 HD12 LEU 59 HD12 LEU 59 -16.570 -6.281 9.445 448 HD13 LEU 59 HD13 LEU 59 -15.289 -7.399 9.913 449 HD21 LEU 59 HD21 LEU 59 -13.042 -7.227 8.855 450 HD22 LEU 59 HD22 LEU 59 -12.739 -5.992 7.632 451 HD23 LEU 59 HD23 LEU 59 -13.769 -7.372 7.254 452 H GLN 60 HN GLN 60 -16.287 -2.251 6.554 453 HA GLN 60 HA GLN 60 -17.039 -2.684 3.895 454 HB2 GLN 60 HB2 GLN 60 -18.150 -1.321 5.853 455 HB3 GLN 60 HB1 GLN 60 -17.263 0.024 5.152 456 HG2 GLN 60 HG2 GLN 60 -19.454 0.061 4.257 457 HG3 GLN 60 HG1 GLN 60 -18.369 -0.480 2.976 458 HE21 GLN 60 HE21 GLN 60 -20.876 -1.410 5.191 459 HE22 GLN 60 HE22 GLN 60 -21.253 -2.928 4.458 460 H ALA 61 HN ALA 61 -14.754 -0.398 5.336 461 HA ALA 61 HA ALA 61 -14.069 0.925 2.921 462 HB1 ALA 61 HB1 ALA 61 -12.435 0.644 5.440 463 HB2 ALA 61 HB2 ALA 61 -13.653 1.886 5.141 464 HB3 ALA 61 HB3 ALA 61 -12.187 1.832 4.161 465 H LEU 62 HN LEU 62 -12.743 -1.874 4.610 466 HA LEU 62 HA LEU 62 -10.520 -2.247 2.874 467 HB2 LEU 62 HB2 LEU 62 -11.959 -4.240 4.634 468 HB3 LEU 62 HB1 LEU 62 -10.399 -4.498 3.877 469 HG LEU 62 HG LEU 62 -10.985 -2.383 5.949 470 HD11 LEU 62 HD11 LEU 62 -9.631 -3.789 7.435 471 HD12 LEU 62 HD12 LEU 62 -9.550 -5.023 6.179 472 HD13 LEU 62 HD13 LEU 62 -11.100 -4.606 6.907 473 HD21 LEU 62 HD21 LEU 62 -8.397 -3.265 4.674 474 HD22 LEU 62 HD22 LEU 62 -8.542 -2.123 6.011 475 HD23 LEU 62 HD23 LEU 62 -9.209 -1.718 4.427 476 H LYS 63 HN LYS 63 -13.860 -3.165 2.785 477 HA LYS 63 HA LYS 63 -13.666 -5.125 0.731 478 HB2 LYS 63 HB2 LYS 63 -15.590 -4.880 2.322 479 HB3 LYS 63 HB1 LYS 63 -16.048 -3.413 1.467 480 HG2 LYS 63 HG2 LYS 63 -16.282 -4.781 -0.607 481 HG3 LYS 63 HG1 LYS 63 -16.013 -6.218 0.381 482 HD2 LYS 63 HD2 LYS 63 -18.247 -4.217 0.715 483 HD3 LYS 63 HD1 LYS 63 -18.394 -5.847 0.055 484 HE2 LYS 63 HE2 LYS 63 -17.819 -6.819 2.167 485 HE3 LYS 63 HE1 LYS 63 -17.425 -5.238 2.840 486 HZ1 LYS 63 HZ1 LYS 63 -19.606 -6.019 3.559 487 HZ2 LYS 63 HZ2 LYS 63 -20.125 -6.094 1.946 488 HZ3 LYS 63 HZ3 LYS 63 -19.733 -4.600 2.640 489 H SER 64 HN SER 64 -14.460 -1.664 0.769 490 HA SER 64 HA SER 64 -14.797 -1.490 -2.055 491 HB2 SER 64 HB2 SER 64 -14.525 1.053 -1.494 492 HB3 SER 64 HB1 SER 64 -15.950 0.182 -0.931 493 HG SER 64 HG SER 64 -15.280 0.326 1.079 494 H GLY 65 HN GLY 65 -12.068 -1.138 0.120 495 HA2 GLY 65 HA2 GLY 65 -10.220 -0.152 -1.785 496 HA3 GLY 65 HA1 GLY 65 -9.817 -1.059 -0.333 497 H GLY 66 HN GLY 66 -11.579 -3.297 -1.226 498 HA2 GLY 66 HA2 GLY 66 -11.642 -4.964 -2.894 499 HA3 GLY 66 HA1 GLY 66 -10.225 -4.239 -3.639 500 H LEU 67 HN LEU 67 -10.236 -4.800 -0.226 501 HA LEU 67 HA LEU 67 -8.090 -6.739 -0.623 502 HB2 LEU 67 HB2 LEU 67 -8.856 -4.884 1.574 503 HB3 LEU 67 HB1 LEU 67 -7.976 -6.337 1.997 504 HG LEU 67 HG LEU 67 -6.122 -5.682 0.562 505 HD11 LEU 67 HD11 LEU 67 -7.358 -4.518 -1.179 506 HD12 LEU 67 HD12 LEU 67 -6.072 -3.501 -0.531 507 HD13 LEU 67 HD13 LEU 67 -7.746 -3.218 -0.051 508 HD21 LEU 67 HD21 LEU 67 -5.380 -3.700 1.801 509 HD22 LEU 67 HD22 LEU 67 -6.103 -4.911 2.858 510 HD23 LEU 67 HD23 LEU 67 -7.020 -3.475 2.407 511 H VAL 68 HN VAL 68 -11.204 -6.438 1.044 512 HA VAL 68 HA VAL 68 -11.029 -9.317 1.648 513 HB VAL 68 HB VAL 68 -12.520 -8.961 3.558 514 HG11 VAL 68 HG11 VAL 68 -10.072 -7.204 3.616 515 HG12 VAL 68 HG12 VAL 68 -10.116 -8.940 3.928 516 HG13 VAL 68 HG13 VAL 68 -10.926 -7.824 5.027 517 HG21 VAL 68 HG21 VAL 68 -12.266 -6.031 2.894 518 HG22 VAL 68 HG22 VAL 68 -12.989 -6.682 4.363 519 HG23 VAL 68 HG23 VAL 68 -13.733 -7.004 2.797 520 H GLU 69 HN GLU 69 -12.923 -10.541 1.576 521 HA GLU 69 HA GLU 69 -15.043 -9.459 -0.162 522 HB2 GLU 69 HB2 GLU 69 -14.189 -12.323 0.302 523 HB3 GLU 69 HB1 GLU 69 -15.533 -11.824 -0.711 524 HG2 GLU 69 HG2 GLU 69 -13.969 -10.630 -2.174 525 HG3 GLU 69 HG1 GLU 69 -12.632 -11.185 -1.167 526 H ALA 70 HN ALA 70 -17.204 -10.573 0.247 527 HA ALA 70 HA ALA 70 -17.593 -10.954 3.143 528 HB1 ALA 70 HB1 ALA 70 -18.331 -8.722 2.554 529 HB2 ALA 70 HB2 ALA 70 -19.717 -9.733 2.962 530 HB3 ALA 70 HB3 ALA 70 -19.354 -9.377 1.275 531 H ARG 71 HN ARG 71 -18.441 -12.855 3.596 532 HA ARG 71 HA ARG 71 -20.359 -14.037 1.694 533 HB2 ARG 71 HB2 ARG 71 -18.136 -15.334 3.229 534 HB3 ARG 71 HB1 ARG 71 -19.576 -16.257 2.829 535 HG2 ARG 71 HG2 ARG 71 -19.196 -15.663 0.435 536 HG3 ARG 71 HG1 ARG 71 -17.654 -14.955 0.922 537 HD2 ARG 71 HD2 ARG 71 -17.427 -17.267 0.085 538 HD3 ARG 71 HD1 ARG 71 -16.887 -17.085 1.753 539 HE ARG 71 HE ARG 71 -19.354 -17.914 2.190 540 HH11 ARG 71 HH11 ARG 71 -17.137 -19.034 -0.283 541 HH12 ARG 71 HH12 ARG 71 -17.690 -20.680 -0.221 542 HH21 ARG 71 HH21 ARG 71 -20.108 -20.066 2.267 543 HH22 ARG 71 HH22 ARG 71 -19.394 -21.267 1.223 544 H ARG 72 HN ARG 72 -22.340 -14.249 2.532 545 HA ARG 72 HA ARG 72 -22.623 -14.140 5.445 546 HB2 ARG 72 HB2 ARG 72 -23.951 -12.629 3.863 547 HB3 ARG 72 HB1 ARG 72 -24.856 -14.072 3.425 548 HG2 ARG 72 HG2 ARG 72 -25.449 -14.356 5.818 549 HG3 ARG 72 HG1 ARG 72 -24.662 -12.809 6.145 550 HD2 ARG 72 HD2 ARG 72 -27.106 -13.347 4.483 551 HD3 ARG 72 HD1 ARG 72 -26.959 -12.330 5.916 552 HE ARG 72 HE ARG 72 -25.321 -11.460 3.721 553 HH11 ARG 72 HH11 ARG 72 -28.514 -11.301 5.136 554 HH12 ARG 72 HH12 ARG 72 -28.923 -9.806 4.365 555 HH21 ARG 72 HH21 ARG 72 -25.853 -9.490 2.687 556 HH22 ARG 72 HH22 ARG 72 -27.411 -8.767 2.979 557 H GLU 73 HN GLU 73 -22.451 -16.075 6.338 558 HA GLU 73 HA GLU 73 -23.599 -18.383 4.944 559 HB2 GLU 73 HB2 GLU 73 -21.787 -18.385 7.364 560 HB3 GLU 73 HB1 GLU 73 -22.224 -19.764 6.365 561 HG2 GLU 73 HG2 GLU 73 -20.535 -17.413 5.542 562 HG3 GLU 73 HG1 GLU 73 -19.971 -19.047 5.874 563 H GLY 74 HN GLY 74 -25.677 -18.596 5.450 564 HA2 GLY 74 HA2 GLY 74 -27.552 -18.982 6.721 565 HA3 GLY 74 HA1 GLY 74 -26.500 -19.152 8.121 566 H THR 75 HN THR 75 -26.648 -17.649 9.641 567 HA THR 75 HA THR 75 -28.092 -15.172 8.981 568 HB THR 75 HB THR 75 -27.563 -16.254 11.754 569 HG1 THR 75 HG1 THR 75 -28.920 -17.786 11.203 570 HG21 THR 75 HG21 THR 75 -29.658 -14.360 10.675 571 HG22 THR 75 HG22 THR 75 -28.241 -13.898 11.619 572 HG23 THR 75 HG23 THR 75 -29.506 -14.886 12.352 573 H ARG 76 HN ARG 76 -24.994 -16.345 9.623 574 HA ARG 76 HA ARG 76 -24.107 -13.807 10.816 575 HB2 ARG 76 HB2 ARG 76 -22.527 -16.363 10.528 576 HB3 ARG 76 HB1 ARG 76 -22.092 -14.947 11.475 577 HG2 ARG 76 HG2 ARG 76 -24.124 -15.388 12.879 578 HG3 ARG 76 HG1 ARG 76 -24.297 -16.921 12.017 579 HD2 ARG 76 HD2 ARG 76 -21.911 -17.416 12.686 580 HD3 ARG 76 HD1 ARG 76 -22.013 -16.014 13.751 581 HE ARG 76 HE ARG 76 -23.679 -18.437 13.999 582 HH11 ARG 76 HH11 ARG 76 -22.221 -15.567 15.400 583 HH12 ARG 76 HH12 ARG 76 -22.474 -16.092 17.039 584 HH21 ARG 76 HH21 ARG 76 -24.012 -19.120 16.146 585 HH22 ARG 76 HH22 ARG 76 -23.514 -18.100 17.465 586 H GLN 77 HN GLN 77 -22.492 -12.578 9.853 587 HA GLN 77 HA GLN 77 -21.911 -13.308 7.070 588 HB2 GLN 77 HB2 GLN 77 -23.064 -11.082 7.689 589 HB3 GLN 77 HB1 GLN 77 -21.475 -10.573 8.247 590 HG2 GLN 77 HG2 GLN 77 -20.566 -11.003 6.013 591 HG3 GLN 77 HG1 GLN 77 -22.173 -11.484 5.465 592 HE21 GLN 77 HE21 GLN 77 -20.422 -9.325 4.563 593 HE22 GLN 77 HE22 GLN 77 -21.342 -7.866 4.714 594 H TYR 78 HN TYR 78 -19.897 -13.715 6.445 595 HA TYR 78 HA TYR 78 -17.745 -13.415 8.436 596 HB2 TYR 78 HB2 TYR 78 -18.137 -15.476 6.255 597 HB3 TYR 78 HB1 TYR 78 -16.652 -15.306 7.181 598 HD1 TYR 78 HD2 TYR 78 -20.308 -15.939 7.599 599 HD2 TYR 78 HD1 TYR 78 -16.389 -16.460 9.174 600 HE1 TYR 78 HE2 TYR 78 -21.204 -17.452 9.318 601 HE2 TYR 78 HE1 TYR 78 -17.275 -17.974 10.894 602 HH TYR 78 HH TYR 78 -20.475 -19.223 10.772 603 H TYR 79 HN TYR 79 -15.738 -12.699 7.744 604 HA TYR 79 HA TYR 79 -15.650 -11.627 5.007 605 HB2 TYR 79 HB2 TYR 79 -14.780 -10.396 7.596 606 HB3 TYR 79 HB1 TYR 79 -13.953 -9.960 6.104 607 HD1 TYR 79 HD2 TYR 79 -17.343 -10.121 7.640 608 HD2 TYR 79 HD1 TYR 79 -14.842 -8.321 4.712 609 HE1 TYR 79 HE2 TYR 79 -19.127 -8.514 7.114 610 HE2 TYR 79 HE1 TYR 79 -16.618 -6.709 4.173 611 HH TYR 79 HH TYR 79 -19.446 -6.367 6.115 612 H ARG 80 HN ARG 80 -13.837 -11.945 3.836 613 HA ARG 80 HA ARG 80 -11.569 -13.309 5.073 614 HB2 ARG 80 HB2 ARG 80 -11.596 -14.914 3.057 615 HB3 ARG 80 HB1 ARG 80 -12.708 -15.228 4.381 616 HG2 ARG 80 HG2 ARG 80 -14.556 -14.609 3.156 617 HG3 ARG 80 HG1 ARG 80 -13.617 -13.610 2.045 618 HD2 ARG 80 HD2 ARG 80 -13.120 -16.547 2.131 619 HD3 ARG 80 HD1 ARG 80 -14.555 -15.948 1.297 620 HE ARG 80 HE ARG 80 -12.833 -14.464 0.084 621 HH11 ARG 80 HH11 ARG 80 -12.195 -17.737 1.162 622 HH12 ARG 80 HH12 ARG 80 -11.074 -18.074 -0.124 623 HH21 ARG 80 HH21 ARG 80 -11.397 -14.896 -1.593 624 HH22 ARG 80 HH22 ARG 80 -10.625 -16.453 -1.702 625 H ILE 81 HN ILE 81 -9.713 -13.455 3.577 626 HA ILE 81 HA ILE 81 -9.347 -10.973 2.207 627 HB ILE 81 HB ILE 81 -7.572 -13.425 2.249 628 HG12 ILE 81 HG12 ILE 81 -7.522 -10.911 3.936 629 HG13 ILE 81 HG11 ILE 81 -7.984 -12.516 4.494 630 HG21 ILE 81 HG21 ILE 81 -7.033 -11.981 0.382 631 HG22 ILE 81 HG22 ILE 81 -5.783 -11.851 1.619 632 HG23 ILE 81 HG23 ILE 81 -6.990 -10.577 1.448 633 HD11 ILE 81 HD11 ILE 81 -5.719 -13.313 4.098 634 HD12 ILE 81 HD12 ILE 81 -5.728 -11.927 5.191 635 HD13 ILE 81 HD13 ILE 81 -5.255 -11.718 3.504 636 H ALA 82 HN ALA 82 -9.387 -10.554 0.042 637 HA ALA 82 HA ALA 82 -11.120 -12.007 -1.568 638 HB1 ALA 82 HB1 ALA 82 -8.997 -10.072 -2.472 639 HB2 ALA 82 HB2 ALA 82 -10.600 -9.636 -1.881 640 HB3 ALA 82 HB3 ALA 82 -10.431 -10.549 -3.381 641 H GLY 83 HN GLY 83 -7.602 -12.160 -1.423 642 HA2 GLY 83 HA2 GLY 83 -7.575 -14.771 -2.557 643 HA3 GLY 83 HA1 GLY 83 -7.034 -13.568 -3.721 644 H GLU 84 HN GLU 84 -5.257 -15.412 -3.153 645 HA GLU 84 HA GLU 84 -3.651 -15.040 -0.875 646 HB2 GLU 84 HB2 GLU 84 -3.622 -17.012 -2.431 647 HB3 GLU 84 HB1 GLU 84 -2.762 -16.018 -3.593 648 HG2 GLU 84 HG2 GLU 84 -0.891 -15.800 -2.096 649 HG3 GLU 84 HG1 GLU 84 -1.764 -16.663 -0.831 650 H ASP 85 HN ASP 85 -3.839 -13.343 -3.902 651 HA ASP 85 HA ASP 85 -1.357 -12.053 -3.929 652 HB2 ASP 85 HB2 ASP 85 -3.998 -10.935 -4.894 653 HB3 ASP 85 HB1 ASP 85 -2.392 -10.429 -5.410 654 H VAL 86 HN VAL 86 -4.442 -11.048 -2.507 655 HA VAL 86 HA VAL 86 -3.520 -8.584 -1.470 656 HB VAL 86 HB VAL 86 -5.820 -10.275 -0.471 657 HG11 VAL 86 HG11 VAL 86 -5.152 -8.544 1.109 658 HG12 VAL 86 HG12 VAL 86 -6.717 -8.167 0.384 659 HG13 VAL 86 HG13 VAL 86 -5.266 -7.327 -0.162 660 HG21 VAL 86 HG21 VAL 86 -6.046 -9.819 -2.848 661 HG22 VAL 86 HG22 VAL 86 -5.768 -8.101 -2.562 662 HG23 VAL 86 HG23 VAL 86 -7.220 -8.878 -1.928 663 H ALA 87 HN ALA 87 -3.753 -11.837 -0.108 664 HA ALA 87 HA ALA 87 -2.996 -11.210 2.527 665 HB1 ALA 87 HB1 ALA 87 -3.992 -13.354 1.933 666 HB2 ALA 87 HB2 ALA 87 -2.442 -13.590 2.742 667 HB3 ALA 87 HB3 ALA 87 -2.561 -13.774 0.993 668 H ARG 88 HN ARG 88 -1.080 -12.193 -0.286 669 HA ARG 88 HA ARG 88 1.430 -12.127 1.014 670 HB2 ARG 88 HB2 ARG 88 0.689 -11.872 -1.899 671 HB3 ARG 88 HB1 ARG 88 2.349 -11.963 -1.325 672 HG2 ARG 88 HG2 ARG 88 1.871 -14.156 -0.340 673 HG3 ARG 88 HG1 ARG 88 0.224 -14.064 -0.965 674 HD2 ARG 88 HD2 ARG 88 2.740 -14.026 -2.626 675 HD3 ARG 88 HD1 ARG 88 1.687 -15.420 -2.394 676 HE ARG 88 HE ARG 88 0.451 -13.034 -3.500 677 HH11 ARG 88 HH11 ARG 88 1.867 -16.179 -4.061 678 HH12 ARG 88 HH12 ARG 88 1.177 -16.349 -5.650 679 HH21 ARG 88 HH21 ARG 88 -0.487 -13.265 -5.603 680 HH22 ARG 88 HH22 ARG 88 -0.154 -14.703 -6.512 681 H LEU 89 HN LEU 89 -0.513 -9.678 -0.571 682 HA LEU 89 HA LEU 89 1.399 -7.645 -0.792 683 HB2 LEU 89 HB2 LEU 89 -0.841 -7.534 -1.803 684 HB3 LEU 89 HB1 LEU 89 -1.555 -7.405 -0.208 685 HG LEU 89 HG LEU 89 -0.258 -5.261 0.085 686 HD11 LEU 89 HD11 LEU 89 0.193 -5.634 -2.869 687 HD12 LEU 89 HD12 LEU 89 1.426 -5.586 -1.609 688 HD13 LEU 89 HD13 LEU 89 0.483 -4.142 -1.975 689 HD21 LEU 89 HD21 LEU 89 -1.837 -3.946 -1.267 690 HD22 LEU 89 HD22 LEU 89 -2.630 -5.253 -0.389 691 HD23 LEU 89 HD23 LEU 89 -2.311 -5.419 -2.117 692 H PHE 90 HN PHE 90 -0.852 -8.399 1.854 693 HA PHE 90 HA PHE 90 0.003 -6.328 3.574 694 HB2 PHE 90 HB2 PHE 90 -2.148 -7.593 3.782 695 HB3 PHE 90 HB1 PHE 90 -1.228 -8.976 4.366 696 HD1 PHE 90 HD1 PHE 90 -1.968 -5.412 5.106 697 HD2 PHE 90 HD2 PHE 90 -0.743 -9.192 6.634 698 HE1 PHE 90 HE1 PHE 90 -2.118 -4.531 7.398 699 HE2 PHE 90 HE2 PHE 90 -0.892 -8.315 8.929 700 HZ PHE 90 HZ PHE 90 -1.582 -5.983 9.313 701 H ALA 91 HN ALA 91 1.072 -9.646 3.121 702 HA ALA 91 HA ALA 91 2.847 -9.705 5.338 703 HB1 ALA 91 HB1 ALA 91 3.765 -11.716 4.300 704 HB2 ALA 91 HB2 ALA 91 2.887 -11.359 2.813 705 HB3 ALA 91 HB3 ALA 91 2.001 -11.746 4.288 706 H LEU 92 HN LEU 92 3.216 -8.866 1.926 707 HA LEU 92 HA LEU 92 6.049 -8.613 2.039 708 HB2 LEU 92 HB2 LEU 92 4.781 -9.088 -0.029 709 HB3 LEU 92 HB1 LEU 92 4.122 -7.465 0.026 710 HG LEU 92 HG LEU 92 6.342 -6.516 -0.304 711 HD11 LEU 92 HD11 LEU 92 8.261 -7.959 -0.790 712 HD12 LEU 92 HD12 LEU 92 7.287 -9.381 -0.413 713 HD13 LEU 92 HD13 LEU 92 7.663 -8.208 0.850 714 HD21 LEU 92 HD21 LEU 92 5.015 -7.055 -2.263 715 HD22 LEU 92 HD22 LEU 92 5.673 -8.690 -2.282 716 HD23 LEU 92 HD23 LEU 92 6.727 -7.310 -2.593 717 H VAL 93 HN VAL 93 3.365 -6.299 2.322 718 HA VAL 93 HA VAL 93 5.044 -4.009 2.389 719 HB VAL 93 HB VAL 93 2.585 -3.916 1.944 720 HG11 VAL 93 HG11 VAL 93 1.764 -5.392 3.666 721 HG12 VAL 93 HG12 VAL 93 1.047 -3.792 3.858 722 HG13 VAL 93 HG13 VAL 93 2.356 -4.306 4.923 723 HG21 VAL 93 HG21 VAL 93 3.648 -2.141 4.134 724 HG22 VAL 93 HG22 VAL 93 2.218 -1.801 3.159 725 HG23 VAL 93 HG23 VAL 93 3.805 -1.891 2.396 726 H GLN 94 HN GLN 94 3.981 -6.301 4.809 727 HA GLN 94 HA GLN 94 4.841 -4.956 7.117 728 HB2 GLN 94 HB2 GLN 94 3.519 -7.065 7.119 729 HB3 GLN 94 HB1 GLN 94 4.947 -7.928 6.569 730 HG2 GLN 94 HG2 GLN 94 6.106 -7.122 8.652 731 HG3 GLN 94 HG1 GLN 94 4.536 -6.545 9.205 732 HE21 GLN 94 HE21 GLN 94 5.050 -9.489 7.366 733 HE22 GLN 94 HE22 GLN 94 4.625 -10.580 8.636 734 H VAL 95 HN VAL 95 6.536 -7.092 4.863 735 HA VAL 95 HA VAL 95 9.043 -7.191 6.047 736 HB VAL 95 HB VAL 95 8.458 -7.018 3.083 737 HG11 VAL 95 HG11 VAL 95 10.805 -6.641 3.538 738 HG12 VAL 95 HG12 VAL 95 10.582 -8.239 2.822 739 HG13 VAL 95 HG13 VAL 95 10.865 -8.081 4.557 740 HG21 VAL 95 HG21 VAL 95 7.198 -8.819 4.092 741 HG22 VAL 95 HG22 VAL 95 8.644 -9.411 4.907 742 HG23 VAL 95 HG23 VAL 95 8.530 -9.484 3.150 743 H VAL 96 HN VAL 96 7.840 -4.846 3.655 744 HA VAL 96 HA VAL 96 10.093 -3.242 3.439 745 HB VAL 96 HB VAL 96 7.225 -2.291 3.350 746 HG11 VAL 96 HG11 VAL 96 8.082 -0.555 1.847 747 HG12 VAL 96 HG12 VAL 96 9.722 -1.158 2.089 748 HG13 VAL 96 HG13 VAL 96 8.829 -0.462 3.442 749 HG21 VAL 96 HG21 VAL 96 8.947 -3.429 1.149 750 HG22 VAL 96 HG22 VAL 96 7.343 -2.725 0.938 751 HG23 VAL 96 HG23 VAL 96 7.542 -4.202 1.882 752 H ALA 97 HN ALA 97 7.364 -2.948 5.675 753 HA ALA 97 HA ALA 97 8.186 -0.642 7.036 754 HB1 ALA 97 HB1 ALA 97 6.638 -1.323 8.775 755 HB2 ALA 97 HB2 ALA 97 6.586 -2.959 8.115 756 HB3 ALA 97 HB3 ALA 97 5.931 -1.612 7.186 757 H ASP 98 HN ASP 98 8.705 -4.058 7.819 758 HA ASP 98 HA ASP 98 10.060 -3.610 10.252 759 HB2 ASP 98 HB2 ASP 98 8.959 -5.740 9.569 760 HB3 ASP 98 HB1 ASP 98 10.263 -6.006 8.418 761 H GLU 99 HN GLU 99 11.251 -4.160 6.950 762 HA GLU 99 HA GLU 99 13.987 -4.374 7.591 763 HB2 GLU 99 HB2 GLU 99 12.683 -3.449 5.025 764 HB3 GLU 99 HB1 GLU 99 14.379 -3.868 5.192 765 HG2 GLU 99 HG2 GLU 99 12.119 -5.779 5.718 766 HG3 GLU 99 HG1 GLU 99 12.948 -5.630 4.170 767 H HIS 100 HN HIS 100 11.938 -1.566 7.114 768 HA HIS 100 HA HIS 100 14.324 0.157 7.072 769 HB2 HIS 100 HB2 HIS 100 11.509 0.642 6.115 770 HB3 HIS 100 HB1 HIS 100 12.675 1.946 6.311 771 HD1 HIS 100 HD1 HIS 100 14.411 2.251 4.489 772 HD2 HIS 100 HD2 HIS 100 12.182 -1.238 4.057 773 HE1 HIS 100 HE1 HIS 100 15.010 1.340 2.232 774 HE2 HIS 100 HE2 HIS 100 13.848 -0.891 2.102 775 H LEU 101 HN LEU 101 12.169 -0.981 9.250 776 HA LEU 101 HA LEU 101 11.366 1.345 10.632 777 HB2 LEU 101 HB2 LEU 101 10.294 -0.845 10.900 778 HB3 LEU 101 HB1 LEU 101 11.746 -1.465 11.662 779 HG LEU 101 HG LEU 101 11.435 0.069 13.545 780 HD11 LEU 101 HD11 LEU 101 9.378 1.376 13.747 781 HD12 LEU 101 HD12 LEU 101 8.914 0.900 12.114 782 HD13 LEU 101 HD13 LEU 101 10.341 1.903 12.368 783 HD21 LEU 101 HD21 LEU 101 9.003 -1.568 12.847 784 HD22 LEU 101 HD22 LEU 101 9.386 -0.955 14.457 785 HD23 LEU 101 HD23 LEU 101 10.448 -2.133 13.689 786 H GLU 102 HN GLU 102 14.080 -0.879 11.125 787 HA GLU 102 HA GLU 102 15.585 1.250 12.411 788 HB2 GLU 102 HB2 GLU 102 16.239 -0.252 14.294 789 HB3 GLU 102 HB1 GLU 102 14.545 0.222 14.327 790 HG2 GLU 102 HG2 GLU 102 13.851 -1.911 13.535 791 HG3 GLU 102 HG1 GLU 102 15.513 -2.385 13.188 792 H HIS 103 HN HIS 103 17.895 0.693 12.590 793 HA HIS 103 HA HIS 103 18.637 -1.585 10.886 794 HB2 HIS 103 HB2 HIS 103 18.970 0.653 9.765 795 HB3 HIS 103 HB1 HIS 103 20.177 1.012 10.996 796 HD1 HIS 103 HD1 HIS 103 22.507 0.182 10.576 797 HD2 HIS 103 HD2 HIS 103 19.690 -1.623 8.099 798 HE1 HIS 103 HE1 HIS 103 23.823 -1.215 8.951 799 HE2 HIS 103 HE2 HIS 103 22.105 -2.243 7.415 800 H HIS 104 HN HIS 104 18.837 -2.805 12.809 801 HA HIS 104 HA HIS 104 21.194 -2.206 14.447 802 HB2 HIS 104 HB2 HIS 104 19.071 -4.358 14.601 803 HB3 HIS 104 HB1 HIS 104 20.518 -4.384 15.598 804 HD1 HIS 104 HD1 HIS 104 18.897 -4.257 17.670 805 HD2 HIS 104 HD2 HIS 104 18.902 -0.902 15.209 806 HE1 HIS 104 HE1 HIS 104 17.759 -2.442 18.990 807 HE2 HIS 104 HE2 HIS 104 17.971 -0.375 17.565 808 H HIS 105 HN HIS 105 21.448 -5.281 14.663 809 HA HIS 105 HA HIS 105 22.377 -7.066 13.596 810 HB2 HIS 105 HB2 HIS 105 20.798 -6.716 11.783 811 HB3 HIS 105 HB1 HIS 105 21.812 -5.457 11.096 812 HD1 HIS 105 HD1 HIS 105 21.598 -9.187 11.493 813 HD2 HIS 105 HD2 HIS 105 23.859 -6.347 9.459 814 HE1 HIS 105 HE1 HIS 105 22.936 -10.469 9.787 815 HE2 HIS 105 HE2 HIS 105 24.128 -8.706 8.437 816 H HIS 106 HN HIS 106 23.515 -4.259 11.710 817 HA HIS 106 HA HIS 106 26.227 -4.739 12.706 818 HB2 HIS 106 HB2 HIS 106 25.862 -5.901 10.461 819 HB3 HIS 106 HB1 HIS 106 25.677 -4.294 9.767 820 HD1 HIS 106 HD1 HIS 106 28.061 -6.712 9.683 821 HD2 HIS 106 HD2 HIS 106 28.228 -2.756 10.970 822 HE1 HIS 106 HE1 HIS 106 30.486 -6.051 9.552 823 HE2 HIS 106 HE2 HIS 106 30.527 -3.601 10.137 824 H HIS 107 HN HIS 107 26.345 -2.872 13.832 825 HA HIS 107 HA HIS 107 25.345 -0.385 12.796 826 HB2 HIS 107 HB2 HIS 107 25.397 -0.941 15.227 827 HB3 HIS 107 HB1 HIS 107 27.153 -0.891 15.171 828 HD1 HIS 107 HD1 HIS 107 24.232 1.191 15.735 829 HD2 HIS 107 HD2 HIS 107 28.187 1.786 14.587 830 HE1 HIS 107 HE1 HIS 107 24.685 3.639 16.098 831 HE2 HIS 107 HE2 HIS 107 27.144 3.924 15.610 832 H HIS 108 HN HIS 108 26.369 0.304 11.009 833 HA HIS 108 HA HIS 108 27.928 1.377 9.758 834 HB2 HIS 108 HB2 HIS 108 28.493 2.582 11.862 835 HB3 HIS 108 HB1 HIS 108 29.678 1.334 12.230 836 HD1 HIS 108 HD1 HIS 108 31.914 1.414 10.962 837 HD2 HIS 108 HD2 HIS 108 29.215 4.356 9.798 838 HE1 HIS 108 HE1 HIS 108 33.240 3.040 9.571 839 HE2 HIS 108 HE2 HIS 108 31.631 4.908 9.051 840 H1 MET 1 HT1 MET 1 -4.389 6.441 26.249 841 H2 MET 1 HT2 MET 1 -3.409 5.146 26.740 842 H3 MET 1 HT3 MET 1 -4.043 6.208 27.896 843 HA MET 1 HA MET 1 -5.254 4.145 27.905 844 HB2 MET 1 HB2 MET 1 -6.766 6.507 26.774 845 HB3 MET 1 HB1 MET 1 -7.541 5.082 27.452 846 HG2 MET 1 HG2 MET 1 -5.741 7.002 28.911 847 HG3 MET 1 HG1 MET 1 -7.492 6.869 29.071 848 HE1 MET 1 HE1 MET 1 -5.473 6.814 31.535 849 HE2 MET 1 HE2 MET 1 -6.158 5.507 32.502 850 HE3 MET 1 HE3 MET 1 -7.221 6.676 31.716 851 H ALA 2 HN ALA 2 -7.601 3.795 26.368 852 HA ALA 2 HA ALA 2 -8.429 2.731 24.555 853 HB1 ALA 2 HB1 ALA 2 -7.472 4.527 23.192 854 HB2 ALA 2 HB2 ALA 2 -7.413 2.972 22.362 855 HB3 ALA 2 HB3 ALA 2 -5.953 3.638 23.091 856 H GLY 3 HN GLY 3 -4.901 2.199 24.456 857 HA2 GLY 3 HA2 GLY 3 -5.408 -0.662 24.886 858 HA3 GLY 3 HA1 GLY 3 -4.447 -0.167 23.499 859 H GLN 4 HN GLN 4 -3.354 -1.845 25.325 860 HA GLN 4 HA GLN 4 -1.477 -0.116 26.814 861 HB2 GLN 4 HB2 GLN 4 -2.336 -2.950 27.447 862 HB3 GLN 4 HB1 GLN 4 -1.131 -2.035 28.338 863 HG2 GLN 4 HG2 GLN 4 -4.011 -1.209 28.060 864 HG3 GLN 4 HG1 GLN 4 -3.363 -2.123 29.420 865 HE21 GLN 4 HE21 GLN 4 -3.428 0.968 27.810 866 HE22 GLN 4 HE22 GLN 4 -2.746 1.879 29.117 867 H SER 5 HN SER 5 0.651 -0.352 26.380 868 HA SER 5 HA SER 5 2.524 -0.869 25.209 869 HB2 SER 5 HB2 SER 5 2.157 -3.162 26.141 870 HB3 SER 5 HB1 SER 5 1.234 -3.561 24.692 871 HG SER 5 HG SER 5 3.941 -3.415 25.072 872 H ASP 6 HN ASP 6 2.943 0.057 23.305 873 HA ASP 6 HA ASP 6 0.834 -0.121 21.245 874 HB2 ASP 6 HB2 ASP 6 2.701 2.195 21.795 875 HB3 ASP 6 HB1 ASP 6 1.418 2.159 20.592 876 H ARG 7 HN ARG 7 3.510 -1.613 21.667 877 HA ARG 7 HA ARG 7 5.225 -0.740 19.563 878 HB2 ARG 7 HB2 ARG 7 5.979 -2.096 21.523 879 HB3 ARG 7 HB1 ARG 7 5.114 -3.472 20.849 880 HG2 ARG 7 HG2 ARG 7 6.559 -2.971 18.732 881 HG3 ARG 7 HG1 ARG 7 7.597 -2.140 19.889 882 HD2 ARG 7 HD2 ARG 7 6.731 -5.021 20.006 883 HD3 ARG 7 HD1 ARG 7 8.329 -4.429 19.568 884 HE ARG 7 HE ARG 7 7.293 -3.779 22.224 885 HH11 ARG 7 HH11 ARG 7 9.496 -5.596 20.202 886 HH12 ARG 7 HH12 ARG 7 10.491 -6.126 21.529 887 HH21 ARG 7 HH21 ARG 7 8.568 -4.518 23.985 888 HH22 ARG 7 HH22 ARG 7 9.950 -5.525 23.677 889 H LYS 8 HN LYS 8 2.795 -3.281 19.875 890 HA LYS 8 HA LYS 8 3.215 -4.485 17.359 891 HB2 LYS 8 HB2 LYS 8 1.961 -5.515 19.242 892 HB3 LYS 8 HB1 LYS 8 0.658 -4.366 18.980 893 HG2 LYS 8 HG2 LYS 8 0.286 -5.302 16.748 894 HG3 LYS 8 HG1 LYS 8 1.595 -6.456 17.018 895 HD2 LYS 8 HD2 LYS 8 0.353 -7.343 18.968 896 HD3 LYS 8 HD1 LYS 8 -0.973 -6.243 18.589 897 HE2 LYS 8 HE2 LYS 8 0.085 -8.412 16.779 898 HE3 LYS 8 HE1 LYS 8 -1.382 -8.513 17.751 899 HZ1 LYS 8 HZ1 LYS 8 -2.267 -6.620 16.494 900 HZ2 LYS 8 HZ2 LYS 8 -1.927 -7.947 15.493 901 HZ3 LYS 8 HZ3 LYS 8 -0.877 -6.619 15.524 902 H ALA 9 HN ALA 9 0.937 -1.990 18.434 903 HA ALA 9 HA ALA 9 -0.371 -1.607 15.979 904 HB1 ALA 9 HB1 ALA 9 0.081 0.391 18.193 905 HB2 ALA 9 HB2 ALA 9 -1.247 -0.764 18.095 906 HB3 ALA 9 HB3 ALA 9 -1.112 0.526 16.902 907 H ALA 10 HN ALA 10 2.682 -0.404 17.185 908 HA ALA 10 HA ALA 10 3.061 1.745 15.426 909 HB1 ALA 10 HB1 ALA 10 5.431 1.551 15.947 910 HB2 ALA 10 HB2 ALA 10 5.158 -0.046 16.648 911 HB3 ALA 10 HB3 ALA 10 4.449 1.384 17.402 912 H LEU 11 HN LEU 11 3.575 -1.707 15.010 913 HA LEU 11 HA LEU 11 5.017 -1.488 12.556 914 HB2 LEU 11 HB2 LEU 11 3.482 -3.779 13.783 915 HB3 LEU 11 HB1 LEU 11 4.407 -3.915 12.301 916 HG LEU 11 HG LEU 11 5.562 -3.190 14.996 917 HD11 LEU 11 HD11 LEU 11 5.677 -5.770 13.441 918 HD12 LEU 11 HD12 LEU 11 4.786 -5.496 14.939 919 HD13 LEU 11 HD13 LEU 11 6.549 -5.426 14.935 920 HD21 LEU 11 HD21 LEU 11 6.894 -3.807 12.358 921 HD22 LEU 11 HD22 LEU 11 7.720 -3.524 13.892 922 HD23 LEU 11 HD23 LEU 11 6.804 -2.224 13.132 923 H LEU 12 HN LEU 12 1.658 -1.643 13.445 924 HA LEU 12 HA LEU 12 0.686 -2.165 10.805 925 HB2 LEU 12 HB2 LEU 12 -0.743 -1.119 13.253 926 HB3 LEU 12 HB1 LEU 12 -1.526 -1.639 11.772 927 HG LEU 12 HG LEU 12 0.127 -3.431 13.557 928 HD11 LEU 12 HD11 LEU 12 -2.023 -4.435 14.174 929 HD12 LEU 12 HD12 LEU 12 -2.859 -3.184 13.256 930 HD13 LEU 12 HD13 LEU 12 -1.912 -2.750 14.676 931 HD21 LEU 12 HD21 LEU 12 -1.602 -4.027 11.161 932 HD22 LEU 12 HD22 LEU 12 -0.844 -5.233 12.198 933 HD23 LEU 12 HD23 LEU 12 0.156 -4.141 11.239 934 H ASP 13 HN ASP 13 1.159 0.711 12.801 935 HA ASP 13 HA ASP 13 0.071 2.462 10.799 936 HB2 ASP 13 HB2 ASP 13 1.559 2.919 13.367 937 HB3 ASP 13 HB1 ASP 13 1.253 4.248 12.254 938 H GLN 14 HN GLN 14 3.047 0.893 11.244 939 HA GLN 14 HA GLN 14 4.641 2.765 9.784 940 HB2 GLN 14 HB2 GLN 14 5.644 1.162 11.362 941 HB3 GLN 14 HB1 GLN 14 5.132 -0.169 10.334 942 HG2 GLN 14 HG2 GLN 14 7.437 0.223 9.934 943 HG3 GLN 14 HG1 GLN 14 6.544 0.771 8.519 944 HE21 GLN 14 HE21 GLN 14 9.191 1.486 9.397 945 HE22 GLN 14 HE22 GLN 14 9.194 3.199 9.619 946 H VAL 15 HN VAL 15 3.032 -0.319 8.971 947 HA VAL 15 HA VAL 15 3.700 -0.160 6.209 948 HB VAL 15 HB VAL 15 1.989 -1.870 5.823 949 HG11 VAL 15 HG11 VAL 15 3.647 -2.420 8.276 950 HG12 VAL 15 HG12 VAL 15 4.188 -2.558 6.603 951 HG13 VAL 15 HG13 VAL 15 2.931 -3.635 7.215 952 HG21 VAL 15 HG21 VAL 15 0.676 -2.788 7.666 953 HG22 VAL 15 HG22 VAL 15 0.276 -1.096 7.368 954 HG23 VAL 15 HG23 VAL 15 1.300 -1.532 8.737 955 H ALA 16 HN ALA 16 1.174 1.176 8.184 956 HA ALA 16 HA ALA 16 -0.534 2.103 6.130 957 HB1 ALA 16 HB1 ALA 16 -1.407 3.633 7.816 958 HB2 ALA 16 HB2 ALA 16 -0.032 3.281 8.862 959 HB3 ALA 16 HB3 ALA 16 -1.201 2.015 8.490 960 H ARG 17 HN ARG 17 2.343 3.411 7.664 961 HA ARG 17 HA ARG 17 2.374 5.949 6.473 962 HB2 ARG 17 HB2 ARG 17 3.783 5.469 8.345 963 HB3 ARG 17 HB1 ARG 17 4.565 4.147 7.499 964 HG2 ARG 17 HG2 ARG 17 5.716 5.673 6.055 965 HG3 ARG 17 HG1 ARG 17 4.806 7.042 6.704 966 HD2 ARG 17 HD2 ARG 17 5.864 6.883 8.803 967 HD3 ARG 17 HD1 ARG 17 6.489 5.274 8.455 968 HE ARG 17 HE ARG 17 7.782 6.655 6.621 969 HH11 ARG 17 HH11 ARG 17 7.136 7.583 9.937 970 HH12 ARG 17 HH12 ARG 17 8.643 8.427 10.135 971 HH21 ARG 17 HH21 ARG 17 9.761 7.742 6.875 972 HH22 ARG 17 HH22 ARG 17 10.138 8.532 8.378 973 H VAL 18 HN VAL 18 3.594 2.827 5.377 974 HA VAL 18 HA VAL 18 4.803 3.712 2.985 975 HB VAL 18 HB VAL 18 3.505 1.038 3.550 976 HG11 VAL 18 HG11 VAL 18 5.555 1.814 1.479 977 HG12 VAL 18 HG12 VAL 18 3.868 1.405 1.170 978 HG13 VAL 18 HG13 VAL 18 4.973 0.178 1.790 979 HG21 VAL 18 HG21 VAL 18 5.213 1.559 5.198 980 HG22 VAL 18 HG22 VAL 18 6.363 1.931 3.913 981 HG23 VAL 18 HG23 VAL 18 5.769 0.282 4.115 982 H GLY 19 HN GLY 19 1.565 2.369 3.608 983 HA2 GLY 19 HA2 GLY 19 0.575 2.673 0.990 984 HA3 GLY 19 HA1 GLY 19 -0.405 2.541 2.443 985 H LYS 20 HN LYS 20 0.819 4.907 3.654 986 HA LYS 20 HA LYS 20 -0.935 6.898 2.729 987 HB2 LYS 20 HB2 LYS 20 0.190 6.664 5.021 988 HB3 LYS 20 HB1 LYS 20 1.598 7.411 4.283 989 HG2 LYS 20 HG2 LYS 20 0.287 9.401 3.777 990 HG3 LYS 20 HG1 LYS 20 -1.139 8.648 4.501 991 HD2 LYS 20 HD2 LYS 20 0.205 8.425 6.627 992 HD3 LYS 20 HD1 LYS 20 1.429 9.443 5.868 993 HE2 LYS 20 HE2 LYS 20 -0.013 10.781 7.279 994 HE3 LYS 20 HE1 LYS 20 -0.246 11.217 5.586 995 HZ1 LYS 20 HZ1 LYS 20 -2.322 10.968 6.948 996 HZ2 LYS 20 HZ2 LYS 20 -2.010 9.301 7.008 997 HZ3 LYS 20 HZ3 LYS 20 -2.287 10.060 5.518 998 H ALA 21 HN ALA 21 2.503 6.294 2.139 999 HA ALA 21 HA ALA 21 2.902 8.584 0.485 1000 HB1 ALA 21 HB1 ALA 21 4.466 6.004 0.612 1001 HB2 ALA 21 HB2 ALA 21 4.773 7.452 1.572 1002 HB3 ALA 21 HB3 ALA 21 4.993 7.491 -0.178 1003 H LEU 22 HN LEU 22 1.627 5.411 -0.015 1004 HA LEU 22 HA LEU 22 1.778 5.598 -2.925 1005 HB2 LEU 22 HB2 LEU 22 2.230 3.495 -1.570 1006 HB3 LEU 22 HB1 LEU 22 0.513 3.443 -1.230 1007 HG LEU 22 HG LEU 22 0.645 3.621 -4.004 1008 HD11 LEU 22 HD11 LEU 22 3.050 3.155 -3.895 1009 HD12 LEU 22 HD12 LEU 22 2.161 1.846 -4.669 1010 HD13 LEU 22 HD13 LEU 22 2.716 1.670 -3.005 1011 HD21 LEU 22 HD21 LEU 22 -0.935 2.311 -2.685 1012 HD22 LEU 22 HD22 LEU 22 0.352 1.185 -2.250 1013 HD23 LEU 22 HD23 LEU 22 -0.170 1.325 -3.930 1014 H ALA 23 HN ALA 23 0.005 7.411 -1.260 1015 HA ALA 23 HA ALA 23 -2.657 6.365 -1.884 1016 HB1 ALA 23 HB1 ALA 23 -2.146 6.969 0.451 1017 HB2 ALA 23 HB2 ALA 23 -3.526 7.840 -0.218 1018 HB3 ALA 23 HB3 ALA 23 -1.967 8.650 -0.053 1019 H ASN 24 HN ASN 24 -0.696 8.168 -3.676 1020 HA ASN 24 HA ASN 24 -3.034 9.408 -4.861 1021 HB2 ASN 24 HB2 ASN 24 -2.282 11.592 -5.054 1022 HB3 ASN 24 HB1 ASN 24 -1.782 11.159 -3.433 1023 HD21 ASN 24 HD21 ASN 24 -0.206 12.619 -3.236 1024 HD22 ASN 24 HD22 ASN 24 1.243 12.625 -4.185 1025 H GLY 25 HN GLY 25 -2.485 10.266 -7.141 1026 HA2 GLY 25 HA2 GLY 25 -1.650 7.790 -8.359 1027 HA3 GLY 25 HA1 GLY 25 -2.429 9.139 -9.157 1028 H ARG 26 HN ARG 26 -0.513 11.188 -8.652 1029 HA ARG 26 HA ARG 26 1.097 10.318 -10.876 1030 HB2 ARG 26 HB2 ARG 26 1.726 12.635 -11.205 1031 HB3 ARG 26 HB1 ARG 26 -0.012 12.442 -11.089 1032 HG2 ARG 26 HG2 ARG 26 -0.035 13.373 -8.888 1033 HG3 ARG 26 HG1 ARG 26 1.733 13.390 -8.830 1034 HD2 ARG 26 HD2 ARG 26 1.831 15.002 -10.608 1035 HD3 ARG 26 HD1 ARG 26 0.093 14.894 -10.863 1036 HE ARG 26 HE ARG 26 0.122 15.736 -8.367 1037 HH11 ARG 26 HH11 ARG 26 2.150 16.756 -11.052 1038 HH12 ARG 26 HH12 ARG 26 2.289 18.398 -10.488 1039 HH21 ARG 26 HH21 ARG 26 0.282 17.909 -7.643 1040 HH22 ARG 26 HH22 ARG 26 1.199 19.055 -8.571 1041 H ARG 27 HN ARG 27 1.712 10.508 -7.518 1042 HA ARG 27 HA ARG 27 4.565 10.681 -8.097 1043 HB2 ARG 27 HB2 ARG 27 5.019 10.687 -5.762 1044 HB3 ARG 27 HB1 ARG 27 3.720 11.822 -6.066 1045 HG2 ARG 27 HG2 ARG 27 2.108 10.143 -5.229 1046 HG3 ARG 27 HG1 ARG 27 3.471 9.082 -4.844 1047 HD2 ARG 27 HD2 ARG 27 4.397 10.786 -3.367 1048 HD3 ARG 27 HD1 ARG 27 3.074 11.875 -3.764 1049 HE ARG 27 HE ARG 27 2.413 9.298 -2.548 1050 HH11 ARG 27 HH11 ARG 27 2.761 12.782 -2.185 1051 HH12 ARG 27 HH12 ARG 27 1.842 12.837 -0.709 1052 HH21 ARG 27 HH21 ARG 27 1.209 9.401 -0.586 1053 HH22 ARG 27 HH22 ARG 27 0.991 10.928 0.206 1054 H LEU 28 HN LEU 28 2.159 8.355 -7.987 1055 HA LEU 28 HA LEU 28 3.809 6.088 -7.414 1056 HB2 LEU 28 HB2 LEU 28 1.272 6.288 -9.045 1057 HB3 LEU 28 HB1 LEU 28 2.036 4.788 -8.559 1058 HG LEU 28 HG LEU 28 0.793 6.835 -6.724 1059 HD11 LEU 28 HD11 LEU 28 -0.844 5.520 -7.947 1060 HD12 LEU 28 HD12 LEU 28 -0.813 5.051 -6.247 1061 HD13 LEU 28 HD13 LEU 28 -0.035 4.030 -7.457 1062 HD21 LEU 28 HD21 LEU 28 2.139 4.215 -6.087 1063 HD22 LEU 28 HD22 LEU 28 1.253 5.220 -4.940 1064 HD23 LEU 28 HD23 LEU 28 2.736 5.822 -5.677 1065 H GLN 29 HN GLN 29 3.175 8.096 -10.165 1066 HA GLN 29 HA GLN 29 4.204 6.493 -12.222 1067 HB2 GLN 29 HB2 GLN 29 4.243 9.504 -11.906 1068 HB3 GLN 29 HB1 GLN 29 4.639 8.656 -13.395 1069 HG2 GLN 29 HG2 GLN 29 2.381 7.744 -13.484 1070 HG3 GLN 29 HG1 GLN 29 1.984 8.573 -11.981 1071 HE21 GLN 29 HE21 GLN 29 0.321 9.723 -12.975 1072 HE22 GLN 29 HE22 GLN 29 0.627 11.037 -14.060 1073 H ILE 30 HN ILE 30 5.728 8.445 -9.777 1074 HA ILE 30 HA ILE 30 8.354 8.398 -10.850 1075 HB ILE 30 HB ILE 30 7.487 8.725 -7.970 1076 HG12 ILE 30 HG12 ILE 30 8.065 10.806 -10.096 1077 HG13 ILE 30 HG11 ILE 30 6.465 10.380 -9.495 1078 HG21 ILE 30 HG21 ILE 30 10.072 9.456 -9.344 1079 HG22 ILE 30 HG22 ILE 30 9.847 8.149 -8.181 1080 HG23 ILE 30 HG23 ILE 30 9.656 9.826 -7.669 1081 HD11 ILE 30 HD11 ILE 30 7.109 11.168 -7.268 1082 HD12 ILE 30 HD12 ILE 30 7.236 12.434 -8.488 1083 HD13 ILE 30 HD13 ILE 30 8.690 11.626 -7.899 1084 H LEU 31 HN LEU 31 6.573 6.328 -8.602 1085 HA LEU 31 HA LEU 31 8.691 4.624 -7.887 1086 HB2 LEU 31 HB2 LEU 31 5.726 4.085 -8.077 1087 HB3 LEU 31 HB1 LEU 31 6.881 2.960 -7.386 1088 HG LEU 31 HG LEU 31 6.306 5.732 -6.333 1089 HD11 LEU 31 HD11 LEU 31 5.267 4.558 -4.459 1090 HD12 LEU 31 HD12 LEU 31 5.535 3.018 -5.274 1091 HD13 LEU 31 HD13 LEU 31 4.440 4.209 -5.977 1092 HD21 LEU 31 HD21 LEU 31 8.606 5.048 -5.917 1093 HD22 LEU 31 HD22 LEU 31 8.043 3.516 -5.251 1094 HD23 LEU 31 HD23 LEU 31 7.672 5.027 -4.420 1095 H ASP 32 HN ASP 32 6.368 4.498 -10.550 1096 HA ASP 32 HA ASP 32 7.241 2.075 -11.695 1097 HB2 ASP 32 HB2 ASP 32 5.138 3.046 -12.387 1098 HB3 ASP 32 HB1 ASP 32 5.939 4.512 -12.937 1099 H LEU 33 HN LEU 33 8.428 5.345 -11.886 1100 HA LEU 33 HA LEU 33 10.184 4.880 -14.105 1101 HB2 LEU 33 HB2 LEU 33 9.149 7.076 -13.551 1102 HB3 LEU 33 HB1 LEU 33 10.147 7.150 -12.115 1103 HG LEU 33 HG LEU 33 11.480 6.888 -14.781 1104 HD11 LEU 33 HD11 LEU 33 9.827 8.664 -15.080 1105 HD12 LEU 33 HD12 LEU 33 11.463 9.323 -15.013 1106 HD13 LEU 33 HD13 LEU 33 10.399 9.452 -13.611 1107 HD21 LEU 33 HD21 LEU 33 12.815 6.781 -12.724 1108 HD22 LEU 33 HD22 LEU 33 12.180 8.351 -12.232 1109 HD23 LEU 33 HD23 LEU 33 13.198 8.222 -13.667 1110 H LEU 34 HN LEU 34 10.412 4.612 -10.643 1111 HA LEU 34 HA LEU 34 13.326 4.436 -10.747 1112 HB2 LEU 34 HB2 LEU 34 11.454 4.338 -8.383 1113 HB3 LEU 34 HB1 LEU 34 13.205 4.401 -8.299 1114 HG LEU 34 HG LEU 34 11.402 6.564 -9.385 1115 HD11 LEU 34 HD11 LEU 34 12.142 7.841 -7.445 1116 HD12 LEU 34 HD12 LEU 34 13.076 6.456 -6.881 1117 HD13 LEU 34 HD13 LEU 34 11.316 6.360 -6.957 1118 HD21 LEU 34 HD21 LEU 34 14.399 6.504 -9.067 1119 HD22 LEU 34 HD22 LEU 34 13.439 7.901 -9.554 1120 HD23 LEU 34 HD23 LEU 34 13.513 6.475 -10.593 1121 H ALA 35 HN ALA 35 10.709 2.387 -11.022 1122 HA ALA 35 HA ALA 35 12.012 0.083 -9.820 1123 HB1 ALA 35 HB1 ALA 35 10.023 -1.151 -10.498 1124 HB2 ALA 35 HB2 ALA 35 9.435 0.257 -11.383 1125 HB3 ALA 35 HB3 ALA 35 9.581 0.316 -9.626 1126 H GLN 36 HN GLN 36 12.173 1.748 -12.684 1127 HA GLN 36 HA GLN 36 12.903 -0.635 -14.247 1128 HB2 GLN 36 HB2 GLN 36 12.640 0.849 -16.231 1129 HB3 GLN 36 HB1 GLN 36 11.159 0.648 -15.304 1130 HG2 GLN 36 HG2 GLN 36 11.584 2.818 -14.215 1131 HG3 GLN 36 HG1 GLN 36 13.010 3.018 -15.228 1132 HE21 GLN 36 HE21 GLN 36 9.551 2.997 -15.115 1133 HE22 GLN 36 HE22 GLN 36 9.294 3.700 -16.675 1134 H GLY 37 HN GLY 37 14.412 1.238 -12.254 1135 HA2 GLY 37 HA2 GLY 37 16.932 0.851 -12.597 1136 HA3 GLY 37 HA1 GLY 37 16.692 1.892 -13.995 1137 H GLU 38 HN GLU 38 18.506 2.807 -12.362 1138 HA GLU 38 HA GLU 38 17.269 4.559 -10.391 1139 HB2 GLU 38 HB2 GLU 38 19.606 5.179 -9.802 1140 HB3 GLU 38 HB1 GLU 38 19.274 3.461 -9.643 1141 HG2 GLU 38 HG2 GLU 38 20.549 4.575 -12.115 1142 HG3 GLU 38 HG1 GLU 38 21.498 4.197 -10.680 1143 H ARG 39 HN ARG 39 16.747 6.575 -10.795 1144 HA ARG 39 HA ARG 39 18.158 7.994 -12.949 1145 HB2 ARG 39 HB2 ARG 39 15.207 7.759 -12.510 1146 HB3 ARG 39 HB1 ARG 39 15.856 9.244 -13.185 1147 HG2 ARG 39 HG2 ARG 39 15.239 7.963 -15.032 1148 HG3 ARG 39 HG1 ARG 39 16.988 7.777 -14.923 1149 HD2 ARG 39 HD2 ARG 39 16.561 5.642 -13.653 1150 HD3 ARG 39 HD1 ARG 39 14.863 5.810 -14.103 1151 HE ARG 39 HE ARG 39 17.115 5.310 -15.926 1152 HH11 ARG 39 HH11 ARG 39 13.669 5.487 -15.337 1153 HH12 ARG 39 HH12 ARG 39 13.240 4.820 -16.882 1154 HH21 ARG 39 HH21 ARG 39 16.566 4.449 -17.957 1155 HH22 ARG 39 HH22 ARG 39 14.894 4.229 -18.383 1156 H ALA 40 HN ALA 40 18.376 10.238 -12.674 1157 HA ALA 40 HA ALA 40 18.495 11.051 -9.905 1158 HB1 ALA 40 HB1 ALA 40 19.619 13.041 -10.749 1159 HB2 ALA 40 HB2 ALA 40 19.244 12.567 -12.405 1160 HB3 ALA 40 HB3 ALA 40 20.339 11.584 -11.433 1161 H VAL 41 HN VAL 41 17.549 13.026 -9.131 1162 HA VAL 41 HA VAL 41 14.833 13.297 -9.458 1163 HB VAL 41 HB VAL 41 16.686 15.577 -8.747 1164 HG11 VAL 41 HG11 VAL 41 13.822 15.034 -7.975 1165 HG12 VAL 41 HG12 VAL 41 14.379 16.265 -9.109 1166 HG13 VAL 41 HG13 VAL 41 14.807 16.380 -7.402 1167 HG21 VAL 41 HG21 VAL 41 15.559 13.416 -6.969 1168 HG22 VAL 41 HG22 VAL 41 16.452 14.834 -6.421 1169 HG23 VAL 41 HG23 VAL 41 17.252 13.622 -7.420 1170 H GLU 42 HN GLU 42 17.386 14.927 -11.220 1171 HA GLU 42 HA GLU 42 15.892 16.866 -12.559 1172 HB2 GLU 42 HB2 GLU 42 18.389 16.704 -12.379 1173 HB3 GLU 42 HB1 GLU 42 18.346 15.416 -13.568 1174 HG2 GLU 42 HG2 GLU 42 17.105 18.017 -14.268 1175 HG3 GLU 42 HG1 GLU 42 18.862 17.905 -14.224 1176 H ALA 43 HN ALA 43 16.819 13.590 -13.619 1177 HA ALA 43 HA ALA 43 15.370 13.697 -16.053 1178 HB1 ALA 43 HB1 ALA 43 17.250 12.169 -15.686 1179 HB2 ALA 43 HB2 ALA 43 15.796 11.308 -16.191 1180 HB3 ALA 43 HB3 ALA 43 16.291 11.284 -14.499 1181 H ILE 44 HN ILE 44 14.619 12.480 -12.824 1182 HA ILE 44 HA ILE 44 12.223 11.158 -13.368 1183 HB ILE 44 HB ILE 44 12.975 12.688 -10.869 1184 HG12 ILE 44 HG12 ILE 44 13.228 9.738 -11.501 1185 HG13 ILE 44 HG11 ILE 44 14.560 10.887 -11.516 1186 HG21 ILE 44 HG21 ILE 44 10.870 10.571 -11.284 1187 HG22 ILE 44 HG22 ILE 44 10.579 12.284 -10.986 1188 HG23 ILE 44 HG23 ILE 44 11.322 11.286 -9.735 1189 HD11 ILE 44 HD11 ILE 44 14.526 9.581 -9.468 1190 HD12 ILE 44 HD12 ILE 44 12.897 10.158 -9.117 1191 HD13 ILE 44 HD13 ILE 44 14.248 11.292 -9.138 1192 H ALA 45 HN ALA 45 12.761 14.528 -12.386 1193 HA ALA 45 HA ALA 45 10.074 15.324 -12.357 1194 HB1 ALA 45 HB1 ALA 45 11.891 16.601 -11.319 1195 HB2 ALA 45 HB2 ALA 45 10.927 17.598 -12.408 1196 HB3 ALA 45 HB3 ALA 45 12.509 17.010 -12.919 1197 H THR 46 HN THR 46 12.489 15.388 -14.934 1198 HA THR 46 HA THR 46 10.982 16.822 -16.819 1199 HB THR 46 HB THR 46 13.112 14.734 -17.327 1200 HG1 THR 46 HG1 THR 46 14.190 16.246 -16.221 1201 HG21 THR 46 HG21 THR 46 13.475 15.942 -19.437 1202 HG22 THR 46 HG22 THR 46 12.106 16.989 -19.068 1203 HG23 THR 46 HG23 THR 46 11.848 15.267 -19.348 1204 H ALA 47 HN ALA 47 11.314 13.314 -16.292 1205 HA ALA 47 HA ALA 47 9.745 12.563 -18.528 1206 HB1 ALA 47 HB1 ALA 47 11.360 11.051 -17.514 1207 HB2 ALA 47 HB2 ALA 47 9.752 10.327 -17.546 1208 HB3 ALA 47 HB3 ALA 47 10.389 10.989 -16.041 1209 H THR 48 HN THR 48 8.939 13.318 -15.199 1210 HA THR 48 HA THR 48 6.226 12.339 -15.514 1211 HB THR 48 HB THR 48 5.964 13.283 -13.156 1212 HG1 THR 48 HG1 THR 48 8.801 13.295 -13.140 1213 HG21 THR 48 HG21 THR 48 7.190 11.402 -12.140 1214 HG22 THR 48 HG22 THR 48 8.039 11.144 -13.665 1215 HG23 THR 48 HG23 THR 48 6.293 10.905 -13.576 1216 H GLY 49 HN GLY 49 7.864 15.168 -16.250 1217 HA2 GLY 49 HA2 GLY 49 7.038 17.111 -17.176 1218 HA3 GLY 49 HA1 GLY 49 5.414 16.486 -16.932 1219 H MET 50 HN MET 50 7.858 16.936 -14.423 1220 HA MET 50 HA MET 50 6.299 19.207 -13.388 1221 HB2 MET 50 HB2 MET 50 6.545 18.369 -11.099 1222 HB3 MET 50 HB1 MET 50 5.657 17.226 -12.094 1223 HG2 MET 50 HG2 MET 50 7.688 15.880 -12.333 1224 HG3 MET 50 HG1 MET 50 8.554 17.021 -11.305 1225 HE1 MET 50 HE1 MET 50 4.866 15.605 -11.019 1226 HE2 MET 50 HE2 MET 50 5.126 14.269 -9.897 1227 HE3 MET 50 HE3 MET 50 5.845 14.220 -11.507 1228 H ASN 51 HN ASN 51 7.661 20.154 -11.411 1229 HA ASN 51 HA ASN 51 10.250 20.830 -12.542 1230 HB2 ASN 51 HB2 ASN 51 8.842 22.645 -11.704 1231 HB3 ASN 51 HB1 ASN 51 8.789 21.898 -10.111 1232 HD21 ASN 51 HD21 ASN 51 10.761 23.623 -12.411 1233 HD22 ASN 51 HD22 ASN 51 12.012 24.065 -11.294 1234 H LEU 52 HN LEU 52 12.224 20.717 -11.291 1235 HA LEU 52 HA LEU 52 12.655 18.210 -10.141 1236 HB2 LEU 52 HB2 LEU 52 14.260 20.740 -10.167 1237 HB3 LEU 52 HB1 LEU 52 14.812 19.349 -9.255 1238 HG LEU 52 HG LEU 52 14.748 18.021 -11.384 1239 HD11 LEU 52 HD11 LEU 52 14.323 20.729 -12.634 1240 HD12 LEU 52 HD12 LEU 52 13.185 19.383 -12.647 1241 HD13 LEU 52 HD13 LEU 52 14.720 19.246 -13.504 1242 HD21 LEU 52 HD21 LEU 52 16.825 18.939 -12.247 1243 HD22 LEU 52 HD22 LEU 52 16.820 18.957 -10.483 1244 HD23 LEU 52 HD23 LEU 52 16.534 20.449 -11.382 1245 H THR 53 HN THR 53 12.150 21.360 -8.586 1246 HA THR 53 HA THR 53 12.546 20.446 -5.940 1247 HB THR 53 HB THR 53 10.848 22.780 -6.851 1248 HG1 THR 53 HG1 THR 53 13.163 23.671 -6.054 1249 HG21 THR 53 HG21 THR 53 10.523 22.203 -4.499 1250 HG22 THR 53 HG22 THR 53 11.411 23.719 -4.646 1251 HG23 THR 53 HG23 THR 53 12.267 22.232 -4.240 1252 H THR 54 HN THR 54 9.717 20.640 -8.040 1253 HA THR 54 HA THR 54 7.766 19.874 -6.154 1254 HB THR 54 HB THR 54 7.737 19.247 -9.114 1255 HG1 THR 54 HG1 THR 54 6.708 21.599 -7.875 1256 HG21 THR 54 HG21 THR 54 5.301 19.444 -8.858 1257 HG22 THR 54 HG22 THR 54 5.512 19.710 -7.127 1258 HG23 THR 54 HG23 THR 54 5.965 18.164 -7.844 1259 H ALA 55 HN ALA 55 9.694 18.006 -8.478 1260 HA ALA 55 HA ALA 55 8.677 15.472 -7.805 1261 HB1 ALA 55 HB1 ALA 55 10.614 14.573 -8.966 1262 HB2 ALA 55 HB2 ALA 55 11.398 16.151 -8.912 1263 HB3 ALA 55 HB3 ALA 55 9.930 15.930 -9.867 1264 H SER 56 HN SER 56 11.359 17.362 -6.500 1265 HA SER 56 HA SER 56 12.499 15.344 -4.912 1266 HB2 SER 56 HB2 SER 56 13.575 17.531 -5.467 1267 HB3 SER 56 HB1 SER 56 12.476 18.317 -4.335 1268 HG SER 56 HG SER 56 13.378 16.768 -2.741 1269 H ALA 57 HN ALA 57 9.804 17.527 -4.340 1270 HA ALA 57 HA ALA 57 9.474 16.949 -1.582 1271 HB1 ALA 57 HB1 ALA 57 7.255 17.922 -1.831 1272 HB2 ALA 57 HB2 ALA 57 7.398 17.836 -3.586 1273 HB3 ALA 57 HB3 ALA 57 8.458 18.906 -2.668 1274 H ASN 58 HN ASN 58 7.996 15.629 -4.514 1275 HA ASN 58 HA ASN 58 6.376 13.703 -3.237 1276 HB2 ASN 58 HB2 ASN 58 7.481 13.911 -6.035 1277 HB3 ASN 58 HB1 ASN 58 6.463 12.568 -5.538 1278 HD21 ASN 58 HD21 ASN 58 6.582 16.006 -6.149 1279 HD22 ASN 58 HD22 ASN 58 4.871 16.247 -6.209 1280 H LEU 59 HN LEU 59 9.665 13.592 -4.512 1281 HA LEU 59 HA LEU 59 10.164 10.863 -4.029 1282 HB2 LEU 59 HB2 LEU 59 11.983 13.253 -4.231 1283 HB3 LEU 59 HB1 LEU 59 12.595 11.628 -3.989 1284 HG LEU 59 HG LEU 59 10.891 12.437 -6.345 1285 HD11 LEU 59 HD11 LEU 59 13.885 12.182 -6.114 1286 HD12 LEU 59 HD12 LEU 59 12.976 13.664 -6.418 1287 HD13 LEU 59 HD13 LEU 59 12.996 12.375 -7.623 1288 HD21 LEU 59 HD21 LEU 59 12.560 9.993 -5.769 1289 HD22 LEU 59 HD22 LEU 59 11.726 10.326 -7.286 1290 HD23 LEU 59 HD23 LEU 59 10.799 10.070 -5.807 1291 H GLN 60 HN GLN 60 10.409 13.708 -1.972 1292 HA GLN 60 HA GLN 60 11.814 12.499 0.151 1293 HB2 GLN 60 HB2 GLN 60 11.565 14.936 -0.071 1294 HB3 GLN 60 HB1 GLN 60 9.837 14.789 0.231 1295 HG2 GLN 60 HG2 GLN 60 10.290 13.960 2.475 1296 HG3 GLN 60 HG1 GLN 60 12.025 14.067 2.171 1297 HE21 GLN 60 HE21 GLN 60 13.020 16.059 2.160 1298 HE22 GLN 60 HE22 GLN 60 12.243 17.495 2.728 1299 H ALA 61 HN ALA 61 8.389 12.703 -0.640 1300 HA ALA 61 HA ALA 61 7.398 11.532 1.737 1301 HB1 ALA 61 HB1 ALA 61 5.348 11.128 0.456 1302 HB2 ALA 61 HB2 ALA 61 6.200 11.529 -1.035 1303 HB3 ALA 61 HB3 ALA 61 5.956 12.763 0.200 1304 H LEU 62 HN LEU 62 8.286 10.172 -1.412 1305 HA LEU 62 HA LEU 62 7.622 7.491 -0.779 1306 HB2 LEU 62 HB2 LEU 62 9.586 8.534 -2.821 1307 HB3 LEU 62 HB1 LEU 62 8.921 6.911 -2.772 1308 HG LEU 62 HG LEU 62 7.316 9.429 -3.224 1309 HD11 LEU 62 HD11 LEU 62 8.757 8.980 -5.108 1310 HD12 LEU 62 HD12 LEU 62 7.084 8.597 -5.520 1311 HD13 LEU 62 HD13 LEU 62 8.221 7.300 -5.149 1312 HD21 LEU 62 HD21 LEU 62 6.008 7.693 -2.141 1313 HD22 LEU 62 HD22 LEU 62 6.523 6.522 -3.353 1314 HD23 LEU 62 HD23 LEU 62 5.507 7.886 -3.820 1315 H LYS 63 HN LYS 63 10.564 9.393 -0.503 1316 HA LYS 63 HA LYS 63 12.310 7.328 0.291 1317 HB2 LYS 63 HB2 LYS 63 13.113 9.525 -0.420 1318 HB3 LYS 63 HB1 LYS 63 12.331 10.280 0.962 1319 HG2 LYS 63 HG2 LYS 63 13.825 9.030 2.462 1320 HG3 LYS 63 HG1 LYS 63 14.629 8.334 1.053 1321 HD2 LYS 63 HD2 LYS 63 14.452 11.285 1.675 1322 HD3 LYS 63 HD1 LYS 63 15.854 10.263 1.997 1323 HE2 LYS 63 HE2 LYS 63 16.103 9.807 -0.371 1324 HE3 LYS 63 HE1 LYS 63 14.650 10.739 -0.729 1325 HZ1 LYS 63 HZ1 LYS 63 15.772 12.716 0.130 1326 HZ2 LYS 63 HZ2 LYS 63 16.623 12.034 -1.165 1327 HZ3 LYS 63 HZ3 LYS 63 17.177 11.809 0.423 1328 H SER 64 HN SER 64 10.235 9.528 2.138 1329 HA SER 64 HA SER 64 11.030 8.613 4.697 1330 HB2 SER 64 HB2 SER 64 8.471 9.980 3.840 1331 HB3 SER 64 HB1 SER 64 9.025 9.800 5.506 1332 HG SER 64 HG SER 64 10.128 11.360 3.421 1333 H GLY 65 HN GLY 65 8.574 7.543 2.428 1334 HA2 GLY 65 HA2 GLY 65 7.223 5.827 4.278 1335 HA3 GLY 65 HA1 GLY 65 7.059 5.810 2.528 1336 H GLY 66 HN GLY 66 10.162 5.557 2.550 1337 HA2 GLY 66 HA2 GLY 66 11.726 3.834 2.786 1338 HA3 GLY 66 HA1 GLY 66 10.469 2.819 3.479 1339 H LEU 67 HN LEU 67 9.756 4.482 0.559 1340 HA LEU 67 HA LEU 67 9.456 1.955 -0.813 1341 HB2 LEU 67 HB2 LEU 67 8.781 4.796 -1.548 1342 HB3 LEU 67 HB1 LEU 67 8.655 3.492 -2.707 1343 HG LEU 67 HG LEU 67 6.477 3.888 -1.860 1344 HD11 LEU 67 HD11 LEU 67 7.047 1.541 -2.148 1345 HD12 LEU 67 HD12 LEU 67 5.895 1.762 -0.831 1346 HD13 LEU 67 HD13 LEU 67 7.594 1.460 -0.474 1347 HD21 LEU 67 HD21 LEU 67 7.086 5.110 0.163 1348 HD22 LEU 67 HD22 LEU 67 7.597 3.602 0.923 1349 HD23 LEU 67 HD23 LEU 67 5.902 3.846 0.499 1350 H VAL 68 HN VAL 68 11.489 4.832 -1.055 1351 HA VAL 68 HA VAL 68 13.165 3.390 -2.987 1352 HB VAL 68 HB VAL 68 13.561 5.479 -4.244 1353 HG11 VAL 68 HG11 VAL 68 11.936 3.863 -5.056 1354 HG12 VAL 68 HG12 VAL 68 11.425 5.508 -5.435 1355 HG13 VAL 68 HG13 VAL 68 10.669 4.635 -4.101 1356 HG21 VAL 68 HG21 VAL 68 13.019 7.115 -2.545 1357 HG22 VAL 68 HG22 VAL 68 11.339 6.582 -2.525 1358 HG23 VAL 68 HG23 VAL 68 11.996 7.368 -3.960 1359 H GLU 69 HN GLU 69 15.352 3.901 -2.985 1360 HA GLU 69 HA GLU 69 16.294 5.346 -0.598 1361 HB2 GLU 69 HB2 GLU 69 17.550 3.175 -2.277 1362 HB3 GLU 69 HB1 GLU 69 18.480 4.131 -1.133 1363 HG2 GLU 69 HG2 GLU 69 16.071 2.492 -0.392 1364 HG3 GLU 69 HG1 GLU 69 17.733 1.916 -0.289 1365 H ALA 70 HN ALA 70 17.967 6.863 -0.805 1366 HA ALA 70 HA ALA 70 18.223 7.987 -3.510 1367 HB1 ALA 70 HB1 ALA 70 17.334 9.493 -1.803 1368 HB2 ALA 70 HB2 ALA 70 18.888 10.059 -2.412 1369 HB3 ALA 70 HB3 ALA 70 18.791 9.267 -0.838 1370 H ARG 71 HN ARG 71 20.084 7.895 -4.563 1371 HA ARG 71 HA ARG 71 22.552 7.405 -3.025 1372 HB2 ARG 71 HB2 ARG 71 21.900 6.276 -5.755 1373 HB3 ARG 71 HB1 ARG 71 23.385 6.015 -4.856 1374 HG2 ARG 71 HG2 ARG 71 20.641 5.055 -4.059 1375 HG3 ARG 71 HG1 ARG 71 21.929 4.071 -4.755 1376 HD2 ARG 71 HD2 ARG 71 23.342 4.615 -2.796 1377 HD3 ARG 71 HD1 ARG 71 21.983 5.493 -2.095 1378 HE ARG 71 HE ARG 71 21.661 2.654 -2.787 1379 HH11 ARG 71 HH11 ARG 71 21.880 5.153 -0.334 1380 HH12 ARG 71 HH12 ARG 71 21.277 4.131 0.938 1381 HH21 ARG 71 HH21 ARG 71 20.856 1.328 -1.145 1382 HH22 ARG 71 HH22 ARG 71 20.666 1.950 0.467 1383 H ARG 72 HN ARG 72 23.621 9.304 -3.136 1384 HA ARG 72 HA ARG 72 23.446 10.943 -5.513 1385 HB2 ARG 72 HB2 ARG 72 24.727 11.280 -2.828 1386 HB3 ARG 72 HB1 ARG 72 25.214 12.318 -4.163 1387 HG2 ARG 72 HG2 ARG 72 22.879 13.024 -4.444 1388 HG3 ARG 72 HG1 ARG 72 22.423 12.019 -3.069 1389 HD2 ARG 72 HD2 ARG 72 23.760 13.336 -1.581 1390 HD3 ARG 72 HD1 ARG 72 24.453 14.238 -2.928 1391 HE ARG 72 HE ARG 72 22.139 15.103 -3.309 1392 HH11 ARG 72 HH11 ARG 72 23.152 13.988 -0.143 1393 HH12 ARG 72 HH12 ARG 72 21.994 14.965 0.712 1394 HH21 ARG 72 HH21 ARG 72 20.626 16.405 -2.172 1395 HH22 ARG 72 HH22 ARG 72 20.565 16.323 -0.437 1396 H GLU 73 HN GLU 73 24.865 11.059 -7.101 1397 HA GLU 73 HA GLU 73 27.509 9.836 -6.771 1398 HB2 GLU 73 HB2 GLU 73 25.644 8.360 -7.930 1399 HB3 GLU 73 HB1 GLU 73 25.992 9.383 -9.314 1400 HG2 GLU 73 HG2 GLU 73 28.058 7.761 -7.844 1401 HG3 GLU 73 HG1 GLU 73 27.213 7.223 -9.291 1402 H GLY 74 HN GLY 74 28.881 11.436 -7.167 1403 HA2 GLY 74 HA2 GLY 74 29.918 13.195 -8.228 1404 HA3 GLY 74 HA1 GLY 74 28.824 12.949 -9.582 1405 H THR 75 HN THR 75 27.139 14.297 -9.853 1406 HA THR 75 HA THR 75 26.772 16.389 -7.812 1407 HB THR 75 HB THR 75 26.207 16.594 -10.781 1408 HG1 THR 75 HG1 THR 75 28.142 17.929 -10.742 1409 HG21 THR 75 HG21 THR 75 26.338 18.711 -8.627 1410 HG22 THR 75 HG22 THR 75 24.873 18.128 -9.416 1411 HG23 THR 75 HG23 THR 75 26.086 19.007 -10.348 1412 H ARG 76 HN ARG 76 25.283 13.778 -9.394 1413 HA ARG 76 HA ARG 76 22.603 14.935 -9.146 1414 HB2 ARG 76 HB2 ARG 76 23.525 12.407 -10.506 1415 HB3 ARG 76 HB1 ARG 76 21.867 12.978 -10.461 1416 HG2 ARG 76 HG2 ARG 76 22.529 14.977 -11.712 1417 HG3 ARG 76 HG1 ARG 76 24.188 14.370 -11.777 1418 HD2 ARG 76 HD2 ARG 76 23.375 12.354 -12.930 1419 HD3 ARG 76 HD1 ARG 76 21.745 13.020 -12.916 1420 HE ARG 76 HE ARG 76 22.816 14.915 -14.258 1421 HH11 ARG 76 HH11 ARG 76 23.890 11.587 -14.347 1422 HH12 ARG 76 HH12 ARG 76 24.422 11.667 -16.003 1423 HH21 ARG 76 HH21 ARG 76 23.489 15.033 -16.426 1424 HH22 ARG 76 HH22 ARG 76 24.181 13.635 -17.192 1425 H GLN 77 HN GLN 77 21.010 14.038 -7.920 1426 HA GLN 77 HA GLN 77 21.752 11.866 -6.098 1427 HB2 GLN 77 HB2 GLN 77 20.754 13.941 -5.132 1428 HB3 GLN 77 HB1 GLN 77 19.301 13.644 -6.074 1429 HG2 GLN 77 HG2 GLN 77 19.009 11.499 -4.877 1430 HG3 GLN 77 HG1 GLN 77 20.407 11.899 -3.884 1431 HE21 GLN 77 HE21 GLN 77 18.057 14.266 -4.941 1432 HE22 GLN 77 HE22 GLN 77 17.355 14.551 -3.386 1433 H TYR 78 HN TYR 78 21.367 9.922 -6.968 1434 HA TYR 78 HA TYR 78 19.188 9.594 -8.883 1435 HB2 TYR 78 HB2 TYR 78 21.404 7.718 -8.026 1436 HB3 TYR 78 HB1 TYR 78 20.178 7.326 -9.226 1437 HD1 TYR 78 HD1 TYR 78 20.227 8.354 -11.435 1438 HD2 TYR 78 HD2 TYR 78 23.209 9.257 -8.538 1439 HE1 TYR 78 HE1 TYR 78 21.633 9.334 -13.198 1440 HE2 TYR 78 HE2 TYR 78 24.622 10.242 -10.292 1441 HH TYR 78 HH TYR 78 24.916 10.079 -12.737 1442 H TYR 79 HN TYR 79 17.521 8.142 -8.615 1443 HA TYR 79 HA TYR 79 17.190 7.065 -5.895 1444 HB2 TYR 79 HB2 TYR 79 15.224 8.444 -7.697 1445 HB3 TYR 79 HB1 TYR 79 14.668 7.312 -6.471 1446 HD1 TYR 79 HD2 TYR 79 16.502 10.499 -6.975 1447 HD2 TYR 79 HD1 TYR 79 14.502 7.947 -4.221 1448 HE1 TYR 79 HE2 TYR 79 16.546 12.287 -5.291 1449 HE2 TYR 79 HE1 TYR 79 14.541 9.729 -2.532 1450 HH TYR 79 HH TYR 79 15.453 12.972 -3.289 1451 H ARG 80 HN ARG 80 16.464 5.034 -5.674 1452 HA ARG 80 HA ARG 80 15.282 3.638 -7.945 1453 HB2 ARG 80 HB2 ARG 80 17.647 2.986 -8.081 1454 HB3 ARG 80 HB1 ARG 80 17.646 2.560 -6.374 1455 HG2 ARG 80 HG2 ARG 80 15.865 0.858 -6.924 1456 HG3 ARG 80 HG1 ARG 80 16.208 1.177 -8.622 1457 HD2 ARG 80 HD2 ARG 80 18.345 0.367 -6.669 1458 HD3 ARG 80 HD1 ARG 80 17.374 -0.813 -7.545 1459 HE ARG 80 HE ARG 80 19.194 1.145 -8.803 1460 HH11 ARG 80 HH11 ARG 80 17.541 -1.943 -8.761 1461 HH12 ARG 80 HH12 ARG 80 18.272 -2.515 -10.232 1462 HH21 ARG 80 HH21 ARG 80 20.180 0.401 -10.739 1463 HH22 ARG 80 HH22 ARG 80 19.790 -1.188 -11.347 1464 H ILE 81 HN ILE 81 13.947 1.862 -7.236 1465 HA ILE 81 HA ILE 81 12.598 2.121 -4.838 1466 HB ILE 81 HB ILE 81 13.084 -0.489 -6.288 1467 HG12 ILE 81 HG12 ILE 81 12.208 1.238 -7.807 1468 HG13 ILE 81 HG11 ILE 81 11.017 -0.021 -7.505 1469 HG21 ILE 81 HG21 ILE 81 10.946 -1.167 -5.308 1470 HG22 ILE 81 HG22 ILE 81 10.858 0.369 -4.446 1471 HG23 ILE 81 HG23 ILE 81 12.137 -0.785 -4.064 1472 HD11 ILE 81 HD11 ILE 81 9.987 2.168 -7.518 1473 HD12 ILE 81 HD12 ILE 81 11.070 2.706 -6.232 1474 HD13 ILE 81 HD13 ILE 81 9.881 1.442 -5.913 1475 H ALA 82 HN ALA 82 12.907 1.434 -2.777 1476 HA ALA 82 HA ALA 82 15.512 1.252 -1.832 1477 HB1 ALA 82 HB1 ALA 82 12.984 0.390 -0.442 1478 HB2 ALA 82 HB2 ALA 82 13.630 2.030 -0.495 1479 HB3 ALA 82 HB3 ALA 82 14.524 0.757 0.335 1480 H GLY 83 HN GLY 83 13.278 -1.303 -2.677 1481 HA2 GLY 83 HA2 GLY 83 15.484 -3.185 -2.662 1482 HA3 GLY 83 HA1 GLY 83 14.166 -3.559 -1.553 1483 H GLU 84 HN GLU 84 15.039 -5.087 -3.882 1484 HA GLU 84 HA GLU 84 13.323 -4.647 -6.074 1485 HB2 GLU 84 HB2 GLU 84 15.361 -6.075 -6.126 1486 HB3 GLU 84 HB1 GLU 84 14.509 -7.274 -5.164 1487 HG2 GLU 84 HG2 GLU 84 12.995 -7.738 -6.901 1488 HG3 GLU 84 HG1 GLU 84 13.495 -6.318 -7.819 1489 H ASP 85 HN ASP 85 12.905 -6.357 -3.054 1490 HA ASP 85 HA ASP 85 10.488 -7.682 -3.646 1491 HB2 ASP 85 HB2 ASP 85 11.372 -6.598 -0.959 1492 HB3 ASP 85 HB1 ASP 85 10.189 -7.871 -1.236 1493 H VAL 86 HN VAL 86 11.223 -4.419 -2.590 1494 HA VAL 86 HA VAL 86 8.546 -3.638 -2.025 1495 HB VAL 86 HB VAL 86 10.862 -1.845 -2.793 1496 HG11 VAL 86 HG11 VAL 86 8.332 -1.304 -1.245 1497 HG12 VAL 86 HG12 VAL 86 8.720 -0.716 -2.863 1498 HG13 VAL 86 HG13 VAL 86 9.652 -0.157 -1.473 1499 HG21 VAL 86 HG21 VAL 86 11.259 -1.611 -0.377 1500 HG22 VAL 86 HG22 VAL 86 11.522 -3.264 -0.934 1501 HG23 VAL 86 HG23 VAL 86 10.042 -2.849 -0.067 1502 H ALA 87 HN ALA 87 10.621 -3.504 -4.874 1503 HA ALA 87 HA ALA 87 8.885 -2.008 -6.524 1504 HB1 ALA 87 HB1 ALA 87 11.251 -2.370 -7.062 1505 HB2 ALA 87 HB2 ALA 87 10.200 -2.862 -8.389 1506 HB3 ALA 87 HB3 ALA 87 10.922 -4.081 -7.339 1507 H ARG 88 HN ARG 88 9.184 -5.438 -5.836 1508 HA ARG 88 HA ARG 88 7.252 -6.303 -7.724 1509 HB2 ARG 88 HB2 ARG 88 8.340 -7.589 -5.222 1510 HB3 ARG 88 HB1 ARG 88 7.211 -8.390 -6.308 1511 HG2 ARG 88 HG2 ARG 88 8.811 -8.201 -8.133 1512 HG3 ARG 88 HG1 ARG 88 9.945 -7.375 -7.062 1513 HD2 ARG 88 HD2 ARG 88 10.132 -9.343 -5.677 1514 HD3 ARG 88 HD1 ARG 88 8.893 -10.167 -6.626 1515 HE ARG 88 HE ARG 88 11.024 -9.346 -8.299 1516 HH11 ARG 88 HH11 ARG 88 10.257 -11.713 -5.839 1517 HH12 ARG 88 HH12 ARG 88 11.343 -12.910 -6.477 1518 HH21 ARG 88 HH21 ARG 88 12.451 -10.908 -9.130 1519 HH22 ARG 88 HH22 ARG 88 12.579 -12.457 -8.355 1520 H LEU 89 HN LEU 89 7.042 -4.986 -4.519 1521 HA LEU 89 HA LEU 89 4.377 -5.745 -3.933 1522 HB2 LEU 89 HB2 LEU 89 6.071 -4.798 -2.319 1523 HB3 LEU 89 HB1 LEU 89 5.809 -3.231 -3.052 1524 HG LEU 89 HG LEU 89 3.526 -4.756 -1.820 1525 HD11 LEU 89 HD11 LEU 89 5.405 -2.868 -0.408 1526 HD12 LEU 89 HD12 LEU 89 5.305 -4.608 -0.143 1527 HD13 LEU 89 HD13 LEU 89 3.935 -3.574 0.265 1528 HD21 LEU 89 HD21 LEU 89 2.987 -2.819 -3.220 1529 HD22 LEU 89 HD22 LEU 89 4.052 -1.812 -2.237 1530 HD23 LEU 89 HD23 LEU 89 2.599 -2.516 -1.526 1531 H PHE 90 HN PHE 90 5.770 -2.822 -5.398 1532 HA PHE 90 HA PHE 90 3.320 -1.548 -5.965 1533 HB2 PHE 90 HB2 PHE 90 5.485 -0.367 -5.969 1534 HB3 PHE 90 HB1 PHE 90 5.976 -1.275 -7.394 1535 HD1 PHE 90 HD1 PHE 90 3.396 1.101 -6.171 1536 HD2 PHE 90 HD2 PHE 90 5.524 -0.451 -9.516 1537 HE1 PHE 90 HE1 PHE 90 2.398 2.832 -7.604 1538 HE2 PHE 90 HE2 PHE 90 4.530 1.279 -10.955 1539 HZ PHE 90 HZ PHE 90 2.964 2.925 -10.001 1540 H ALA 91 HN ALA 91 5.250 -3.885 -7.727 1541 HA ALA 91 HA ALA 91 3.741 -3.814 -10.126 1542 HB1 ALA 91 HB1 ALA 91 5.405 -6.077 -9.024 1543 HB2 ALA 91 HB2 ALA 91 6.016 -4.740 -10.000 1544 HB3 ALA 91 HB3 ALA 91 4.868 -5.886 -10.694 1545 H LEU 92 HN LEU 92 3.572 -5.824 -7.209 1546 HA LEU 92 HA LEU 92 1.649 -7.650 -8.057 1547 HB2 LEU 92 HB2 LEU 92 2.946 -7.881 -5.991 1548 HB3 LEU 92 HB1 LEU 92 2.071 -6.536 -5.284 1549 HG LEU 92 HG LEU 92 -0.022 -7.861 -5.425 1550 HD11 LEU 92 HD11 LEU 92 1.823 -10.069 -6.324 1551 HD12 LEU 92 HD12 LEU 92 0.538 -9.321 -7.276 1552 HD13 LEU 92 HD13 LEU 92 0.138 -10.278 -5.848 1553 HD21 LEU 92 HD21 LEU 92 0.513 -9.390 -3.596 1554 HD22 LEU 92 HD22 LEU 92 1.284 -7.821 -3.365 1555 HD23 LEU 92 HD23 LEU 92 2.234 -9.196 -3.931 1556 H VAL 93 HN VAL 93 1.156 -4.590 -6.294 1557 HA VAL 93 HA VAL 93 -1.666 -4.775 -6.320 1558 HB VAL 93 HB VAL 93 -0.486 -3.363 -4.707 1559 HG11 VAL 93 HG11 VAL 93 0.419 -1.181 -5.367 1560 HG12 VAL 93 HG12 VAL 93 0.163 -1.598 -7.062 1561 HG13 VAL 93 HG13 VAL 93 1.311 -2.519 -6.091 1562 HG21 VAL 93 HG21 VAL 93 -2.363 -1.813 -6.483 1563 HG22 VAL 93 HG22 VAL 93 -1.946 -1.399 -4.819 1564 HG23 VAL 93 HG23 VAL 93 -2.820 -2.892 -5.164 1565 H GLN 94 HN GLN 94 0.661 -3.539 -8.606 1566 HA GLN 94 HA GLN 94 -1.166 -2.147 -10.270 1567 HB2 GLN 94 HB2 GLN 94 1.285 -1.828 -10.380 1568 HB3 GLN 94 HB1 GLN 94 1.459 -3.461 -11.010 1569 HG2 GLN 94 HG2 GLN 94 0.130 -2.828 -12.970 1570 HG3 GLN 94 HG1 GLN 94 0.014 -1.184 -12.346 1571 HE21 GLN 94 HE21 GLN 94 2.760 -1.257 -11.309 1572 HE22 GLN 94 HE22 GLN 94 3.792 -1.088 -12.687 1573 H VAL 95 HN VAL 95 0.124 -5.455 -10.311 1574 HA VAL 95 HA VAL 95 -1.211 -6.278 -12.664 1575 HB VAL 95 HB VAL 95 -0.178 -7.955 -10.368 1576 HG11 VAL 95 HG11 VAL 95 -1.811 -9.208 -11.656 1577 HG12 VAL 95 HG12 VAL 95 -0.186 -9.810 -11.989 1578 HG13 VAL 95 HG13 VAL 95 -0.996 -8.767 -13.157 1579 HG21 VAL 95 HG21 VAL 95 1.539 -6.594 -11.479 1580 HG22 VAL 95 HG22 VAL 95 1.072 -7.292 -13.030 1581 HG23 VAL 95 HG23 VAL 95 1.768 -8.317 -11.776 1582 H VAL 96 HN VAL 96 -2.051 -6.614 -9.214 1583 HA VAL 96 HA VAL 96 -4.347 -8.178 -9.633 1584 HB VAL 96 HB VAL 96 -3.236 -7.872 -7.414 1585 HG11 VAL 96 HG11 VAL 96 -3.868 -5.977 -6.012 1586 HG12 VAL 96 HG12 VAL 96 -4.709 -5.244 -7.379 1587 HG13 VAL 96 HG13 VAL 96 -2.958 -5.455 -7.429 1588 HG21 VAL 96 HG21 VAL 96 -6.202 -7.338 -7.493 1589 HG22 VAL 96 HG22 VAL 96 -5.303 -7.958 -6.107 1590 HG23 VAL 96 HG23 VAL 96 -5.420 -8.917 -7.583 1591 H ALA 97 HN ALA 97 -3.853 -4.698 -9.727 1592 HA ALA 97 HA ALA 97 -6.644 -4.083 -10.002 1593 HB1 ALA 97 HB1 ALA 97 -5.030 -2.446 -9.138 1594 HB2 ALA 97 HB2 ALA 97 -5.886 -1.837 -10.555 1595 HB3 ALA 97 HB3 ALA 97 -4.226 -2.419 -10.709 1596 H ASP 98 HN ASP 98 -3.906 -4.409 -12.204 1597 HA ASP 98 HA ASP 98 -5.175 -3.569 -14.556 1598 HB2 ASP 98 HB2 ASP 98 -2.731 -3.740 -14.251 1599 HB3 ASP 98 HB1 ASP 98 -2.862 -5.493 -14.229 1600 H GLU 99 HN GLU 99 -4.964 -6.764 -13.070 1601 HA GLU 99 HA GLU 99 -6.147 -8.053 -15.376 1602 HB2 GLU 99 HB2 GLU 99 -4.374 -9.117 -13.953 1603 HB3 GLU 99 HB1 GLU 99 -5.552 -9.239 -12.660 1604 HG2 GLU 99 HG2 GLU 99 -6.071 -10.469 -15.339 1605 HG3 GLU 99 HG1 GLU 99 -5.095 -11.293 -14.130 1606 H HIS 100 HN HIS 100 -7.180 -7.111 -12.118 1607 HA HIS 100 HA HIS 100 -9.586 -8.671 -12.269 1608 HB2 HIS 100 HB2 HIS 100 -8.578 -6.657 -10.273 1609 HB3 HIS 100 HB1 HIS 100 -10.180 -7.376 -10.143 1610 HD1 HIS 100 HD1 HIS 100 -9.945 -8.938 -8.201 1611 HD2 HIS 100 HD2 HIS 100 -6.790 -9.281 -10.892 1612 HE1 HIS 100 HE1 HIS 100 -8.583 -10.899 -7.409 1613 HE2 HIS 100 HE2 HIS 100 -6.814 -11.207 -9.174 1614 H LEU 101 HN LEU 101 -8.746 -5.376 -13.036 1615 HA LEU 101 HA LEU 101 -11.471 -4.475 -13.134 1616 HB2 LEU 101 HB2 LEU 101 -8.808 -3.276 -13.728 1617 HB3 LEU 101 HB1 LEU 101 -10.225 -2.548 -14.458 1618 HG LEU 101 HG LEU 101 -11.183 -2.175 -12.220 1619 HD11 LEU 101 HD11 LEU 101 -9.806 -2.482 -10.227 1620 HD12 LEU 101 HD12 LEU 101 -8.556 -3.253 -11.206 1621 HD13 LEU 101 HD13 LEU 101 -10.135 -4.021 -11.026 1622 HD21 LEU 101 HD21 LEU 101 -9.642 -0.405 -11.539 1623 HD22 LEU 101 HD22 LEU 101 -9.862 -0.432 -13.289 1624 HD23 LEU 101 HD23 LEU 101 -8.393 -1.093 -12.575 1625 H GLU 102 HN GLU 102 -12.590 -3.903 -14.955 1626 HA GLU 102 HA GLU 102 -13.509 -4.241 -17.000 1627 HB2 GLU 102 HB2 GLU 102 -11.280 -3.013 -17.552 1628 HB3 GLU 102 HB1 GLU 102 -10.760 -4.573 -18.167 1629 HG2 GLU 102 HG2 GLU 102 -13.203 -3.084 -19.103 1630 HG3 GLU 102 HG1 GLU 102 -11.636 -3.060 -19.908 1631 H HIS 103 HN HIS 103 -14.495 -6.182 -16.615 1632 HA HIS 103 HA HIS 103 -13.106 -8.528 -17.705 1633 HB2 HIS 103 HB2 HIS 103 -14.298 -8.186 -15.038 1634 HB3 HIS 103 HB1 HIS 103 -14.791 -9.653 -15.873 1635 HD1 HIS 103 HD1 HIS 103 -13.456 -11.456 -14.821 1636 HD2 HIS 103 HD2 HIS 103 -11.145 -8.101 -15.684 1637 HE1 HIS 103 HE1 HIS 103 -11.087 -12.099 -14.268 1638 HE2 HIS 103 HE2 HIS 103 -9.703 -10.058 -14.787 1639 H HIS 104 HN HIS 104 -14.163 -8.346 -19.659 1640 HA HIS 104 HA HIS 104 -17.062 -8.575 -19.688 1641 HB2 HIS 104 HB2 HIS 104 -15.960 -7.219 -21.419 1642 HB3 HIS 104 HB1 HIS 104 -15.043 -8.620 -21.950 1643 HD1 HIS 104 HD1 HIS 104 -16.042 -8.407 -24.334 1644 HD2 HIS 104 HD2 HIS 104 -18.862 -9.088 -21.353 1645 HE1 HIS 104 HE1 HIS 104 -18.149 -9.069 -25.531 1646 HE2 HIS 104 HE2 HIS 104 -19.753 -9.717 -23.702 1647 H HIS 105 HN HIS 105 -16.774 -10.528 -18.313 1648 HA HIS 105 HA HIS 105 -17.069 -12.885 -19.928 1649 HB2 HIS 105 HB2 HIS 105 -14.561 -12.666 -19.550 1650 HB3 HIS 105 HB1 HIS 105 -14.884 -12.911 -17.837 1651 HD1 HIS 105 HD1 HIS 105 -15.011 -14.691 -21.147 1652 HD2 HIS 105 HD2 HIS 105 -15.335 -15.541 -17.085 1653 HE1 HIS 105 HE1 HIS 105 -14.990 -17.201 -20.972 1654 HE2 HIS 105 HE2 HIS 105 -15.001 -17.686 -18.498 1655 H HIS 106 HN HIS 106 -18.589 -14.086 -19.031 1656 HA HIS 106 HA HIS 106 -20.257 -14.720 -17.648 1657 HB2 HIS 106 HB2 HIS 106 -18.097 -15.444 -16.324 1658 HB3 HIS 106 HB1 HIS 106 -18.590 -14.162 -15.224 1659 HD1 HIS 106 HD1 HIS 106 -20.268 -14.799 -13.492 1660 HD2 HIS 106 HD2 HIS 106 -20.199 -17.469 -16.674 1661 HE1 HIS 106 HE1 HIS 106 -21.785 -16.688 -12.823 1662 HE2 HIS 106 HE2 HIS 106 -21.641 -18.346 -14.716 1663 H HIS 107 HN HIS 107 -21.304 -12.780 -18.349 1664 HA HIS 107 HA HIS 107 -21.079 -10.305 -17.015 1665 HB2 HIS 107 HB2 HIS 107 -21.888 -10.531 -19.322 1666 HB3 HIS 107 HB1 HIS 107 -23.323 -11.367 -18.742 1667 HD1 HIS 107 HD1 HIS 107 -25.307 -9.939 -18.404 1668 HD2 HIS 107 HD2 HIS 107 -21.766 -7.752 -18.247 1669 HE1 HIS 107 HE1 HIS 107 -26.000 -7.525 -18.177 1670 HE2 HIS 107 HE2 HIS 107 -23.844 -6.231 -17.984 1671 H HIS 108 HN HIS 108 -22.982 -13.134 -16.368 1672 HA HIS 108 HA HIS 108 -23.994 -11.788 -13.967 1673 HB2 HIS 108 HB2 HIS 108 -25.871 -11.940 -15.570 1674 HB3 HIS 108 HB1 HIS 108 -25.633 -13.683 -15.670 1675 HD1 HIS 108 HD1 HIS 108 -27.200 -14.955 -14.237 1676 HD2 HIS 108 HD2 HIS 108 -26.371 -11.190 -12.668 1677 HE1 HIS 108 HE1 HIS 108 -28.568 -14.777 -12.132 1678 HE2 HIS 108 HE2 HIS 108 -28.040 -12.496 -11.185 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 9.009 9.058 -30.163 2 H2 MET 1 HT2 MET 1 8.743 8.846 -28.500 3 H3 MET 1 HT3 MET 1 7.431 9.111 -29.543 4 HA MET 1 HA MET 1 7.827 7.025 -30.648 5 HB2 MET 1 HB2 MET 1 9.488 5.464 -29.820 6 HB3 MET 1 HB1 MET 1 10.271 6.970 -30.273 7 HG2 MET 1 HG2 MET 1 10.320 7.625 -27.899 8 HG3 MET 1 HG1 MET 1 9.609 6.067 -27.481 9 HE1 MET 1 HE1 MET 1 12.281 6.794 -30.295 10 HE2 MET 1 HE2 MET 1 13.781 6.567 -29.395 11 HE3 MET 1 HE3 MET 1 12.711 7.914 -29.002 12 H ALA 2 HN ALA 2 6.823 8.388 -27.915 13 HA ALA 2 HA ALA 2 5.976 5.960 -26.542 14 HB1 ALA 2 HB1 ALA 2 6.767 7.862 -25.205 15 HB2 ALA 2 HB2 ALA 2 5.087 7.463 -24.842 16 HB3 ALA 2 HB3 ALA 2 5.461 8.854 -25.857 17 H GLY 3 HN GLY 3 3.849 5.270 -26.404 18 HA2 GLY 3 HA2 GLY 3 2.093 6.385 -28.482 19 HA3 GLY 3 HA1 GLY 3 1.956 4.785 -27.770 20 H GLN 4 HN GLN 4 2.277 7.937 -26.214 21 HA GLN 4 HA GLN 4 1.045 9.048 -24.676 22 HB2 GLN 4 HB2 GLN 4 -1.295 7.598 -25.938 23 HB3 GLN 4 HB1 GLN 4 -1.410 8.991 -24.871 24 HG2 GLN 4 HG2 GLN 4 -0.303 10.386 -26.481 25 HG3 GLN 4 HG1 GLN 4 0.006 9.000 -27.525 26 HE21 GLN 4 HE21 GLN 4 -2.995 9.546 -25.792 27 HE22 GLN 4 HE22 GLN 4 -3.967 9.821 -27.204 28 H SER 5 HN SER 5 -1.138 6.273 -24.664 29 HA SER 5 HA SER 5 -1.592 4.650 -23.160 30 HB2 SER 5 HB2 SER 5 1.277 5.066 -22.291 31 HB3 SER 5 HB1 SER 5 0.277 3.655 -21.935 32 HG SER 5 HG SER 5 0.730 4.498 -24.593 33 H ASP 6 HN ASP 6 -2.375 7.247 -22.449 34 HA ASP 6 HA ASP 6 -1.713 7.672 -19.673 35 HB2 ASP 6 HB2 ASP 6 -3.587 9.022 -21.585 36 HB3 ASP 6 HB1 ASP 6 -3.690 9.345 -19.855 37 H ARG 7 HN ARG 7 -3.444 5.370 -21.085 38 HA ARG 7 HA ARG 7 -5.722 5.113 -19.442 39 HB2 ARG 7 HB2 ARG 7 -5.788 2.828 -20.166 40 HB3 ARG 7 HB1 ARG 7 -5.231 3.785 -21.531 41 HG2 ARG 7 HG2 ARG 7 -2.903 3.144 -20.963 42 HG3 ARG 7 HG1 ARG 7 -3.545 2.083 -19.707 43 HD2 ARG 7 HD2 ARG 7 -4.895 0.959 -21.520 44 HD3 ARG 7 HD1 ARG 7 -3.943 1.882 -22.684 45 HE ARG 7 HE ARG 7 -2.955 -0.245 -20.916 46 HH11 ARG 7 HH11 ARG 7 -2.382 2.023 -23.540 47 HH12 ARG 7 HH12 ARG 7 -0.936 1.219 -24.083 48 HH21 ARG 7 HH21 ARG 7 -1.076 -1.314 -21.652 49 HH22 ARG 7 HH22 ARG 7 -0.199 -0.680 -23.008 50 H LYS 8 HN LYS 8 -2.400 4.895 -18.828 51 HA LYS 8 HA LYS 8 -2.172 3.042 -16.787 52 HB2 LYS 8 HB2 LYS 8 -0.238 4.393 -16.021 53 HB3 LYS 8 HB1 LYS 8 -0.226 4.079 -17.749 54 HG2 LYS 8 HG2 LYS 8 -1.032 6.341 -18.180 55 HG3 LYS 8 HG1 LYS 8 -1.089 6.658 -16.444 56 HD2 LYS 8 HD2 LYS 8 1.337 6.235 -16.318 57 HD3 LYS 8 HD1 LYS 8 1.370 5.998 -18.064 58 HE2 LYS 8 HE2 LYS 8 0.406 8.540 -16.767 59 HE3 LYS 8 HE1 LYS 8 2.086 8.279 -17.221 60 HZ1 LYS 8 HZ1 LYS 8 1.262 7.874 -19.527 61 HZ2 LYS 8 HZ2 LYS 8 1.054 9.462 -18.963 62 HZ3 LYS 8 HZ3 LYS 8 -0.267 8.407 -19.020 63 H ALA 9 HN ALA 9 -3.616 6.204 -16.753 64 HA ALA 9 HA ALA 9 -3.534 6.748 -14.006 65 HB1 ALA 9 HB1 ALA 9 -4.138 8.408 -15.702 66 HB2 ALA 9 HB2 ALA 9 -5.356 8.297 -14.429 67 HB3 ALA 9 HB3 ALA 9 -5.648 7.547 -16.000 68 H ALA 10 HN ALA 10 -5.610 4.665 -15.898 69 HA ALA 10 HA ALA 10 -7.603 4.274 -13.892 70 HB1 ALA 10 HB1 ALA 10 -8.314 2.377 -15.268 71 HB2 ALA 10 HB2 ALA 10 -6.848 2.532 -16.235 72 HB3 ALA 10 HB3 ALA 10 -8.050 3.822 -16.246 73 H LEU 11 HN LEU 11 -4.608 2.632 -14.774 74 HA LEU 11 HA LEU 11 -4.971 0.449 -12.969 75 HB2 LEU 11 HB2 LEU 11 -3.518 0.327 -14.961 76 HB3 LEU 11 HB1 LEU 11 -2.447 1.518 -14.253 77 HG LEU 11 HG LEU 11 -2.948 -1.031 -12.765 78 HD11 LEU 11 HD11 LEU 11 -1.108 -2.097 -13.984 79 HD12 LEU 11 HD12 LEU 11 -1.054 -0.728 -15.095 80 HD13 LEU 11 HD13 LEU 11 -2.483 -1.763 -15.038 81 HD21 LEU 11 HD21 LEU 11 -1.632 0.765 -11.733 82 HD22 LEU 11 HD22 LEU 11 -0.515 0.726 -13.098 83 HD23 LEU 11 HD23 LEU 11 -0.656 -0.673 -12.032 84 H LEU 12 HN LEU 12 -3.165 3.483 -12.904 85 HA LEU 12 HA LEU 12 -2.117 3.165 -10.297 86 HB2 LEU 12 HB2 LEU 12 -2.652 5.677 -11.884 87 HB3 LEU 12 HB1 LEU 12 -1.714 5.610 -10.405 88 HG LEU 12 HG LEU 12 -1.006 4.242 -13.002 89 HD11 LEU 12 HD11 LEU 12 -0.725 6.632 -13.161 90 HD12 LEU 12 HD12 LEU 12 0.854 5.855 -13.041 91 HD13 LEU 12 HD13 LEU 12 0.157 6.659 -11.635 92 HD21 LEU 12 HD21 LEU 12 0.509 4.412 -10.399 93 HD22 LEU 12 HD22 LEU 12 1.121 3.728 -11.904 94 HD23 LEU 12 HD23 LEU 12 -0.237 2.963 -11.078 95 H ASP 13 HN ASP 13 -5.196 4.249 -11.515 96 HA ASP 13 HA ASP 13 -6.161 5.557 -9.224 97 HB2 ASP 13 HB2 ASP 13 -7.419 5.770 -11.243 98 HB3 ASP 13 HB1 ASP 13 -7.596 4.024 -11.394 99 H GLN 14 HN GLN 14 -6.490 2.142 -10.223 100 HA GLN 14 HA GLN 14 -7.804 1.376 -7.826 101 HB2 GLN 14 HB2 GLN 14 -8.009 0.013 -9.821 102 HB3 GLN 14 HB1 GLN 14 -6.276 -0.289 -9.832 103 HG2 GLN 14 HG2 GLN 14 -7.507 -2.210 -9.000 104 HG3 GLN 14 HG1 GLN 14 -6.462 -1.539 -7.754 105 HE21 GLN 14 HE21 GLN 14 -7.386 -0.530 -5.962 106 HE22 GLN 14 HE22 GLN 14 -9.055 -0.747 -5.556 107 H VAL 15 HN VAL 15 -4.395 1.326 -8.834 108 HA VAL 15 HA VAL 15 -3.352 0.101 -6.534 109 HB VAL 15 HB VAL 15 -2.076 2.192 -8.314 110 HG11 VAL 15 HG11 VAL 15 -0.955 2.134 -6.152 111 HG12 VAL 15 HG12 VAL 15 0.066 1.424 -7.402 112 HG13 VAL 15 HG13 VAL 15 -0.793 0.381 -6.268 113 HG21 VAL 15 HG21 VAL 15 -2.666 0.159 -9.500 114 HG22 VAL 15 HG22 VAL 15 -1.858 -0.817 -8.272 115 HG23 VAL 15 HG23 VAL 15 -0.916 0.258 -9.304 116 H ALA 16 HN ALA 16 -4.003 3.510 -7.245 117 HA ALA 16 HA ALA 16 -3.059 4.595 -4.837 118 HB1 ALA 16 HB1 ALA 16 -3.562 5.925 -6.844 119 HB2 ALA 16 HB2 ALA 16 -4.361 6.562 -5.406 120 HB3 ALA 16 HB3 ALA 16 -5.284 5.635 -6.589 121 H ARG 17 HN ARG 17 -6.148 3.205 -5.717 122 HA ARG 17 HA ARG 17 -7.499 3.976 -3.321 123 HB2 ARG 17 HB2 ARG 17 -8.675 3.503 -5.418 124 HB3 ARG 17 HB1 ARG 17 -8.129 1.836 -5.373 125 HG2 ARG 17 HG2 ARG 17 -9.489 1.371 -3.471 126 HG3 ARG 17 HG1 ARG 17 -9.889 3.080 -3.278 127 HD2 ARG 17 HD2 ARG 17 -10.558 1.501 -5.753 128 HD3 ARG 17 HD1 ARG 17 -11.660 1.661 -4.385 129 HE ARG 17 HE ARG 17 -11.856 3.978 -4.845 130 HH11 ARG 17 HH11 ARG 17 -9.966 2.262 -7.244 131 HH12 ARG 17 HH12 ARG 17 -10.137 3.496 -8.456 132 HH21 ARG 17 HH21 ARG 17 -12.130 5.575 -6.445 133 HH22 ARG 17 HH22 ARG 17 -11.382 5.378 -8.000 134 H VAL 18 HN VAL 18 -5.619 1.184 -4.333 135 HA VAL 18 HA VAL 18 -6.214 -0.397 -2.023 136 HB VAL 18 HB VAL 18 -3.927 -0.576 -3.998 137 HG11 VAL 18 HG11 VAL 18 -3.257 -1.545 -1.868 138 HG12 VAL 18 HG12 VAL 18 -3.513 -2.810 -3.070 139 HG13 VAL 18 HG13 VAL 18 -4.731 -2.516 -1.828 140 HG21 VAL 18 HG21 VAL 18 -6.433 -2.231 -3.697 141 HG22 VAL 18 HG22 VAL 18 -5.150 -2.501 -4.877 142 HG23 VAL 18 HG23 VAL 18 -6.128 -1.037 -4.959 143 H GLY 19 HN GLY 19 -3.470 1.647 -3.000 144 HA2 GLY 19 HA2 GLY 19 -1.958 1.360 -0.646 145 HA3 GLY 19 HA1 GLY 19 -1.870 2.726 -1.752 146 H LYS 20 HN LYS 20 -4.450 3.718 -1.530 147 HA LYS 20 HA LYS 20 -4.370 5.277 0.789 148 HB2 LYS 20 HB2 LYS 20 -5.652 5.816 -1.290 149 HB3 LYS 20 HB1 LYS 20 -6.823 4.581 -0.839 150 HG2 LYS 20 HG2 LYS 20 -7.063 5.881 1.344 151 HG3 LYS 20 HG1 LYS 20 -6.240 7.189 0.499 152 HD2 LYS 20 HD2 LYS 20 -7.962 7.231 -1.195 153 HD3 LYS 20 HD1 LYS 20 -8.762 5.841 -0.455 154 HE2 LYS 20 HE2 LYS 20 -9.028 7.215 1.623 155 HE3 LYS 20 HE1 LYS 20 -8.419 8.597 0.714 156 HZ1 LYS 20 HZ1 LYS 20 -10.839 7.030 -0.006 157 HZ2 LYS 20 HZ2 LYS 20 -10.276 8.428 -0.788 158 HZ3 LYS 20 HZ3 LYS 20 -10.850 8.518 0.805 159 H ALA 21 HN ALA 21 -6.036 2.251 0.079 160 HA ALA 21 HA ALA 21 -7.517 2.170 2.515 161 HB1 ALA 21 HB1 ALA 21 -6.856 -0.035 0.566 162 HB2 ALA 21 HB2 ALA 21 -8.307 0.970 0.562 163 HB3 ALA 21 HB3 ALA 21 -8.017 -0.156 1.888 164 H LEU 22 HN LEU 22 -4.292 1.298 1.619 165 HA LEU 22 HA LEU 22 -3.853 -0.440 3.881 166 HB2 LEU 22 HB2 LEU 22 -2.610 -0.683 1.751 167 HB3 LEU 22 HB1 LEU 22 -1.858 0.877 2.030 168 HG LEU 22 HG LEU 22 -0.829 -0.060 4.110 169 HD11 LEU 22 HD11 LEU 22 -0.777 -2.484 4.394 170 HD12 LEU 22 HD12 LEU 22 -1.891 -2.672 3.039 171 HD13 LEU 22 HD13 LEU 22 -2.423 -1.862 4.514 172 HD21 LEU 22 HD21 LEU 22 0.452 0.081 2.062 173 HD22 LEU 22 HD22 LEU 22 -0.201 -1.465 1.520 174 HD23 LEU 22 HD23 LEU 22 0.857 -1.401 2.929 175 H ALA 23 HN ALA 23 -3.417 2.927 3.095 176 HA ALA 23 HA ALA 23 -1.810 3.550 5.374 177 HB1 ALA 23 HB1 ALA 23 -2.170 5.876 4.725 178 HB2 ALA 23 HB2 ALA 23 -3.384 5.364 3.553 179 HB3 ALA 23 HB3 ALA 23 -1.700 4.887 3.344 180 H ASN 24 HN ASN 24 -2.740 3.051 7.275 181 HA ASN 24 HA ASN 24 -4.725 4.865 8.258 182 HB2 ASN 24 HB2 ASN 24 -6.220 3.199 7.265 183 HB3 ASN 24 HB1 ASN 24 -5.404 1.915 8.153 184 HD21 ASN 24 HD21 ASN 24 -7.710 4.476 8.307 185 HD22 ASN 24 HD22 ASN 24 -8.248 4.179 9.927 186 H GLY 25 HN GLY 25 -3.622 1.586 9.129 187 HA2 GLY 25 HA2 GLY 25 -1.794 1.452 10.813 188 HA3 GLY 25 HA1 GLY 25 -2.645 2.729 11.670 189 H ARG 26 HN ARG 26 -4.715 2.239 12.622 190 HA ARG 26 HA ARG 26 -4.588 -0.296 13.935 191 HB2 ARG 26 HB2 ARG 26 -6.666 1.886 14.094 192 HB3 ARG 26 HB1 ARG 26 -6.611 0.476 15.145 193 HG2 ARG 26 HG2 ARG 26 -4.370 1.181 15.909 194 HG3 ARG 26 HG1 ARG 26 -4.534 2.645 14.935 195 HD2 ARG 26 HD2 ARG 26 -6.569 3.218 16.220 196 HD3 ARG 26 HD1 ARG 26 -6.293 1.800 17.233 197 HE ARG 26 HE ARG 26 -4.264 3.923 17.034 198 HH11 ARG 26 HH11 ARG 26 -6.433 1.954 18.951 199 HH12 ARG 26 HH12 ARG 26 -5.841 2.547 20.474 200 HH21 ARG 26 HH21 ARG 26 -3.453 4.684 19.019 201 HH22 ARG 26 HH22 ARG 26 -4.116 4.074 20.514 202 H ARG 27 HN ARG 27 -6.495 0.973 11.287 203 HA ARG 27 HA ARG 27 -8.425 -1.126 11.306 204 HB2 ARG 27 HB2 ARG 27 -8.967 0.915 10.161 205 HB3 ARG 27 HB1 ARG 27 -7.552 0.783 9.131 206 HG2 ARG 27 HG2 ARG 27 -8.495 -1.022 7.917 207 HG3 ARG 27 HG1 ARG 27 -9.796 -1.216 9.091 208 HD2 ARG 27 HD2 ARG 27 -10.460 -0.087 6.955 209 HD3 ARG 27 HD1 ARG 27 -10.829 0.813 8.421 210 HE ARG 27 HE ARG 27 -9.469 2.480 7.684 211 HH11 ARG 27 HH11 ARG 27 -8.579 -0.449 6.008 212 HH12 ARG 27 HH12 ARG 27 -7.525 0.356 4.887 213 HH21 ARG 27 HH21 ARG 27 -8.146 3.563 6.169 214 HH22 ARG 27 HH22 ARG 27 -7.291 2.636 4.971 215 H LEU 28 HN LEU 28 -5.147 -0.998 10.433 216 HA LEU 28 HA LEU 28 -5.179 -3.135 8.528 217 HB2 LEU 28 HB2 LEU 28 -2.911 -2.036 10.191 218 HB3 LEU 28 HB1 LEU 28 -2.733 -3.181 8.876 219 HG LEU 28 HG LEU 28 -3.766 -0.355 8.595 220 HD11 LEU 28 HD11 LEU 28 -1.117 -1.553 7.783 221 HD12 LEU 28 HD12 LEU 28 -1.374 -0.465 9.148 222 HD13 LEU 28 HD13 LEU 28 -1.651 0.106 7.502 223 HD21 LEU 28 HD21 LEU 28 -3.603 -0.770 6.198 224 HD22 LEU 28 HD22 LEU 28 -4.719 -1.908 6.955 225 HD23 LEU 28 HD23 LEU 28 -3.095 -2.431 6.508 226 H GLN 29 HN GLN 29 -5.392 -2.898 11.919 227 HA GLN 29 HA GLN 29 -4.290 -5.384 12.688 228 HB2 GLN 29 HB2 GLN 29 -4.964 -3.433 14.188 229 HB3 GLN 29 HB1 GLN 29 -6.618 -4.012 14.032 230 HG2 GLN 29 HG2 GLN 29 -5.726 -6.247 14.867 231 HG3 GLN 29 HG1 GLN 29 -4.283 -5.352 15.343 232 HE21 GLN 29 HE21 GLN 29 -4.450 -3.791 16.979 233 HE22 GLN 29 HE22 GLN 29 -5.789 -3.766 18.076 234 H ILE 30 HN ILE 30 -7.264 -4.448 11.211 235 HA ILE 30 HA ILE 30 -8.730 -6.825 11.726 236 HB ILE 30 HB ILE 30 -9.046 -4.866 9.440 237 HG12 ILE 30 HG12 ILE 30 -10.437 -4.972 12.127 238 HG13 ILE 30 HG11 ILE 30 -9.209 -3.799 11.666 239 HG21 ILE 30 HG21 ILE 30 -11.342 -5.721 9.325 240 HG22 ILE 30 HG22 ILE 30 -10.956 -6.908 10.570 241 HG23 ILE 30 HG23 ILE 30 -10.153 -6.983 9.001 242 HD11 ILE 30 HD11 ILE 30 -11.925 -4.110 10.403 243 HD12 ILE 30 HD12 ILE 30 -10.695 -2.936 9.929 244 HD13 ILE 30 HD13 ILE 30 -11.433 -2.845 11.531 245 H LEU 31 HN LEU 31 -6.503 -5.781 9.208 246 HA LEU 31 HA LEU 31 -6.871 -8.048 7.524 247 HB2 LEU 31 HB2 LEU 31 -4.536 -6.141 7.734 248 HB3 LEU 31 HB1 LEU 31 -4.768 -7.311 6.450 249 HG LEU 31 HG LEU 31 -6.571 -4.962 7.034 250 HD11 LEU 31 HD11 LEU 31 -4.609 -5.450 4.797 251 HD12 LEU 31 HD12 LEU 31 -4.430 -4.281 6.104 252 HD13 LEU 31 HD13 LEU 31 -5.717 -4.082 4.913 253 HD21 LEU 31 HD21 LEU 31 -7.819 -6.845 6.138 254 HD22 LEU 31 HD22 LEU 31 -6.659 -7.010 4.819 255 HD23 LEU 31 HD23 LEU 31 -7.671 -5.571 4.928 256 H ASP 32 HN ASP 32 -4.729 -7.245 10.182 257 HA ASP 32 HA ASP 32 -3.075 -9.527 10.090 258 HB2 ASP 32 HB2 ASP 32 -2.434 -7.642 11.440 259 HB3 ASP 32 HB1 ASP 32 -3.921 -7.734 12.376 260 H LEU 33 HN LEU 33 -6.272 -8.963 11.346 261 HA LEU 33 HA LEU 33 -6.470 -11.490 12.706 262 HB2 LEU 33 HB2 LEU 33 -7.725 -9.362 13.293 263 HB3 LEU 33 HB1 LEU 33 -8.709 -9.642 11.874 264 HG LEU 33 HG LEU 33 -8.522 -11.678 14.089 265 HD11 LEU 33 HD11 LEU 33 -10.593 -10.706 14.988 266 HD12 LEU 33 HD12 LEU 33 -10.453 -9.376 13.837 267 HD13 LEU 33 HD13 LEU 33 -9.235 -9.586 15.094 268 HD21 LEU 33 HD21 LEU 33 -10.693 -12.382 13.217 269 HD22 LEU 33 HD22 LEU 33 -9.459 -12.437 11.956 270 HD23 LEU 33 HD23 LEU 33 -10.621 -11.111 11.996 271 H LEU 34 HN LEU 34 -7.649 -10.111 9.652 272 HA LEU 34 HA LEU 34 -9.040 -12.462 8.848 273 HB2 LEU 34 HB2 LEU 34 -8.110 -10.072 7.260 274 HB3 LEU 34 HB1 LEU 34 -9.111 -11.354 6.609 275 HG LEU 34 HG LEU 34 -9.871 -9.478 8.849 276 HD11 LEU 34 HD11 LEU 34 -11.531 -8.652 7.236 277 HD12 LEU 34 HD12 LEU 34 -10.828 -9.697 6.000 278 HD13 LEU 34 HD13 LEU 34 -9.875 -8.384 6.691 279 HD21 LEU 34 HD21 LEU 34 -10.839 -11.677 9.194 280 HD22 LEU 34 HD22 LEU 34 -11.441 -11.693 7.536 281 HD23 LEU 34 HD23 LEU 34 -12.080 -10.527 8.696 282 H ALA 35 HN ALA 35 -5.749 -11.679 8.899 283 HA ALA 35 HA ALA 35 -4.855 -13.270 6.718 284 HB1 ALA 35 HB1 ALA 35 -3.414 -12.517 9.262 285 HB2 ALA 35 HB2 ALA 35 -3.424 -11.585 7.765 286 HB3 ALA 35 HB3 ALA 35 -2.667 -13.177 7.808 287 H GLN 36 HN GLN 36 -6.218 -13.993 9.734 288 HA GLN 36 HA GLN 36 -5.072 -16.631 9.996 289 HB2 GLN 36 HB2 GLN 36 -7.433 -15.367 11.403 290 HB3 GLN 36 HB1 GLN 36 -6.673 -16.891 11.845 291 HG2 GLN 36 HG2 GLN 36 -4.640 -15.766 12.440 292 HG3 GLN 36 HG1 GLN 36 -5.265 -14.231 11.842 293 HE21 GLN 36 HE21 GLN 36 -4.976 -13.232 13.831 294 HE22 GLN 36 HE22 GLN 36 -5.996 -13.567 15.185 295 H GLY 37 HN GLY 37 -7.688 -15.152 8.337 296 HA2 GLY 37 HA2 GLY 37 -8.375 -16.829 6.502 297 HA3 GLY 37 HA1 GLY 37 -8.971 -17.754 7.873 298 H GLU 38 HN GLU 38 -11.059 -17.668 7.016 299 HA GLU 38 HA GLU 38 -12.356 -15.094 6.647 300 HB2 GLU 38 HB2 GLU 38 -12.665 -17.179 5.192 301 HB3 GLU 38 HB1 GLU 38 -13.605 -17.841 6.519 302 HG2 GLU 38 HG2 GLU 38 -15.241 -16.107 6.303 303 HG3 GLU 38 HG1 GLU 38 -14.252 -15.263 5.109 304 H ARG 39 HN ARG 39 -13.277 -14.061 8.319 305 HA ARG 39 HA ARG 39 -14.059 -15.655 10.679 306 HB2 ARG 39 HB2 ARG 39 -11.821 -14.357 10.781 307 HB3 ARG 39 HB1 ARG 39 -12.824 -12.918 10.879 308 HG2 ARG 39 HG2 ARG 39 -12.263 -13.483 13.089 309 HG3 ARG 39 HG1 ARG 39 -13.941 -13.985 12.876 310 HD2 ARG 39 HD2 ARG 39 -13.231 -16.283 12.532 311 HD3 ARG 39 HD1 ARG 39 -11.539 -15.800 12.661 312 HE ARG 39 HE ARG 39 -13.314 -15.297 14.933 313 HH11 ARG 39 HH11 ARG 39 -10.717 -17.175 13.526 314 HH12 ARG 39 HH12 ARG 39 -10.157 -17.785 15.059 315 HH21 ARG 39 HH21 ARG 39 -12.603 -16.118 16.937 316 HH22 ARG 39 HH22 ARG 39 -11.223 -17.172 17.001 317 H ALA 40 HN ALA 40 -15.805 -14.871 11.888 318 HA ALA 40 HA ALA 40 -17.730 -13.331 10.437 319 HB1 ALA 40 HB1 ALA 40 -19.176 -13.701 12.369 320 HB2 ALA 40 HB2 ALA 40 -17.807 -14.352 13.272 321 HB3 ALA 40 HB3 ALA 40 -18.406 -15.200 11.847 322 H VAL 41 HN VAL 41 -18.797 -11.421 11.261 323 HA VAL 41 HA VAL 41 -16.951 -9.352 11.693 324 HB VAL 41 HB VAL 41 -19.948 -9.269 12.086 325 HG11 VAL 41 HG11 VAL 41 -17.961 -7.039 11.645 326 HG12 VAL 41 HG12 VAL 41 -18.865 -7.359 13.124 327 HG13 VAL 41 HG13 VAL 41 -19.714 -6.854 11.664 328 HG21 VAL 41 HG21 VAL 41 -19.320 -10.035 9.854 329 HG22 VAL 41 HG22 VAL 41 -18.286 -8.620 9.655 330 HG23 VAL 41 HG23 VAL 41 -20.032 -8.424 9.799 331 H GLU 42 HN GLU 42 -19.139 -11.009 13.937 332 HA GLU 42 HA GLU 42 -18.879 -9.257 16.110 333 HB2 GLU 42 HB2 GLU 42 -19.099 -12.212 16.561 334 HB3 GLU 42 HB1 GLU 42 -19.853 -10.898 17.450 335 HG2 GLU 42 HG2 GLU 42 -21.628 -11.814 16.319 336 HG3 GLU 42 HG1 GLU 42 -21.156 -10.489 15.256 337 H ALA 43 HN ALA 43 -17.014 -12.137 15.251 338 HA ALA 43 HA ALA 43 -15.261 -12.107 17.447 339 HB1 ALA 43 HB1 ALA 43 -13.831 -13.557 16.112 340 HB2 ALA 43 HB2 ALA 43 -14.749 -13.150 14.662 341 HB3 ALA 43 HB3 ALA 43 -15.520 -14.044 15.973 342 H ILE 44 HN ILE 44 -14.999 -10.667 14.219 343 HA ILE 44 HA ILE 44 -12.418 -9.603 14.476 344 HB ILE 44 HB ILE 44 -14.742 -8.503 12.882 345 HG12 ILE 44 HG12 ILE 44 -12.480 -10.324 12.019 346 HG13 ILE 44 HG11 ILE 44 -14.121 -10.862 12.365 347 HG21 ILE 44 HG21 ILE 44 -11.781 -7.970 12.648 348 HG22 ILE 44 HG22 ILE 44 -13.018 -6.822 13.161 349 HG23 ILE 44 HG23 ILE 44 -13.005 -7.423 11.503 350 HD11 ILE 44 HD11 ILE 44 -13.323 -8.936 10.197 351 HD12 ILE 44 HD12 ILE 44 -14.962 -9.497 10.535 352 HD13 ILE 44 HD13 ILE 44 -13.738 -10.636 9.977 353 H ALA 45 HN ALA 45 -15.587 -8.144 15.125 354 HA ALA 45 HA ALA 45 -14.686 -5.622 15.935 355 HB1 ALA 45 HB1 ALA 45 -16.878 -5.393 17.010 356 HB2 ALA 45 HB2 ALA 45 -17.154 -7.125 16.804 357 HB3 ALA 45 HB3 ALA 45 -17.009 -6.079 15.391 358 H THR 46 HN THR 46 -15.485 -8.481 17.894 359 HA THR 46 HA THR 46 -14.940 -7.359 20.394 360 HB THR 46 HB THR 46 -14.594 -10.268 19.633 361 HG1 THR 46 HG1 THR 46 -16.662 -9.596 19.016 362 HG21 THR 46 HG21 THR 46 -15.279 -8.945 22.264 363 HG22 THR 46 HG22 THR 46 -13.735 -9.695 21.855 364 HG23 THR 46 HG23 THR 46 -15.191 -10.684 21.980 365 H ALA 47 HN ALA 47 -12.826 -9.248 18.234 366 HA ALA 47 HA ALA 47 -10.626 -9.336 20.000 367 HB1 ALA 47 HB1 ALA 47 -10.583 -9.572 16.995 368 HB2 ALA 47 HB2 ALA 47 -10.947 -10.886 18.115 369 HB3 ALA 47 HB3 ALA 47 -9.349 -10.142 18.121 370 H THR 48 HN THR 48 -11.591 -6.981 17.564 371 HA THR 48 HA THR 48 -9.067 -5.585 17.688 372 HB THR 48 HB THR 48 -10.269 -3.852 16.304 373 HG1 THR 48 HG1 THR 48 -12.320 -5.786 16.008 374 HG21 THR 48 HG21 THR 48 -10.349 -6.686 15.263 375 HG22 THR 48 HG22 THR 48 -8.930 -5.640 15.282 376 HG23 THR 48 HG23 THR 48 -10.321 -5.220 14.283 377 H GLY 49 HN GLY 49 -12.004 -5.568 19.454 378 HA2 GLY 49 HA2 GLY 49 -12.346 -4.448 21.484 379 HA3 GLY 49 HA1 GLY 49 -11.029 -3.354 21.083 380 H MET 50 HN MET 50 -13.320 -3.875 18.599 381 HA MET 50 HA MET 50 -14.495 -1.229 19.162 382 HB2 MET 50 HB2 MET 50 -13.883 -2.541 16.506 383 HB3 MET 50 HB1 MET 50 -14.806 -1.053 16.676 384 HG2 MET 50 HG2 MET 50 -12.872 0.033 17.697 385 HG3 MET 50 HG1 MET 50 -11.950 -1.461 17.541 386 HE1 MET 50 HE1 MET 50 -12.723 -2.594 14.763 387 HE2 MET 50 HE2 MET 50 -11.037 -2.428 15.250 388 HE3 MET 50 HE3 MET 50 -11.563 -1.829 13.678 389 H ASN 51 HN ASN 51 -16.657 -1.002 17.808 390 HA ASN 51 HA ASN 51 -18.352 -3.199 18.675 391 HB2 ASN 51 HB2 ASN 51 -19.051 -0.530 17.430 392 HB3 ASN 51 HB1 ASN 51 -20.226 -1.715 17.985 393 HD21 ASN 51 HD21 ASN 51 -20.444 -2.098 20.211 394 HD22 ASN 51 HD22 ASN 51 -19.877 -0.957 21.378 395 H LEU 52 HN LEU 52 -20.176 -3.832 17.130 396 HA LEU 52 HA LEU 52 -19.020 -5.048 14.869 397 HB2 LEU 52 HB2 LEU 52 -21.834 -4.707 15.829 398 HB3 LEU 52 HB1 LEU 52 -21.540 -5.351 14.226 399 HG LEU 52 HG LEU 52 -20.145 -7.151 15.292 400 HD11 LEU 52 HD11 LEU 52 -20.431 -7.579 17.667 401 HD12 LEU 52 HD12 LEU 52 -21.364 -6.092 17.837 402 HD13 LEU 52 HD13 LEU 52 -19.657 -6.017 17.402 403 HD21 LEU 52 HD21 LEU 52 -22.421 -7.570 14.570 404 HD22 LEU 52 HD22 LEU 52 -23.039 -6.963 16.108 405 HD23 LEU 52 HD23 LEU 52 -22.078 -8.442 16.065 406 H THR 53 HN THR 53 -21.149 -2.221 15.160 407 HA THR 53 HA THR 53 -21.297 -1.721 12.378 408 HB THR 53 HB THR 53 -22.927 -0.833 14.042 409 HG1 THR 53 HG1 THR 53 -21.666 1.189 12.457 410 HG21 THR 53 HG21 THR 53 -20.704 1.097 14.708 411 HG22 THR 53 HG22 THR 53 -21.396 -0.115 15.786 412 HG23 THR 53 HG23 THR 53 -22.379 1.245 15.244 413 H THR 54 HN THR 54 -18.996 -0.873 14.848 414 HA THR 54 HA THR 54 -17.603 1.134 13.386 415 HB THR 54 HB THR 54 -16.323 -0.622 15.472 416 HG1 THR 54 HG1 THR 54 -18.195 1.503 15.900 417 HG21 THR 54 HG21 THR 54 -14.941 1.079 14.371 418 HG22 THR 54 HG22 THR 54 -15.176 1.455 16.077 419 HG23 THR 54 HG23 THR 54 -16.093 2.325 14.847 420 H ALA 55 HN ALA 55 -17.122 -2.333 13.935 421 HA ALA 55 HA ALA 55 -14.770 -2.599 12.410 422 HB1 ALA 55 HB1 ALA 55 -15.202 -4.991 12.482 423 HB2 ALA 55 HB2 ALA 55 -16.853 -4.692 13.025 424 HB3 ALA 55 HB3 ALA 55 -15.493 -4.259 14.060 425 H SER 56 HN SER 56 -18.197 -3.125 11.565 426 HA SER 56 HA SER 56 -17.639 -4.074 8.962 427 HB2 SER 56 HB2 SER 56 -20.099 -3.550 8.561 428 HB3 SER 56 HB1 SER 56 -19.739 -4.667 9.877 429 HG SER 56 HG SER 56 -20.452 -3.261 11.288 430 H ALA 57 HN ALA 57 -18.139 -0.840 10.242 431 HA ALA 57 HA ALA 57 -18.405 0.509 7.782 432 HB1 ALA 57 HB1 ALA 57 -18.880 1.569 9.945 433 HB2 ALA 57 HB2 ALA 57 -17.736 2.515 8.993 434 HB3 ALA 57 HB3 ALA 57 -17.161 1.529 10.337 435 H ASN 58 HN ASN 58 -15.571 -0.360 9.710 436 HA ASN 58 HA ASN 58 -13.694 0.768 7.878 437 HB2 ASN 58 HB2 ASN 58 -13.454 -1.109 10.213 438 HB3 ASN 58 HB1 ASN 58 -12.069 -0.762 9.183 439 HD21 ASN 58 HD21 ASN 58 -14.308 0.551 11.515 440 HD22 ASN 58 HD22 ASN 58 -13.412 2.001 11.836 441 H LEU 59 HN LEU 59 -15.103 -2.417 8.342 442 HA LEU 59 HA LEU 59 -13.536 -3.817 6.458 443 HB2 LEU 59 HB2 LEU 59 -16.333 -4.262 7.491 444 HB3 LEU 59 HB1 LEU 59 -15.542 -5.371 6.388 445 HG LEU 59 HG LEU 59 -14.406 -4.652 9.089 446 HD11 LEU 59 HD11 LEU 59 -15.277 -6.789 9.873 447 HD12 LEU 59 HD12 LEU 59 -16.084 -7.039 8.326 448 HD13 LEU 59 HD13 LEU 59 -16.587 -5.716 9.378 449 HD21 LEU 59 HD21 LEU 59 -13.084 -6.680 8.736 450 HD22 LEU 59 HD22 LEU 59 -12.802 -5.497 7.460 451 HD23 LEU 59 HD23 LEU 59 -13.835 -6.893 7.155 452 H GLN 60 HN GLN 60 -16.489 -1.919 6.163 453 HA GLN 60 HA GLN 60 -17.078 -2.476 3.478 454 HB2 GLN 60 HB2 GLN 60 -18.598 -1.285 5.046 455 HB3 GLN 60 HB1 GLN 60 -17.530 0.110 4.984 456 HG2 GLN 60 HG2 GLN 60 -17.956 0.300 2.569 457 HG3 GLN 60 HG1 GLN 60 -19.085 -1.050 2.680 458 HE21 GLN 60 HE21 GLN 60 -20.817 0.160 1.994 459 HE22 GLN 60 HE22 GLN 60 -21.557 1.380 2.978 460 H ALA 61 HN ALA 61 -15.023 -0.013 4.970 461 HA ALA 61 HA ALA 61 -14.230 1.289 2.601 462 HB1 ALA 61 HB1 ALA 61 -13.908 2.259 4.824 463 HB2 ALA 61 HB2 ALA 61 -12.394 2.204 3.921 464 HB3 ALA 61 HB3 ALA 61 -12.706 1.021 5.193 465 H LEU 62 HN LEU 62 -12.920 -1.491 4.330 466 HA LEU 62 HA LEU 62 -10.600 -1.852 2.776 467 HB2 LEU 62 HB2 LEU 62 -12.271 -3.799 4.359 468 HB3 LEU 62 HB1 LEU 62 -10.772 -4.248 3.573 469 HG LEU 62 HG LEU 62 -10.980 -2.102 5.686 470 HD11 LEU 62 HD11 LEU 62 -10.086 -4.975 5.931 471 HD12 LEU 62 HD12 LEU 62 -11.551 -4.282 6.624 472 HD13 LEU 62 HD13 LEU 62 -9.969 -3.745 7.191 473 HD21 LEU 62 HD21 LEU 62 -8.606 -3.522 4.480 474 HD22 LEU 62 HD22 LEU 62 -8.552 -2.306 5.755 475 HD23 LEU 62 HD23 LEU 62 -9.094 -1.863 4.138 476 H LYS 63 HN LYS 63 -13.897 -3.127 2.427 477 HA LYS 63 HA LYS 63 -13.330 -4.628 0.083 478 HB2 LYS 63 HB2 LYS 63 -15.293 -5.284 1.192 479 HB3 LYS 63 HB1 LYS 63 -15.882 -3.631 1.326 480 HG2 LYS 63 HG2 LYS 63 -16.540 -3.558 -0.908 481 HG3 LYS 63 HG1 LYS 63 -15.549 -4.948 -1.340 482 HD2 LYS 63 HD2 LYS 63 -17.873 -5.176 0.552 483 HD3 LYS 63 HD1 LYS 63 -18.070 -5.308 -1.196 484 HE2 LYS 63 HE2 LYS 63 -16.241 -7.087 -1.092 485 HE3 LYS 63 HE1 LYS 63 -16.503 -7.084 0.652 486 HZ1 LYS 63 HZ1 LYS 63 -18.765 -7.745 0.328 487 HZ2 LYS 63 HZ2 LYS 63 -17.783 -8.802 -0.568 488 HZ3 LYS 63 HZ3 LYS 63 -18.640 -7.568 -1.349 489 H SER 64 HN SER 64 -14.358 -1.310 0.655 490 HA SER 64 HA SER 64 -14.926 -0.630 -2.016 491 HB2 SER 64 HB2 SER 64 -13.918 1.154 0.214 492 HB3 SER 64 HB1 SER 64 -14.683 1.699 -1.279 493 HG SER 64 HG SER 64 -15.880 0.060 0.719 494 H GLY 65 HN GLY 65 -11.911 -0.795 -0.217 495 HA2 GLY 65 HA2 GLY 65 -10.333 0.400 -2.301 496 HA3 GLY 65 HA1 GLY 65 -9.727 -0.471 -0.898 497 H GLY 66 HN GLY 66 -11.491 -2.791 -1.576 498 HA2 GLY 66 HA2 GLY 66 -11.595 -4.474 -3.265 499 HA3 GLY 66 HA1 GLY 66 -10.157 -3.779 -4.001 500 H LEU 67 HN LEU 67 -10.226 -4.190 -0.575 501 HA LEU 67 HA LEU 67 -8.014 -6.069 -0.842 502 HB2 LEU 67 HB2 LEU 67 -8.714 -3.939 0.970 503 HB3 LEU 67 HB1 LEU 67 -8.333 -5.403 1.853 504 HG LEU 67 HG LEU 67 -6.140 -5.508 0.881 505 HD11 LEU 67 HD11 LEU 67 -6.710 -4.744 -1.370 506 HD12 LEU 67 HD12 LEU 67 -5.331 -3.862 -0.716 507 HD13 LEU 67 HD13 LEU 67 -6.921 -3.100 -0.759 508 HD21 LEU 67 HD21 LEU 67 -5.177 -3.411 1.705 509 HD22 LEU 67 HD22 LEU 67 -6.391 -4.051 2.810 510 HD23 LEU 67 HD23 LEU 67 -6.787 -2.695 1.754 511 H VAL 68 HN VAL 68 -11.204 -5.874 0.706 512 HA VAL 68 HA VAL 68 -10.857 -8.701 1.452 513 HB VAL 68 HB VAL 68 -12.157 -8.395 3.458 514 HG11 VAL 68 HG11 VAL 68 -9.973 -6.326 3.285 515 HG12 VAL 68 HG12 VAL 68 -9.755 -8.041 3.633 516 HG13 VAL 68 HG13 VAL 68 -10.632 -7.015 4.768 517 HG21 VAL 68 HG21 VAL 68 -12.868 -6.168 4.219 518 HG22 VAL 68 HG22 VAL 68 -13.673 -6.657 2.729 519 HG23 VAL 68 HG23 VAL 68 -12.352 -5.491 2.672 520 H GLU 69 HN GLU 69 -12.847 -9.888 1.771 521 HA GLU 69 HA GLU 69 -15.108 -8.890 0.175 522 HB2 GLU 69 HB2 GLU 69 -13.508 -11.298 -0.206 523 HB3 GLU 69 HB1 GLU 69 -15.218 -11.662 -0.010 524 HG2 GLU 69 HG2 GLU 69 -14.054 -9.750 -2.023 525 HG3 GLU 69 HG1 GLU 69 -14.600 -11.394 -2.353 526 H ALA 70 HN ALA 70 -17.096 -10.401 0.654 527 HA ALA 70 HA ALA 70 -17.190 -11.139 3.482 528 HB1 ALA 70 HB1 ALA 70 -19.051 -9.081 2.301 529 HB2 ALA 70 HB2 ALA 70 -17.749 -8.749 3.442 530 HB3 ALA 70 HB3 ALA 70 -19.125 -9.735 3.937 531 H ARG 71 HN ARG 71 -18.430 -12.861 3.810 532 HA ARG 71 HA ARG 71 -20.493 -13.517 1.806 533 HB2 ARG 71 HB2 ARG 71 -18.644 -15.403 3.279 534 HB3 ARG 71 HB1 ARG 71 -20.059 -15.927 2.382 535 HG2 ARG 71 HG2 ARG 71 -19.079 -14.954 0.335 536 HG3 ARG 71 HG1 ARG 71 -17.628 -14.561 1.259 537 HD2 ARG 71 HD2 ARG 71 -17.257 -16.899 1.745 538 HD3 ARG 71 HD1 ARG 71 -18.767 -17.332 0.949 539 HE ARG 71 HE ARG 71 -16.409 -16.242 -0.451 540 HH11 ARG 71 HH11 ARG 71 -19.285 -18.237 -0.353 541 HH12 ARG 71 HH12 ARG 71 -19.033 -18.897 -1.944 542 HH21 ARG 71 HH21 ARG 71 -16.048 -17.131 -2.527 543 HH22 ARG 71 HH22 ARG 71 -17.183 -18.282 -3.171 544 H ARG 72 HN ARG 72 -22.473 -13.445 2.690 545 HA ARG 72 HA ARG 72 -22.812 -13.637 5.551 546 HB2 ARG 72 HB2 ARG 72 -24.225 -12.145 4.091 547 HB3 ARG 72 HB1 ARG 72 -24.966 -13.592 3.425 548 HG2 ARG 72 HG2 ARG 72 -25.736 -14.209 5.680 549 HG3 ARG 72 HG1 ARG 72 -25.050 -12.709 6.301 550 HD2 ARG 72 HD2 ARG 72 -27.293 -13.008 4.310 551 HD3 ARG 72 HD1 ARG 72 -27.405 -12.398 5.959 552 HE ARG 72 HE ARG 72 -26.437 -10.977 3.614 553 HH11 ARG 72 HH11 ARG 72 -26.749 -11.011 7.121 554 HH12 ARG 72 HH12 ARG 72 -26.525 -9.288 7.265 555 HH21 ARG 72 HH21 ARG 72 -26.134 -8.743 3.828 556 HH22 ARG 72 HH22 ARG 72 -26.158 -8.010 5.401 557 H GLU 73 HN GLU 73 -22.335 -15.627 6.266 558 HA GLU 73 HA GLU 73 -23.513 -17.935 4.869 559 HB2 GLU 73 HB2 GLU 73 -20.987 -17.751 5.018 560 HB3 GLU 73 HB1 GLU 73 -21.150 -17.967 6.754 561 HG2 GLU 73 HG2 GLU 73 -20.569 -20.054 5.687 562 HG3 GLU 73 HG1 GLU 73 -22.184 -20.150 6.385 563 H GLY 74 HN GLY 74 -24.949 -19.168 5.935 564 HA2 GLY 74 HA2 GLY 74 -26.242 -19.990 7.656 565 HA3 GLY 74 HA1 GLY 74 -25.031 -19.393 8.784 566 H THR 75 HN THR 75 -25.398 -17.552 9.875 567 HA THR 75 HA THR 75 -27.657 -15.869 9.033 568 HB THR 75 HB THR 75 -27.089 -16.544 11.927 569 HG1 THR 75 HG1 THR 75 -28.254 -18.301 11.670 570 HG21 THR 75 HG21 THR 75 -28.319 -14.450 11.529 571 HG22 THR 75 HG22 THR 75 -29.343 -15.665 12.295 572 HG23 THR 75 HG23 THR 75 -29.506 -15.334 10.570 573 H ARG 76 HN ARG 76 -24.451 -15.976 9.413 574 HA ARG 76 HA ARG 76 -24.266 -13.267 10.576 575 HB2 ARG 76 HB2 ARG 76 -22.102 -15.368 10.641 576 HB3 ARG 76 HB1 ARG 76 -22.115 -13.827 11.483 577 HG2 ARG 76 HG2 ARG 76 -23.991 -14.615 12.858 578 HG3 ARG 76 HG1 ARG 76 -23.916 -16.175 12.034 579 HD2 ARG 76 HD2 ARG 76 -21.508 -16.308 12.771 580 HD3 ARG 76 HD1 ARG 76 -21.832 -14.910 13.795 581 HE ARG 76 HE ARG 76 -23.562 -17.236 14.114 582 HH11 ARG 76 HH11 ARG 76 -20.972 -15.221 15.343 583 HH12 ARG 76 HH12 ARG 76 -20.924 -16.020 16.889 584 HH21 ARG 76 HH21 ARG 76 -23.512 -18.277 16.129 585 HH22 ARG 76 HH22 ARG 76 -22.387 -17.746 17.351 586 H GLN 77 HN GLN 77 -22.277 -12.083 9.860 587 HA GLN 77 HA GLN 77 -21.743 -12.605 7.017 588 HB2 GLN 77 HB2 GLN 77 -21.185 -10.129 8.660 589 HB3 GLN 77 HB1 GLN 77 -20.859 -10.311 6.944 590 HG2 GLN 77 HG2 GLN 77 -23.304 -10.660 6.596 591 HG3 GLN 77 HG1 GLN 77 -23.542 -10.250 8.295 592 HE21 GLN 77 HE21 GLN 77 -21.327 -8.312 8.219 593 HE22 GLN 77 HE22 GLN 77 -21.942 -6.922 7.392 594 H TYR 78 HN TYR 78 -19.889 -13.530 6.504 595 HA TYR 78 HA TYR 78 -17.671 -13.375 8.429 596 HB2 TYR 78 HB2 TYR 78 -18.230 -15.407 6.254 597 HB3 TYR 78 HB1 TYR 78 -16.782 -15.389 7.256 598 HD1 TYR 78 HD2 TYR 78 -20.480 -15.699 7.422 599 HD2 TYR 78 HD1 TYR 78 -16.767 -16.458 9.348 600 HE1 TYR 78 HE2 TYR 78 -21.640 -17.049 9.111 601 HE2 TYR 78 HE1 TYR 78 -17.919 -17.815 11.046 602 HH TYR 78 HH TYR 78 -20.107 -18.120 11.997 603 H TYR 79 HN TYR 79 -15.949 -12.207 7.880 604 HA TYR 79 HA TYR 79 -15.783 -11.274 5.107 605 HB2 TYR 79 HB2 TYR 79 -14.874 -10.119 7.716 606 HB3 TYR 79 HB1 TYR 79 -14.043 -9.658 6.235 607 HD1 TYR 79 HD1 TYR 79 -17.388 -9.720 7.856 608 HD2 TYR 79 HD2 TYR 79 -14.954 -8.051 4.793 609 HE1 TYR 79 HE1 TYR 79 -19.135 -8.057 7.381 610 HE2 TYR 79 HE2 TYR 79 -16.693 -6.382 4.305 611 HH TYR 79 HH TYR 79 -19.120 -6.114 4.602 612 H ARG 80 HN ARG 80 -13.848 -11.274 4.005 613 HA ARG 80 HA ARG 80 -11.700 -12.988 4.993 614 HB2 ARG 80 HB2 ARG 80 -11.827 -14.492 3.118 615 HB3 ARG 80 HB1 ARG 80 -13.424 -14.439 3.850 616 HG2 ARG 80 HG2 ARG 80 -13.990 -12.676 2.107 617 HG3 ARG 80 HG1 ARG 80 -12.505 -13.163 1.296 618 HD2 ARG 80 HD2 ARG 80 -14.943 -14.833 1.856 619 HD3 ARG 80 HD1 ARG 80 -14.295 -14.356 0.288 620 HE ARG 80 HE ARG 80 -13.335 -16.485 2.024 621 HH11 ARG 80 HH11 ARG 80 -12.771 -14.532 -0.830 622 HH12 ARG 80 HH12 ARG 80 -11.713 -15.687 -1.580 623 HH21 ARG 80 HH21 ARG 80 -11.913 -17.998 1.049 624 HH22 ARG 80 HH22 ARG 80 -11.221 -17.646 -0.502 625 H ILE 81 HN ILE 81 -9.877 -12.978 3.329 626 HA ILE 81 HA ILE 81 -9.572 -10.308 2.264 627 HB ILE 81 HB ILE 81 -7.678 -12.666 2.078 628 HG12 ILE 81 HG12 ILE 81 -7.743 -10.348 4.026 629 HG13 ILE 81 HG11 ILE 81 -8.163 -12.014 4.405 630 HG21 ILE 81 HG21 ILE 81 -5.971 -10.944 1.627 631 HG22 ILE 81 HG22 ILE 81 -7.239 -9.718 1.597 632 HG23 ILE 81 HG23 ILE 81 -7.217 -10.994 0.379 633 HD11 ILE 81 HD11 ILE 81 -5.450 -11.038 3.546 634 HD12 ILE 81 HD12 ILE 81 -5.873 -12.699 3.957 635 HD13 ILE 81 HD13 ILE 81 -5.936 -11.442 5.193 636 H ALA 82 HN ALA 82 -9.457 -9.764 0.075 637 HA ALA 82 HA ALA 82 -11.133 -11.433 -1.584 638 HB1 ALA 82 HB1 ALA 82 -11.141 -9.544 -3.113 639 HB2 ALA 82 HB2 ALA 82 -9.869 -8.763 -2.174 640 HB3 ALA 82 HB3 ALA 82 -11.463 -9.014 -1.463 641 H GLY 83 HN GLY 83 -8.638 -12.629 -1.088 642 HA2 GLY 83 HA2 GLY 83 -7.861 -13.920 -3.214 643 HA3 GLY 83 HA1 GLY 83 -7.149 -12.357 -3.598 644 H GLU 84 HN GLU 84 -6.093 -15.149 -2.829 645 HA GLU 84 HA GLU 84 -4.727 -14.855 -0.369 646 HB2 GLU 84 HB2 GLU 84 -5.082 -17.037 -1.498 647 HB3 GLU 84 HB1 GLU 84 -3.943 -16.553 -2.748 648 HG2 GLU 84 HG2 GLU 84 -2.192 -16.355 -1.017 649 HG3 GLU 84 HG1 GLU 84 -3.346 -16.955 0.172 650 H ASP 85 HN ASP 85 -4.030 -13.845 -3.638 651 HA ASP 85 HA ASP 85 -1.304 -13.178 -3.267 652 HB2 ASP 85 HB2 ASP 85 -3.369 -12.032 -5.163 653 HB3 ASP 85 HB1 ASP 85 -1.650 -11.658 -5.233 654 H VAL 86 HN VAL 86 -4.306 -11.494 -2.625 655 HA VAL 86 HA VAL 86 -3.128 -8.997 -1.894 656 HB VAL 86 HB VAL 86 -5.811 -10.108 -1.043 657 HG11 VAL 86 HG11 VAL 86 -6.442 -7.753 -0.786 658 HG12 VAL 86 HG12 VAL 86 -4.800 -7.268 -1.217 659 HG13 VAL 86 HG13 VAL 86 -5.091 -8.180 0.265 660 HG21 VAL 86 HG21 VAL 86 -6.734 -8.876 -2.958 661 HG22 VAL 86 HG22 VAL 86 -5.633 -10.159 -3.462 662 HG23 VAL 86 HG23 VAL 86 -5.095 -8.478 -3.479 663 H ALA 87 HN ALA 87 -4.028 -11.948 -0.210 664 HA ALA 87 HA ALA 87 -3.616 -11.077 2.431 665 HB1 ALA 87 HB1 ALA 87 -3.456 -13.429 3.008 666 HB2 ALA 87 HB2 ALA 87 -3.214 -13.850 1.314 667 HB3 ALA 87 HB3 ALA 87 -4.755 -13.177 1.843 668 H ARG 88 HN ARG 88 -1.407 -12.601 0.098 669 HA ARG 88 HA ARG 88 0.809 -12.563 1.896 670 HB2 ARG 88 HB2 ARG 88 0.717 -12.926 -1.101 671 HB3 ARG 88 HB1 ARG 88 2.168 -13.109 -0.125 672 HG2 ARG 88 HG2 ARG 88 0.888 -14.857 1.194 673 HG3 ARG 88 HG1 ARG 88 -0.312 -14.794 -0.095 674 HD2 ARG 88 HD2 ARG 88 2.600 -15.514 -0.383 675 HD3 ARG 88 HD1 ARG 88 1.230 -16.617 -0.484 676 HE ARG 88 HE ARG 88 2.013 -14.612 -2.482 677 HH11 ARG 88 HH11 ARG 88 -0.015 -17.286 -1.509 678 HH12 ARG 88 HH12 ARG 88 -0.648 -17.565 -3.096 679 HH21 ARG 88 HH21 ARG 88 1.195 -14.961 -4.582 680 HH22 ARG 88 HH22 ARG 88 0.043 -16.237 -4.853 681 H LEU 89 HN LEU 89 -0.602 -10.249 -0.221 682 HA LEU 89 HA LEU 89 1.583 -8.508 -0.569 683 HB2 LEU 89 HB2 LEU 89 -0.644 -8.382 -1.738 684 HB3 LEU 89 HB1 LEU 89 -1.334 -7.758 -0.257 685 HG LEU 89 HG LEU 89 0.946 -6.329 -1.599 686 HD11 LEU 89 HD11 LEU 89 -0.771 -6.646 -3.305 687 HD12 LEU 89 HD12 LEU 89 -0.694 -4.960 -2.788 688 HD13 LEU 89 HD13 LEU 89 -1.991 -6.003 -2.206 689 HD21 LEU 89 HD21 LEU 89 -0.015 -4.388 -0.488 690 HD22 LEU 89 HD22 LEU 89 0.326 -5.664 0.681 691 HD23 LEU 89 HD23 LEU 89 -1.330 -5.382 0.142 692 H PHE 90 HN PHE 90 -0.954 -8.624 1.923 693 HA PHE 90 HA PHE 90 0.122 -6.540 3.507 694 HB2 PHE 90 HB2 PHE 90 -2.217 -7.278 3.706 695 HB3 PHE 90 HB1 PHE 90 -1.677 -8.834 4.328 696 HD1 PHE 90 HD2 PHE 90 -1.515 -5.187 5.048 697 HD2 PHE 90 HD1 PHE 90 -1.442 -9.146 6.615 698 HE1 PHE 90 HE2 PHE 90 -1.557 -4.279 7.335 699 HE2 PHE 90 HE1 PHE 90 -1.483 -8.245 8.904 700 HZ PHE 90 HZ PHE 90 -1.539 -5.809 9.267 701 H ALA 91 HN ALA 91 0.575 -10.030 3.481 702 HA ALA 91 HA ALA 91 2.113 -10.227 5.830 703 HB1 ALA 91 HB1 ALA 91 2.829 -12.386 4.972 704 HB2 ALA 91 HB2 ALA 91 2.229 -11.967 3.368 705 HB3 ALA 91 HB3 ALA 91 1.101 -12.161 4.710 706 H LEU 92 HN LEU 92 3.023 -9.734 2.445 707 HA LEU 92 HA LEU 92 5.802 -9.866 2.746 708 HB2 LEU 92 HB2 LEU 92 4.562 -9.929 0.595 709 HB3 LEU 92 HB1 LEU 92 4.219 -8.221 0.765 710 HG LEU 92 HG LEU 92 7.070 -9.138 0.726 711 HD11 LEU 92 HD11 LEU 92 6.032 -10.255 -1.181 712 HD12 LEU 92 HD12 LEU 92 7.082 -8.941 -1.713 713 HD13 LEU 92 HD13 LEU 92 5.330 -8.724 -1.705 714 HD21 LEU 92 HD21 LEU 92 5.661 -6.662 -0.282 715 HD22 LEU 92 HD22 LEU 92 7.401 -6.950 -0.326 716 HD23 LEU 92 HD23 LEU 92 6.573 -6.791 1.222 717 H VAL 93 HN VAL 93 3.658 -7.008 2.760 718 HA VAL 93 HA VAL 93 5.760 -5.168 3.214 719 HB VAL 93 HB VAL 93 3.575 -4.501 2.270 720 HG11 VAL 93 HG11 VAL 93 2.107 -5.833 3.685 721 HG12 VAL 93 HG12 VAL 93 1.655 -4.129 3.722 722 HG13 VAL 93 HG13 VAL 93 2.532 -4.838 5.077 723 HG21 VAL 93 HG21 VAL 93 4.370 -3.040 4.784 724 HG22 VAL 93 HG22 VAL 93 3.357 -2.383 3.500 725 HG23 VAL 93 HG23 VAL 93 5.039 -2.798 3.169 726 H GLN 94 HN GLN 94 3.789 -7.102 5.367 727 HA GLN 94 HA GLN 94 4.501 -5.754 7.765 728 HB2 GLN 94 HB2 GLN 94 2.554 -7.289 7.554 729 HB3 GLN 94 HB1 GLN 94 3.668 -8.641 7.404 730 HG2 GLN 94 HG2 GLN 94 4.504 -8.237 9.639 731 HG3 GLN 94 HG1 GLN 94 3.460 -6.824 9.798 732 HE21 GLN 94 HE21 GLN 94 1.246 -7.122 10.069 733 HE22 GLN 94 HE22 GLN 94 0.570 -8.643 10.534 734 H VAL 95 HN VAL 95 5.853 -8.516 6.010 735 HA VAL 95 HA VAL 95 7.892 -9.160 7.843 736 HB VAL 95 HB VAL 95 7.784 -9.542 4.846 737 HG11 VAL 95 HG11 VAL 95 9.722 -10.704 6.844 738 HG12 VAL 95 HG12 VAL 95 10.104 -9.547 5.568 739 HG13 VAL 95 HG13 VAL 95 9.589 -11.183 5.151 740 HG21 VAL 95 HG21 VAL 95 6.057 -10.755 6.029 741 HG22 VAL 95 HG22 VAL 95 7.248 -11.413 7.153 742 HG23 VAL 95 HG23 VAL 95 7.283 -11.886 5.453 743 H VAL 96 HN VAL 96 7.902 -7.060 4.972 744 HA VAL 96 HA VAL 96 10.550 -6.169 5.180 745 HB VAL 96 HB VAL 96 8.114 -4.791 4.036 746 HG11 VAL 96 HG11 VAL 96 11.008 -3.984 3.750 747 HG12 VAL 96 HG12 VAL 96 9.781 -3.109 4.666 748 HG13 VAL 96 HG13 VAL 96 9.637 -3.252 2.914 749 HG21 VAL 96 HG21 VAL 96 9.076 -5.445 1.895 750 HG22 VAL 96 HG22 VAL 96 8.808 -6.855 2.919 751 HG23 VAL 96 HG23 VAL 96 10.435 -6.199 2.729 752 H ALA 97 HN ALA 97 7.582 -4.978 6.677 753 HA ALA 97 HA ALA 97 8.623 -2.687 7.901 754 HB1 ALA 97 HB1 ALA 97 6.218 -3.198 7.757 755 HB2 ALA 97 HB2 ALA 97 6.722 -2.809 9.402 756 HB3 ALA 97 HB3 ALA 97 6.437 -4.488 8.943 757 H ASP 98 HN ASP 98 8.340 -6.015 9.144 758 HA ASP 98 HA ASP 98 9.484 -5.481 11.667 759 HB2 ASP 98 HB2 ASP 98 8.181 -7.478 11.357 760 HB3 ASP 98 HB1 ASP 98 9.268 -8.048 10.094 761 H GLU 99 HN GLU 99 10.926 -6.778 8.685 762 HA GLU 99 HA GLU 99 13.485 -7.234 9.792 763 HB2 GLU 99 HB2 GLU 99 12.562 -8.236 7.672 764 HB3 GLU 99 HB1 GLU 99 12.848 -6.689 6.888 765 HG2 GLU 99 HG2 GLU 99 15.206 -6.887 7.204 766 HG3 GLU 99 HG1 GLU 99 15.002 -8.318 8.214 767 H HIS 100 HN HIS 100 11.926 -4.385 8.648 768 HA HIS 100 HA HIS 100 14.135 -2.753 8.080 769 HB2 HIS 100 HB2 HIS 100 11.313 -2.259 8.899 770 HB3 HIS 100 HB1 HIS 100 12.447 -0.922 9.022 771 HD1 HIS 100 HD1 HIS 100 10.275 -0.421 7.171 772 HD2 HIS 100 HD2 HIS 100 13.648 -2.517 5.945 773 HE1 HIS 100 HE1 HIS 100 10.411 -0.083 4.685 774 HE2 HIS 100 HE2 HIS 100 12.610 -1.114 4.021 775 H LEU 101 HN LEU 101 12.760 -3.769 11.148 776 HA LEU 101 HA LEU 101 13.977 -1.656 12.647 777 HB2 LEU 101 HB2 LEU 101 12.650 -4.222 13.464 778 HB3 LEU 101 HB1 LEU 101 13.429 -3.177 14.631 779 HG LEU 101 HG LEU 101 11.200 -2.574 14.788 780 HD11 LEU 101 HD11 LEU 101 12.368 -0.664 12.772 781 HD12 LEU 101 HD12 LEU 101 12.583 -0.600 14.522 782 HD13 LEU 101 HD13 LEU 101 10.985 -0.342 13.818 783 HD21 LEU 101 HD21 LEU 101 11.020 -2.663 11.784 784 HD22 LEU 101 HD22 LEU 101 9.718 -2.194 12.876 785 HD23 LEU 101 HD23 LEU 101 10.351 -3.840 12.915 786 H GLU 102 HN GLU 102 14.858 -5.011 11.942 787 HA GLU 102 HA GLU 102 17.008 -4.948 13.857 788 HB2 GLU 102 HB2 GLU 102 15.767 -7.033 13.394 789 HB3 GLU 102 HB1 GLU 102 16.396 -7.026 11.751 790 HG2 GLU 102 HG2 GLU 102 18.659 -7.250 12.596 791 HG3 GLU 102 HG1 GLU 102 18.064 -7.196 14.252 792 H HIS 103 HN HIS 103 16.705 -4.758 10.337 793 HA HIS 103 HA HIS 103 18.181 -4.231 8.678 794 HB2 HIS 103 HB2 HIS 103 19.845 -3.093 10.944 795 HB3 HIS 103 HB1 HIS 103 20.181 -2.860 9.235 796 HD1 HIS 103 HD1 HIS 103 18.788 -1.104 7.988 797 HD2 HIS 103 HD2 HIS 103 17.701 -1.587 11.967 798 HE1 HIS 103 HE1 HIS 103 17.323 0.860 8.525 799 HE2 HIS 103 HE2 HIS 103 16.500 0.423 10.862 800 H HIS 104 HN HIS 104 20.798 -4.429 8.263 801 HA HIS 104 HA HIS 104 21.844 -6.707 9.775 802 HB2 HIS 104 HB2 HIS 104 22.866 -7.599 7.619 803 HB3 HIS 104 HB1 HIS 104 21.146 -7.866 7.848 804 HD1 HIS 104 HD1 HIS 104 23.605 -6.173 5.621 805 HD2 HIS 104 HD2 HIS 104 19.476 -6.441 6.087 806 HE1 HIS 104 HE1 HIS 104 22.617 -5.317 3.477 807 HE2 HIS 104 HE2 HIS 104 20.139 -5.731 3.695 808 H HIS 105 HN HIS 105 22.315 -3.994 10.090 809 HA HIS 105 HA HIS 105 24.797 -3.274 8.825 810 HB2 HIS 105 HB2 HIS 105 23.142 -1.557 9.453 811 HB3 HIS 105 HB1 HIS 105 23.336 -1.988 11.147 812 HD1 HIS 105 HD1 HIS 105 24.509 -0.086 12.208 813 HD2 HIS 105 HD2 HIS 105 26.165 -1.075 8.521 814 HE1 HIS 105 HE1 HIS 105 26.487 1.436 11.921 815 HE2 HIS 105 HE2 HIS 105 27.616 0.633 9.817 816 H HIS 106 HN HIS 106 25.751 -5.358 9.533 817 HA HIS 106 HA HIS 106 27.622 -4.857 11.629 818 HB2 HIS 106 HB2 HIS 106 25.595 -5.692 12.892 819 HB3 HIS 106 HB1 HIS 106 25.763 -7.215 12.029 820 HD1 HIS 106 HD1 HIS 106 26.588 -8.821 13.707 821 HD2 HIS 106 HD2 HIS 106 28.589 -5.184 13.922 822 HE1 HIS 106 HE1 HIS 106 28.386 -9.136 15.436 823 HE2 HIS 106 HE2 HIS 106 29.723 -6.999 15.377 824 H HIS 107 HN HIS 107 27.316 -5.509 8.762 825 HA HIS 107 HA HIS 107 29.336 -7.522 8.503 826 HB2 HIS 107 HB2 HIS 107 27.151 -8.819 8.813 827 HB3 HIS 107 HB1 HIS 107 26.644 -8.149 7.268 828 HD1 HIS 107 HD1 HIS 107 26.842 -9.926 5.560 829 HD2 HIS 107 HD2 HIS 107 30.006 -10.012 8.263 830 HE1 HIS 107 HE1 HIS 107 28.344 -11.789 4.793 831 HE2 HIS 107 HE2 HIS 107 30.090 -11.981 6.592 832 H HIS 108 HN HIS 108 26.636 -6.528 6.452 833 HA HIS 108 HA HIS 108 27.722 -4.269 5.328 834 HB2 HIS 108 HB2 HIS 108 28.344 -5.002 3.053 835 HB3 HIS 108 HB1 HIS 108 29.441 -5.641 4.265 836 HD1 HIS 108 HD1 HIS 108 26.518 -6.776 2.117 837 HD2 HIS 108 HD2 HIS 108 29.785 -8.322 4.168 838 HE1 HIS 108 HE1 HIS 108 26.645 -9.199 1.460 839 HE2 HIS 108 HE2 HIS 108 28.779 -10.038 2.513 840 H1 MET 1 HT1 MET 1 -7.033 -14.705 26.974 841 H2 MET 1 HT2 MET 1 -7.032 -16.051 25.939 842 H3 MET 1 HT3 MET 1 -7.364 -14.503 25.322 843 HA MET 1 HA MET 1 -4.801 -15.392 26.506 844 HB2 MET 1 HB2 MET 1 -3.888 -15.175 24.231 845 HB3 MET 1 HB1 MET 1 -5.132 -16.410 24.324 846 HG2 MET 1 HG2 MET 1 -5.634 -13.621 23.322 847 HG3 MET 1 HG1 MET 1 -5.187 -14.974 22.283 848 HE1 MET 1 HE1 MET 1 -7.354 -14.609 20.794 849 HE2 MET 1 HE2 MET 1 -7.776 -13.227 21.804 850 HE3 MET 1 HE3 MET 1 -8.980 -14.471 21.463 851 H ALA 2 HN ALA 2 -3.411 -13.847 27.038 852 HA ALA 2 HA ALA 2 -3.799 -11.124 26.075 853 HB1 ALA 2 HB1 ALA 2 -5.210 -11.252 28.079 854 HB2 ALA 2 HB2 ALA 2 -3.845 -10.161 28.309 855 HB3 ALA 2 HB3 ALA 2 -3.815 -11.774 29.021 856 H GLY 3 HN GLY 3 -1.834 -11.094 25.113 857 HA2 GLY 3 HA2 GLY 3 0.531 -11.965 26.548 858 HA3 GLY 3 HA1 GLY 3 0.477 -11.299 24.920 859 H GLN 4 HN GLN 4 -1.285 -9.122 26.285 860 HA GLN 4 HA GLN 4 -1.026 -7.009 27.055 861 HB2 GLN 4 HB2 GLN 4 1.302 -8.193 28.581 862 HB3 GLN 4 HB1 GLN 4 0.547 -6.639 28.911 863 HG2 GLN 4 HG2 GLN 4 -1.556 -7.776 29.431 864 HG3 GLN 4 HG1 GLN 4 -0.787 -9.330 29.115 865 HE21 GLN 4 HE21 GLN 4 0.807 -6.655 30.715 866 HE22 GLN 4 HE22 GLN 4 0.908 -7.403 32.276 867 H SER 5 HN SER 5 0.437 -7.961 24.656 868 HA SER 5 HA SER 5 2.540 -5.911 24.587 869 HB2 SER 5 HB2 SER 5 3.335 -8.242 24.191 870 HB3 SER 5 HB1 SER 5 2.259 -8.342 22.797 871 HG SER 5 HG SER 5 4.498 -6.635 23.156 872 H ASP 6 HN ASP 6 2.109 -4.181 23.426 873 HA ASP 6 HA ASP 6 -0.024 -4.313 21.390 874 HB2 ASP 6 HB2 ASP 6 -0.281 -2.798 23.451 875 HB3 ASP 6 HB1 ASP 6 1.004 -1.819 22.757 876 H ARG 7 HN ARG 7 2.817 -5.016 21.216 877 HA ARG 7 HA ARG 7 4.375 -2.945 20.121 878 HB2 ARG 7 HB2 ARG 7 5.243 -5.029 21.172 879 HB3 ARG 7 HB1 ARG 7 4.713 -5.920 19.755 880 HG2 ARG 7 HG2 ARG 7 6.232 -4.613 18.360 881 HG3 ARG 7 HG1 ARG 7 6.768 -3.722 19.785 882 HD2 ARG 7 HD2 ARG 7 7.082 -6.674 19.269 883 HD3 ARG 7 HD1 ARG 7 8.360 -5.461 19.283 884 HE ARG 7 HE ARG 7 6.847 -5.710 21.753 885 HH11 ARG 7 HH11 ARG 7 9.690 -6.660 19.942 886 HH12 ARG 7 HH12 ARG 7 10.570 -7.189 21.345 887 HH21 ARG 7 HH21 ARG 7 7.984 -6.436 23.604 888 HH22 ARG 7 HH22 ARG 7 9.600 -7.055 23.428 889 H LYS 8 HN LYS 8 2.329 -5.421 18.621 890 HA LYS 8 HA LYS 8 3.287 -5.097 16.003 891 HB2 LYS 8 HB2 LYS 8 1.237 -6.165 15.240 892 HB3 LYS 8 HB1 LYS 8 1.979 -7.027 16.577 893 HG2 LYS 8 HG2 LYS 8 0.324 -6.310 18.084 894 HG3 LYS 8 HG1 LYS 8 -0.288 -5.098 16.953 895 HD2 LYS 8 HD2 LYS 8 -1.724 -7.099 17.059 896 HD3 LYS 8 HD1 LYS 8 -1.040 -6.828 15.455 897 HE2 LYS 8 HE2 LYS 8 0.681 -8.493 15.895 898 HE3 LYS 8 HE1 LYS 8 0.020 -8.764 17.506 899 HZ1 LYS 8 HZ1 LYS 8 -1.899 -9.739 16.621 900 HZ2 LYS 8 HZ2 LYS 8 -0.630 -10.392 15.706 901 HZ3 LYS 8 HZ3 LYS 8 -1.594 -9.164 15.056 902 H ALA 9 HN ALA 9 1.125 -3.140 17.857 903 HA ALA 9 HA ALA 9 -0.184 -1.797 15.757 904 HB1 ALA 9 HB1 ALA 9 -0.903 -1.665 18.103 905 HB2 ALA 9 HB2 ALA 9 -0.685 -0.068 17.387 906 HB3 ALA 9 HB3 ALA 9 0.536 -0.718 18.479 907 H ALA 10 HN ALA 10 2.996 -1.423 17.168 908 HA ALA 10 HA ALA 10 3.570 1.084 15.914 909 HB1 ALA 10 HB1 ALA 10 5.882 0.662 16.603 910 HB2 ALA 10 HB2 ALA 10 5.447 -0.985 17.057 911 HB3 ALA 10 HB3 ALA 10 4.753 0.382 17.930 912 H LEU 11 HN LEU 11 3.853 -2.281 15.046 913 HA LEU 11 HA LEU 11 5.481 -1.833 12.729 914 HB2 LEU 11 HB2 LEU 11 3.846 -4.165 13.702 915 HB3 LEU 11 HB1 LEU 11 4.558 -4.171 12.102 916 HG LEU 11 HG LEU 11 6.806 -3.861 13.183 917 HD11 LEU 11 HD11 LEU 11 6.079 -2.936 15.312 918 HD12 LEU 11 HD12 LEU 11 7.025 -4.405 15.558 919 HD13 LEU 11 HD13 LEU 11 5.268 -4.451 15.707 920 HD21 LEU 11 HD21 LEU 11 6.989 -6.201 13.898 921 HD22 LEU 11 HD22 LEU 11 6.073 -6.033 12.401 922 HD23 LEU 11 HD23 LEU 11 5.229 -6.320 13.923 923 H LEU 12 HN LEU 12 2.047 -2.260 13.393 924 HA LEU 12 HA LEU 12 1.111 -2.084 10.749 925 HB2 LEU 12 HB2 LEU 12 -0.244 -1.244 13.316 926 HB3 LEU 12 HB1 LEU 12 -1.051 -1.463 11.775 927 HG LEU 12 HG LEU 12 0.362 -3.657 13.298 928 HD11 LEU 12 HD11 LEU 12 -2.580 -3.068 13.018 929 HD12 LEU 12 HD12 LEU 12 -1.618 -2.909 14.490 930 HD13 LEU 12 HD13 LEU 12 -1.881 -4.499 13.776 931 HD21 LEU 12 HD21 LEU 12 0.344 -4.017 10.886 932 HD22 LEU 12 HD22 LEU 12 -1.399 -3.748 10.850 933 HD23 LEU 12 HD23 LEU 12 -0.740 -5.144 11.702 934 H ASP 13 HN ASP 13 1.893 0.377 13.146 935 HA ASP 13 HA ASP 13 0.999 2.624 11.703 936 HB2 ASP 13 HB2 ASP 13 1.607 2.820 14.053 937 HB3 ASP 13 HB1 ASP 13 3.274 2.386 13.685 938 H GLN 14 HN GLN 14 4.110 0.931 11.748 939 HA GLN 14 HA GLN 14 5.467 2.631 9.966 940 HB2 GLN 14 HB2 GLN 14 6.496 0.805 11.395 941 HB3 GLN 14 HB1 GLN 14 5.907 -0.348 10.204 942 HG2 GLN 14 HG2 GLN 14 7.182 1.055 8.490 943 HG3 GLN 14 HG1 GLN 14 7.981 1.785 9.879 944 HE21 GLN 14 HE21 GLN 14 7.874 -0.746 11.400 945 HE22 GLN 14 HE22 GLN 14 9.108 -1.747 10.712 946 H VAL 15 HN VAL 15 3.572 -0.320 9.419 947 HA VAL 15 HA VAL 15 3.812 -0.436 6.633 948 HB VAL 15 HB VAL 15 1.474 -1.295 8.355 949 HG11 VAL 15 HG11 VAL 15 0.836 -1.080 6.004 950 HG12 VAL 15 HG12 VAL 15 0.870 -2.770 6.507 951 HG13 VAL 15 HG13 VAL 15 2.190 -2.111 5.540 952 HG21 VAL 15 HG21 VAL 15 2.481 -3.532 8.185 953 HG22 VAL 15 HG22 VAL 15 3.537 -2.384 9.008 954 HG23 VAL 15 HG23 VAL 15 3.858 -2.834 7.333 955 H ALA 16 HN ALA 16 1.556 1.328 8.699 956 HA ALA 16 HA ALA 16 -0.074 2.368 6.656 957 HB1 ALA 16 HB1 ALA 16 -0.809 4.007 8.305 958 HB2 ALA 16 HB2 ALA 16 0.541 3.569 9.351 959 HB3 ALA 16 HB3 ALA 16 -0.728 2.393 9.012 960 H ARG 17 HN ARG 17 2.977 3.495 8.041 961 HA ARG 17 HA ARG 17 3.036 6.002 6.724 962 HB2 ARG 17 HB2 ARG 17 5.333 4.255 7.631 963 HB3 ARG 17 HB1 ARG 17 5.483 5.929 7.119 964 HG2 ARG 17 HG2 ARG 17 3.992 6.582 8.992 965 HG3 ARG 17 HG1 ARG 17 4.010 4.901 9.533 966 HD2 ARG 17 HD2 ARG 17 6.461 5.017 9.723 967 HD3 ARG 17 HD1 ARG 17 6.401 6.716 9.253 968 HE ARG 17 HE ARG 17 4.979 5.780 11.664 969 HH11 ARG 17 HH11 ARG 17 7.378 7.819 10.127 970 HH12 ARG 17 HH12 ARG 17 7.718 8.731 11.566 971 HH21 ARG 17 HH21 ARG 17 5.436 6.988 13.575 972 HH22 ARG 17 HH22 ARG 17 6.615 8.261 13.515 973 H VAL 18 HN VAL 18 4.263 2.799 5.867 974 HA VAL 18 HA VAL 18 5.337 3.449 3.347 975 HB VAL 18 HB VAL 18 4.068 0.850 4.250 976 HG11 VAL 18 HG11 VAL 18 5.395 -0.203 2.489 977 HG12 VAL 18 HG12 VAL 18 5.975 1.381 1.973 978 HG13 VAL 18 HG13 VAL 18 4.266 0.975 1.821 979 HG21 VAL 18 HG21 VAL 18 5.888 1.501 5.716 980 HG22 VAL 18 HG22 VAL 18 6.942 1.765 4.328 981 HG23 VAL 18 HG23 VAL 18 6.381 0.138 4.710 982 H GLY 19 HN GLY 19 2.120 2.436 4.378 983 HA2 GLY 19 HA2 GLY 19 0.914 2.356 1.834 984 HA3 GLY 19 HA1 GLY 19 0.073 2.529 3.366 985 H LYS 20 HN LYS 20 1.578 5.044 3.985 986 HA LYS 20 HA LYS 20 -0.174 6.850 2.612 987 HB2 LYS 20 HB2 LYS 20 2.025 7.245 4.623 988 HB3 LYS 20 HB1 LYS 20 1.248 8.614 3.838 989 HG2 LYS 20 HG2 LYS 20 -0.937 7.795 4.675 990 HG3 LYS 20 HG1 LYS 20 -0.080 6.527 5.553 991 HD2 LYS 20 HD2 LYS 20 1.085 8.160 6.882 992 HD3 LYS 20 HD1 LYS 20 0.414 9.478 5.917 993 HE2 LYS 20 HE2 LYS 20 -1.190 7.569 7.613 994 HE3 LYS 20 HE1 LYS 20 -0.742 9.209 8.074 995 HZ1 LYS 20 HZ1 LYS 20 -3.006 9.102 7.205 996 HZ2 LYS 20 HZ2 LYS 20 -2.433 8.489 5.732 997 HZ3 LYS 20 HZ3 LYS 20 -2.020 10.059 6.213 998 H ALA 21 HN ALA 21 3.168 5.887 2.286 999 HA ALA 21 HA ALA 21 3.801 7.900 0.330 1000 HB1 ALA 21 HB1 ALA 21 5.214 5.314 0.990 1001 HB2 ALA 21 HB2 ALA 21 5.565 6.893 1.690 1002 HB3 ALA 21 HB3 ALA 21 5.854 6.608 -0.025 1003 H LEU 22 HN LEU 22 2.858 4.504 0.302 1004 HA LEU 22 HA LEU 22 2.753 4.433 -2.608 1005 HB2 LEU 22 HB2 LEU 22 3.631 2.532 -1.246 1006 HB3 LEU 22 HB1 LEU 22 2.031 2.321 -0.566 1007 HG LEU 22 HG LEU 22 1.200 1.863 -2.896 1008 HD11 LEU 22 HD11 LEU 22 2.811 1.261 -4.597 1009 HD12 LEU 22 HD12 LEU 22 4.141 1.685 -3.519 1010 HD13 LEU 22 HD13 LEU 22 3.043 2.937 -4.101 1011 HD21 LEU 22 HD21 LEU 22 1.615 0.076 -1.307 1012 HD22 LEU 22 HD22 LEU 22 3.312 0.027 -1.780 1013 HD23 LEU 22 HD23 LEU 22 2.061 -0.429 -2.936 1014 H ALA 23 HN ALA 23 0.902 6.070 -0.808 1015 HA ALA 23 HA ALA 23 -1.651 4.838 -0.863 1016 HB1 ALA 23 HB1 ALA 23 -1.027 7.776 -0.606 1017 HB2 ALA 23 HB2 ALA 23 -1.084 6.622 0.727 1018 HB3 ALA 23 HB3 ALA 23 -2.547 6.983 -0.190 1019 H ASN 24 HN ASN 24 -0.955 7.911 -2.496 1020 HA ASN 24 HA ASN 24 -2.151 6.883 -4.934 1021 HB2 ASN 24 HB2 ASN 24 -3.805 8.755 -4.988 1022 HB3 ASN 24 HB1 ASN 24 -4.107 7.576 -3.719 1023 HD21 ASN 24 HD21 ASN 24 -5.327 9.054 -2.550 1024 HD22 ASN 24 HD22 ASN 24 -4.598 10.358 -1.675 1025 H GLY 25 HN GLY 25 -2.372 8.776 -6.558 1026 HA2 GLY 25 HA2 GLY 25 -1.688 10.935 -7.262 1027 HA3 GLY 25 HA1 GLY 25 -0.365 10.858 -6.111 1028 H ARG 26 HN ARG 26 0.257 11.736 -8.509 1029 HA ARG 26 HA ARG 26 1.100 9.699 -10.315 1030 HB2 ARG 26 HB2 ARG 26 1.657 12.632 -10.044 1031 HB3 ARG 26 HB1 ARG 26 2.612 11.657 -11.156 1032 HG2 ARG 26 HG2 ARG 26 0.604 10.990 -12.345 1033 HG3 ARG 26 HG1 ARG 26 -0.392 11.887 -11.197 1034 HD2 ARG 26 HD2 ARG 26 0.396 13.960 -11.968 1035 HD3 ARG 26 HD1 ARG 26 1.769 13.226 -12.795 1036 HE ARG 26 HE ARG 26 0.009 12.214 -14.304 1037 HH11 ARG 26 HH11 ARG 26 -0.480 15.257 -12.653 1038 HH12 ARG 26 HH12 ARG 26 -1.519 15.910 -13.888 1039 HH21 ARG 26 HH21 ARG 26 -1.339 13.080 -15.955 1040 HH22 ARG 26 HH22 ARG 26 -1.981 14.681 -15.767 1041 H ARG 27 HN ARG 27 2.183 10.514 -7.295 1042 HA ARG 27 HA ARG 27 4.942 10.061 -7.419 1043 HB2 ARG 27 HB2 ARG 27 3.040 9.055 -5.292 1044 HB3 ARG 27 HB1 ARG 27 4.769 9.317 -5.108 1045 HG2 ARG 27 HG2 ARG 27 4.427 11.719 -5.460 1046 HG3 ARG 27 HG1 ARG 27 2.690 11.435 -5.597 1047 HD2 ARG 27 HD2 ARG 27 4.405 10.873 -3.183 1048 HD3 ARG 27 HD1 ARG 27 3.267 12.205 -3.366 1049 HE ARG 27 HE ARG 27 1.785 9.935 -3.786 1050 HH11 ARG 27 HH11 ARG 27 3.742 11.237 -1.191 1051 HH12 ARG 27 HH12 ARG 27 2.852 10.435 0.066 1052 HH21 ARG 27 HH21 ARG 27 0.612 8.882 -2.150 1053 HH22 ARG 27 HH22 ARG 27 1.085 9.056 -0.487 1054 H LEU 28 HN LEU 28 2.187 7.907 -7.511 1055 HA LEU 28 HA LEU 28 3.591 5.456 -7.399 1056 HB2 LEU 28 HB2 LEU 28 0.939 6.085 -8.706 1057 HB3 LEU 28 HB1 LEU 28 1.519 4.482 -8.289 1058 HG LEU 28 HG LEU 28 0.747 6.688 -6.379 1059 HD11 LEU 28 HD11 LEU 28 -0.434 3.963 -6.868 1060 HD12 LEU 28 HD12 LEU 28 -1.119 5.496 -7.410 1061 HD13 LEU 28 HD13 LEU 28 -0.992 5.146 -5.686 1062 HD21 LEU 28 HD21 LEU 28 1.233 5.108 -4.587 1063 HD22 LEU 28 HD22 LEU 28 2.685 5.472 -5.518 1064 HD23 LEU 28 HD23 LEU 28 1.840 3.944 -5.763 1065 H GLN 29 HN GLN 29 2.746 7.671 -9.960 1066 HA GLN 29 HA GLN 29 3.476 6.059 -12.170 1067 HB2 GLN 29 HB2 GLN 29 2.133 8.253 -12.141 1068 HB3 GLN 29 HB1 GLN 29 3.689 9.068 -12.056 1069 HG2 GLN 29 HG2 GLN 29 4.315 7.857 -14.167 1070 HG3 GLN 29 HG1 GLN 29 2.631 7.340 -14.270 1071 HE21 GLN 29 HE21 GLN 29 4.841 9.976 -14.557 1072 HE22 GLN 29 HE22 GLN 29 3.727 11.113 -15.234 1073 H ILE 30 HN ILE 30 5.208 8.265 -10.054 1074 HA ILE 30 HA ILE 30 7.680 8.262 -11.426 1075 HB ILE 30 HB ILE 30 7.185 8.648 -8.464 1076 HG12 ILE 30 HG12 ILE 30 7.405 10.711 -10.670 1077 HG13 ILE 30 HG11 ILE 30 5.904 10.221 -9.891 1078 HG21 ILE 30 HG21 ILE 30 9.535 9.410 -10.189 1079 HG22 ILE 30 HG22 ILE 30 9.512 8.181 -8.925 1080 HG23 ILE 30 HG23 ILE 30 9.314 9.882 -8.505 1081 HD11 ILE 30 HD11 ILE 30 6.753 12.339 -9.021 1082 HD12 ILE 30 HD12 ILE 30 8.234 11.532 -8.509 1083 HD13 ILE 30 HD13 ILE 30 6.691 11.096 -7.773 1084 H LEU 31 HN LEU 31 6.307 6.213 -8.901 1085 HA LEU 31 HA LEU 31 8.543 4.701 -8.247 1086 HB2 LEU 31 HB2 LEU 31 5.640 3.898 -8.337 1087 HB3 LEU 31 HB1 LEU 31 6.904 2.926 -7.609 1088 HG LEU 31 HG LEU 31 6.140 5.706 -6.708 1089 HD11 LEU 31 HD11 LEU 31 4.352 4.140 -6.248 1090 HD12 LEU 31 HD12 LEU 31 5.187 4.559 -4.752 1091 HD13 LEU 31 HD13 LEU 31 5.496 3.006 -5.531 1092 HD21 LEU 31 HD21 LEU 31 7.981 3.654 -5.482 1093 HD22 LEU 31 HD22 LEU 31 7.547 5.209 -4.772 1094 HD23 LEU 31 HD23 LEU 31 8.480 5.150 -6.268 1095 H ASP 32 HN ASP 32 6.105 4.085 -10.774 1096 HA ASP 32 HA ASP 32 7.286 1.735 -11.786 1097 HB2 ASP 32 HB2 ASP 32 5.015 2.377 -12.415 1098 HB3 ASP 32 HB1 ASP 32 5.619 3.820 -13.224 1099 H LEU 33 HN LEU 33 7.780 5.132 -12.541 1100 HA LEU 33 HA LEU 33 9.484 4.802 -14.754 1101 HB2 LEU 33 HB2 LEU 33 8.295 6.895 -14.076 1102 HB3 LEU 33 HB1 LEU 33 9.453 7.080 -12.775 1103 HG LEU 33 HG LEU 33 11.268 7.224 -14.479 1104 HD11 LEU 33 HD11 LEU 33 10.661 7.642 -16.801 1105 HD12 LEU 33 HD12 LEU 33 8.966 7.334 -16.422 1106 HD13 LEU 33 HD13 LEU 33 10.152 6.033 -16.290 1107 HD21 LEU 33 HD21 LEU 33 10.307 9.227 -13.489 1108 HD22 LEU 33 HD22 LEU 33 9.039 9.242 -14.714 1109 HD23 LEU 33 HD23 LEU 33 10.718 9.506 -15.180 1110 H LEU 34 HN LEU 34 10.093 4.844 -11.295 1111 HA LEU 34 HA LEU 34 12.966 4.840 -11.647 1112 HB2 LEU 34 HB2 LEU 34 11.298 4.470 -9.158 1113 HB3 LEU 34 HB1 LEU 34 13.041 4.664 -9.195 1114 HG LEU 34 HG LEU 34 10.982 6.727 -9.976 1115 HD11 LEU 34 HD11 LEU 34 12.984 6.621 -7.728 1116 HD12 LEU 34 HD12 LEU 34 11.236 6.449 -7.578 1117 HD13 LEU 34 HD13 LEU 34 11.929 7.984 -8.101 1118 HD21 LEU 34 HD21 LEU 34 13.988 6.923 -10.045 1119 HD22 LEU 34 HD22 LEU 34 12.847 8.224 -10.389 1120 HD23 LEU 34 HD23 LEU 34 12.934 6.822 -11.455 1121 H ALA 35 HN ALA 35 10.432 2.533 -11.379 1122 HA ALA 35 HA ALA 35 12.079 0.314 -10.642 1123 HB1 ALA 35 HB1 ALA 35 9.665 0.261 -10.291 1124 HB2 ALA 35 HB2 ALA 35 10.177 -1.066 -11.336 1125 HB3 ALA 35 HB3 ALA 35 9.399 0.356 -12.032 1126 H GLN 36 HN GLN 36 11.288 1.982 -13.559 1127 HA GLN 36 HA GLN 36 12.187 0.044 -15.421 1128 HB2 GLN 36 HB2 GLN 36 12.050 3.057 -15.692 1129 HB3 GLN 36 HB1 GLN 36 12.238 1.917 -17.018 1130 HG2 GLN 36 HG2 GLN 36 10.042 0.997 -16.574 1131 HG3 GLN 36 HG1 GLN 36 9.857 2.061 -15.182 1132 HE21 GLN 36 HE21 GLN 36 8.016 3.037 -16.021 1133 HE22 GLN 36 HE22 GLN 36 8.084 4.133 -17.360 1134 H GLY 37 HN GLY 37 13.801 2.416 -13.444 1135 HA2 GLY 37 HA2 GLY 37 16.310 1.325 -13.595 1136 HA3 GLY 37 HA1 GLY 37 16.235 2.447 -14.946 1137 H GLU 38 HN GLU 38 18.103 2.931 -13.156 1138 HA GLU 38 HA GLU 38 17.261 4.614 -10.995 1139 HB2 GLU 38 HB2 GLU 38 19.414 3.199 -11.240 1140 HB3 GLU 38 HB1 GLU 38 20.017 4.543 -12.194 1141 HG2 GLU 38 HG2 GLU 38 19.971 6.004 -10.357 1142 HG3 GLU 38 HG1 GLU 38 18.968 4.902 -9.408 1143 H ARG 39 HN ARG 39 16.865 6.766 -11.054 1144 HA ARG 39 HA ARG 39 17.586 8.206 -13.508 1145 HB2 ARG 39 HB2 ARG 39 15.183 7.149 -13.370 1146 HB3 ARG 39 HB1 ARG 39 14.854 8.539 -12.347 1147 HG2 ARG 39 HG2 ARG 39 15.393 10.052 -14.108 1148 HG3 ARG 39 HG1 ARG 39 15.975 8.733 -15.126 1149 HD2 ARG 39 HD2 ARG 39 13.154 9.303 -14.254 1150 HD3 ARG 39 HD1 ARG 39 13.801 9.279 -15.894 1151 HE ARG 39 HE ARG 39 13.115 6.973 -14.243 1152 HH11 ARG 39 HH11 ARG 39 14.517 8.177 -17.219 1153 HH12 ARG 39 HH12 ARG 39 14.347 6.659 -18.049 1154 HH21 ARG 39 HH21 ARG 39 12.887 4.989 -15.340 1155 HH22 ARG 39 HH22 ARG 39 13.429 4.853 -16.995 1156 H ALA 40 HN ALA 40 18.122 10.290 -13.244 1157 HA ALA 40 HA ALA 40 18.451 11.301 -10.571 1158 HB1 ALA 40 HB1 ALA 40 19.468 13.249 -11.676 1159 HB2 ALA 40 HB2 ALA 40 18.974 12.604 -13.242 1160 HB3 ALA 40 HB3 ALA 40 20.149 11.731 -12.259 1161 H VAL 41 HN VAL 41 17.557 13.242 -9.743 1162 HA VAL 41 HA VAL 41 14.826 13.481 -9.841 1163 HB VAL 41 HB VAL 41 16.752 15.726 -9.208 1164 HG11 VAL 41 HG11 VAL 41 14.461 16.509 -9.520 1165 HG12 VAL 41 HG12 VAL 41 14.940 16.609 -7.825 1166 HG13 VAL 41 HG13 VAL 41 13.885 15.303 -8.370 1167 HG21 VAL 41 HG21 VAL 41 16.534 14.985 -6.887 1168 HG22 VAL 41 HG22 VAL 41 17.229 13.723 -7.906 1169 HG23 VAL 41 HG23 VAL 41 15.537 13.629 -7.414 1170 H GLU 42 HN GLU 42 17.162 15.455 -11.657 1171 HA GLU 42 HA GLU 42 15.347 17.200 -12.869 1172 HB2 GLU 42 HB2 GLU 42 18.025 16.174 -13.817 1173 HB3 GLU 42 HB1 GLU 42 17.142 17.471 -14.613 1174 HG2 GLU 42 HG2 GLU 42 17.315 18.867 -12.682 1175 HG3 GLU 42 HG1 GLU 42 17.988 17.547 -11.727 1176 H ALA 43 HN ALA 43 16.510 14.023 -13.905 1177 HA ALA 43 HA ALA 43 15.136 14.049 -16.400 1178 HB1 ALA 43 HB1 ALA 43 17.097 12.639 -16.009 1179 HB2 ALA 43 HB2 ALA 43 15.705 11.684 -16.519 1180 HB3 ALA 43 HB3 ALA 43 16.187 11.703 -14.822 1181 H ILE 44 HN ILE 44 14.438 12.733 -13.195 1182 HA ILE 44 HA ILE 44 12.033 11.414 -13.760 1183 HB ILE 44 HB ILE 44 12.780 12.885 -11.221 1184 HG12 ILE 44 HG12 ILE 44 13.104 9.958 -11.906 1185 HG13 ILE 44 HG11 ILE 44 14.410 11.138 -11.932 1186 HG21 ILE 44 HG21 ILE 44 10.392 12.412 -11.351 1187 HG22 ILE 44 HG22 ILE 44 11.169 11.410 -10.124 1188 HG23 ILE 44 HG23 ILE 44 10.738 10.715 -11.686 1189 HD11 ILE 44 HD11 ILE 44 14.449 9.829 -9.893 1190 HD12 ILE 44 HD12 ILE 44 12.801 10.336 -9.519 1191 HD13 ILE 44 HD13 ILE 44 14.105 11.524 -9.540 1192 H ALA 45 HN ALA 45 12.609 14.720 -12.624 1193 HA ALA 45 HA ALA 45 9.982 15.606 -12.496 1194 HB1 ALA 45 HB1 ALA 45 10.914 17.864 -12.622 1195 HB2 ALA 45 HB2 ALA 45 12.453 17.199 -13.172 1196 HB3 ALA 45 HB3 ALA 45 11.862 16.833 -11.550 1197 H THR 46 HN THR 46 12.266 15.849 -15.204 1198 HA THR 46 HA THR 46 10.578 17.230 -16.953 1199 HB THR 46 HB THR 46 12.759 15.284 -17.721 1200 HG1 THR 46 HG1 THR 46 13.672 16.783 -16.351 1201 HG21 THR 46 HG21 THR 46 11.369 15.984 -19.603 1202 HG22 THR 46 HG22 THR 46 12.971 16.713 -19.712 1203 HG23 THR 46 HG23 THR 46 11.601 17.674 -19.160 1204 H ALA 47 HN ALA 47 11.155 13.728 -16.625 1205 HA ALA 47 HA ALA 47 9.529 12.965 -18.800 1206 HB1 ALA 47 HB1 ALA 47 9.699 10.716 -17.920 1207 HB2 ALA 47 HB2 ALA 47 10.272 11.342 -16.374 1208 HB3 ALA 47 HB3 ALA 47 11.263 11.529 -17.822 1209 H THR 48 HN THR 48 8.814 13.553 -15.417 1210 HA THR 48 HA THR 48 6.146 12.448 -15.651 1211 HB THR 48 HB THR 48 5.896 13.274 -13.279 1212 HG1 THR 48 HG1 THR 48 8.710 13.656 -13.349 1213 HG21 THR 48 HG21 THR 48 7.364 11.548 -12.334 1214 HG22 THR 48 HG22 THR 48 8.229 11.449 -13.868 1215 HG23 THR 48 HG23 THR 48 6.535 10.969 -13.779 1216 H GLY 49 HN GLY 49 7.640 15.445 -16.216 1217 HA2 GLY 49 HA2 GLY 49 6.680 17.372 -17.078 1218 HA3 GLY 49 HA1 GLY 49 5.095 16.663 -16.814 1219 H MET 50 HN MET 50 7.271 16.681 -14.156 1220 HA MET 50 HA MET 50 5.775 18.928 -12.968 1221 HB2 MET 50 HB2 MET 50 6.935 16.476 -11.621 1222 HB3 MET 50 HB1 MET 50 6.227 17.840 -10.765 1223 HG2 MET 50 HG2 MET 50 4.084 17.413 -11.869 1224 HG3 MET 50 HG1 MET 50 4.795 16.036 -12.706 1225 HE1 MET 50 HE1 MET 50 5.444 13.510 -9.808 1226 HE2 MET 50 HE2 MET 50 6.581 14.627 -10.562 1227 HE3 MET 50 HE3 MET 50 5.418 13.746 -11.555 1228 H ASN 51 HN ASN 51 6.953 20.361 -11.591 1229 HA ASN 51 HA ASN 51 9.637 20.823 -12.476 1230 HB2 ASN 51 HB2 ASN 51 8.112 22.673 -11.848 1231 HB3 ASN 51 HB1 ASN 51 8.138 22.114 -10.180 1232 HD21 ASN 51 HD21 ASN 51 9.908 23.718 -12.697 1233 HD22 ASN 51 HD22 ASN 51 11.187 24.310 -11.690 1234 H LEU 52 HN LEU 52 11.511 20.980 -11.062 1235 HA LEU 52 HA LEU 52 12.088 18.640 -9.696 1236 HB2 LEU 52 HB2 LEU 52 13.368 21.362 -9.573 1237 HB3 LEU 52 HB1 LEU 52 14.000 19.996 -8.678 1238 HG LEU 52 HG LEU 52 14.253 18.785 -10.871 1239 HD11 LEU 52 HD11 LEU 52 12.690 20.105 -12.202 1240 HD12 LEU 52 HD12 LEU 52 14.304 20.108 -12.913 1241 HD13 LEU 52 HD13 LEU 52 13.729 21.519 -12.024 1242 HD21 LEU 52 HD21 LEU 52 15.779 21.350 -10.468 1243 HD22 LEU 52 HD22 LEU 52 16.292 20.004 -11.485 1244 HD23 LEU 52 HD23 LEU 52 16.142 19.784 -9.742 1245 H THR 53 HN THR 53 10.795 21.683 -8.451 1246 HA THR 53 HA THR 53 11.125 21.100 -5.708 1247 HB THR 53 HB THR 53 9.295 22.782 -5.360 1248 HG1 THR 53 HG1 THR 53 7.988 22.909 -7.035 1249 HG21 THR 53 HG21 THR 53 11.635 23.478 -5.512 1250 HG22 THR 53 HG22 THR 53 10.566 24.687 -6.225 1251 HG23 THR 53 HG23 THR 53 11.487 23.601 -7.265 1252 H THR 54 HN THR 54 8.406 20.599 -7.928 1253 HA THR 54 HA THR 54 6.694 19.374 -6.038 1254 HB THR 54 HB THR 54 6.687 18.927 -9.032 1255 HG1 THR 54 HG1 THR 54 6.145 21.186 -7.529 1256 HG21 THR 54 HG21 THR 54 5.199 17.452 -7.775 1257 HG22 THR 54 HG22 THR 54 4.267 18.627 -8.703 1258 HG23 THR 54 HG23 THR 54 4.483 18.844 -6.966 1259 H ALA 55 HN ALA 55 8.949 18.095 -8.459 1260 HA ALA 55 HA ALA 55 8.483 15.371 -8.074 1261 HB1 ALA 55 HB1 ALA 55 9.774 16.244 -9.945 1262 HB2 ALA 55 HB2 ALA 55 10.697 15.028 -9.064 1263 HB3 ALA 55 HB3 ALA 55 11.059 16.741 -8.845 1264 H SER 56 HN SER 56 10.973 17.439 -6.560 1265 HA SER 56 HA SER 56 12.178 15.476 -4.998 1266 HB2 SER 56 HB2 SER 56 13.124 17.734 -5.360 1267 HB3 SER 56 HB1 SER 56 11.871 18.415 -4.327 1268 HG SER 56 HG SER 56 12.715 17.218 -2.593 1269 H ALA 57 HN ALA 57 9.527 17.700 -4.115 1270 HA ALA 57 HA ALA 57 9.237 16.931 -1.455 1271 HB1 ALA 57 HB1 ALA 57 8.147 18.889 -2.441 1272 HB2 ALA 57 HB2 ALA 57 6.994 17.865 -1.584 1273 HB3 ALA 57 HB3 ALA 57 7.066 17.828 -3.344 1274 H ASN 58 HN ASN 58 7.757 15.561 -4.364 1275 HA ASN 58 HA ASN 58 6.184 13.668 -2.911 1276 HB2 ASN 58 HB2 ASN 58 6.855 13.972 -5.833 1277 HB3 ASN 58 HB1 ASN 58 5.912 12.614 -5.231 1278 HD21 ASN 58 HD21 ASN 58 5.942 16.023 -5.866 1279 HD22 ASN 58 HD22 ASN 58 4.252 16.284 -5.606 1280 H LEU 59 HN LEU 59 9.312 13.595 -4.537 1281 HA LEU 59 HA LEU 59 9.802 10.826 -4.283 1282 HB2 LEU 59 HB2 LEU 59 11.665 13.188 -4.449 1283 HB3 LEU 59 HB1 LEU 59 12.233 11.530 -4.424 1284 HG LEU 59 HG LEU 59 10.388 12.667 -6.529 1285 HD11 LEU 59 HD11 LEU 59 13.346 12.108 -6.664 1286 HD12 LEU 59 HD12 LEU 59 12.602 13.706 -6.624 1287 HD13 LEU 59 HD13 LEU 59 12.324 12.638 -8.000 1288 HD21 LEU 59 HD21 LEU 59 10.154 10.260 -6.181 1289 HD22 LEU 59 HD22 LEU 59 11.895 10.059 -6.392 1290 HD23 LEU 59 HD23 LEU 59 10.902 10.618 -7.738 1291 H GLN 60 HN GLN 60 10.523 13.571 -2.168 1292 HA GLN 60 HA GLN 60 11.937 12.158 -0.192 1293 HB2 GLN 60 HB2 GLN 60 10.305 14.694 -0.056 1294 HB3 GLN 60 HB1 GLN 60 11.258 14.089 1.292 1295 HG2 GLN 60 HG2 GLN 60 13.286 14.364 0.094 1296 HG3 GLN 60 HG1 GLN 60 12.427 14.679 -1.413 1297 HE21 GLN 60 HE21 GLN 60 13.368 15.966 1.673 1298 HE22 GLN 60 HE22 GLN 60 13.005 17.621 1.323 1299 H ALA 61 HN ALA 61 8.504 12.668 -0.710 1300 HA ALA 61 HA ALA 61 7.602 11.581 1.739 1301 HB1 ALA 61 HB1 ALA 61 5.445 11.329 0.622 1302 HB2 ALA 61 HB2 ALA 61 6.211 11.641 -0.936 1303 HB3 ALA 61 HB3 ALA 61 6.157 12.908 0.290 1304 H LEU 62 HN LEU 62 8.020 10.126 -1.476 1305 HA LEU 62 HA LEU 62 7.323 7.496 -0.789 1306 HB2 LEU 62 HB2 LEU 62 9.308 8.431 -2.866 1307 HB3 LEU 62 HB1 LEU 62 8.570 6.845 -2.803 1308 HG LEU 62 HG LEU 62 7.033 9.410 -3.214 1309 HD11 LEU 62 HD11 LEU 62 7.876 7.347 -5.246 1310 HD12 LEU 62 HD12 LEU 62 8.560 8.964 -5.082 1311 HD13 LEU 62 HD13 LEU 62 6.869 8.765 -5.546 1312 HD21 LEU 62 HD21 LEU 62 5.225 7.908 -3.897 1313 HD22 LEU 62 HD22 LEU 62 5.714 7.615 -2.228 1314 HD23 LEU 62 HD23 LEU 62 6.235 6.516 -3.506 1315 H LYS 63 HN LYS 63 10.342 9.260 -0.605 1316 HA LYS 63 HA LYS 63 11.999 7.083 0.110 1317 HB2 LYS 63 HB2 LYS 63 12.961 9.074 -0.814 1318 HB3 LYS 63 HB1 LYS 63 12.278 10.066 0.463 1319 HG2 LYS 63 HG2 LYS 63 13.769 9.156 2.075 1320 HG3 LYS 63 HG1 LYS 63 14.336 7.931 0.938 1321 HD2 LYS 63 HD2 LYS 63 15.451 9.531 -0.388 1322 HD3 LYS 63 HD1 LYS 63 14.612 10.874 0.393 1323 HE2 LYS 63 HE2 LYS 63 16.966 10.628 1.107 1324 HE3 LYS 63 HE1 LYS 63 15.813 10.515 2.432 1325 HZ1 LYS 63 HZ1 LYS 63 17.258 8.273 1.121 1326 HZ2 LYS 63 HZ2 LYS 63 15.996 8.055 2.223 1327 HZ3 LYS 63 HZ3 LYS 63 17.423 8.814 2.718 1328 H SER 64 HN SER 64 10.070 9.364 1.993 1329 HA SER 64 HA SER 64 11.097 8.572 4.524 1330 HB2 SER 64 HB2 SER 64 8.461 9.890 3.829 1331 HB3 SER 64 HB1 SER 64 9.136 9.750 5.454 1332 HG SER 64 HG SER 64 10.043 11.292 3.267 1333 H GLY 65 HN GLY 65 8.708 7.263 2.382 1334 HA2 GLY 65 HA2 GLY 65 7.589 5.492 4.384 1335 HA3 GLY 65 HA1 GLY 65 7.230 5.485 2.663 1336 H GLY 66 HN GLY 66 10.367 5.532 2.455 1337 HA2 GLY 66 HA2 GLY 66 12.092 3.967 2.491 1338 HA3 GLY 66 HA1 GLY 66 10.996 2.810 3.235 1339 H LEU 67 HN LEU 67 9.952 4.482 0.414 1340 HA LEU 67 HA LEU 67 9.840 1.975 -1.026 1341 HB2 LEU 67 HB2 LEU 67 8.642 4.676 -1.351 1342 HB3 LEU 67 HB1 LEU 67 8.817 3.690 -2.787 1343 HG LEU 67 HG LEU 67 7.404 1.965 -1.849 1344 HD11 LEU 67 HD11 LEU 67 6.317 2.234 0.326 1345 HD12 LEU 67 HD12 LEU 67 7.269 3.690 0.620 1346 HD13 LEU 67 HD13 LEU 67 8.071 2.123 0.485 1347 HD21 LEU 67 HD21 LEU 67 5.305 3.203 -1.686 1348 HD22 LEU 67 HD22 LEU 67 6.318 3.827 -2.990 1349 HD23 LEU 67 HD23 LEU 67 6.205 4.703 -1.464 1350 H VAL 68 HN VAL 68 11.271 5.192 -1.505 1351 HA VAL 68 HA VAL 68 13.153 3.939 -3.384 1352 HB VAL 68 HB VAL 68 13.231 6.017 -4.695 1353 HG11 VAL 68 HG11 VAL 68 11.059 5.787 -5.815 1354 HG12 VAL 68 HG12 VAL 68 10.468 4.835 -4.453 1355 HG13 VAL 68 HG13 VAL 68 11.788 4.223 -5.450 1356 HG21 VAL 68 HG21 VAL 68 10.918 6.903 -2.973 1357 HG22 VAL 68 HG22 VAL 68 11.527 7.747 -4.398 1358 HG23 VAL 68 HG23 VAL 68 12.541 7.591 -2.964 1359 H GLU 69 HN GLU 69 15.233 4.935 -3.502 1360 HA GLU 69 HA GLU 69 15.871 6.540 -1.120 1361 HB2 GLU 69 HB2 GLU 69 17.077 4.072 -2.110 1362 HB3 GLU 69 HB1 GLU 69 18.254 5.346 -1.821 1363 HG2 GLU 69 HG2 GLU 69 16.306 4.172 0.142 1364 HG3 GLU 69 HG1 GLU 69 18.067 4.057 0.163 1365 H ALA 70 HN ALA 70 17.990 7.720 -1.373 1366 HA ALA 70 HA ALA 70 18.058 8.926 -4.064 1367 HB1 ALA 70 HB1 ALA 70 18.466 10.339 -1.430 1368 HB2 ALA 70 HB2 ALA 70 17.004 10.412 -2.415 1369 HB3 ALA 70 HB3 ALA 70 18.517 11.076 -3.033 1370 H ARG 71 HN ARG 71 19.867 8.334 -5.011 1371 HA ARG 71 HA ARG 71 22.333 8.107 -3.449 1372 HB2 ARG 71 HB2 ARG 71 21.963 6.221 -4.868 1373 HB3 ARG 71 HB1 ARG 71 21.580 7.246 -6.244 1374 HG2 ARG 71 HG2 ARG 71 23.865 7.943 -6.437 1375 HG3 ARG 71 HG1 ARG 71 24.289 7.109 -4.941 1376 HD2 ARG 71 HD2 ARG 71 23.167 5.692 -7.348 1377 HD3 ARG 71 HD1 ARG 71 24.897 5.923 -7.090 1378 HE ARG 71 HE ARG 71 24.348 4.756 -4.832 1379 HH11 ARG 71 HH11 ARG 71 22.837 4.039 -7.920 1380 HH12 ARG 71 HH12 ARG 71 22.651 2.343 -7.568 1381 HH21 ARG 71 HH21 ARG 71 24.079 2.539 -4.366 1382 HH22 ARG 71 HH22 ARG 71 23.374 1.482 -5.559 1383 H ARG 72 HN ARG 72 23.348 9.957 -3.188 1384 HA ARG 72 HA ARG 72 23.150 12.045 -5.224 1385 HB2 ARG 72 HB2 ARG 72 24.574 12.211 -2.567 1386 HB3 ARG 72 HB1 ARG 72 24.003 13.540 -3.570 1387 HG2 ARG 72 HG2 ARG 72 21.708 12.936 -3.120 1388 HG3 ARG 72 HG1 ARG 72 22.236 11.531 -2.194 1389 HD2 ARG 72 HD2 ARG 72 23.529 13.253 -0.768 1390 HD3 ARG 72 HD1 ARG 72 22.453 14.438 -1.509 1391 HE ARG 72 HE ARG 72 21.243 12.098 -0.236 1392 HH11 ARG 72 HH11 ARG 72 21.917 15.541 -0.146 1393 HH12 ARG 72 HH12 ARG 72 20.827 15.834 1.175 1394 HH21 ARG 72 HH21 ARG 72 19.809 12.484 1.450 1395 HH22 ARG 72 HH22 ARG 72 19.612 14.088 2.093 1396 H GLU 73 HN GLU 73 24.508 11.701 -6.852 1397 HA GLU 73 HA GLU 73 27.303 11.038 -6.191 1398 HB2 GLU 73 HB2 GLU 73 25.623 9.463 -7.633 1399 HB3 GLU 73 HB1 GLU 73 26.318 10.446 -8.914 1400 HG2 GLU 73 HG2 GLU 73 27.890 8.825 -6.923 1401 HG3 GLU 73 HG1 GLU 73 27.523 8.337 -8.576 1402 H GLY 74 HN GLY 74 28.436 12.852 -6.366 1403 HA2 GLY 74 HA2 GLY 74 29.329 14.764 -7.289 1404 HA3 GLY 74 HA1 GLY 74 28.462 14.397 -8.777 1405 H THR 75 HN THR 75 26.950 15.806 -9.326 1406 HA THR 75 HA THR 75 25.752 17.469 -7.212 1407 HB THR 75 HB THR 75 25.521 18.029 -10.163 1408 HG1 THR 75 HG1 THR 75 27.453 19.139 -10.094 1409 HG21 THR 75 HG21 THR 75 25.562 19.811 -7.725 1410 HG22 THR 75 HG22 THR 75 24.129 19.340 -8.638 1411 HG23 THR 75 HG23 THR 75 25.361 20.352 -9.391 1412 H ARG 76 HN ARG 76 25.131 14.758 -9.003 1413 HA ARG 76 HA ARG 76 22.331 15.407 -9.547 1414 HB2 ARG 76 HB2 ARG 76 23.973 13.026 -10.407 1415 HB3 ARG 76 HB1 ARG 76 22.311 13.346 -10.880 1416 HG2 ARG 76 HG2 ARG 76 23.108 15.470 -11.931 1417 HG3 ARG 76 HG1 ARG 76 24.759 14.929 -11.614 1418 HD2 ARG 76 HD2 ARG 76 24.296 12.878 -12.896 1419 HD3 ARG 76 HD1 ARG 76 22.686 13.495 -13.260 1420 HE ARG 76 HE ARG 76 24.940 15.166 -14.041 1421 HH11 ARG 76 HH11 ARG 76 22.502 12.848 -14.968 1422 HH12 ARG 76 HH12 ARG 76 22.622 13.183 -16.665 1423 HH21 ARG 76 HH21 ARG 76 25.138 15.606 -16.287 1424 HH22 ARG 76 HH22 ARG 76 24.144 14.734 -17.421 1425 H GLN 77 HN GLN 77 20.685 14.494 -8.536 1426 HA GLN 77 HA GLN 77 21.250 12.468 -6.486 1427 HB2 GLN 77 HB2 GLN 77 18.805 14.215 -6.864 1428 HB3 GLN 77 HB1 GLN 77 19.028 13.043 -5.574 1429 HG2 GLN 77 HG2 GLN 77 20.893 14.323 -4.697 1430 HG3 GLN 77 HG1 GLN 77 20.741 15.477 -6.023 1431 HE21 GLN 77 HE21 GLN 77 17.988 14.034 -4.431 1432 HE22 GLN 77 HE22 GLN 77 17.440 15.471 -3.651 1433 H TYR 78 HN TYR 78 21.025 10.480 -7.251 1434 HA TYR 78 HA TYR 78 19.041 9.924 -9.323 1435 HB2 TYR 78 HB2 TYR 78 21.169 8.159 -8.088 1436 HB3 TYR 78 HB1 TYR 78 20.101 7.681 -9.402 1437 HD1 TYR 78 HD1 TYR 78 20.363 8.712 -11.642 1438 HD2 TYR 78 HD2 TYR 78 23.093 9.512 -8.482 1439 HE1 TYR 78 HE1 TYR 78 21.995 9.562 -13.272 1440 HE2 TYR 78 HE2 TYR 78 24.731 10.369 -10.103 1441 HH TYR 78 HH TYR 78 25.247 10.121 -12.509 1442 H TYR 79 HN TYR 79 17.079 9.203 -8.786 1443 HA TYR 79 HA TYR 79 16.761 7.923 -6.167 1444 HB2 TYR 79 HB2 TYR 79 14.887 9.460 -7.917 1445 HB3 TYR 79 HB1 TYR 79 14.233 8.252 -6.816 1446 HD1 TYR 79 HD1 TYR 79 16.125 11.421 -7.006 1447 HD2 TYR 79 HD2 TYR 79 14.125 8.651 -4.468 1448 HE1 TYR 79 HE1 TYR 79 16.220 13.046 -5.164 1449 HE2 TYR 79 HE2 TYR 79 14.216 10.273 -2.617 1450 HH TYR 79 HH TYR 79 15.464 12.210 -1.930 1451 H ARG 80 HN ARG 80 16.179 5.887 -5.980 1452 HA ARG 80 HA ARG 80 15.039 4.416 -8.203 1453 HB2 ARG 80 HB2 ARG 80 17.710 4.444 -8.173 1454 HB3 ARG 80 HB1 ARG 80 17.475 3.204 -6.953 1455 HG2 ARG 80 HG2 ARG 80 16.086 2.966 -9.583 1456 HG3 ARG 80 HG1 ARG 80 17.794 2.556 -9.454 1457 HD2 ARG 80 HD2 ARG 80 15.556 1.358 -7.826 1458 HD3 ARG 80 HD1 ARG 80 16.361 0.591 -9.195 1459 HE ARG 80 HE ARG 80 17.836 1.335 -6.749 1460 HH11 ARG 80 HH11 ARG 80 16.920 -1.035 -9.174 1461 HH12 ARG 80 HH12 ARG 80 17.977 -2.268 -8.539 1462 HH21 ARG 80 HH21 ARG 80 19.206 -0.273 -5.930 1463 HH22 ARG 80 HH22 ARG 80 19.293 -1.823 -6.705 1464 H ILE 81 HN ILE 81 14.212 2.333 -7.476 1465 HA ILE 81 HA ILE 81 12.854 2.397 -5.079 1466 HB ILE 81 HB ILE 81 13.736 -0.142 -6.465 1467 HG12 ILE 81 HG12 ILE 81 12.744 1.411 -8.093 1468 HG13 ILE 81 HG11 ILE 81 11.679 0.042 -7.793 1469 HG21 ILE 81 HG21 ILE 81 11.336 0.497 -4.758 1470 HG22 ILE 81 HG22 ILE 81 12.720 -0.491 -4.287 1471 HG23 ILE 81 HG23 ILE 81 11.640 -1.041 -5.568 1472 HD11 ILE 81 HD11 ILE 81 10.313 1.439 -6.320 1473 HD12 ILE 81 HD12 ILE 81 10.430 2.116 -7.943 1474 HD13 ILE 81 HD13 ILE 81 11.383 2.805 -6.630 1475 H ALA 82 HN ALA 82 13.331 1.976 -3.006 1476 HA ALA 82 HA ALA 82 16.037 1.910 -2.203 1477 HB1 ALA 82 HB1 ALA 82 15.189 1.851 0.064 1478 HB2 ALA 82 HB2 ALA 82 13.591 1.382 -0.518 1479 HB3 ALA 82 HB3 ALA 82 14.237 2.978 -0.903 1480 H GLY 83 HN GLY 83 13.556 -0.584 -2.364 1481 HA2 GLY 83 HA2 GLY 83 15.659 -2.611 -2.124 1482 HA3 GLY 83 HA1 GLY 83 14.285 -2.709 -1.029 1483 H GLU 84 HN GLU 84 15.169 -4.584 -3.143 1484 HA GLU 84 HA GLU 84 13.543 -4.297 -5.433 1485 HB2 GLU 84 HB2 GLU 84 15.507 -5.800 -5.325 1486 HB3 GLU 84 HB1 GLU 84 14.619 -6.853 -4.231 1487 HG2 GLU 84 HG2 GLU 84 12.998 -7.339 -5.947 1488 HG3 GLU 84 HG1 GLU 84 13.771 -6.194 -7.042 1489 H ASP 85 HN ASP 85 12.978 -5.725 -2.289 1490 HA ASP 85 HA ASP 85 10.576 -7.065 -2.854 1491 HB2 ASP 85 HB2 ASP 85 11.497 -5.788 -0.272 1492 HB3 ASP 85 HB1 ASP 85 10.155 -6.921 -0.417 1493 H VAL 86 HN VAL 86 11.269 -3.703 -2.146 1494 HA VAL 86 HA VAL 86 8.594 -2.816 -1.832 1495 HB VAL 86 HB VAL 86 10.969 -1.273 -2.904 1496 HG11 VAL 86 HG11 VAL 86 8.790 -0.245 -3.411 1497 HG12 VAL 86 HG12 VAL 86 9.745 0.717 -2.285 1498 HG13 VAL 86 HG13 VAL 86 8.400 -0.259 -1.690 1499 HG21 VAL 86 HG21 VAL 86 9.909 -1.511 -0.089 1500 HG22 VAL 86 HG22 VAL 86 11.204 -0.435 -0.612 1501 HG23 VAL 86 HG23 VAL 86 11.423 -2.182 -0.694 1502 H ALA 87 HN ALA 87 10.762 -3.082 -4.622 1503 HA ALA 87 HA ALA 87 8.962 -2.102 -6.563 1504 HB1 ALA 87 HB1 ALA 87 11.224 -4.074 -6.896 1505 HB2 ALA 87 HB2 ALA 87 11.353 -2.317 -6.998 1506 HB3 ALA 87 HB3 ALA 87 10.417 -3.205 -8.200 1507 H ARG 88 HN ARG 88 9.548 -5.329 -5.258 1508 HA ARG 88 HA ARG 88 7.826 -6.784 -6.935 1509 HB2 ARG 88 HB2 ARG 88 8.478 -7.295 -4.022 1510 HB3 ARG 88 HB1 ARG 88 7.767 -8.461 -5.128 1511 HG2 ARG 88 HG2 ARG 88 9.773 -8.527 -6.439 1512 HG3 ARG 88 HG1 ARG 88 10.480 -7.214 -5.495 1513 HD2 ARG 88 HD2 ARG 88 10.335 -8.670 -3.483 1514 HD3 ARG 88 HD1 ARG 88 9.789 -9.983 -4.522 1515 HE ARG 88 HE ARG 88 12.208 -8.988 -5.535 1516 HH11 ARG 88 HH11 ARG 88 10.999 -10.694 -2.737 1517 HH12 ARG 88 HH12 ARG 88 12.461 -11.586 -2.484 1518 HH21 ARG 88 HH21 ARG 88 14.160 -10.126 -5.188 1519 HH22 ARG 88 HH22 ARG 88 14.260 -11.258 -3.867 1520 H LEU 89 HN LEU 89 7.254 -5.007 -3.946 1521 HA LEU 89 HA LEU 89 4.559 -5.725 -3.582 1522 HB2 LEU 89 HB2 LEU 89 5.935 -4.667 -1.842 1523 HB3 LEU 89 HB1 LEU 89 5.989 -3.188 -2.781 1524 HG LEU 89 HG LEU 89 3.507 -3.021 -2.547 1525 HD11 LEU 89 HD11 LEU 89 2.405 -4.351 -0.834 1526 HD12 LEU 89 HD12 LEU 89 3.889 -5.268 -0.574 1527 HD13 LEU 89 HD13 LEU 89 3.043 -5.379 -2.118 1528 HD21 LEU 89 HD21 LEU 89 3.565 -2.251 -0.235 1529 HD22 LEU 89 HD22 LEU 89 5.007 -1.747 -1.118 1530 HD23 LEU 89 HD23 LEU 89 5.092 -3.096 0.015 1531 H PHE 90 HN PHE 90 6.031 -2.927 -5.220 1532 HA PHE 90 HA PHE 90 3.599 -1.739 -6.021 1533 HB2 PHE 90 HB2 PHE 90 5.714 -0.496 -6.009 1534 HB3 PHE 90 HB1 PHE 90 6.339 -1.523 -7.294 1535 HD1 PHE 90 HD2 PHE 90 3.657 0.927 -6.511 1536 HD2 PHE 90 HD1 PHE 90 5.967 -0.987 -9.530 1537 HE1 PHE 90 HE2 PHE 90 2.718 2.455 -8.192 1538 HE2 PHE 90 HE1 PHE 90 5.032 0.538 -11.217 1539 HZ PHE 90 HZ PHE 90 3.405 2.260 -10.548 1540 H ALA 91 HN ALA 91 5.707 -4.113 -7.569 1541 HA ALA 91 HA ALA 91 4.286 -4.253 -10.015 1542 HB1 ALA 91 HB1 ALA 91 5.993 -6.349 -8.671 1543 HB2 ALA 91 HB2 ALA 91 6.564 -5.102 -9.780 1544 HB3 ALA 91 HB3 ALA 91 5.479 -6.366 -10.357 1545 H LEU 92 HN LEU 92 4.024 -5.979 -6.952 1546 HA LEU 92 HA LEU 92 2.095 -7.860 -7.745 1547 HB2 LEU 92 HB2 LEU 92 3.409 -8.016 -5.665 1548 HB3 LEU 92 HB1 LEU 92 2.538 -6.638 -5.021 1549 HG LEU 92 HG LEU 92 0.447 -7.943 -5.072 1550 HD11 LEU 92 HD11 LEU 92 0.523 -10.350 -5.470 1551 HD12 LEU 92 HD12 LEU 92 2.219 -10.223 -5.934 1552 HD13 LEU 92 HD13 LEU 92 0.976 -9.443 -6.913 1553 HD21 LEU 92 HD21 LEU 92 1.792 -7.885 -3.046 1554 HD22 LEU 92 HD22 LEU 92 2.719 -9.276 -3.606 1555 HD23 LEU 92 HD23 LEU 92 1.004 -9.452 -3.229 1556 H VAL 93 HN VAL 93 1.689 -4.729 -6.060 1557 HA VAL 93 HA VAL 93 -1.136 -4.826 -6.081 1558 HB VAL 93 HB VAL 93 0.184 -3.373 -4.562 1559 HG11 VAL 93 HG11 VAL 93 0.568 -1.636 -6.993 1560 HG12 VAL 93 HG12 VAL 93 1.829 -2.522 -6.136 1561 HG13 VAL 93 HG13 VAL 93 0.980 -1.201 -5.334 1562 HG21 VAL 93 HG21 VAL 93 -1.351 -1.469 -4.608 1563 HG22 VAL 93 HG22 VAL 93 -2.199 -2.996 -4.861 1564 HG23 VAL 93 HG23 VAL 93 -1.872 -1.930 -6.228 1565 H GLN 94 HN GLN 94 1.196 -3.789 -8.447 1566 HA GLN 94 HA GLN 94 -0.477 -2.383 -10.211 1567 HB2 GLN 94 HB2 GLN 94 1.972 -2.469 -10.433 1568 HB3 GLN 94 HB1 GLN 94 1.884 -4.180 -10.821 1569 HG2 GLN 94 HG2 GLN 94 0.569 -3.595 -12.838 1570 HG3 GLN 94 HG1 GLN 94 0.834 -1.892 -12.465 1571 HE21 GLN 94 HE21 GLN 94 3.542 -2.412 -11.449 1572 HE22 GLN 94 HE22 GLN 94 4.529 -2.682 -12.846 1573 H VAL 95 HN VAL 95 0.325 -5.837 -10.002 1574 HA VAL 95 HA VAL 95 -1.414 -6.657 -12.093 1575 HB VAL 95 HB VAL 95 -0.354 -8.289 -9.771 1576 HG11 VAL 95 HG11 VAL 95 -0.724 -10.219 -11.247 1577 HG12 VAL 95 HG12 VAL 95 -1.462 -9.153 -12.442 1578 HG13 VAL 95 HG13 VAL 95 -2.228 -9.380 -10.870 1579 HG21 VAL 95 HG21 VAL 95 1.402 -9.002 -11.324 1580 HG22 VAL 95 HG22 VAL 95 1.457 -7.264 -11.040 1581 HG23 VAL 95 HG23 VAL 95 0.776 -7.892 -12.541 1582 H VAL 96 HN VAL 96 -1.727 -6.473 -8.573 1583 HA VAL 96 HA VAL 96 -4.277 -7.636 -8.341 1584 HB VAL 96 HB VAL 96 -2.966 -5.562 -6.563 1585 HG11 VAL 96 HG11 VAL 96 -5.265 -7.416 -5.936 1586 HG12 VAL 96 HG12 VAL 96 -5.385 -5.671 -6.170 1587 HG13 VAL 96 HG13 VAL 96 -4.473 -6.316 -4.805 1588 HG21 VAL 96 HG21 VAL 96 -2.337 -7.482 -5.176 1589 HG22 VAL 96 HG22 VAL 96 -1.643 -7.588 -6.795 1590 HG23 VAL 96 HG23 VAL 96 -3.045 -8.569 -6.371 1591 H ALA 97 HN ALA 97 -3.335 -4.584 -9.596 1592 HA ALA 97 HA ALA 97 -5.992 -3.465 -9.341 1593 HB1 ALA 97 HB1 ALA 97 -4.021 -1.997 -9.314 1594 HB2 ALA 97 HB2 ALA 97 -5.144 -1.588 -10.611 1595 HB3 ALA 97 HB3 ALA 97 -3.661 -2.472 -10.974 1596 H ASP 98 HN ASP 98 -3.929 -4.580 -12.028 1597 HA ASP 98 HA ASP 98 -5.885 -4.013 -13.990 1598 HB2 ASP 98 HB2 ASP 98 -3.479 -4.061 -14.482 1599 HB3 ASP 98 HB1 ASP 98 -3.462 -5.800 -14.211 1600 H GLU 99 HN GLU 99 -4.981 -7.095 -12.410 1601 HA GLU 99 HA GLU 99 -6.823 -8.463 -14.212 1602 HB2 GLU 99 HB2 GLU 99 -5.873 -10.534 -13.425 1603 HB3 GLU 99 HB1 GLU 99 -4.585 -9.425 -13.855 1604 HG2 GLU 99 HG2 GLU 99 -3.740 -10.221 -11.913 1605 HG3 GLU 99 HG1 GLU 99 -4.685 -8.883 -11.263 1606 H HIS 100 HN HIS 100 -6.921 -7.106 -11.129 1607 HA HIS 100 HA HIS 100 -8.815 -9.023 -10.043 1608 HB2 HIS 100 HB2 HIS 100 -7.014 -7.728 -8.725 1609 HB3 HIS 100 HB1 HIS 100 -8.119 -6.363 -8.821 1610 HD1 HIS 100 HD1 HIS 100 -9.666 -6.161 -6.906 1611 HD2 HIS 100 HD2 HIS 100 -8.341 -10.069 -7.438 1612 HE1 HIS 100 HE1 HIS 100 -10.595 -7.465 -4.964 1613 HE2 HIS 100 HE2 HIS 100 -9.583 -9.764 -5.189 1614 H LEU 101 HN LEU 101 -8.847 -6.078 -11.811 1615 HA LEU 101 HA LEU 101 -11.584 -5.403 -11.179 1616 HB2 LEU 101 HB2 LEU 101 -9.862 -4.430 -13.463 1617 HB3 LEU 101 HB1 LEU 101 -11.374 -3.725 -12.936 1618 HG LEU 101 HG LEU 101 -8.789 -3.751 -11.382 1619 HD11 LEU 101 HD11 LEU 101 -10.297 -1.518 -12.734 1620 HD12 LEU 101 HD12 LEU 101 -8.757 -2.206 -13.252 1621 HD13 LEU 101 HD13 LEU 101 -8.862 -1.325 -11.728 1622 HD21 LEU 101 HD21 LEU 101 -9.946 -2.331 -9.779 1623 HD22 LEU 101 HD22 LEU 101 -10.705 -3.920 -9.892 1624 HD23 LEU 101 HD23 LEU 101 -11.451 -2.527 -10.679 1625 H GLU 102 HN GLU 102 -9.906 -7.445 -13.350 1626 HA GLU 102 HA GLU 102 -11.822 -7.449 -15.466 1627 HB2 GLU 102 HB2 GLU 102 -9.396 -7.936 -15.755 1628 HB3 GLU 102 HB1 GLU 102 -9.625 -9.437 -14.872 1629 HG2 GLU 102 HG2 GLU 102 -11.072 -10.285 -16.593 1630 HG3 GLU 102 HG1 GLU 102 -11.016 -8.744 -17.447 1631 H HIS 103 HN HIS 103 -13.687 -8.483 -15.522 1632 HA HIS 103 HA HIS 103 -14.202 -10.591 -13.538 1633 HB2 HIS 103 HB2 HIS 103 -16.010 -8.796 -15.141 1634 HB3 HIS 103 HB1 HIS 103 -16.626 -10.261 -14.387 1635 HD1 HIS 103 HD1 HIS 103 -16.818 -10.282 -11.802 1636 HD2 HIS 103 HD2 HIS 103 -15.452 -6.690 -13.401 1637 HE1 HIS 103 HE1 HIS 103 -17.005 -8.597 -9.946 1638 HE2 HIS 103 HE2 HIS 103 -16.402 -6.392 -11.008 1639 H HIS 104 HN HIS 104 -13.769 -12.571 -14.262 1640 HA HIS 104 HA HIS 104 -14.049 -13.217 -17.084 1641 HB2 HIS 104 HB2 HIS 104 -13.314 -15.009 -14.752 1642 HB3 HIS 104 HB1 HIS 104 -13.177 -15.421 -16.458 1643 HD1 HIS 104 HD1 HIS 104 -11.073 -14.604 -13.826 1644 HD2 HIS 104 HD2 HIS 104 -11.432 -13.156 -17.708 1645 HE1 HIS 104 HE1 HIS 104 -8.880 -13.476 -14.339 1646 HE2 HIS 104 HE2 HIS 104 -9.222 -12.406 -16.600 1647 H HIS 105 HN HIS 105 -15.459 -14.153 -13.992 1648 HA HIS 105 HA HIS 105 -17.505 -14.878 -13.366 1649 HB2 HIS 105 HB2 HIS 105 -18.219 -13.058 -15.016 1650 HB3 HIS 105 HB1 HIS 105 -18.516 -14.367 -16.154 1651 HD1 HIS 105 HD1 HIS 105 -20.415 -16.152 -15.379 1652 HD2 HIS 105 HD2 HIS 105 -20.213 -12.591 -13.239 1653 HE1 HIS 105 HE1 HIS 105 -22.610 -15.953 -14.184 1654 HE2 HIS 105 HE2 HIS 105 -22.553 -13.672 -13.119 1655 H HIS 106 HN HIS 106 -17.279 -15.887 -16.771 1656 HA HIS 106 HA HIS 106 -18.467 -18.427 -16.250 1657 HB2 HIS 106 HB2 HIS 106 -16.911 -17.494 -18.675 1658 HB3 HIS 106 HB1 HIS 106 -17.908 -18.940 -18.592 1659 HD1 HIS 106 HD1 HIS 106 -20.448 -18.647 -18.804 1660 HD2 HIS 106 HD2 HIS 106 -18.335 -15.061 -18.833 1661 HE1 HIS 106 HE1 HIS 106 -22.098 -16.885 -19.527 1662 HE2 HIS 106 HE2 HIS 106 -20.792 -14.725 -19.579 1663 H HIS 107 HN HIS 107 -15.184 -17.249 -16.659 1664 HA HIS 107 HA HIS 107 -14.036 -19.882 -16.551 1665 HB2 HIS 107 HB2 HIS 107 -12.936 -18.056 -17.809 1666 HB3 HIS 107 HB1 HIS 107 -12.686 -17.182 -16.301 1667 HD1 HIS 107 HD1 HIS 107 -11.392 -20.030 -18.312 1668 HD2 HIS 107 HD2 HIS 107 -10.651 -18.231 -14.641 1669 HE1 HIS 107 HE1 HIS 107 -9.202 -20.981 -17.522 1670 HE2 HIS 107 HE2 HIS 107 -8.692 -19.745 -15.385 1671 H HIS 108 HN HIS 108 -14.215 -20.955 -14.717 1672 HA HIS 108 HA HIS 108 -13.638 -19.556 -12.197 1673 HB2 HIS 108 HB2 HIS 108 -15.069 -22.164 -12.738 1674 HB3 HIS 108 HB1 HIS 108 -14.612 -21.629 -11.125 1675 HD1 HIS 108 HD1 HIS 108 -15.922 -19.616 -10.122 1676 HD2 HIS 108 HD2 HIS 108 -17.281 -20.904 -13.839 1677 HE1 HIS 108 HE1 HIS 108 -18.173 -18.531 -10.441 1678 HE2 HIS 108 HE2 HIS 108 -18.895 -19.190 -12.765 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 -11.654 2.274 -29.568 2 H2 MET 1 HT2 MET 1 -11.997 1.365 -30.958 3 H3 MET 1 HT3 MET 1 -12.838 2.806 -30.662 4 HA MET 1 HA MET 1 -11.211 3.187 -32.351 5 HB2 MET 1 HB2 MET 1 -10.458 4.364 -29.668 6 HB3 MET 1 HB1 MET 1 -9.787 4.919 -31.193 7 HG2 MET 1 HG2 MET 1 -11.516 6.413 -30.561 8 HG3 MET 1 HG1 MET 1 -12.099 5.471 -31.932 9 HE1 MET 1 HE1 MET 1 -14.038 7.186 -30.106 10 HE2 MET 1 HE2 MET 1 -15.374 6.057 -29.893 11 HE3 MET 1 HE3 MET 1 -14.587 6.202 -31.464 12 H ALA 2 HN ALA 2 -9.060 3.073 -33.100 13 HA ALA 2 HA ALA 2 -7.630 0.781 -32.102 14 HB1 ALA 2 HB1 ALA 2 -6.153 1.102 -33.997 15 HB2 ALA 2 HB2 ALA 2 -6.876 2.676 -34.323 16 HB3 ALA 2 HB3 ALA 2 -7.836 1.210 -34.513 17 H GLY 3 HN GLY 3 -7.120 1.581 -30.011 18 HA2 GLY 3 HA2 GLY 3 -4.543 2.272 -29.544 19 HA3 GLY 3 HA1 GLY 3 -5.339 3.830 -29.730 20 H GLN 4 HN GLN 4 -4.149 2.137 -27.412 21 HA GLN 4 HA GLN 4 -6.352 1.599 -25.680 22 HB2 GLN 4 HB2 GLN 4 -3.424 1.958 -25.008 23 HB3 GLN 4 HB1 GLN 4 -4.644 1.239 -23.962 24 HG2 GLN 4 HG2 GLN 4 -4.967 -0.567 -25.558 25 HG3 GLN 4 HG1 GLN 4 -3.769 0.157 -26.630 26 HE21 GLN 4 HE21 GLN 4 -4.308 -1.570 -23.678 27 HE22 GLN 4 HE22 GLN 4 -2.655 -2.040 -23.420 28 H SER 5 HN SER 5 -7.624 3.245 -25.167 29 HA SER 5 HA SER 5 -6.538 5.898 -24.740 30 HB2 SER 5 HB2 SER 5 -9.414 4.967 -24.623 31 HB3 SER 5 HB1 SER 5 -8.845 6.629 -24.778 32 HG SER 5 HG SER 5 -7.998 4.762 -26.684 33 H ASP 6 HN ASP 6 -5.929 6.571 -22.843 34 HA ASP 6 HA ASP 6 -5.586 6.759 -20.616 35 HB2 ASP 6 HB2 ASP 6 -8.592 6.555 -20.729 36 HB3 ASP 6 HB1 ASP 6 -7.718 6.931 -19.248 37 H ARG 7 HN ARG 7 -4.500 4.633 -20.766 38 HA ARG 7 HA ARG 7 -5.959 2.416 -19.575 39 HB2 ARG 7 HB2 ARG 7 -4.401 2.119 -21.520 40 HB3 ARG 7 HB1 ARG 7 -3.069 2.520 -20.445 41 HG2 ARG 7 HG2 ARG 7 -3.648 0.579 -19.043 42 HG3 ARG 7 HG1 ARG 7 -4.931 0.167 -20.183 43 HD2 ARG 7 HD2 ARG 7 -3.225 -0.008 -21.969 44 HD3 ARG 7 HD1 ARG 7 -1.975 0.289 -20.762 45 HE ARG 7 HE ARG 7 -3.774 -1.988 -20.367 46 HH11 ARG 7 HH11 ARG 7 -0.613 -0.764 -21.204 47 HH12 ARG 7 HH12 ARG 7 0.183 -2.295 -21.030 48 HH21 ARG 7 HH21 ARG 7 -2.755 -4.026 -20.142 49 HH22 ARG 7 HH22 ARG 7 -1.041 -4.152 -20.419 50 H LYS 8 HN LYS 8 -2.842 4.060 -18.895 51 HA LYS 8 HA LYS 8 -2.429 2.740 -16.448 52 HB2 LYS 8 HB2 LYS 8 -1.331 5.435 -17.270 53 HB3 LYS 8 HB1 LYS 8 -0.697 4.402 -15.998 54 HG2 LYS 8 HG2 LYS 8 -0.320 2.664 -17.816 55 HG3 LYS 8 HG1 LYS 8 -0.619 3.973 -18.964 56 HD2 LYS 8 HD2 LYS 8 1.563 3.811 -16.887 57 HD3 LYS 8 HD1 LYS 8 1.745 3.801 -18.641 58 HE2 LYS 8 HE2 LYS 8 0.854 6.102 -18.716 59 HE3 LYS 8 HE1 LYS 8 0.743 6.099 -16.956 60 HZ1 LYS 8 HZ1 LYS 8 2.751 7.206 -17.693 61 HZ2 LYS 8 HZ2 LYS 8 3.238 5.824 -18.551 62 HZ3 LYS 8 HZ3 LYS 8 3.154 5.785 -16.859 63 H ALA 9 HN ALA 9 -4.207 5.614 -17.256 64 HA ALA 9 HA ALA 9 -4.457 6.825 -14.768 65 HB1 ALA 9 HB1 ALA 9 -5.205 7.850 -16.860 66 HB2 ALA 9 HB2 ALA 9 -6.476 7.864 -15.639 67 HB3 ALA 9 HB3 ALA 9 -6.530 6.689 -16.953 68 H ALA 10 HN ALA 10 -6.025 3.974 -16.040 69 HA ALA 10 HA ALA 10 -7.911 3.843 -13.834 70 HB1 ALA 10 HB1 ALA 10 -7.377 1.855 -16.039 71 HB2 ALA 10 HB2 ALA 10 -8.601 3.124 -16.078 72 HB3 ALA 10 HB3 ALA 10 -8.724 1.816 -14.900 73 H LEU 11 HN LEU 11 -4.835 2.512 -14.767 74 HA LEU 11 HA LEU 11 -4.850 0.290 -12.987 75 HB2 LEU 11 HB2 LEU 11 -2.756 1.686 -14.599 76 HB3 LEU 11 HB1 LEU 11 -2.254 0.573 -13.343 77 HG LEU 11 HG LEU 11 -2.264 -0.578 -15.453 78 HD11 LEU 11 HD11 LEU 11 -3.794 -2.416 -14.954 79 HD12 LEU 11 HD12 LEU 11 -4.625 -1.399 -13.775 80 HD13 LEU 11 HD13 LEU 11 -2.944 -1.860 -13.511 81 HD21 LEU 11 HD21 LEU 11 -5.167 0.204 -15.685 82 HD22 LEU 11 HD22 LEU 11 -4.293 -0.867 -16.778 83 HD23 LEU 11 HD23 LEU 11 -3.841 0.833 -16.664 84 H LEU 12 HN LEU 12 -3.286 3.483 -12.841 85 HA LEU 12 HA LEU 12 -2.304 3.081 -10.195 86 HB2 LEU 12 HB2 LEU 12 -2.679 5.621 -11.781 87 HB3 LEU 12 HB1 LEU 12 -1.825 5.516 -10.253 88 HG LEU 12 HG LEU 12 -1.013 4.170 -12.833 89 HD11 LEU 12 HD11 LEU 12 0.209 6.469 -11.316 90 HD12 LEU 12 HD12 LEU 12 -0.640 6.572 -12.859 91 HD13 LEU 12 HD13 LEU 12 0.890 5.702 -12.750 92 HD21 LEU 12 HD21 LEU 12 -0.416 2.797 -10.917 93 HD22 LEU 12 HD22 LEU 12 0.329 4.188 -10.131 94 HD23 LEU 12 HD23 LEU 12 1.023 3.538 -11.616 95 H ASP 13 HN ASP 13 -5.304 4.041 -11.521 96 HA ASP 13 HA ASP 13 -6.409 5.434 -9.322 97 HB2 ASP 13 HB2 ASP 13 -7.400 5.390 -11.605 98 HB3 ASP 13 HB1 ASP 13 -7.819 3.697 -11.365 99 H GLN 14 HN GLN 14 -6.353 2.008 -10.245 100 HA GLN 14 HA GLN 14 -7.858 1.107 -8.016 101 HB2 GLN 14 HB2 GLN 14 -5.886 -0.398 -9.745 102 HB3 GLN 14 HB1 GLN 14 -6.935 -1.144 -8.552 103 HG2 GLN 14 HG2 GLN 14 -7.525 -0.170 -11.260 104 HG3 GLN 14 HG1 GLN 14 -8.219 -1.513 -10.358 105 HE21 GLN 14 HE21 GLN 14 -8.504 1.766 -11.258 106 HE22 GLN 14 HE22 GLN 14 -10.015 2.094 -10.484 107 H VAL 15 HN VAL 15 -4.377 1.309 -8.666 108 HA VAL 15 HA VAL 15 -3.417 0.251 -6.276 109 HB VAL 15 HB VAL 15 -2.211 2.541 -7.847 110 HG11 VAL 15 HG11 VAL 15 -1.240 2.295 -5.618 111 HG12 VAL 15 HG12 VAL 15 -0.090 1.830 -6.871 112 HG13 VAL 15 HG13 VAL 15 -0.927 0.588 -5.940 113 HG21 VAL 15 HG21 VAL 15 -0.879 0.808 -8.968 114 HG22 VAL 15 HG22 VAL 15 -2.606 0.613 -9.273 115 HG23 VAL 15 HG23 VAL 15 -1.789 -0.433 -8.108 116 H ALA 16 HN ALA 16 -4.516 3.504 -7.054 117 HA ALA 16 HA ALA 16 -3.755 4.826 -4.733 118 HB1 ALA 16 HB1 ALA 16 -6.188 5.342 -6.436 119 HB2 ALA 16 HB2 ALA 16 -4.566 5.971 -6.727 120 HB3 ALA 16 HB3 ALA 16 -5.462 6.472 -5.293 121 H ARG 17 HN ARG 17 -6.931 3.289 -5.429 122 HA ARG 17 HA ARG 17 -7.889 3.873 -2.811 123 HB2 ARG 17 HB2 ARG 17 -9.772 2.349 -3.344 124 HB3 ARG 17 HB1 ARG 17 -9.515 3.605 -4.540 125 HG2 ARG 17 HG2 ARG 17 -8.552 2.051 -6.069 126 HG3 ARG 17 HG1 ARG 17 -8.521 0.782 -4.842 127 HD2 ARG 17 HD2 ARG 17 -10.400 0.659 -6.543 128 HD3 ARG 17 HD1 ARG 17 -10.870 0.579 -4.846 129 HE ARG 17 HE ARG 17 -11.978 2.575 -5.076 130 HH11 ARG 17 HH11 ARG 17 -9.973 2.030 -7.889 131 HH12 ARG 17 HH12 ARG 17 -10.546 3.429 -8.746 132 HH21 ARG 17 HH21 ARG 17 -12.814 4.375 -6.228 133 HH22 ARG 17 HH22 ARG 17 -12.204 4.737 -7.816 134 H VAL 18 HN VAL 18 -6.293 1.042 -4.196 135 HA VAL 18 HA VAL 18 -6.750 -0.687 -2.005 136 HB VAL 18 HB VAL 18 -4.449 -0.665 -3.974 137 HG11 VAL 18 HG11 VAL 18 -3.835 -1.887 -1.961 138 HG12 VAL 18 HG12 VAL 18 -4.088 -2.997 -3.307 139 HG13 VAL 18 HG13 VAL 18 -5.322 -2.829 -2.061 140 HG21 VAL 18 HG21 VAL 18 -7.009 -2.260 -3.914 141 HG22 VAL 18 HG22 VAL 18 -5.695 -2.480 -5.067 142 HG23 VAL 18 HG23 VAL 18 -6.605 -0.970 -5.048 143 H GLY 19 HN GLY 19 -3.996 1.430 -2.803 144 HA2 GLY 19 HA2 GLY 19 -2.550 0.896 -0.420 145 HA3 GLY 19 HA1 GLY 19 -2.304 2.269 -1.490 146 H LYS 20 HN LYS 20 -5.013 3.263 -1.238 147 HA LYS 20 HA LYS 20 -4.627 4.921 1.029 148 HB2 LYS 20 HB2 LYS 20 -5.867 5.458 -1.156 149 HB3 LYS 20 HB1 LYS 20 -7.231 4.607 -0.447 150 HG2 LYS 20 HG2 LYS 20 -7.313 6.177 1.381 151 HG3 LYS 20 HG1 LYS 20 -5.872 6.996 0.774 152 HD2 LYS 20 HD2 LYS 20 -7.155 7.424 -1.352 153 HD3 LYS 20 HD1 LYS 20 -8.590 6.847 -0.506 154 HE2 LYS 20 HE2 LYS 20 -6.871 9.201 0.260 155 HE3 LYS 20 HE1 LYS 20 -8.490 9.268 -0.431 156 HZ1 LYS 20 HZ1 LYS 20 -8.721 9.606 1.870 157 HZ2 LYS 20 HZ2 LYS 20 -7.705 8.307 2.259 158 HZ3 LYS 20 HZ3 LYS 20 -9.237 8.010 1.594 159 H ALA 21 HN ALA 21 -6.648 2.098 0.389 160 HA ALA 21 HA ALA 21 -8.056 2.196 2.867 161 HB1 ALA 21 HB1 ALA 21 -7.550 -0.172 1.056 162 HB2 ALA 21 HB2 ALA 21 -8.908 0.945 0.931 163 HB3 ALA 21 HB3 ALA 21 -8.748 -0.090 2.348 164 H LEU 22 HN LEU 22 -5.068 0.739 1.769 165 HA LEU 22 HA LEU 22 -4.528 -0.829 4.073 166 HB2 LEU 22 HB2 LEU 22 -3.496 -0.694 1.600 167 HB3 LEU 22 HB1 LEU 22 -2.315 0.297 2.428 168 HG LEU 22 HG LEU 22 -1.633 -2.072 2.160 169 HD11 LEU 22 HD11 LEU 22 -0.840 -2.414 4.424 170 HD12 LEU 22 HD12 LEU 22 -1.991 -1.219 5.023 171 HD13 LEU 22 HD13 LEU 22 -0.681 -0.721 3.951 172 HD21 LEU 22 HD21 LEU 22 -3.803 -3.126 2.366 173 HD22 LEU 22 HD22 LEU 22 -3.916 -2.614 4.050 174 HD23 LEU 22 HD23 LEU 22 -2.683 -3.780 3.562 175 H ALA 23 HN ALA 23 -3.846 2.480 3.141 176 HA ALA 23 HA ALA 23 -2.074 3.050 5.306 177 HB1 ALA 23 HB1 ALA 23 -1.976 4.293 3.206 178 HB2 ALA 23 HB2 ALA 23 -2.249 5.370 4.577 179 HB3 ALA 23 HB3 ALA 23 -3.589 4.941 3.511 180 H ASN 24 HN ASN 24 -2.930 2.704 7.263 181 HA ASN 24 HA ASN 24 -4.446 4.715 8.472 182 HB2 ASN 24 HB2 ASN 24 -6.267 3.434 7.146 183 HB3 ASN 24 HB1 ASN 24 -6.034 2.150 8.327 184 HD21 ASN 24 HD21 ASN 24 -5.490 4.207 10.468 185 HD22 ASN 24 HD22 ASN 24 -7.064 4.806 10.890 186 H GLY 25 HN GLY 25 -3.587 1.287 8.491 187 HA2 GLY 25 HA2 GLY 25 -2.346 0.133 10.082 188 HA3 GLY 25 HA1 GLY 25 -2.341 1.575 11.088 189 H ARG 26 HN ARG 26 -4.885 2.120 11.574 190 HA ARG 26 HA ARG 26 -5.636 0.309 13.566 191 HB2 ARG 26 HB2 ARG 26 -7.473 2.260 12.175 192 HB3 ARG 26 HB1 ARG 26 -7.644 1.615 13.801 193 HG2 ARG 26 HG2 ARG 26 -5.437 3.434 12.861 194 HG3 ARG 26 HG1 ARG 26 -6.844 3.919 13.806 195 HD2 ARG 26 HD2 ARG 26 -6.135 2.535 15.652 196 HD3 ARG 26 HD1 ARG 26 -4.794 1.898 14.701 197 HE ARG 26 HE ARG 26 -4.057 4.356 14.637 198 HH11 ARG 26 HH11 ARG 26 -5.642 2.776 17.339 199 HH12 ARG 26 HH12 ARG 26 -5.019 3.897 18.517 200 HH21 ARG 26 HH21 ARG 26 -3.201 5.799 16.195 201 HH22 ARG 26 HH22 ARG 26 -3.614 5.593 17.874 202 H ARG 27 HN ARG 27 -6.856 0.706 10.263 203 HA ARG 27 HA ARG 27 -8.941 -1.225 10.530 204 HB2 ARG 27 HB2 ARG 27 -7.656 -0.088 8.032 205 HB3 ARG 27 HB1 ARG 27 -9.139 -1.033 8.069 206 HG2 ARG 27 HG2 ARG 27 -10.150 0.731 9.498 207 HG3 ARG 27 HG1 ARG 27 -8.689 1.691 9.263 208 HD2 ARG 27 HD2 ARG 27 -10.492 0.701 7.053 209 HD3 ARG 27 HD1 ARG 27 -10.526 2.326 7.733 210 HE ARG 27 HE ARG 27 -8.112 1.261 6.413 211 HH11 ARG 27 HH11 ARG 27 -10.585 3.717 6.748 212 HH12 ARG 27 HH12 ARG 27 -9.852 4.794 5.604 213 HH21 ARG 27 HH21 ARG 27 -7.128 2.693 4.924 214 HH22 ARG 27 HH22 ARG 27 -7.863 4.233 4.598 215 H LEU 28 HN LEU 28 -5.587 -1.510 10.147 216 HA LEU 28 HA LEU 28 -5.568 -3.810 8.433 217 HB2 LEU 28 HB2 LEU 28 -3.384 -2.684 10.184 218 HB3 LEU 28 HB1 LEU 28 -3.171 -3.910 8.948 219 HG LEU 28 HG LEU 28 -3.988 -1.040 8.494 220 HD11 LEU 28 HD11 LEU 28 -1.460 -2.545 7.849 221 HD12 LEU 28 HD12 LEU 28 -1.647 -1.257 9.039 222 HD13 LEU 28 HD13 LEU 28 -1.828 -0.903 7.322 223 HD21 LEU 28 HD21 LEU 28 -3.872 -1.554 6.120 224 HD22 LEU 28 HD22 LEU 28 -5.093 -2.551 6.912 225 HD23 LEU 28 HD23 LEU 28 -3.527 -3.244 6.488 226 H GLN 29 HN GLN 29 -6.142 -3.306 11.731 227 HA GLN 29 HA GLN 29 -5.162 -5.733 12.793 228 HB2 GLN 29 HB2 GLN 29 -7.500 -4.059 13.728 229 HB3 GLN 29 HB1 GLN 29 -6.714 -5.328 14.657 230 HG2 GLN 29 HG2 GLN 29 -4.631 -4.045 14.632 231 HG3 GLN 29 HG1 GLN 29 -5.436 -2.768 13.725 232 HE21 GLN 29 HE21 GLN 29 -7.005 -1.513 14.751 233 HE22 GLN 29 HE22 GLN 29 -7.103 -1.414 16.475 234 H ILE 30 HN ILE 30 -7.958 -4.913 10.929 235 HA ILE 30 HA ILE 30 -9.480 -7.250 11.471 236 HB ILE 30 HB ILE 30 -9.533 -5.439 9.047 237 HG12 ILE 30 HG12 ILE 30 -11.277 -5.484 11.524 238 HG13 ILE 30 HG11 ILE 30 -10.032 -4.289 11.178 239 HG21 ILE 30 HG21 ILE 30 -11.764 -6.380 8.650 240 HG22 ILE 30 HG22 ILE 30 -11.524 -7.497 9.993 241 HG23 ILE 30 HG23 ILE 30 -10.505 -7.611 8.560 242 HD11 ILE 30 HD11 ILE 30 -11.289 -3.554 9.221 243 HD12 ILE 30 HD12 ILE 30 -12.242 -3.421 10.699 244 HD13 ILE 30 HD13 ILE 30 -12.535 -4.751 9.577 245 H LEU 31 HN LEU 31 -7.272 -6.339 8.829 246 HA LEU 31 HA LEU 31 -7.343 -8.768 7.427 247 HB2 LEU 31 HB2 LEU 31 -5.104 -6.754 7.685 248 HB3 LEU 31 HB1 LEU 31 -5.125 -8.067 6.525 249 HG LEU 31 HG LEU 31 -7.138 -5.817 6.615 250 HD11 LEU 31 HD11 LEU 31 -4.832 -6.306 4.736 251 HD12 LEU 31 HD12 LEU 31 -4.919 -5.037 5.958 252 HD13 LEU 31 HD13 LEU 31 -6.034 -5.022 4.591 253 HD21 LEU 31 HD21 LEU 31 -7.859 -6.701 4.455 254 HD22 LEU 31 HD22 LEU 31 -8.044 -7.908 5.729 255 HD23 LEU 31 HD23 LEU 31 -6.693 -8.016 4.601 256 H ASP 32 HN ASP 32 -5.319 -7.662 10.084 257 HA ASP 32 HA ASP 32 -3.608 -9.887 10.243 258 HB2 ASP 32 HB2 ASP 32 -3.127 -7.770 11.357 259 HB3 ASP 32 HB1 ASP 32 -4.530 -7.978 12.400 260 H LEU 33 HN LEU 33 -6.758 -9.230 11.664 261 HA LEU 33 HA LEU 33 -6.845 -11.588 13.268 262 HB2 LEU 33 HB2 LEU 33 -8.188 -9.594 13.774 263 HB3 LEU 33 HB1 LEU 33 -9.070 -9.805 12.273 264 HG LEU 33 HG LEU 33 -9.900 -11.997 13.145 265 HD11 LEU 33 HD11 LEU 33 -8.644 -11.027 15.705 266 HD12 LEU 33 HD12 LEU 33 -8.163 -12.444 14.772 267 HD13 LEU 33 HD13 LEU 33 -9.741 -12.398 15.556 268 HD21 LEU 33 HD21 LEU 33 -11.288 -10.012 13.231 269 HD22 LEU 33 HD22 LEU 33 -10.545 -9.532 14.758 270 HD23 LEU 33 HD23 LEU 33 -11.535 -10.991 14.678 271 H LEU 34 HN LEU 34 -7.817 -10.766 9.997 272 HA LEU 34 HA LEU 34 -9.278 -13.217 9.608 273 HB2 LEU 34 HB2 LEU 34 -8.327 -11.191 7.584 274 HB3 LEU 34 HB1 LEU 34 -9.467 -12.488 7.274 275 HG LEU 34 HG LEU 34 -9.894 -10.109 9.076 276 HD11 LEU 34 HD11 LEU 34 -11.204 -10.924 6.492 277 HD12 LEU 34 HD12 LEU 34 -10.064 -9.595 6.712 278 HD13 LEU 34 HD13 LEU 34 -11.650 -9.537 7.484 279 HD21 LEU 34 HD21 LEU 34 -10.933 -12.084 10.042 280 HD22 LEU 34 HD22 LEU 34 -11.725 -12.432 8.505 281 HD23 LEU 34 HD23 LEU 34 -12.154 -10.981 9.410 282 H ALA 35 HN ALA 35 -6.023 -12.348 9.555 283 HA ALA 35 HA ALA 35 -5.083 -14.184 7.592 284 HB1 ALA 35 HB1 ALA 35 -2.880 -13.732 8.490 285 HB2 ALA 35 HB2 ALA 35 -3.592 -12.974 9.914 286 HB3 ALA 35 HB3 ALA 35 -3.786 -12.228 8.328 287 H GLN 36 HN GLN 36 -6.162 -14.508 10.834 288 HA GLN 36 HA GLN 36 -4.925 -17.159 11.066 289 HB2 GLN 36 HB2 GLN 36 -5.567 -17.114 13.402 290 HB3 GLN 36 HB1 GLN 36 -4.718 -15.629 13.004 291 HG2 GLN 36 HG2 GLN 36 -6.875 -14.469 12.821 292 HG3 GLN 36 HG1 GLN 36 -7.696 -15.958 13.281 293 HE21 GLN 36 HE21 GLN 36 -4.652 -14.975 14.679 294 HE22 GLN 36 HE22 GLN 36 -5.276 -14.597 16.249 295 H GLY 37 HN GLY 37 -7.498 -15.964 9.615 296 HA2 GLY 37 HA2 GLY 37 -8.866 -18.001 8.813 297 HA3 GLY 37 HA1 GLY 37 -9.356 -18.061 10.500 298 H GLU 38 HN GLU 38 -11.079 -17.721 8.261 299 HA GLU 38 HA GLU 38 -11.854 -14.986 8.017 300 HB2 GLU 38 HB2 GLU 38 -13.933 -15.989 6.966 301 HB3 GLU 38 HB1 GLU 38 -12.414 -16.424 6.199 302 HG2 GLU 38 HG2 GLU 38 -12.461 -18.552 7.515 303 HG3 GLU 38 HG1 GLU 38 -14.086 -18.114 8.037 304 H ARG 39 HN ARG 39 -13.339 -13.834 9.153 305 HA ARG 39 HA ARG 39 -14.431 -15.172 11.542 306 HB2 ARG 39 HB2 ARG 39 -12.351 -13.260 11.454 307 HB3 ARG 39 HB1 ARG 39 -13.761 -12.441 12.112 308 HG2 ARG 39 HG2 ARG 39 -12.432 -13.373 13.894 309 HG3 ARG 39 HG1 ARG 39 -13.984 -14.208 13.801 310 HD2 ARG 39 HD2 ARG 39 -12.914 -16.032 12.554 311 HD3 ARG 39 HD1 ARG 39 -11.363 -15.205 12.688 312 HE ARG 39 HE ARG 39 -12.850 -15.995 15.101 313 HH11 ARG 39 HH11 ARG 39 -10.018 -16.245 13.058 314 HH12 ARG 39 HH12 ARG 39 -9.075 -17.079 14.250 315 HH21 ARG 39 HH21 ARG 39 -11.610 -17.070 16.680 316 HH22 ARG 39 HH22 ARG 39 -9.979 -17.551 16.313 317 H ALA 40 HN ALA 40 -16.423 -14.603 12.183 318 HA ALA 40 HA ALA 40 -18.142 -13.206 10.424 319 HB1 ALA 40 HB1 ALA 40 -19.845 -13.497 12.125 320 HB2 ALA 40 HB2 ALA 40 -18.616 -13.927 13.313 321 HB3 ALA 40 HB3 ALA 40 -18.916 -14.983 11.932 322 H VAL 41 HN VAL 41 -19.424 -11.306 10.937 323 HA VAL 41 HA VAL 41 -17.935 -9.027 11.397 324 HB VAL 41 HB VAL 41 -20.901 -9.301 11.909 325 HG11 VAL 41 HG11 VAL 41 -19.959 -7.199 12.721 326 HG12 VAL 41 HG12 VAL 41 -20.997 -6.932 11.320 327 HG13 VAL 41 HG13 VAL 41 -19.244 -6.901 11.136 328 HG21 VAL 41 HG21 VAL 41 -19.451 -8.699 9.333 329 HG22 VAL 41 HG22 VAL 41 -21.200 -8.680 9.565 330 HG23 VAL 41 HG23 VAL 41 -20.308 -10.192 9.718 331 H GLU 42 HN GLU 42 -20.171 -10.601 13.693 332 HA GLU 42 HA GLU 42 -19.696 -8.846 15.829 333 HB2 GLU 42 HB2 GLU 42 -20.389 -11.769 16.111 334 HB3 GLU 42 HB1 GLU 42 -20.754 -10.468 17.235 335 HG2 GLU 42 HG2 GLU 42 -22.781 -10.612 16.270 336 HG3 GLU 42 HG1 GLU 42 -22.038 -9.539 15.085 337 H ALA 43 HN ALA 43 -18.032 -11.772 14.820 338 HA ALA 43 HA ALA 43 -16.420 -12.091 17.117 339 HB1 ALA 43 HB1 ALA 43 -16.762 -13.898 15.526 340 HB2 ALA 43 HB2 ALA 43 -15.042 -13.548 15.704 341 HB3 ALA 43 HB3 ALA 43 -15.914 -12.982 14.279 342 H ILE 44 HN ILE 44 -15.868 -10.476 14.007 343 HA ILE 44 HA ILE 44 -13.236 -9.616 14.489 344 HB ILE 44 HB ILE 44 -15.367 -8.309 12.788 345 HG12 ILE 44 HG12 ILE 44 -13.138 -10.217 12.045 346 HG13 ILE 44 HG11 ILE 44 -14.839 -10.651 12.181 347 HG21 ILE 44 HG21 ILE 44 -13.535 -7.199 11.628 348 HG22 ILE 44 HG22 ILE 44 -12.374 -7.933 12.734 349 HG23 ILE 44 HG23 ILE 44 -13.547 -6.762 13.337 350 HD11 ILE 44 HD11 ILE 44 -15.369 -9.112 10.357 351 HD12 ILE 44 HD12 ILE 44 -14.209 -10.347 9.867 352 HD13 ILE 44 HD13 ILE 44 -13.657 -8.707 10.212 353 H ALA 45 HN ALA 45 -16.354 -8.047 15.103 354 HA ALA 45 HA ALA 45 -15.373 -5.626 16.125 355 HB1 ALA 45 HB1 ALA 45 -17.580 -5.351 17.128 356 HB2 ALA 45 HB2 ALA 45 -17.933 -7.055 16.837 357 HB3 ALA 45 HB3 ALA 45 -17.706 -5.956 15.477 358 H THR 46 HN THR 46 -16.291 -8.621 17.797 359 HA THR 46 HA THR 46 -15.786 -7.730 20.410 360 HB THR 46 HB THR 46 -15.579 -10.560 19.361 361 HG1 THR 46 HG1 THR 46 -17.628 -9.645 18.905 362 HG21 THR 46 HG21 THR 46 -14.625 -10.311 21.594 363 HG22 THR 46 HG22 THR 46 -16.148 -11.199 21.670 364 HG23 THR 46 HG23 THR 46 -16.091 -9.501 22.144 365 H ALA 47 HN ALA 47 -13.704 -9.479 18.110 366 HA ALA 47 HA ALA 47 -11.545 -9.887 19.865 367 HB1 ALA 47 HB1 ALA 47 -10.235 -10.371 17.867 368 HB2 ALA 47 HB2 ALA 47 -11.503 -9.670 16.860 369 HB3 ALA 47 HB3 ALA 47 -11.824 -11.134 17.787 370 H THR 48 HN THR 48 -12.300 -7.200 17.695 371 HA THR 48 HA THR 48 -9.760 -5.921 18.255 372 HB THR 48 HB THR 48 -10.723 -4.048 16.856 373 HG1 THR 48 HG1 THR 48 -12.716 -5.933 16.121 374 HG21 THR 48 HG21 THR 48 -10.603 -6.806 15.631 375 HG22 THR 48 HG22 THR 48 -9.237 -5.723 15.893 376 HG23 THR 48 HG23 THR 48 -10.498 -5.288 14.741 377 H GLY 49 HN GLY 49 -12.832 -6.033 19.685 378 HA2 GLY 49 HA2 GLY 49 -13.584 -4.975 21.600 379 HA3 GLY 49 HA1 GLY 49 -12.099 -4.032 21.617 380 H MET 50 HN MET 50 -14.078 -4.140 18.774 381 HA MET 50 HA MET 50 -14.861 -1.344 19.275 382 HB2 MET 50 HB2 MET 50 -14.439 -2.753 16.624 383 HB3 MET 50 HB1 MET 50 -14.980 -1.089 16.810 384 HG2 MET 50 HG2 MET 50 -12.831 -0.645 18.037 385 HG3 MET 50 HG1 MET 50 -12.308 -2.250 17.536 386 HE1 MET 50 HE1 MET 50 -13.360 -2.574 14.571 387 HE2 MET 50 HE2 MET 50 -11.714 -2.937 15.090 388 HE3 MET 50 HE3 MET 50 -11.986 -1.921 13.673 389 H ASN 51 HN ASN 51 -16.885 -0.797 17.812 390 HA ASN 51 HA ASN 51 -18.995 -2.549 18.731 391 HB2 ASN 51 HB2 ASN 51 -18.970 0.068 17.231 392 HB3 ASN 51 HB1 ASN 51 -20.453 -0.851 17.450 393 HD21 ASN 51 HD21 ASN 51 -17.974 -0.790 19.901 394 HD22 ASN 51 HD22 ASN 51 -18.846 0.193 21.035 395 H LEU 52 HN LEU 52 -20.677 -3.367 17.264 396 HA LEU 52 HA LEU 52 -19.618 -4.723 15.014 397 HB2 LEU 52 HB2 LEU 52 -22.445 -4.222 15.929 398 HB3 LEU 52 HB1 LEU 52 -22.084 -5.117 14.469 399 HG LEU 52 HG LEU 52 -20.786 -6.746 15.880 400 HD11 LEU 52 HD11 LEU 52 -22.112 -5.271 18.154 401 HD12 LEU 52 HD12 LEU 52 -20.379 -5.322 17.819 402 HD13 LEU 52 HD13 LEU 52 -21.232 -6.796 18.280 403 HD21 LEU 52 HD21 LEU 52 -22.783 -7.878 16.711 404 HD22 LEU 52 HD22 LEU 52 -23.041 -7.216 15.098 405 HD23 LEU 52 HD23 LEU 52 -23.713 -6.395 16.506 406 H THR 53 HN THR 53 -21.443 -1.763 15.461 407 HA THR 53 HA THR 53 -21.863 -1.034 12.797 408 HB THR 53 HB THR 53 -21.131 0.969 14.920 409 HG1 THR 53 HG1 THR 53 -23.702 -0.243 14.670 410 HG21 THR 53 HG21 THR 53 -23.178 0.939 12.699 411 HG22 THR 53 HG22 THR 53 -21.664 1.843 12.711 412 HG23 THR 53 HG23 THR 53 -22.948 2.255 13.849 413 H THR 54 HN THR 54 -19.123 -0.395 14.963 414 HA THR 54 HA THR 54 -17.584 1.136 13.190 415 HB THR 54 HB THR 54 -16.377 -0.673 15.271 416 HG1 THR 54 HG1 THR 54 -17.748 1.805 15.708 417 HG21 THR 54 HG21 THR 54 -14.864 1.241 15.577 418 HG22 THR 54 HG22 THR 54 -15.744 2.131 14.336 419 HG23 THR 54 HG23 THR 54 -14.855 0.669 13.909 420 H ALA 55 HN ALA 55 -17.575 -2.334 13.924 421 HA ALA 55 HA ALA 55 -15.428 -3.062 12.277 422 HB1 ALA 55 HB1 ALA 55 -16.282 -5.341 12.470 423 HB2 ALA 55 HB2 ALA 55 -17.808 -4.722 13.106 424 HB3 ALA 55 HB3 ALA 55 -16.317 -4.513 14.027 425 H SER 56 HN SER 56 -18.938 -3.286 11.626 426 HA SER 56 HA SER 56 -18.663 -4.329 9.041 427 HB2 SER 56 HB2 SER 56 -21.046 -3.510 8.739 428 HB3 SER 56 HB1 SER 56 -20.767 -4.570 10.123 429 HG SER 56 HG SER 56 -20.897 -2.853 11.484 430 H ALA 57 HN ALA 57 -18.783 -0.983 10.169 431 HA ALA 57 HA ALA 57 -19.072 0.250 7.654 432 HB1 ALA 57 HB1 ALA 57 -19.415 1.453 9.745 433 HB2 ALA 57 HB2 ALA 57 -18.212 2.267 8.744 434 HB3 ALA 57 HB3 ALA 57 -17.699 1.299 10.126 435 H ASN 58 HN ASN 58 -16.198 -0.672 9.504 436 HA ASN 58 HA ASN 58 -14.352 0.314 7.558 437 HB2 ASN 58 HB2 ASN 58 -14.088 -1.434 9.987 438 HB3 ASN 58 HB1 ASN 58 -12.728 -1.211 8.890 439 HD21 ASN 58 HD21 ASN 58 -14.788 0.284 11.251 440 HD22 ASN 58 HD22 ASN 58 -13.847 1.723 11.446 441 H LEU 59 HN LEU 59 -15.868 -2.779 8.209 442 HA LEU 59 HA LEU 59 -14.322 -4.380 6.497 443 HB2 LEU 59 HB2 LEU 59 -17.199 -4.611 7.371 444 HB3 LEU 59 HB1 LEU 59 -16.370 -5.849 6.445 445 HG LEU 59 HG LEU 59 -15.506 -4.894 9.176 446 HD11 LEU 59 HD11 LEU 59 -16.362 -7.050 9.977 447 HD12 LEU 59 HD12 LEU 59 -17.019 -7.374 8.372 448 HD13 LEU 59 HD13 LEU 59 -17.643 -6.027 9.325 449 HD21 LEU 59 HD21 LEU 59 -14.604 -7.228 7.492 450 HD22 LEU 59 HD22 LEU 59 -14.072 -6.874 9.136 451 HD23 LEU 59 HD23 LEU 59 -13.679 -5.764 7.823 452 H GLN 60 HN GLN 60 -17.303 -2.542 5.898 453 HA GLN 60 HA GLN 60 -17.550 -3.273 3.181 454 HB2 GLN 60 HB2 GLN 60 -18.552 -0.836 4.661 455 HB3 GLN 60 HB1 GLN 60 -18.989 -1.229 3.002 456 HG2 GLN 60 HG2 GLN 60 -20.000 -3.312 3.743 457 HG3 GLN 60 HG1 GLN 60 -19.527 -2.960 5.405 458 HE21 GLN 60 HE21 GLN 60 -21.635 -3.014 6.119 459 HE22 GLN 60 HE22 GLN 60 -22.781 -1.767 5.769 460 H ALA 61 HN ALA 61 -15.835 -0.664 4.802 461 HA ALA 61 HA ALA 61 -15.062 0.754 2.485 462 HB1 ALA 61 HB1 ALA 61 -13.657 0.610 5.152 463 HB2 ALA 61 HB2 ALA 61 -14.975 1.709 4.746 464 HB3 ALA 61 HB3 ALA 61 -13.427 1.843 3.913 465 H LEU 62 HN LEU 62 -13.447 -1.794 4.370 466 HA LEU 62 HA LEU 62 -11.095 -1.868 2.804 467 HB2 LEU 62 HB2 LEU 62 -12.369 -3.992 4.526 468 HB3 LEU 62 HB1 LEU 62 -10.783 -4.144 3.792 469 HG LEU 62 HG LEU 62 -11.583 -2.071 5.837 470 HD11 LEU 62 HD11 LEU 62 -11.405 -4.324 6.765 471 HD12 LEU 62 HD12 LEU 62 -10.091 -3.290 7.327 472 HD13 LEU 62 HD13 LEU 62 -9.793 -4.488 6.066 473 HD21 LEU 62 HD21 LEU 62 -9.211 -1.492 5.867 474 HD22 LEU 62 HD22 LEU 62 -9.916 -1.223 4.272 475 HD23 LEU 62 HD23 LEU 62 -8.910 -2.643 4.562 476 H LYS 63 HN LYS 63 -14.179 -3.574 2.558 477 HA LYS 63 HA LYS 63 -13.486 -5.244 0.397 478 HB2 LYS 63 HB2 LYS 63 -15.505 -5.725 1.547 479 HB3 LYS 63 HB1 LYS 63 -16.116 -4.094 1.317 480 HG2 LYS 63 HG2 LYS 63 -16.432 -4.494 -1.040 481 HG3 LYS 63 HG1 LYS 63 -15.689 -6.090 -0.899 482 HD2 LYS 63 HD2 LYS 63 -18.072 -5.406 0.774 483 HD3 LYS 63 HD1 LYS 63 -18.290 -5.849 -0.920 484 HE2 LYS 63 HE2 LYS 63 -16.732 -7.534 1.026 485 HE3 LYS 63 HE1 LYS 63 -18.464 -7.733 0.759 486 HZ1 LYS 63 HZ1 LYS 63 -17.167 -9.267 -0.604 487 HZ2 LYS 63 HZ2 LYS 63 -16.360 -7.967 -1.332 488 HZ3 LYS 63 HZ3 LYS 63 -18.024 -8.170 -1.571 489 H SER 64 HN SER 64 -14.511 -1.897 0.564 490 HA SER 64 HA SER 64 -14.927 -1.525 -2.219 491 HB2 SER 64 HB2 SER 64 -14.222 0.544 -0.122 492 HB3 SER 64 HB1 SER 64 -14.951 0.858 -1.698 493 HG SER 64 HG SER 64 -16.086 -0.508 0.520 494 H GLY 65 HN GLY 65 -12.102 -1.495 -0.179 495 HA2 GLY 65 HA2 GLY 65 -10.420 -0.433 -2.307 496 HA3 GLY 65 HA1 GLY 65 -9.893 -0.912 -0.699 497 H GLY 66 HN GLY 66 -11.650 -3.441 -1.397 498 HA2 GLY 66 HA2 GLY 66 -11.354 -5.436 -2.586 499 HA3 GLY 66 HA1 GLY 66 -9.887 -4.776 -3.288 500 H LEU 67 HN LEU 67 -10.406 -4.645 0.143 501 HA LEU 67 HA LEU 67 -8.062 -6.331 0.512 502 HB2 LEU 67 HB2 LEU 67 -9.593 -4.500 2.342 503 HB3 LEU 67 HB1 LEU 67 -8.388 -5.610 2.958 504 HG LEU 67 HG LEU 67 -7.391 -3.447 2.745 505 HD11 LEU 67 HD11 LEU 67 -6.454 -5.219 0.501 506 HD12 LEU 67 HD12 LEU 67 -5.974 -5.341 2.194 507 HD13 LEU 67 HD13 LEU 67 -5.532 -3.918 1.255 508 HD21 LEU 67 HD21 LEU 67 -7.241 -2.250 0.638 509 HD22 LEU 67 HD22 LEU 67 -8.924 -2.483 1.113 510 HD23 LEU 67 HD23 LEU 67 -8.216 -3.490 -0.151 511 H VAL 68 HN VAL 68 -11.455 -6.239 1.616 512 HA VAL 68 HA VAL 68 -11.070 -8.987 2.600 513 HB VAL 68 HB VAL 68 -12.737 -8.599 4.328 514 HG11 VAL 68 HG11 VAL 68 -10.540 -6.535 4.352 515 HG12 VAL 68 HG12 VAL 68 -10.407 -8.211 4.883 516 HG13 VAL 68 HG13 VAL 68 -11.444 -7.088 5.762 517 HG21 VAL 68 HG21 VAL 68 -14.103 -6.921 3.214 518 HG22 VAL 68 HG22 VAL 68 -12.791 -5.748 3.337 519 HG23 VAL 68 HG23 VAL 68 -13.582 -6.341 4.797 520 H GLU 69 HN GLU 69 -12.912 -10.361 2.599 521 HA GLU 69 HA GLU 69 -14.976 -9.669 0.610 522 HB2 GLU 69 HB2 GLU 69 -12.957 -11.495 0.210 523 HB3 GLU 69 HB1 GLU 69 -14.248 -12.514 0.831 524 HG2 GLU 69 HG2 GLU 69 -14.506 -10.656 -1.522 525 HG3 GLU 69 HG1 GLU 69 -14.192 -12.388 -1.627 526 H ALA 70 HN ALA 70 -16.987 -11.038 0.901 527 HA ALA 70 HA ALA 70 -17.379 -11.599 3.775 528 HB1 ALA 70 HB1 ALA 70 -19.606 -10.627 3.618 529 HB2 ALA 70 HB2 ALA 70 -19.334 -10.250 1.919 530 HB3 ALA 70 HB3 ALA 70 -18.375 -9.451 3.164 531 H ARG 71 HN ARG 71 -18.226 -13.493 4.264 532 HA ARG 71 HA ARG 71 -19.438 -15.113 2.123 533 HB2 ARG 71 HB2 ARG 71 -17.321 -15.854 3.475 534 HB3 ARG 71 HB1 ARG 71 -18.476 -16.202 4.754 535 HG2 ARG 71 HG2 ARG 71 -19.679 -17.709 3.216 536 HG3 ARG 71 HG1 ARG 71 -18.438 -17.409 1.995 537 HD2 ARG 71 HD2 ARG 71 -16.790 -18.162 3.849 538 HD3 ARG 71 HD1 ARG 71 -18.221 -18.866 4.603 539 HE ARG 71 HE ARG 71 -17.148 -19.611 1.959 540 HH11 ARG 71 HH11 ARG 71 -19.063 -20.363 4.807 541 HH12 ARG 71 HH12 ARG 71 -19.328 -22.016 4.340 542 HH21 ARG 71 HH21 ARG 71 -17.463 -21.775 1.369 543 HH22 ARG 71 HH22 ARG 71 -18.404 -22.830 2.379 544 H ARG 72 HN ARG 72 -21.604 -15.264 2.235 545 HA ARG 72 HA ARG 72 -22.956 -14.482 4.698 546 HB2 ARG 72 HB2 ARG 72 -23.835 -13.441 2.749 547 HB3 ARG 72 HB1 ARG 72 -23.909 -14.966 1.878 548 HG2 ARG 72 HG2 ARG 72 -26.128 -14.345 2.469 549 HG3 ARG 72 HG1 ARG 72 -25.666 -15.722 3.470 550 HD2 ARG 72 HD2 ARG 72 -26.748 -14.250 4.937 551 HD3 ARG 72 HD1 ARG 72 -25.029 -14.006 5.242 552 HE ARG 72 HE ARG 72 -25.558 -12.097 3.424 553 HH11 ARG 72 HH11 ARG 72 -27.181 -13.019 6.379 554 HH12 ARG 72 HH12 ARG 72 -27.754 -11.413 6.728 555 HH21 ARG 72 HH21 ARG 72 -26.327 -9.992 3.832 556 HH22 ARG 72 HH22 ARG 72 -27.276 -9.675 5.259 557 H GLU 73 HN GLU 73 -23.375 -15.973 6.163 558 HA GLU 73 HA GLU 73 -24.642 -18.453 5.246 559 HB2 GLU 73 HB2 GLU 73 -22.592 -18.237 7.452 560 HB3 GLU 73 HB1 GLU 73 -23.577 -19.661 7.152 561 HG2 GLU 73 HG2 GLU 73 -22.592 -19.669 4.818 562 HG3 GLU 73 HG1 GLU 73 -21.433 -18.484 5.417 563 H GLY 74 HN GLY 74 -26.678 -17.942 5.713 564 HA2 GLY 74 HA2 GLY 74 -28.542 -17.587 7.001 565 HA3 GLY 74 HA1 GLY 74 -27.548 -17.899 8.417 566 H THR 75 HN THR 75 -27.809 -16.276 9.789 567 HA THR 75 HA THR 75 -28.283 -13.592 8.810 568 HB THR 75 HB THR 75 -28.417 -13.097 11.319 569 HG1 THR 75 HG1 THR 75 -28.419 -14.798 12.686 570 HG21 THR 75 HG21 THR 75 -30.394 -13.324 9.911 571 HG22 THR 75 HG22 THR 75 -30.672 -14.078 11.482 572 HG23 THR 75 HG23 THR 75 -30.325 -15.079 10.073 573 H ARG 76 HN ARG 76 -25.565 -15.389 9.396 574 HA ARG 76 HA ARG 76 -24.056 -13.064 10.369 575 HB2 ARG 76 HB2 ARG 76 -23.581 -16.007 10.615 576 HB3 ARG 76 HB1 ARG 76 -22.231 -14.887 10.719 577 HG2 ARG 76 HG2 ARG 76 -23.440 -13.699 12.537 578 HG3 ARG 76 HG1 ARG 76 -24.656 -14.977 12.492 579 HD2 ARG 76 HD2 ARG 76 -23.098 -16.610 13.182 580 HD3 ARG 76 HD1 ARG 76 -21.731 -15.534 12.898 581 HE ARG 76 HE ARG 76 -23.000 -14.157 14.758 582 HH11 ARG 76 HH11 ARG 76 -22.354 -17.607 14.594 583 HH12 ARG 76 HH12 ARG 76 -22.365 -17.816 16.317 584 HH21 ARG 76 HH21 ARG 76 -22.973 -14.431 17.028 585 HH22 ARG 76 HH22 ARG 76 -22.662 -16.010 17.703 586 H GLN 77 HN GLN 77 -22.388 -12.241 9.265 587 HA GLN 77 HA GLN 77 -21.686 -13.534 6.719 588 HB2 GLN 77 HB2 GLN 77 -21.533 -10.610 7.484 589 HB3 GLN 77 HB1 GLN 77 -20.900 -11.280 5.988 590 HG2 GLN 77 HG2 GLN 77 -23.217 -12.059 5.461 591 HG3 GLN 77 HG1 GLN 77 -23.771 -11.146 6.863 592 HE21 GLN 77 HE21 GLN 77 -21.773 -9.027 6.397 593 HE22 GLN 77 HE22 GLN 77 -22.375 -8.106 5.066 594 H TYR 78 HN TYR 78 -19.812 -14.507 6.774 595 HA TYR 78 HA TYR 78 -17.826 -13.775 8.774 596 HB2 TYR 78 HB2 TYR 78 -17.818 -16.006 6.725 597 HB3 TYR 78 HB1 TYR 78 -16.626 -15.781 7.999 598 HD1 TYR 78 HD2 TYR 78 -17.206 -16.218 10.338 599 HD2 TYR 78 HD1 TYR 78 -19.991 -16.919 7.199 600 HE1 TYR 78 HE2 TYR 78 -18.567 -17.586 11.859 601 HE2 TYR 78 HE1 TYR 78 -21.356 -18.288 8.716 602 HH TYR 78 HH TYR 78 -20.960 -19.653 10.805 603 H TYR 79 HN TYR 79 -16.134 -12.512 8.329 604 HA TYR 79 HA TYR 79 -15.736 -11.793 5.525 605 HB2 TYR 79 HB2 TYR 79 -15.149 -10.374 8.101 606 HB3 TYR 79 HB1 TYR 79 -14.282 -9.934 6.632 607 HD1 TYR 79 HD2 TYR 79 -17.721 -10.319 8.009 608 HD2 TYR 79 HD1 TYR 79 -15.238 -8.471 5.094 609 HE1 TYR 79 HE2 TYR 79 -19.605 -8.904 7.312 610 HE2 TYR 79 HE1 TYR 79 -17.117 -7.048 4.386 611 HH TYR 79 HH TYR 79 -19.538 -7.015 4.461 612 H ARG 80 HN ARG 80 -13.747 -11.762 4.607 613 HA ARG 80 HA ARG 80 -11.582 -13.238 5.905 614 HB2 ARG 80 HB2 ARG 80 -11.482 -14.770 3.919 615 HB3 ARG 80 HB1 ARG 80 -12.938 -14.987 4.885 616 HG2 ARG 80 HG2 ARG 80 -14.124 -13.481 3.283 617 HG3 ARG 80 HG1 ARG 80 -12.680 -13.515 2.276 618 HD2 ARG 80 HD2 ARG 80 -12.903 -15.880 1.944 619 HD3 ARG 80 HD1 ARG 80 -14.236 -15.960 3.099 620 HE ARG 80 HE ARG 80 -14.772 -14.127 0.993 621 HH11 ARG 80 HH11 ARG 80 -14.728 -17.548 1.732 622 HH12 ARG 80 HH12 ARG 80 -15.964 -17.939 0.566 623 HH21 ARG 80 HH21 ARG 80 -16.396 -14.615 -0.526 624 HH22 ARG 80 HH22 ARG 80 -16.936 -16.264 -0.690 625 H ILE 81 HN ILE 81 -9.637 -13.244 4.375 626 HA ILE 81 HA ILE 81 -9.266 -10.681 3.191 627 HB ILE 81 HB ILE 81 -7.631 -13.197 2.790 628 HG12 ILE 81 HG12 ILE 81 -7.278 -10.915 4.753 629 HG13 ILE 81 HG11 ILE 81 -7.810 -12.542 5.161 630 HG21 ILE 81 HG21 ILE 81 -5.834 -11.673 2.143 631 HG22 ILE 81 HG22 ILE 81 -6.930 -10.303 2.315 632 HG23 ILE 81 HG23 ILE 81 -7.224 -11.516 1.070 633 HD11 ILE 81 HD11 ILE 81 -5.123 -11.788 4.040 634 HD12 ILE 81 HD12 ILE 81 -5.651 -13.423 4.441 635 HD13 ILE 81 HD13 ILE 81 -5.473 -12.216 5.715 636 H ALA 82 HN ALA 82 -9.688 -10.011 1.163 637 HA ALA 82 HA ALA 82 -11.640 -11.300 -0.326 638 HB1 ALA 82 HB1 ALA 82 -11.237 -9.650 -2.063 639 HB2 ALA 82 HB2 ALA 82 -9.690 -9.230 -1.326 640 HB3 ALA 82 HB3 ALA 82 -11.195 -8.902 -0.468 641 H GLY 83 HN GLY 83 -8.154 -11.178 -0.950 642 HA2 GLY 83 HA2 GLY 83 -8.435 -13.628 -2.525 643 HA3 GLY 83 HA1 GLY 83 -7.679 -12.235 -3.292 644 H GLU 84 HN GLU 84 -6.404 -14.703 -2.927 645 HA GLU 84 HA GLU 84 -4.751 -14.729 -0.621 646 HB2 GLU 84 HB2 GLU 84 -5.199 -16.720 -2.013 647 HB3 GLU 84 HB1 GLU 84 -4.288 -15.993 -3.329 648 HG2 GLU 84 HG2 GLU 84 -2.263 -16.100 -2.061 649 HG3 GLU 84 HG1 GLU 84 -3.135 -16.653 -0.632 650 H ASP 85 HN ASP 85 -4.682 -13.049 -3.611 651 HA ASP 85 HA ASP 85 -2.018 -12.248 -3.826 652 HB2 ASP 85 HB2 ASP 85 -4.287 -10.334 -4.321 653 HB3 ASP 85 HB1 ASP 85 -2.792 -10.528 -5.230 654 H VAL 86 HN VAL 86 -4.717 -10.807 -2.057 655 HA VAL 86 HA VAL 86 -3.198 -8.706 -0.878 656 HB VAL 86 HB VAL 86 -5.854 -9.856 0.006 657 HG11 VAL 86 HG11 VAL 86 -6.201 -7.667 1.061 658 HG12 VAL 86 HG12 VAL 86 -4.562 -7.197 0.608 659 HG13 VAL 86 HG13 VAL 86 -4.817 -8.520 1.745 660 HG21 VAL 86 HG21 VAL 86 -6.855 -8.022 -1.281 661 HG22 VAL 86 HG22 VAL 86 -5.941 -9.123 -2.311 662 HG23 VAL 86 HG23 VAL 86 -5.254 -7.562 -1.860 663 H ALA 87 HN ALA 87 -4.123 -11.954 0.091 664 HA ALA 87 HA ALA 87 -3.397 -11.848 2.790 665 HB1 ALA 87 HB1 ALA 87 -3.253 -14.279 2.687 666 HB2 ALA 87 HB2 ALA 87 -3.242 -14.213 0.924 667 HB3 ALA 87 HB3 ALA 87 -4.673 -13.696 1.817 668 H ARG 88 HN ARG 88 -1.469 -12.796 -0.052 669 HA ARG 88 HA ARG 88 0.905 -13.162 1.513 670 HB2 ARG 88 HB2 ARG 88 0.524 -12.973 -1.479 671 HB3 ARG 88 HB1 ARG 88 2.037 -13.402 -0.691 672 HG2 ARG 88 HG2 ARG 88 0.845 -15.326 0.368 673 HG3 ARG 88 HG1 ARG 88 -0.548 -14.939 -0.641 674 HD2 ARG 88 HD2 ARG 88 0.768 -16.710 -1.653 675 HD3 ARG 88 HD1 ARG 88 0.829 -15.253 -2.645 676 HE ARG 88 HE ARG 88 3.076 -15.026 -2.161 677 HH11 ARG 88 HH11 ARG 88 1.679 -17.591 -0.231 678 HH12 ARG 88 HH12 ARG 88 3.218 -18.227 0.269 679 HH21 ARG 88 HH21 ARG 88 5.112 -15.843 -1.470 680 HH22 ARG 88 HH22 ARG 88 5.155 -17.220 -0.413 681 H LEU 89 HN LEU 89 -0.570 -10.513 -0.168 682 HA LEU 89 HA LEU 89 1.662 -8.781 -0.283 683 HB2 LEU 89 HB2 LEU 89 -0.518 -8.455 -1.477 684 HB3 LEU 89 HB1 LEU 89 -1.253 -8.046 0.057 685 HG LEU 89 HG LEU 89 1.079 -6.449 -0.963 686 HD11 LEU 89 HD11 LEU 89 -0.497 -4.938 -2.061 687 HD12 LEU 89 HD12 LEU 89 -1.822 -6.043 -1.694 688 HD13 LEU 89 HD13 LEU 89 -0.537 -6.542 -2.795 689 HD21 LEU 89 HD21 LEU 89 0.320 -6.085 1.347 690 HD22 LEU 89 HD22 LEU 89 -1.309 -5.751 0.756 691 HD23 LEU 89 HD23 LEU 89 0.020 -4.670 0.336 692 H PHE 90 HN PHE 90 -0.867 -9.283 2.151 693 HA PHE 90 HA PHE 90 0.075 -7.374 3.999 694 HB2 PHE 90 HB2 PHE 90 -2.197 -8.427 4.035 695 HB3 PHE 90 HB1 PHE 90 -1.453 -9.916 4.608 696 HD1 PHE 90 HD2 PHE 90 -1.728 -6.300 5.459 697 HD2 PHE 90 HD1 PHE 90 -1.290 -10.288 6.875 698 HE1 PHE 90 HE2 PHE 90 -1.928 -5.496 7.776 699 HE2 PHE 90 HE1 PHE 90 -1.490 -9.492 9.195 700 HZ PHE 90 HZ PHE 90 -1.808 -7.091 9.649 701 H ALA 91 HN ALA 91 0.732 -10.832 3.603 702 HA ALA 91 HA ALA 91 2.425 -11.115 5.836 703 HB1 ALA 91 HB1 ALA 91 1.461 -13.007 4.584 704 HB2 ALA 91 HB2 ALA 91 3.207 -13.151 4.777 705 HB3 ALA 91 HB3 ALA 91 2.529 -12.635 3.233 706 H LEU 92 HN LEU 92 3.011 -10.056 2.532 707 HA LEU 92 HA LEU 92 5.827 -10.045 2.625 708 HB2 LEU 92 HB2 LEU 92 4.364 -9.921 0.576 709 HB3 LEU 92 HB1 LEU 92 4.062 -8.244 0.967 710 HG LEU 92 HG LEU 92 6.870 -9.232 0.545 711 HD11 LEU 92 HD11 LEU 92 5.610 -9.928 -1.415 712 HD12 LEU 92 HD12 LEU 92 6.671 -8.575 -1.805 713 HD13 LEU 92 HD13 LEU 92 4.944 -8.304 -1.580 714 HD21 LEU 92 HD21 LEU 92 6.602 -7.007 1.503 715 HD22 LEU 92 HD22 LEU 92 5.537 -6.549 0.175 716 HD23 LEU 92 HD23 LEU 92 7.237 -6.903 -0.141 717 H VAL 93 HN VAL 93 3.443 -7.452 3.217 718 HA VAL 93 HA VAL 93 5.392 -5.460 3.703 719 HB VAL 93 HB VAL 93 3.622 -4.086 4.641 720 HG11 VAL 93 HG11 VAL 93 2.045 -4.120 2.734 721 HG12 VAL 93 HG12 VAL 93 2.760 -5.647 2.214 722 HG13 VAL 93 HG13 VAL 93 3.739 -4.180 2.245 723 HG21 VAL 93 HG21 VAL 93 1.887 -6.546 4.505 724 HG22 VAL 93 HG22 VAL 93 1.336 -4.916 4.890 725 HG23 VAL 93 HG23 VAL 93 2.451 -5.748 5.973 726 H GLN 94 HN GLN 94 3.937 -7.882 5.758 727 HA GLN 94 HA GLN 94 4.773 -6.830 8.237 728 HB2 GLN 94 HB2 GLN 94 4.337 -9.696 7.379 729 HB3 GLN 94 HB1 GLN 94 4.636 -9.202 9.039 730 HG2 GLN 94 HG2 GLN 94 2.600 -7.815 8.960 731 HG3 GLN 94 HG1 GLN 94 2.288 -8.416 7.330 732 HE21 GLN 94 HE21 GLN 94 2.287 -9.160 10.717 733 HE22 GLN 94 HE22 GLN 94 1.434 -10.657 10.593 734 H VAL 95 HN VAL 95 6.345 -9.024 5.939 735 HA VAL 95 HA VAL 95 8.628 -9.513 7.530 736 HB VAL 95 HB VAL 95 8.362 -9.688 4.524 737 HG11 VAL 95 HG11 VAL 95 10.697 -9.615 5.239 738 HG12 VAL 95 HG12 VAL 95 10.268 -11.218 4.641 739 HG13 VAL 95 HG13 VAL 95 10.396 -10.929 6.377 740 HG21 VAL 95 HG21 VAL 95 8.004 -11.794 6.656 741 HG22 VAL 95 HG22 VAL 95 7.975 -12.079 4.916 742 HG23 VAL 95 HG23 VAL 95 6.729 -11.081 5.668 743 H VAL 96 HN VAL 96 8.073 -7.244 4.835 744 HA VAL 96 HA VAL 96 10.722 -6.287 4.764 745 HB VAL 96 HB VAL 96 9.115 -6.009 2.899 746 HG11 VAL 96 HG11 VAL 96 7.136 -5.364 4.157 747 HG12 VAL 96 HG12 VAL 96 7.517 -4.161 2.926 748 HG13 VAL 96 HG13 VAL 96 7.909 -3.847 4.615 749 HG21 VAL 96 HG21 VAL 96 9.839 -3.766 2.234 750 HG22 VAL 96 HG22 VAL 96 11.157 -4.694 2.949 751 HG23 VAL 96 HG23 VAL 96 10.348 -3.444 3.891 752 H ALA 97 HN ALA 97 7.984 -5.367 6.745 753 HA ALA 97 HA ALA 97 9.270 -2.937 7.649 754 HB1 ALA 97 HB1 ALA 97 7.308 -2.647 9.064 755 HB2 ALA 97 HB2 ALA 97 6.740 -4.258 8.622 756 HB3 ALA 97 HB3 ALA 97 6.843 -2.991 7.397 757 H ASP 98 HN ASP 98 8.497 -6.131 9.003 758 HA ASP 98 HA ASP 98 9.469 -5.445 11.613 759 HB2 ASP 98 HB2 ASP 98 7.704 -7.021 11.519 760 HB3 ASP 98 HB1 ASP 98 8.559 -8.027 10.357 761 H GLU 99 HN GLU 99 10.783 -7.246 8.874 762 HA GLU 99 HA GLU 99 12.791 -8.572 10.346 763 HB2 GLU 99 HB2 GLU 99 11.889 -9.299 8.146 764 HB3 GLU 99 HB1 GLU 99 12.772 -7.981 7.387 765 HG2 GLU 99 HG2 GLU 99 14.854 -8.955 7.879 766 HG3 GLU 99 HG1 GLU 99 14.141 -10.083 9.032 767 H HIS 100 HN HIS 100 12.675 -5.332 9.161 768 HA HIS 100 HA HIS 100 15.588 -5.122 9.342 769 HB2 HIS 100 HB2 HIS 100 15.503 -3.078 8.204 770 HB3 HIS 100 HB1 HIS 100 14.277 -4.053 7.413 771 HD1 HIS 100 HD1 HIS 100 14.565 -1.228 9.947 772 HD2 HIS 100 HD2 HIS 100 11.811 -2.883 7.300 773 HE1 HIS 100 HE1 HIS 100 12.625 0.361 9.906 774 HE2 HIS 100 HE2 HIS 100 11.103 -0.531 8.116 775 H LEU 101 HN LEU 101 13.065 -4.962 11.428 776 HA LEU 101 HA LEU 101 13.833 -2.588 12.877 777 HB2 LEU 101 HB2 LEU 101 11.941 -4.829 13.605 778 HB3 LEU 101 HB1 LEU 101 12.179 -3.375 14.554 779 HG LEU 101 HG LEU 101 11.072 -3.466 11.744 780 HD11 LEU 101 HD11 LEU 101 8.968 -2.786 12.815 781 HD12 LEU 101 HD12 LEU 101 9.727 -2.978 14.395 782 HD13 LEU 101 HD13 LEU 101 9.504 -4.380 13.350 783 HD21 LEU 101 HD21 LEU 101 12.323 -1.414 12.194 784 HD22 LEU 101 HD22 LEU 101 11.376 -1.156 13.659 785 HD23 LEU 101 HD23 LEU 101 10.590 -1.100 12.080 786 H GLU 102 HN GLU 102 13.965 -6.081 13.501 787 HA GLU 102 HA GLU 102 15.005 -5.939 16.075 788 HB2 GLU 102 HB2 GLU 102 14.169 -7.945 14.422 789 HB3 GLU 102 HB1 GLU 102 15.898 -8.252 14.496 790 HG2 GLU 102 HG2 GLU 102 14.020 -8.053 16.841 791 HG3 GLU 102 HG1 GLU 102 14.721 -9.529 16.183 792 H HIS 103 HN HIS 103 16.842 -5.237 16.804 793 HA HIS 103 HA HIS 103 19.046 -4.854 17.136 794 HB2 HIS 103 HB2 HIS 103 18.919 -7.368 15.910 795 HB3 HIS 103 HB1 HIS 103 20.207 -6.507 15.071 796 HD1 HIS 103 HD1 HIS 103 22.401 -6.214 16.288 797 HD2 HIS 103 HD2 HIS 103 19.351 -7.660 18.728 798 HE1 HIS 103 HE1 HIS 103 23.504 -6.850 18.457 799 HE2 HIS 103 HE2 HIS 103 21.615 -7.543 19.979 800 H HIS 104 HN HIS 104 17.490 -3.578 14.777 801 HA HIS 104 HA HIS 104 19.870 -2.271 13.659 802 HB2 HIS 104 HB2 HIS 104 18.942 -3.962 12.045 803 HB3 HIS 104 HB1 HIS 104 17.453 -3.028 12.003 804 HD1 HIS 104 HD1 HIS 104 21.162 -2.252 11.460 805 HD2 HIS 104 HD2 HIS 104 17.408 -1.401 9.870 806 HE1 HIS 104 HE1 HIS 104 21.579 -0.762 9.473 807 HE2 HIS 104 HE2 HIS 104 19.299 -0.287 8.500 808 H HIS 105 HN HIS 105 18.360 -1.357 15.801 809 HA HIS 105 HA HIS 105 17.579 1.199 14.714 810 HB2 HIS 105 HB2 HIS 105 15.386 1.309 15.755 811 HB3 HIS 105 HB1 HIS 105 15.449 -0.047 14.642 812 HD1 HIS 105 HD1 HIS 105 13.951 0.714 17.652 813 HD2 HIS 105 HD2 HIS 105 16.320 -2.494 16.440 814 HE1 HIS 105 HE1 HIS 105 13.422 -1.169 19.238 815 HE2 HIS 105 HE2 HIS 105 14.957 -3.058 18.564 816 H HIS 106 HN HIS 106 18.793 2.542 15.843 817 HA HIS 106 HA HIS 106 19.022 2.100 18.752 818 HB2 HIS 106 HB2 HIS 106 20.987 3.246 16.781 819 HB3 HIS 106 HB1 HIS 106 21.118 3.574 18.505 820 HD1 HIS 106 HD1 HIS 106 21.505 1.436 20.058 821 HD2 HIS 106 HD2 HIS 106 22.018 0.839 15.974 822 HE1 HIS 106 HE1 HIS 106 22.806 -0.704 19.844 823 HE2 HIS 106 HE2 HIS 106 23.296 -0.920 17.385 824 H HIS 107 HN HIS 107 17.175 3.691 16.846 825 HA HIS 107 HA HIS 107 16.841 5.918 18.647 826 HB2 HIS 107 HB2 HIS 107 18.511 6.786 17.018 827 HB3 HIS 107 HB1 HIS 107 17.397 6.423 15.707 828 HD1 HIS 107 HD1 HIS 107 17.688 8.682 18.741 829 HD2 HIS 107 HD2 HIS 107 15.612 8.413 15.141 830 HE1 HIS 107 HE1 HIS 107 16.456 10.866 18.494 831 HE2 HIS 107 HE2 HIS 107 15.283 10.717 16.265 832 H HIS 108 HN HIS 108 14.879 4.945 19.087 833 HA HIS 108 HA HIS 108 12.718 4.322 18.866 834 HB2 HIS 108 HB2 HIS 108 12.230 6.469 17.871 835 HB3 HIS 108 HB1 HIS 108 12.860 5.945 16.313 836 HD1 HIS 108 HD1 HIS 108 9.992 5.129 18.679 837 HD2 HIS 108 HD2 HIS 108 10.972 4.918 14.642 838 HE1 HIS 108 HE1 HIS 108 7.908 4.341 17.515 839 HE2 HIS 108 HE2 HIS 108 8.603 3.992 15.115 840 H1 MET 1 HT1 MET 1 15.421 -6.548 32.186 841 H2 MET 1 HT2 MET 1 15.170 -5.828 33.703 842 H3 MET 1 HT3 MET 1 16.528 -5.403 32.773 843 HA MET 1 HA MET 1 13.704 -4.902 32.038 844 HB2 MET 1 HB2 MET 1 14.158 -2.561 32.458 845 HB3 MET 1 HB1 MET 1 14.497 -3.490 33.909 846 HG2 MET 1 HG2 MET 1 16.893 -3.408 33.384 847 HG3 MET 1 HG1 MET 1 16.536 -2.435 31.959 848 HE1 MET 1 HE1 MET 1 14.862 -2.265 35.550 849 HE2 MET 1 HE2 MET 1 15.893 -1.057 36.315 850 HE3 MET 1 HE3 MET 1 16.566 -2.617 35.851 851 H ALA 2 HN ALA 2 13.358 -4.223 30.009 852 HA ALA 2 HA ALA 2 15.612 -3.406 28.347 853 HB1 ALA 2 HB1 ALA 2 15.017 -4.943 26.544 854 HB2 ALA 2 HB2 ALA 2 13.761 -5.655 27.554 855 HB3 ALA 2 HB3 ALA 2 15.455 -5.829 28.006 856 H GLY 3 HN GLY 3 12.129 -4.110 28.409 857 HA2 GLY 3 HA2 GLY 3 10.823 -1.905 28.196 858 HA3 GLY 3 HA1 GLY 3 11.697 -1.763 26.676 859 H GLN 4 HN GLN 4 8.907 -2.866 28.144 860 HA GLN 4 HA GLN 4 8.414 -5.038 26.294 861 HB2 GLN 4 HB2 GLN 4 6.574 -3.763 28.331 862 HB3 GLN 4 HB1 GLN 4 6.246 -5.240 27.434 863 HG2 GLN 4 HG2 GLN 4 8.499 -4.847 29.388 864 HG3 GLN 4 HG1 GLN 4 6.984 -5.682 29.721 865 HE21 GLN 4 HE21 GLN 4 6.843 -6.959 27.112 866 HE22 GLN 4 HE22 GLN 4 8.055 -8.197 27.120 867 H SER 5 HN SER 5 8.666 -3.722 24.384 868 HA SER 5 HA SER 5 6.304 -2.073 23.800 869 HB2 SER 5 HB2 SER 5 9.040 -2.038 22.503 870 HB3 SER 5 HB1 SER 5 7.676 -1.021 22.031 871 HG SER 5 HG SER 5 7.711 -0.328 24.329 872 H ASP 6 HN ASP 6 5.376 -2.259 21.687 873 HA ASP 6 HA ASP 6 5.321 -5.065 20.880 874 HB2 ASP 6 HB2 ASP 6 3.226 -3.848 21.520 875 HB3 ASP 6 HB1 ASP 6 3.451 -2.809 20.116 876 H ARG 7 HN ARG 7 6.151 -5.753 18.999 877 HA ARG 7 HA ARG 7 7.381 -3.766 17.252 878 HB2 ARG 7 HB2 ARG 7 7.688 -6.773 17.347 879 HB3 ARG 7 HB1 ARG 7 8.561 -5.709 16.253 880 HG2 ARG 7 HG2 ARG 7 9.571 -4.577 18.189 881 HG3 ARG 7 HG1 ARG 7 8.736 -5.703 19.260 882 HD2 ARG 7 HD2 ARG 7 10.748 -6.449 17.138 883 HD3 ARG 7 HD1 ARG 7 11.070 -6.357 18.868 884 HE ARG 7 HE ARG 7 9.207 -8.289 17.627 885 HH11 ARG 7 HH11 ARG 7 11.597 -7.446 20.047 886 HH12 ARG 7 HH12 ARG 7 11.575 -9.010 20.798 887 HH21 ARG 7 HH21 ARG 7 9.178 -10.350 18.628 888 HH22 ARG 7 HH22 ARG 7 10.222 -10.655 19.984 889 H LYS 8 HN LYS 8 4.513 -5.363 17.415 890 HA LYS 8 HA LYS 8 4.185 -5.799 14.551 891 HB2 LYS 8 HB2 LYS 8 3.283 -7.412 16.212 892 HB3 LYS 8 HB1 LYS 8 2.248 -6.152 16.854 893 HG2 LYS 8 HG2 LYS 8 2.026 -6.811 13.971 894 HG3 LYS 8 HG1 LYS 8 1.373 -7.950 15.149 895 HD2 LYS 8 HD2 LYS 8 0.176 -5.924 16.161 896 HD3 LYS 8 HD1 LYS 8 0.586 -5.093 14.658 897 HE2 LYS 8 HE2 LYS 8 -1.627 -6.015 14.465 898 HE3 LYS 8 HE1 LYS 8 -0.537 -6.902 13.401 899 HZ1 LYS 8 HZ1 LYS 8 -0.360 -8.602 15.191 900 HZ2 LYS 8 HZ2 LYS 8 -1.911 -8.471 14.521 901 HZ3 LYS 8 HZ3 LYS 8 -1.584 -7.787 16.036 902 H ALA 9 HN ALA 9 3.014 -3.736 17.168 903 HA ALA 9 HA ALA 9 1.319 -2.067 15.675 904 HB1 ALA 9 HB1 ALA 9 1.396 -2.054 18.127 905 HB2 ALA 9 HB2 ALA 9 1.636 -0.434 17.470 906 HB3 ALA 9 HB3 ALA 9 3.014 -1.355 18.073 907 H ALA 10 HN ALA 10 4.797 -1.932 16.279 908 HA ALA 10 HA ALA 10 5.298 0.463 14.857 909 HB1 ALA 10 HB1 ALA 10 6.887 -0.482 16.469 910 HB2 ALA 10 HB2 ALA 10 7.634 -0.228 14.892 911 HB3 ALA 10 HB3 ALA 10 7.159 -1.851 15.391 912 H LEU 11 HN LEU 11 4.863 -2.844 13.915 913 HA LEU 11 HA LEU 11 5.967 -2.671 11.303 914 HB2 LEU 11 HB2 LEU 11 5.480 -4.771 12.618 915 HB3 LEU 11 HB1 LEU 11 3.781 -4.511 12.293 916 HG LEU 11 HG LEU 11 5.794 -4.865 10.077 917 HD11 LEU 11 HD11 LEU 11 5.914 -6.798 11.556 918 HD12 LEU 11 HD12 LEU 11 5.144 -7.216 10.027 919 HD13 LEU 11 HD13 LEU 11 4.163 -6.981 11.474 920 HD21 LEU 11 HD21 LEU 11 2.804 -5.286 10.206 921 HD22 LEU 11 HD22 LEU 11 3.830 -5.539 8.792 922 HD23 LEU 11 HD23 LEU 11 3.618 -3.915 9.449 923 H LEU 12 HN LEU 12 2.656 -2.501 12.568 924 HA LEU 12 HA LEU 12 1.389 -1.922 10.121 925 HB2 LEU 12 HB2 LEU 12 0.531 -1.211 12.926 926 HB3 LEU 12 HB1 LEU 12 -0.498 -1.152 11.509 927 HG LEU 12 HG LEU 12 0.729 -3.634 12.711 928 HD11 LEU 12 HD11 LEU 12 -1.580 -4.229 13.231 929 HD12 LEU 12 HD12 LEU 12 -2.130 -2.687 12.577 930 HD13 LEU 12 HD13 LEU 12 -1.116 -2.723 14.018 931 HD21 LEU 12 HD21 LEU 12 -0.597 -4.853 11.053 932 HD22 LEU 12 HD22 LEU 12 0.599 -3.811 10.284 933 HD23 LEU 12 HD23 LEU 12 -1.095 -3.324 10.328 934 H ASP 13 HN ASP 13 2.878 0.110 12.558 935 HA ASP 13 HA ASP 13 2.015 2.616 11.617 936 HB2 ASP 13 HB2 ASP 13 3.069 2.313 13.804 937 HB3 ASP 13 HB1 ASP 13 4.583 1.859 13.031 938 H GLN 14 HN GLN 14 4.809 0.628 10.764 939 HA GLN 14 HA GLN 14 5.931 2.570 9.001 940 HB2 GLN 14 HB2 GLN 14 6.479 -0.339 9.504 941 HB3 GLN 14 HB1 GLN 14 7.303 0.548 8.227 942 HG2 GLN 14 HG2 GLN 14 8.189 2.114 9.854 943 HG3 GLN 14 HG1 GLN 14 7.317 1.287 11.143 944 HE21 GLN 14 HE21 GLN 14 7.832 -1.360 10.163 945 HE22 GLN 14 HE22 GLN 14 9.500 -1.691 10.464 946 H VAL 15 HN VAL 15 3.959 -0.365 8.501 947 HA VAL 15 HA VAL 15 4.096 -0.172 5.664 948 HB VAL 15 HB VAL 15 2.295 -1.817 5.579 949 HG11 VAL 15 HG11 VAL 15 4.395 -2.408 7.662 950 HG12 VAL 15 HG12 VAL 15 4.556 -2.603 5.915 951 HG13 VAL 15 HG13 VAL 15 3.431 -3.618 6.815 952 HG21 VAL 15 HG21 VAL 15 1.298 -2.710 7.622 953 HG22 VAL 15 HG22 VAL 15 0.928 -0.998 7.431 954 HG23 VAL 15 HG23 VAL 15 2.166 -1.510 8.577 955 H ALA 16 HN ALA 16 1.994 1.227 8.073 956 HA ALA 16 HA ALA 16 0.028 2.195 6.254 957 HB1 ALA 16 HB1 ALA 16 0.792 3.272 8.969 958 HB2 ALA 16 HB2 ALA 16 -0.399 2.010 8.662 959 HB3 ALA 16 HB3 ALA 16 -0.681 3.647 8.075 960 H ARG 17 HN ARG 17 3.107 3.380 7.441 961 HA ARG 17 HA ARG 17 3.001 5.992 6.398 962 HB2 ARG 17 HB2 ARG 17 4.703 5.168 8.008 963 HB3 ARG 17 HB1 ARG 17 5.412 4.193 6.731 964 HG2 ARG 17 HG2 ARG 17 5.838 6.303 5.466 965 HG3 ARG 17 HG1 ARG 17 5.311 7.192 6.898 966 HD2 ARG 17 HD2 ARG 17 7.703 7.051 6.946 967 HD3 ARG 17 HD1 ARG 17 7.065 5.992 8.205 968 HE ARG 17 HE ARG 17 7.663 4.762 5.628 969 HH11 ARG 17 HH11 ARG 17 8.686 5.374 8.917 970 HH12 ARG 17 HH12 ARG 17 9.870 4.101 8.931 971 HH21 ARG 17 HH21 ARG 17 9.216 3.099 5.628 972 HH22 ARG 17 HH22 ARG 17 10.181 2.811 7.046 973 H VAL 18 HN VAL 18 4.158 2.941 5.035 974 HA VAL 18 HA VAL 18 5.020 3.897 2.544 975 HB VAL 18 HB VAL 18 3.878 1.175 3.223 976 HG11 VAL 18 HG11 VAL 18 5.571 2.043 0.883 977 HG12 VAL 18 HG12 VAL 18 3.875 1.566 0.821 978 HG13 VAL 18 HG13 VAL 18 5.108 0.383 1.256 979 HG21 VAL 18 HG21 VAL 18 6.243 0.500 3.417 980 HG22 VAL 18 HG22 VAL 18 5.782 1.709 4.616 981 HG23 VAL 18 HG23 VAL 18 6.721 2.185 3.201 982 H GLY 19 HN GLY 19 1.898 2.453 3.474 983 HA2 GLY 19 HA2 GLY 19 0.648 2.784 0.972 984 HA3 GLY 19 HA1 GLY 19 -0.180 2.585 2.510 985 H LYS 20 HN LYS 20 1.076 4.963 3.664 986 HA LYS 20 HA LYS 20 -0.858 6.885 2.957 987 HB2 LYS 20 HB2 LYS 20 0.344 6.679 5.164 988 HB3 LYS 20 HB1 LYS 20 1.756 7.376 4.391 989 HG2 LYS 20 HG2 LYS 20 0.538 9.426 3.954 990 HG3 LYS 20 HG1 LYS 20 -0.919 8.725 4.659 991 HD2 LYS 20 HD2 LYS 20 1.685 9.222 6.106 992 HD3 LYS 20 HD1 LYS 20 0.221 10.195 6.252 993 HE2 LYS 20 HE2 LYS 20 -0.976 8.243 7.139 994 HE3 LYS 20 HE1 LYS 20 0.495 7.281 7.000 995 HZ1 LYS 20 HZ1 LYS 20 1.569 8.750 8.588 996 HZ2 LYS 20 HZ2 LYS 20 0.166 8.082 9.258 997 HZ3 LYS 20 HZ3 LYS 20 0.159 9.688 8.713 998 H ALA 21 HN ALA 21 2.481 6.374 1.982 999 HA ALA 21 HA ALA 21 2.643 8.794 0.444 1000 HB1 ALA 21 HB1 ALA 21 4.400 6.346 0.376 1001 HB2 ALA 21 HB2 ALA 21 4.648 7.768 1.389 1002 HB3 ALA 21 HB3 ALA 21 4.765 7.903 -0.365 1003 H LEU 22 HN LEU 22 1.676 5.493 -0.138 1004 HA LEU 22 HA LEU 22 1.683 5.643 -2.989 1005 HB2 LEU 22 HB2 LEU 22 0.140 3.799 -1.162 1006 HB3 LEU 22 HB1 LEU 22 0.338 3.587 -2.890 1007 HG LEU 22 HG LEU 22 2.562 3.487 -0.850 1008 HD11 LEU 22 HD11 LEU 22 1.076 1.574 -0.681 1009 HD12 LEU 22 HD12 LEU 22 2.621 1.098 -1.389 1010 HD13 LEU 22 HD13 LEU 22 1.203 1.301 -2.419 1011 HD21 LEU 22 HD21 LEU 22 3.940 2.711 -2.711 1012 HD22 LEU 22 HD22 LEU 22 3.310 4.329 -3.022 1013 HD23 LEU 22 HD23 LEU 22 2.582 2.933 -3.816 1014 H ALA 23 HN ALA 23 -0.661 6.272 -0.464 1015 HA ALA 23 HA ALA 23 -2.921 6.586 -2.144 1016 HB1 ALA 23 HB1 ALA 23 -3.979 7.625 -0.210 1017 HB2 ALA 23 HB2 ALA 23 -2.413 7.746 0.595 1018 HB3 ALA 23 HB3 ALA 23 -3.114 6.162 0.259 1019 H ASN 24 HN ASN 24 -2.461 7.892 -3.844 1020 HA ASN 24 HA ASN 24 -2.788 10.669 -3.573 1021 HB2 ASN 24 HB2 ASN 24 -0.471 10.633 -2.756 1022 HB3 ASN 24 HB1 ASN 24 0.035 9.764 -4.201 1023 HD21 ASN 24 HD21 ASN 24 -0.897 12.809 -2.868 1024 HD22 ASN 24 HD22 ASN 24 -0.480 13.771 -4.243 1025 H GLY 25 HN GLY 25 -1.333 8.098 -5.515 1026 HA2 GLY 25 HA2 GLY 25 -2.099 7.356 -7.596 1027 HA3 GLY 25 HA1 GLY 25 -3.107 8.789 -7.711 1028 H ARG 26 HN ARG 26 -1.445 10.869 -7.565 1029 HA ARG 26 HA ARG 26 -0.283 10.800 -10.170 1030 HB2 ARG 26 HB2 ARG 26 -0.049 12.962 -8.069 1031 HB3 ARG 26 HB1 ARG 26 0.334 13.132 -9.776 1032 HG2 ARG 26 HG2 ARG 26 -1.740 13.988 -9.881 1033 HG3 ARG 26 HG1 ARG 26 -2.220 12.292 -9.949 1034 HD2 ARG 26 HD2 ARG 26 -3.542 13.533 -8.309 1035 HD3 ARG 26 HD1 ARG 26 -2.566 12.281 -7.539 1036 HE ARG 26 HE ARG 26 -1.137 14.708 -7.535 1037 HH11 ARG 26 HH11 ARG 26 -3.947 13.268 -6.035 1038 HH12 ARG 26 HH12 ARG 26 -3.793 14.183 -4.569 1039 HH21 ARG 26 HH21 ARG 26 -0.885 15.881 -5.609 1040 HH22 ARG 26 HH22 ARG 26 -2.029 15.672 -4.310 1041 H ARG 27 HN ARG 27 1.002 10.761 -6.901 1042 HA ARG 27 HA ARG 27 3.726 11.090 -7.593 1043 HB2 ARG 27 HB2 ARG 27 2.366 9.944 -5.160 1044 HB3 ARG 27 HB1 ARG 27 4.115 10.050 -5.297 1045 HG2 ARG 27 HG2 ARG 27 3.993 12.455 -5.502 1046 HG3 ARG 27 HG1 ARG 27 2.230 12.393 -5.475 1047 HD2 ARG 27 HD2 ARG 27 2.229 11.599 -3.217 1048 HD3 ARG 27 HD1 ARG 27 3.979 11.387 -3.242 1049 HE ARG 27 HE ARG 27 3.632 14.035 -3.773 1050 HH11 ARG 27 HH11 ARG 27 2.439 11.930 -1.229 1051 HH12 ARG 27 HH12 ARG 27 2.549 13.155 -0.002 1052 HH21 ARG 27 HH21 ARG 27 3.752 15.656 -2.153 1053 HH22 ARG 27 HH22 ARG 27 3.286 15.264 -0.520 1054 H LEU 28 HN LEU 28 1.658 8.468 -8.083 1055 HA LEU 28 HA LEU 28 3.501 6.347 -7.620 1056 HB2 LEU 28 HB2 LEU 28 0.996 6.391 -9.297 1057 HB3 LEU 28 HB1 LEU 28 1.883 4.949 -8.838 1058 HG LEU 28 HG LEU 28 0.454 6.829 -6.950 1059 HD11 LEU 28 HD11 LEU 28 -0.152 3.990 -7.767 1060 HD12 LEU 28 HD12 LEU 28 -1.049 5.426 -8.262 1061 HD13 LEU 28 HD13 LEU 28 -1.035 4.938 -6.566 1062 HD21 LEU 28 HD21 LEU 28 1.939 4.267 -6.368 1063 HD22 LEU 28 HD22 LEU 28 1.030 5.234 -5.206 1064 HD23 LEU 28 HD23 LEU 28 2.489 5.891 -5.950 1065 H GLN 29 HN GLN 29 3.067 8.578 -10.188 1066 HA GLN 29 HA GLN 29 4.181 7.078 -12.309 1067 HB2 GLN 29 HB2 GLN 29 4.237 10.062 -11.810 1068 HB3 GLN 29 HB1 GLN 29 4.696 9.288 -13.321 1069 HG2 GLN 29 HG2 GLN 29 2.393 8.362 -13.467 1070 HG3 GLN 29 HG1 GLN 29 1.973 9.322 -12.050 1071 HE21 GLN 29 HE21 GLN 29 1.875 11.573 -12.233 1072 HE22 GLN 29 HE22 GLN 29 1.758 12.356 -13.770 1073 H ILE 30 HN ILE 30 5.547 8.751 -9.597 1074 HA ILE 30 HA ILE 30 8.225 8.927 -10.473 1075 HB ILE 30 HB ILE 30 7.166 8.616 -7.656 1076 HG12 ILE 30 HG12 ILE 30 6.222 10.575 -8.801 1077 HG13 ILE 30 HG11 ILE 30 7.317 11.051 -7.510 1078 HG21 ILE 30 HG21 ILE 30 9.279 9.646 -6.956 1079 HG22 ILE 30 HG22 ILE 30 9.843 9.605 -8.626 1080 HG23 ILE 30 HG23 ILE 30 9.527 8.100 -7.763 1081 HD11 ILE 30 HD11 ILE 30 7.624 12.449 -9.453 1082 HD12 ILE 30 HD12 ILE 30 7.940 11.029 -10.451 1083 HD13 ILE 30 HD13 ILE 30 9.065 11.474 -9.168 1084 H LEU 31 HN LEU 31 6.462 6.495 -8.610 1085 HA LEU 31 HA LEU 31 8.616 4.745 -8.162 1086 HB2 LEU 31 HB2 LEU 31 5.668 4.117 -8.352 1087 HB3 LEU 31 HB1 LEU 31 6.889 3.074 -7.650 1088 HG LEU 31 HG LEU 31 6.097 5.789 -6.594 1089 HD11 LEU 31 HD11 LEU 31 4.353 4.108 -6.291 1090 HD12 LEU 31 HD12 LEU 31 5.097 4.550 -4.754 1091 HD13 LEU 31 HD13 LEU 31 5.524 3.026 -5.536 1092 HD21 LEU 31 HD21 LEU 31 7.966 3.707 -5.466 1093 HD22 LEU 31 HD22 LEU 31 7.485 5.209 -4.675 1094 HD23 LEU 31 HD23 LEU 31 8.438 5.261 -6.157 1095 H ASP 32 HN ASP 32 6.227 4.952 -10.746 1096 HA ASP 32 HA ASP 32 6.854 2.602 -12.122 1097 HB2 ASP 32 HB2 ASP 32 4.871 3.911 -12.640 1098 HB3 ASP 32 HB1 ASP 32 5.863 5.262 -13.172 1099 H LEU 33 HN LEU 33 8.197 5.865 -12.436 1100 HA LEU 33 HA LEU 33 9.932 5.211 -14.589 1101 HB2 LEU 33 HB2 LEU 33 9.171 7.501 -14.124 1102 HB3 LEU 33 HB1 LEU 33 10.074 7.496 -12.621 1103 HG LEU 33 HG LEU 33 12.175 7.270 -13.908 1104 HD11 LEU 33 HD11 LEU 33 12.142 7.637 -16.326 1105 HD12 LEU 33 HD12 LEU 33 10.379 7.618 -16.305 1106 HD13 LEU 33 HD13 LEU 33 11.281 6.161 -15.884 1107 HD21 LEU 33 HD21 LEU 33 11.411 9.467 -13.213 1108 HD22 LEU 33 HD22 LEU 33 10.432 9.609 -14.673 1109 HD23 LEU 33 HD23 LEU 33 12.191 9.560 -14.792 1110 H LEU 34 HN LEU 34 10.376 5.432 -11.077 1111 HA LEU 34 HA LEU 34 13.212 5.004 -11.268 1112 HB2 LEU 34 HB2 LEU 34 11.412 4.967 -8.848 1113 HB3 LEU 34 HB1 LEU 34 13.164 4.992 -8.815 1114 HG LEU 34 HG LEU 34 11.333 7.181 -9.783 1115 HD11 LEU 34 HD11 LEU 34 12.403 8.468 -7.991 1116 HD12 LEU 34 HD12 LEU 34 13.312 7.032 -7.519 1117 HD13 LEU 34 HD13 LEU 34 11.554 7.048 -7.376 1118 HD21 LEU 34 HD21 LEU 34 14.344 7.042 -9.884 1119 HD22 LEU 34 HD22 LEU 34 13.370 8.465 -10.244 1120 HD23 LEU 34 HD23 LEU 34 13.255 7.036 -11.269 1121 H ALA 35 HN ALA 35 10.597 2.941 -11.449 1122 HA ALA 35 HA ALA 35 12.042 0.645 -10.378 1123 HB1 ALA 35 HB1 ALA 35 9.637 0.778 -9.961 1124 HB2 ALA 35 HB2 ALA 35 10.027 -0.631 -10.947 1125 HB3 ALA 35 HB3 ALA 35 9.329 0.804 -11.697 1126 H GLN 36 HN GLN 36 12.297 2.415 -13.041 1127 HA GLN 36 HA GLN 36 12.800 0.120 -14.815 1128 HB2 GLN 36 HB2 GLN 36 12.077 2.984 -15.442 1129 HB3 GLN 36 HB1 GLN 36 12.642 1.847 -16.660 1130 HG2 GLN 36 HG2 GLN 36 10.740 0.432 -16.304 1131 HG3 GLN 36 HG1 GLN 36 10.213 1.415 -14.938 1132 HE21 GLN 36 HE21 GLN 36 9.170 3.336 -15.303 1133 HE22 GLN 36 HE22 GLN 36 8.605 3.816 -16.867 1134 H GLY 37 HN GLY 37 14.422 1.901 -12.743 1135 HA2 GLY 37 HA2 GLY 37 16.930 1.382 -13.175 1136 HA3 GLY 37 HA1 GLY 37 16.697 2.522 -14.494 1137 H GLU 38 HN GLU 38 18.377 3.786 -13.404 1138 HA GLU 38 HA GLU 38 17.284 5.277 -11.118 1139 HB2 GLU 38 HB2 GLU 38 19.520 5.900 -10.498 1140 HB3 GLU 38 HB1 GLU 38 19.478 4.159 -10.708 1141 HG2 GLU 38 HG2 GLU 38 20.508 6.089 -12.778 1142 HG3 GLU 38 HG1 GLU 38 21.521 5.263 -11.598 1143 H ARG 39 HN ARG 39 16.729 7.340 -11.412 1144 HA ARG 39 HA ARG 39 17.725 8.661 -13.852 1145 HB2 ARG 39 HB2 ARG 39 14.967 9.004 -12.660 1146 HB3 ARG 39 HB1 ARG 39 15.581 9.788 -14.106 1147 HG2 ARG 39 HG2 ARG 39 15.042 6.850 -13.741 1148 HG3 ARG 39 HG1 ARG 39 14.104 7.988 -14.706 1149 HD2 ARG 39 HD2 ARG 39 16.949 7.116 -15.205 1150 HD3 ARG 39 HD1 ARG 39 15.529 6.652 -16.138 1151 HE ARG 39 HE ARG 39 16.824 9.287 -16.125 1152 HH11 ARG 39 HH11 ARG 39 14.439 7.083 -17.457 1153 HH12 ARG 39 HH12 ARG 39 14.169 8.039 -18.886 1154 HH21 ARG 39 HH21 ARG 39 16.506 10.519 -18.022 1155 HH22 ARG 39 HH22 ARG 39 15.366 9.982 -19.227 1156 H ALA 40 HN ALA 40 18.326 10.780 -13.683 1157 HA ALA 40 HA ALA 40 18.963 11.756 -11.072 1158 HB1 ALA 40 HB1 ALA 40 20.398 12.231 -12.986 1159 HB2 ALA 40 HB2 ALA 40 19.820 13.728 -12.255 1160 HB3 ALA 40 HB3 ALA 40 19.095 13.141 -13.752 1161 H VAL 41 HN VAL 41 18.207 13.736 -10.137 1162 HA VAL 41 HA VAL 41 15.469 13.985 -9.901 1163 HB VAL 41 HB VAL 41 17.467 16.220 -9.505 1164 HG11 VAL 41 HG11 VAL 41 15.175 17.019 -9.499 1165 HG12 VAL 41 HG12 VAL 41 15.850 17.072 -7.869 1166 HG13 VAL 41 HG13 VAL 41 14.730 15.786 -8.318 1167 HG21 VAL 41 HG21 VAL 41 16.543 14.071 -7.602 1168 HG22 VAL 41 HG22 VAL 41 17.533 15.462 -7.161 1169 HG23 VAL 41 HG23 VAL 41 18.161 14.252 -8.279 1170 H GLU 42 HN GLU 42 17.639 15.778 -12.044 1171 HA GLU 42 HA GLU 42 15.787 17.598 -13.088 1172 HB2 GLU 42 HB2 GLU 42 18.195 16.373 -14.437 1173 HB3 GLU 42 HB1 GLU 42 17.366 17.834 -14.955 1174 HG2 GLU 42 HG2 GLU 42 18.026 18.988 -12.965 1175 HG3 GLU 42 HG1 GLU 42 18.696 17.512 -12.277 1176 H ALA 43 HN ALA 43 16.642 14.321 -14.095 1177 HA ALA 43 HA ALA 43 15.061 14.323 -16.460 1178 HB1 ALA 43 HB1 ALA 43 15.469 11.926 -16.508 1179 HB2 ALA 43 HB2 ALA 43 16.081 11.983 -14.855 1180 HB3 ALA 43 HB3 ALA 43 16.957 12.801 -16.147 1181 H ILE 44 HN ILE 44 14.560 13.108 -13.173 1182 HA ILE 44 HA ILE 44 12.054 11.911 -13.546 1183 HB ILE 44 HB ILE 44 13.080 13.307 -11.066 1184 HG12 ILE 44 HG12 ILE 44 13.275 10.392 -11.846 1185 HG13 ILE 44 HG11 ILE 44 14.597 11.549 -11.968 1186 HG21 ILE 44 HG21 ILE 44 10.955 11.195 -11.398 1187 HG22 ILE 44 HG22 ILE 44 10.689 12.887 -10.969 1188 HG23 ILE 44 HG23 ILE 44 11.552 11.820 -9.859 1189 HD11 ILE 44 HD11 ILE 44 14.569 11.858 -9.561 1190 HD12 ILE 44 HD12 ILE 44 14.780 10.156 -9.979 1191 HD13 ILE 44 HD13 ILE 44 13.211 10.740 -9.422 1192 H ALA 45 HN ALA 45 12.937 15.193 -12.593 1193 HA ALA 45 HA ALA 45 10.404 16.293 -12.242 1194 HB1 ALA 45 HB1 ALA 45 11.481 18.455 -12.652 1195 HB2 ALA 45 HB2 ALA 45 12.895 17.630 -13.311 1196 HB3 ALA 45 HB3 ALA 45 12.474 17.434 -11.609 1197 H THR 46 HN THR 46 12.442 16.256 -15.143 1198 HA THR 46 HA THR 46 10.679 17.593 -16.847 1199 HB THR 46 HB THR 46 12.724 15.500 -17.610 1200 HG1 THR 46 HG1 THR 46 13.814 17.038 -16.448 1201 HG21 THR 46 HG21 THR 46 11.223 16.118 -19.442 1202 HG22 THR 46 HG22 THR 46 12.851 16.735 -19.721 1203 HG23 THR 46 HG23 THR 46 11.578 17.824 -19.166 1204 H ALA 47 HN ALA 47 11.152 14.103 -16.319 1205 HA ALA 47 HA ALA 47 9.440 13.209 -18.355 1206 HB1 ALA 47 HB1 ALA 47 10.165 11.787 -15.798 1207 HB2 ALA 47 HB2 ALA 47 11.140 11.810 -17.269 1208 HB3 ALA 47 HB3 ALA 47 9.551 11.045 -17.275 1209 H THR 48 HN THR 48 8.769 14.101 -15.010 1210 HA THR 48 HA THR 48 6.055 13.093 -15.199 1211 HB THR 48 HB THR 48 5.840 14.108 -12.881 1212 HG1 THR 48 HG1 THR 48 8.672 14.238 -12.928 1213 HG21 THR 48 HG21 THR 48 7.155 12.319 -11.823 1214 HG22 THR 48 HG22 THR 48 7.997 12.040 -13.348 1215 HG23 THR 48 HG23 THR 48 6.265 11.728 -13.226 1216 H GLY 49 HN GLY 49 7.735 16.046 -15.753 1217 HA2 GLY 49 HA2 GLY 49 6.804 17.950 -16.772 1218 HA3 GLY 49 HA1 GLY 49 5.202 17.381 -16.323 1219 H MET 50 HN MET 50 7.296 17.137 -13.730 1220 HA MET 50 HA MET 50 6.223 19.633 -12.587 1221 HB2 MET 50 HB2 MET 50 7.199 17.136 -11.176 1222 HB3 MET 50 HB1 MET 50 6.586 18.580 -10.383 1223 HG2 MET 50 HG2 MET 50 4.409 18.228 -11.452 1224 HG3 MET 50 HG1 MET 50 5.030 16.760 -12.204 1225 HE1 MET 50 HE1 MET 50 5.743 14.586 -10.847 1226 HE2 MET 50 HE2 MET 50 5.697 14.476 -9.086 1227 HE3 MET 50 HE3 MET 50 6.849 15.557 -9.871 1228 H ASN 51 HN ASN 51 7.634 21.216 -12.205 1229 HA ASN 51 HA ASN 51 10.314 21.076 -12.941 1230 HB2 ASN 51 HB2 ASN 51 9.061 23.182 -12.816 1231 HB3 ASN 51 HB1 ASN 51 8.999 23.051 -11.061 1232 HD21 ASN 51 HD21 ASN 51 10.678 23.738 -9.875 1233 HD22 ASN 51 HD22 ASN 51 12.141 24.403 -10.535 1234 H LEU 52 HN LEU 52 12.245 21.392 -11.599 1235 HA LEU 52 HA LEU 52 12.747 19.138 -10.169 1236 HB2 LEU 52 HB2 LEU 52 14.134 21.785 -10.201 1237 HB3 LEU 52 HB1 LEU 52 14.711 20.498 -9.160 1238 HG LEU 52 HG LEU 52 14.885 19.052 -11.232 1239 HD11 LEU 52 HD11 LEU 52 13.432 20.323 -12.704 1240 HD12 LEU 52 HD12 LEU 52 15.058 20.203 -13.380 1241 HD13 LEU 52 HD13 LEU 52 14.528 21.703 -12.616 1242 HD21 LEU 52 HD21 LEU 52 16.577 21.533 -11.012 1243 HD22 LEU 52 HD22 LEU 52 16.999 20.102 -11.949 1244 HD23 LEU 52 HD23 LEU 52 16.842 19.990 -10.196 1245 H THR 53 HN THR 53 11.975 22.301 -8.697 1246 HA THR 53 HA THR 53 12.344 21.502 -6.037 1247 HB THR 53 HB THR 53 10.365 23.576 -7.002 1248 HG1 THR 53 HG1 THR 53 12.028 24.843 -7.427 1249 HG21 THR 53 HG21 THR 53 10.813 24.646 -4.854 1250 HG22 THR 53 HG22 THR 53 11.924 23.347 -4.423 1251 HG23 THR 53 HG23 THR 53 10.203 23.008 -4.613 1252 H THR 54 HN THR 54 9.424 21.507 -8.048 1253 HA THR 54 HA THR 54 7.681 20.447 -6.087 1254 HB THR 54 HB THR 54 7.432 20.183 -9.089 1255 HG1 THR 54 HG1 THR 54 6.317 22.269 -7.512 1256 HG21 THR 54 HG21 THR 54 5.027 20.164 -8.635 1257 HG22 THR 54 HG22 THR 54 5.348 20.271 -6.905 1258 HG23 THR 54 HG23 THR 54 5.837 18.836 -7.806 1259 H ALA 55 HN ALA 55 9.666 18.983 -8.623 1260 HA ALA 55 HA ALA 55 8.736 16.343 -8.351 1261 HB1 ALA 55 HB1 ALA 55 10.018 17.103 -10.282 1262 HB2 ALA 55 HB2 ALA 55 10.770 15.695 -9.534 1263 HB3 ALA 55 HB3 ALA 55 11.442 17.302 -9.262 1264 H SER 56 HN SER 56 11.573 17.949 -6.912 1265 HA SER 56 HA SER 56 12.430 15.662 -5.488 1266 HB2 SER 56 HB2 SER 56 13.808 17.340 -4.176 1267 HB3 SER 56 HB1 SER 56 14.046 17.351 -5.925 1268 HG SER 56 HG SER 56 12.819 19.193 -6.073 1269 H ALA 57 HN ALA 57 10.105 18.150 -4.766 1270 HA ALA 57 HA ALA 57 9.850 17.657 -1.994 1271 HB1 ALA 57 HB1 ALA 57 7.773 18.651 -3.947 1272 HB2 ALA 57 HB2 ALA 57 8.915 19.649 -3.051 1273 HB3 ALA 57 HB3 ALA 57 7.665 18.750 -2.189 1274 H ASN 58 HN ASN 58 8.153 16.333 -4.817 1275 HA ASN 58 HA ASN 58 6.544 14.527 -3.319 1276 HB2 ASN 58 HB2 ASN 58 7.280 14.685 -6.241 1277 HB3 ASN 58 HB1 ASN 58 6.290 13.375 -5.605 1278 HD21 ASN 58 HD21 ASN 58 6.423 16.766 -6.358 1279 HD22 ASN 58 HD22 ASN 58 4.729 17.072 -6.164 1280 H LEU 59 HN LEU 59 9.674 14.280 -4.920 1281 HA LEU 59 HA LEU 59 10.149 11.546 -4.590 1282 HB2 LEU 59 HB2 LEU 59 12.050 13.886 -4.549 1283 HB3 LEU 59 HB1 LEU 59 12.585 12.218 -4.538 1284 HG LEU 59 HG LEU 59 10.942 13.463 -6.744 1285 HD11 LEU 59 HD11 LEU 59 13.895 12.867 -6.627 1286 HD12 LEU 59 HD12 LEU 59 13.162 14.471 -6.623 1287 HD13 LEU 59 HD13 LEU 59 13.009 13.433 -8.043 1288 HD21 LEU 59 HD21 LEU 59 11.515 11.452 -7.979 1289 HD22 LEU 59 HD22 LEU 59 10.661 11.041 -6.494 1290 HD23 LEU 59 HD23 LEU 59 12.409 10.833 -6.591 1291 H GLN 60 HN GLN 60 10.826 14.261 -2.423 1292 HA GLN 60 HA GLN 60 12.087 12.781 -0.392 1293 HB2 GLN 60 HB2 GLN 60 12.135 15.278 -0.663 1294 HB3 GLN 60 HB1 GLN 60 10.489 15.323 -0.048 1295 HG2 GLN 60 HG2 GLN 60 11.254 14.333 2.055 1296 HG3 GLN 60 HG1 GLN 60 12.905 14.316 1.435 1297 HE21 GLN 60 HE21 GLN 60 10.322 16.273 2.664 1298 HE22 GLN 60 HE22 GLN 60 11.253 17.724 2.875 1299 H ALA 61 HN ALA 61 8.698 13.555 -0.982 1300 HA ALA 61 HA ALA 61 7.685 12.640 1.486 1301 HB1 ALA 61 HB1 ALA 61 6.403 14.069 -0.020 1302 HB2 ALA 61 HB2 ALA 61 5.516 12.594 0.368 1303 HB3 ALA 61 HB3 ALA 61 6.313 12.758 -1.197 1304 H LEU 62 HN LEU 62 8.179 11.023 -1.631 1305 HA LEU 62 HA LEU 62 7.081 8.535 -0.785 1306 HB2 LEU 62 HB2 LEU 62 8.928 9.199 -3.075 1307 HB3 LEU 62 HB1 LEU 62 8.175 7.635 -2.834 1308 HG LEU 62 HG LEU 62 6.721 10.230 -3.353 1309 HD11 LEU 62 HD11 LEU 62 7.169 7.811 -5.096 1310 HD12 LEU 62 HD12 LEU 62 7.877 9.410 -5.319 1311 HD13 LEU 62 HD13 LEU 62 6.138 9.187 -5.491 1312 HD21 LEU 62 HD21 LEU 62 4.713 8.889 -3.481 1313 HD22 LEU 62 HD22 LEU 62 5.463 8.689 -1.898 1314 HD23 LEU 62 HD23 LEU 62 5.631 7.428 -3.119 1315 H LYS 63 HN LYS 63 10.332 9.897 -0.841 1316 HA LYS 63 HA LYS 63 11.670 7.516 -0.071 1317 HB2 LYS 63 HB2 LYS 63 12.758 9.599 -1.030 1318 HB3 LYS 63 HB1 LYS 63 12.555 10.337 0.556 1319 HG2 LYS 63 HG2 LYS 63 13.887 8.488 1.528 1320 HG3 LYS 63 HG1 LYS 63 14.179 7.890 -0.104 1321 HD2 LYS 63 HD2 LYS 63 15.209 10.092 -0.653 1322 HD3 LYS 63 HD1 LYS 63 15.035 10.544 1.046 1323 HE2 LYS 63 HE2 LYS 63 16.371 8.508 1.629 1324 HE3 LYS 63 HE1 LYS 63 16.670 8.281 -0.091 1325 HZ1 LYS 63 HZ1 LYS 63 18.514 9.416 0.857 1326 HZ2 LYS 63 HZ2 LYS 63 17.516 10.578 1.587 1327 HZ3 LYS 63 HZ3 LYS 63 17.672 10.536 -0.098 1328 H SER 64 HN SER 64 10.161 10.167 1.691 1329 HA SER 64 HA SER 64 10.916 9.388 4.290 1330 HB2 SER 64 HB2 SER 64 9.991 11.605 3.786 1331 HB3 SER 64 HB1 SER 64 8.443 10.874 3.368 1332 HG SER 64 HG SER 64 9.340 10.146 5.848 1333 H GLY 65 HN GLY 65 8.414 8.291 2.123 1334 HA2 GLY 65 HA2 GLY 65 6.991 6.745 4.072 1335 HA3 GLY 65 HA1 GLY 65 6.845 6.612 2.323 1336 H GLY 66 HN GLY 66 9.783 6.242 2.072 1337 HA2 GLY 66 HA2 GLY 66 11.391 4.558 2.597 1338 HA3 GLY 66 HA1 GLY 66 10.090 3.560 3.233 1339 H LEU 67 HN LEU 67 9.568 5.193 0.249 1340 HA LEU 67 HA LEU 67 9.327 2.636 -1.100 1341 HB2 LEU 67 HB2 LEU 67 8.605 5.458 -1.858 1342 HB3 LEU 67 HB1 LEU 67 8.541 4.150 -3.020 1343 HG LEU 67 HG LEU 67 6.335 4.539 -2.199 1344 HD11 LEU 67 HD11 LEU 67 5.754 2.358 -1.316 1345 HD12 LEU 67 HD12 LEU 67 7.443 2.060 -0.907 1346 HD13 LEU 67 HD13 LEU 67 6.960 2.217 -2.594 1347 HD21 LEU 67 HD21 LEU 67 6.855 5.674 -0.122 1348 HD22 LEU 67 HD22 LEU 67 7.451 4.165 0.578 1349 HD23 LEU 67 HD23 LEU 67 5.742 4.335 0.170 1350 H VAL 68 HN VAL 68 11.070 5.697 -1.662 1351 HA VAL 68 HA VAL 68 12.763 4.230 -3.568 1352 HB VAL 68 HB VAL 68 13.141 6.366 -4.738 1353 HG11 VAL 68 HG11 VAL 68 10.930 6.526 -5.777 1354 HG12 VAL 68 HG12 VAL 68 10.234 5.614 -4.438 1355 HG13 VAL 68 HG13 VAL 68 11.402 4.846 -5.516 1356 HG21 VAL 68 HG21 VAL 68 11.054 7.445 -2.841 1357 HG22 VAL 68 HG22 VAL 68 11.696 8.295 -4.246 1358 HG23 VAL 68 HG23 VAL 68 12.755 7.907 -2.889 1359 H GLU 69 HN GLU 69 14.935 5.109 -3.873 1360 HA GLU 69 HA GLU 69 16.016 6.414 -1.472 1361 HB2 GLU 69 HB2 GLU 69 16.729 3.838 -2.654 1362 HB3 GLU 69 HB1 GLU 69 18.113 4.906 -2.458 1363 HG2 GLU 69 HG2 GLU 69 16.197 4.048 -0.298 1364 HG3 GLU 69 HG1 GLU 69 17.856 3.488 -0.518 1365 H ALA 70 HN ALA 70 18.363 7.189 -2.015 1366 HA ALA 70 HA ALA 70 18.466 8.258 -4.742 1367 HB1 ALA 70 HB1 ALA 70 18.882 10.523 -3.942 1368 HB2 ALA 70 HB2 ALA 70 18.653 9.989 -2.278 1369 HB3 ALA 70 HB3 ALA 70 17.301 9.952 -3.410 1370 H ARG 71 HN ARG 71 20.471 8.176 -5.552 1371 HA ARG 71 HA ARG 71 22.683 7.782 -3.648 1372 HB2 ARG 71 HB2 ARG 71 23.890 6.640 -5.407 1373 HB3 ARG 71 HB1 ARG 71 22.308 5.899 -5.213 1374 HG2 ARG 71 HG2 ARG 71 21.581 6.583 -7.254 1375 HG3 ARG 71 HG1 ARG 71 22.585 8.034 -7.249 1376 HD2 ARG 71 HD2 ARG 71 23.607 5.217 -7.594 1377 HD3 ARG 71 HD1 ARG 71 23.324 6.358 -8.909 1378 HE ARG 71 HE ARG 71 25.018 7.577 -7.050 1379 HH11 ARG 71 HH11 ARG 71 25.087 4.878 -9.269 1380 HH12 ARG 71 HH12 ARG 71 26.791 5.004 -9.582 1381 HH21 ARG 71 HH21 ARG 71 27.251 7.746 -7.418 1382 HH22 ARG 71 HH22 ARG 71 28.027 6.653 -8.529 1383 H ARG 72 HN ARG 72 24.705 8.782 -4.112 1384 HA ARG 72 HA ARG 72 24.406 11.368 -5.436 1385 HB2 ARG 72 HB2 ARG 72 26.659 10.228 -3.769 1386 HB3 ARG 72 HB1 ARG 72 26.652 11.843 -4.461 1387 HG2 ARG 72 HG2 ARG 72 24.650 10.809 -2.467 1388 HG3 ARG 72 HG1 ARG 72 26.049 11.811 -2.079 1389 HD2 ARG 72 HD2 ARG 72 23.776 12.596 -3.906 1390 HD3 ARG 72 HD1 ARG 72 23.981 13.129 -2.239 1391 HE ARG 72 HE ARG 72 26.255 13.728 -3.886 1392 HH11 ARG 72 HH11 ARG 72 23.086 14.849 -2.880 1393 HH12 ARG 72 HH12 ARG 72 23.409 16.508 -3.285 1394 HH21 ARG 72 HH21 ARG 72 26.672 15.903 -4.407 1395 HH22 ARG 72 HH22 ARG 72 25.436 17.102 -4.171 1396 H GLU 73 HN GLU 73 25.285 11.844 -7.368 1397 HA GLU 73 HA GLU 73 27.530 10.234 -8.325 1398 HB2 GLU 73 HB2 GLU 73 25.556 9.256 -9.392 1399 HB3 GLU 73 HB1 GLU 73 25.067 10.839 -9.978 1400 HG2 GLU 73 HG2 GLU 73 26.095 9.512 -11.739 1401 HG3 GLU 73 HG1 GLU 73 27.039 10.957 -11.387 1402 H GLY 74 HN GLY 74 28.981 11.812 -8.113 1403 HA2 GLY 74 HA2 GLY 74 30.151 13.714 -8.646 1404 HA3 GLY 74 HA1 GLY 74 29.015 13.970 -9.964 1405 H THR 75 HN THR 75 27.608 15.576 -9.800 1406 HA THR 75 HA THR 75 27.493 17.014 -7.241 1407 HB THR 75 HB THR 75 26.785 17.992 -10.016 1408 HG1 THR 75 HG1 THR 75 29.021 17.589 -9.801 1409 HG21 THR 75 HG21 THR 75 25.610 19.234 -8.277 1410 HG22 THR 75 HG22 THR 75 26.882 20.232 -8.988 1411 HG23 THR 75 HG23 THR 75 27.126 19.483 -7.409 1412 H ARG 76 HN ARG 76 25.598 15.113 -9.395 1413 HA ARG 76 HA ARG 76 23.123 16.258 -8.298 1414 HB2 ARG 76 HB2 ARG 76 21.985 15.420 -10.313 1415 HB3 ARG 76 HB1 ARG 76 23.264 16.559 -10.692 1416 HG2 ARG 76 HG2 ARG 76 24.740 14.611 -11.209 1417 HG3 ARG 76 HG1 ARG 76 23.329 13.572 -11.013 1418 HD2 ARG 76 HD2 ARG 76 22.175 14.841 -12.775 1419 HD3 ARG 76 HD1 ARG 76 23.614 15.834 -12.987 1420 HE ARG 76 HE ARG 76 23.737 12.923 -13.404 1421 HH11 ARG 76 HH11 ARG 76 24.059 16.194 -14.638 1422 HH12 ARG 76 HH12 ARG 76 24.831 15.687 -16.109 1423 HH21 ARG 76 HH21 ARG 76 24.725 12.265 -15.356 1424 HH22 ARG 76 HH22 ARG 76 25.199 13.463 -16.528 1425 H GLN 77 HN GLN 77 21.344 14.832 -7.909 1426 HA GLN 77 HA GLN 77 22.239 12.241 -6.882 1427 HB2 GLN 77 HB2 GLN 77 19.748 13.861 -6.343 1428 HB3 GLN 77 HB1 GLN 77 20.053 12.267 -5.664 1429 HG2 GLN 77 HG2 GLN 77 21.983 13.101 -4.481 1430 HG3 GLN 77 HG1 GLN 77 21.790 14.686 -5.228 1431 HE21 GLN 77 HE21 GLN 77 20.519 12.446 -2.891 1432 HE22 GLN 77 HE22 GLN 77 19.498 13.571 -2.069 1433 H TYR 78 HN TYR 78 21.336 10.344 -7.450 1434 HA TYR 78 HA TYR 78 19.324 10.380 -9.602 1435 HB2 TYR 78 HB2 TYR 78 21.600 8.480 -9.058 1436 HB3 TYR 78 HB1 TYR 78 20.216 7.994 -10.029 1437 HD1 TYR 78 HD1 TYR 78 22.729 10.763 -9.824 1438 HD2 TYR 78 HD2 TYR 78 20.328 8.280 -12.308 1439 HE1 TYR 78 HE1 TYR 78 23.771 11.754 -11.817 1440 HE2 TYR 78 HE2 TYR 78 21.364 9.266 -14.307 1441 HH TYR 78 HH TYR 78 22.560 11.190 -15.010 1442 H TYR 79 HN TYR 79 17.430 9.419 -9.188 1443 HA TYR 79 HA TYR 79 17.155 8.089 -6.589 1444 HB2 TYR 79 HB2 TYR 79 15.255 9.613 -8.328 1445 HB3 TYR 79 HB1 TYR 79 14.625 8.426 -7.192 1446 HD1 TYR 79 HD1 TYR 79 16.694 11.513 -7.404 1447 HD2 TYR 79 HD2 TYR 79 14.367 8.951 -4.928 1448 HE1 TYR 79 HE1 TYR 79 16.800 13.172 -5.591 1449 HE2 TYR 79 HE2 TYR 79 14.466 10.602 -3.113 1450 HH TYR 79 HH TYR 79 15.552 13.791 -3.579 1451 H ARG 80 HN ARG 80 15.974 6.200 -6.374 1452 HA ARG 80 HA ARG 80 15.053 4.688 -8.632 1453 HB2 ARG 80 HB2 ARG 80 17.524 4.331 -8.764 1454 HB3 ARG 80 HB1 ARG 80 17.501 3.720 -7.116 1455 HG2 ARG 80 HG2 ARG 80 15.872 1.955 -7.965 1456 HG3 ARG 80 HG1 ARG 80 16.335 2.473 -9.586 1457 HD2 ARG 80 HD2 ARG 80 18.314 1.591 -7.495 1458 HD3 ARG 80 HD1 ARG 80 17.588 0.493 -8.665 1459 HE ARG 80 HE ARG 80 18.688 2.574 -10.121 1460 HH11 ARG 80 HH11 ARG 80 19.836 0.162 -7.873 1461 HH12 ARG 80 HH12 ARG 80 21.377 -0.026 -8.652 1462 HH21 ARG 80 HH21 ARG 80 20.764 2.325 -11.160 1463 HH22 ARG 80 HH22 ARG 80 21.902 1.203 -10.477 1464 H ILE 81 HN ILE 81 14.113 2.586 -7.838 1465 HA ILE 81 HA ILE 81 12.775 2.782 -5.383 1466 HB ILE 81 HB ILE 81 13.440 0.277 -6.950 1467 HG12 ILE 81 HG12 ILE 81 12.176 1.898 -8.274 1468 HG13 ILE 81 HG11 ILE 81 11.170 0.513 -7.871 1469 HG21 ILE 81 HG21 ILE 81 12.816 -0.261 -4.661 1470 HG22 ILE 81 HG22 ILE 81 11.537 -0.739 -5.780 1471 HG23 ILE 81 HG23 ILE 81 11.360 0.724 -4.811 1472 HD11 ILE 81 HD11 ILE 81 10.093 1.806 -6.106 1473 HD12 ILE 81 HD12 ILE 81 9.939 2.603 -7.674 1474 HD13 ILE 81 HD13 ILE 81 11.110 3.192 -6.497 1475 H ALA 82 HN ALA 82 13.205 1.955 -3.332 1476 HA ALA 82 HA ALA 82 15.793 2.134 -2.405 1477 HB1 ALA 82 HB1 ALA 82 14.991 1.252 -0.316 1478 HB2 ALA 82 HB2 ALA 82 13.587 0.546 -1.112 1479 HB3 ALA 82 HB3 ALA 82 13.760 2.298 -1.018 1480 H GLY 83 HN GLY 83 13.997 -0.867 -3.112 1481 HA2 GLY 83 HA2 GLY 83 16.344 -2.210 -3.957 1482 HA3 GLY 83 HA1 GLY 83 15.935 -2.689 -2.316 1483 H GLU 84 HN GLU 84 15.841 -4.774 -3.567 1484 HA GLU 84 HA GLU 84 13.842 -5.422 -5.385 1485 HB2 GLU 84 HB2 GLU 84 15.629 -6.948 -5.024 1486 HB3 GLU 84 HB1 GLU 84 15.303 -7.039 -3.302 1487 HG2 GLU 84 HG2 GLU 84 13.026 -7.881 -4.863 1488 HG3 GLU 84 HG1 GLU 84 14.474 -8.812 -5.252 1489 H ASP 85 HN ASP 85 13.793 -5.293 -1.895 1490 HA ASP 85 HA ASP 85 11.386 -6.494 -1.296 1491 HB2 ASP 85 HB2 ASP 85 11.393 -4.711 0.628 1492 HB3 ASP 85 HB1 ASP 85 12.649 -5.943 0.563 1493 H VAL 86 HN VAL 86 11.790 -2.945 -1.547 1494 HA VAL 86 HA VAL 86 9.031 -2.414 -1.691 1495 HB VAL 86 HB VAL 86 11.315 -0.702 -2.691 1496 HG11 VAL 86 HG11 VAL 86 9.782 1.171 -2.462 1497 HG12 VAL 86 HG12 VAL 86 8.493 0.076 -1.962 1498 HG13 VAL 86 HG13 VAL 86 9.141 -0.014 -3.599 1499 HG21 VAL 86 HG21 VAL 86 11.148 0.418 -0.526 1500 HG22 VAL 86 HG22 VAL 86 11.547 -1.289 -0.335 1501 HG23 VAL 86 HG23 VAL 86 9.902 -0.726 -0.026 1502 H ALA 87 HN ALA 87 11.412 -3.075 -4.191 1503 HA ALA 87 HA ALA 87 9.953 -2.264 -6.438 1504 HB1 ALA 87 HB1 ALA 87 11.397 -3.734 -7.721 1505 HB2 ALA 87 HB2 ALA 87 11.889 -4.568 -6.248 1506 HB3 ALA 87 HB3 ALA 87 12.332 -2.880 -6.496 1507 H ARG 88 HN ARG 88 10.089 -5.447 -4.838 1508 HA ARG 88 HA ARG 88 8.144 -6.580 -6.599 1509 HB2 ARG 88 HB2 ARG 88 9.237 -7.551 -3.958 1510 HB3 ARG 88 HB1 ARG 88 8.122 -8.475 -4.956 1511 HG2 ARG 88 HG2 ARG 88 9.838 -8.255 -6.815 1512 HG3 ARG 88 HG1 ARG 88 10.950 -7.682 -5.569 1513 HD2 ARG 88 HD2 ARG 88 9.488 -10.317 -5.512 1514 HD3 ARG 88 HD1 ARG 88 11.155 -10.102 -6.035 1515 HE ARG 88 HE ARG 88 11.358 -9.115 -3.614 1516 HH11 ARG 88 HH11 ARG 88 9.507 -11.915 -4.646 1517 HH12 ARG 88 HH12 ARG 88 9.725 -12.767 -3.141 1518 HH21 ARG 88 HH21 ARG 88 11.664 -10.223 -1.664 1519 HH22 ARG 88 HH22 ARG 88 10.963 -11.799 -1.432 1520 H LEU 89 HN LEU 89 7.979 -4.734 -3.680 1521 HA LEU 89 HA LEU 89 5.360 -5.435 -2.886 1522 HB2 LEU 89 HB2 LEU 89 6.800 -4.144 -1.412 1523 HB3 LEU 89 HB1 LEU 89 6.837 -2.819 -2.564 1524 HG LEU 89 HG LEU 89 4.287 -2.731 -2.259 1525 HD11 LEU 89 HD11 LEU 89 3.463 -3.552 -0.115 1526 HD12 LEU 89 HD12 LEU 89 5.031 -4.296 0.201 1527 HD13 LEU 89 HD13 LEU 89 4.037 -4.869 -1.138 1528 HD21 LEU 89 HD21 LEU 89 4.492 -1.305 -0.293 1529 HD22 LEU 89 HD22 LEU 89 5.796 -1.015 -1.442 1530 HD23 LEU 89 HD23 LEU 89 6.101 -1.956 0.018 1531 H PHE 90 HN PHE 90 6.485 -2.582 -4.708 1532 HA PHE 90 HA PHE 90 3.935 -1.689 -5.458 1533 HB2 PHE 90 HB2 PHE 90 5.899 -0.247 -5.605 1534 HB3 PHE 90 HB1 PHE 90 6.593 -1.278 -6.851 1535 HD1 PHE 90 HD1 PHE 90 3.512 0.744 -6.183 1536 HD2 PHE 90 HD2 PHE 90 6.320 -0.677 -9.056 1537 HE1 PHE 90 HE1 PHE 90 2.422 2.102 -7.918 1538 HE2 PHE 90 HE2 PHE 90 5.230 0.681 -10.793 1539 HZ PHE 90 HZ PHE 90 3.280 2.071 -10.227 1540 H ALA 91 HN ALA 91 6.158 -3.958 -6.979 1541 HA ALA 91 HA ALA 91 4.784 -4.384 -9.375 1542 HB1 ALA 91 HB1 ALA 91 5.936 -6.519 -9.491 1543 HB2 ALA 91 HB2 ALA 91 6.343 -6.412 -7.777 1544 HB3 ALA 91 HB3 ALA 91 7.033 -5.260 -8.920 1545 H LEU 92 HN LEU 92 4.455 -6.068 -6.249 1546 HA LEU 92 HA LEU 92 2.403 -7.818 -7.109 1547 HB2 LEU 92 HB2 LEU 92 3.817 -8.186 -5.106 1548 HB3 LEU 92 HB1 LEU 92 3.004 -6.853 -4.312 1549 HG LEU 92 HG LEU 92 0.878 -8.096 -4.399 1550 HD11 LEU 92 HD11 LEU 92 1.282 -9.422 -6.396 1551 HD12 LEU 92 HD12 LEU 92 0.884 -10.465 -5.032 1552 HD13 LEU 92 HD13 LEU 92 2.558 -10.313 -5.568 1553 HD21 LEU 92 HD21 LEU 92 2.307 -8.275 -2.432 1554 HD22 LEU 92 HD22 LEU 92 3.159 -9.632 -3.163 1555 HD23 LEU 92 HD23 LEU 92 1.456 -9.789 -2.734 1556 H VAL 93 HN VAL 93 2.365 -4.653 -5.539 1557 HA VAL 93 HA VAL 93 -0.410 -4.516 -5.105 1558 HB VAL 93 HB VAL 93 1.654 -2.326 -5.411 1559 HG11 VAL 93 HG11 VAL 93 -0.564 -1.458 -5.978 1560 HG12 VAL 93 HG12 VAL 93 0.011 -0.810 -4.441 1561 HG13 VAL 93 HG13 VAL 93 -1.202 -2.092 -4.460 1562 HG21 VAL 93 HG21 VAL 93 1.393 -2.168 -2.960 1563 HG22 VAL 93 HG22 VAL 93 2.001 -3.737 -3.485 1564 HG23 VAL 93 HG23 VAL 93 0.313 -3.559 -3.010 1565 H GLN 94 HN GLN 94 1.598 -3.478 -7.865 1566 HA GLN 94 HA GLN 94 -0.648 -2.390 -9.248 1567 HB2 GLN 94 HB2 GLN 94 0.779 -2.111 -11.157 1568 HB3 GLN 94 HB1 GLN 94 1.679 -1.656 -9.719 1569 HG2 GLN 94 HG2 GLN 94 2.947 -3.660 -9.777 1570 HG3 GLN 94 HG1 GLN 94 1.910 -4.349 -11.028 1571 HE21 GLN 94 HE21 GLN 94 3.630 -4.676 -12.419 1572 HE22 GLN 94 HE22 GLN 94 4.399 -3.373 -13.262 1573 H VAL 95 HN VAL 95 0.691 -5.590 -8.951 1574 HA VAL 95 HA VAL 95 -0.507 -6.735 -11.251 1575 HB VAL 95 HB VAL 95 0.350 -7.976 -8.633 1576 HG11 VAL 95 HG11 VAL 95 -1.500 -9.308 -9.486 1577 HG12 VAL 95 HG12 VAL 95 0.024 -10.171 -9.699 1578 HG13 VAL 95 HG13 VAL 95 -0.741 -9.378 -11.076 1579 HG21 VAL 95 HG21 VAL 95 2.138 -7.205 -10.095 1580 HG22 VAL 95 HG22 VAL 95 1.461 -8.132 -11.433 1581 HG23 VAL 95 HG23 VAL 95 2.110 -8.965 -10.020 1582 H VAL 96 HN VAL 96 -1.621 -6.590 -7.860 1583 HA VAL 96 HA VAL 96 -4.135 -7.820 -8.389 1584 HB VAL 96 HB VAL 96 -3.090 -7.689 -6.127 1585 HG11 VAL 96 HG11 VAL 96 -3.390 -5.665 -4.782 1586 HG12 VAL 96 HG12 VAL 96 -3.971 -4.810 -6.211 1587 HG13 VAL 96 HG13 VAL 96 -2.310 -5.399 -6.152 1588 HG21 VAL 96 HG21 VAL 96 -5.413 -8.292 -6.314 1589 HG22 VAL 96 HG22 VAL 96 -5.887 -6.594 -6.359 1590 HG23 VAL 96 HG23 VAL 96 -5.183 -7.274 -4.892 1591 H ALA 97 HN ALA 97 -2.935 -4.610 -8.778 1592 HA ALA 97 HA ALA 97 -5.579 -3.476 -9.160 1593 HB1 ALA 97 HB1 ALA 97 -3.813 -2.121 -8.163 1594 HB2 ALA 97 HB2 ALA 97 -4.375 -1.415 -9.678 1595 HB3 ALA 97 HB3 ALA 97 -2.846 -2.293 -9.628 1596 H ASP 98 HN ASP 98 -3.352 -5.210 -11.026 1597 HA ASP 98 HA ASP 98 -3.972 -3.861 -13.534 1598 HB2 ASP 98 HB2 ASP 98 -1.650 -4.396 -13.147 1599 HB3 ASP 98 HB1 ASP 98 -2.042 -6.087 -12.873 1600 H GLU 99 HN GLU 99 -3.884 -7.280 -12.484 1601 HA GLU 99 HA GLU 99 -5.341 -7.971 -14.878 1602 HB2 GLU 99 HB2 GLU 99 -4.988 -10.320 -14.102 1603 HB3 GLU 99 HB1 GLU 99 -3.518 -9.392 -14.330 1604 HG2 GLU 99 HG2 GLU 99 -3.156 -10.586 -12.373 1605 HG3 GLU 99 HG1 GLU 99 -3.595 -8.971 -11.819 1606 H HIS 100 HN HIS 100 -6.318 -6.893 -11.964 1607 HA HIS 100 HA HIS 100 -8.496 -8.649 -11.402 1608 HB2 HIS 100 HB2 HIS 100 -7.456 -6.112 -10.345 1609 HB3 HIS 100 HB1 HIS 100 -9.203 -6.284 -10.226 1610 HD1 HIS 100 HD1 HIS 100 -6.964 -9.287 -9.849 1611 HD2 HIS 100 HD2 HIS 100 -9.053 -6.603 -7.464 1612 HE1 HIS 100 HE1 HIS 100 -7.074 -10.342 -7.569 1613 HE2 HIS 100 HE2 HIS 100 -8.192 -8.620 -6.104 1614 H LEU 101 HN LEU 101 -8.022 -6.115 -13.671 1615 HA LEU 101 HA LEU 101 -10.830 -6.404 -14.444 1616 HB2 LEU 101 HB2 LEU 101 -11.078 -4.067 -14.960 1617 HB3 LEU 101 HB1 LEU 101 -10.631 -4.247 -13.278 1618 HG LEU 101 HG LEU 101 -8.614 -3.540 -15.407 1619 HD11 LEU 101 HD11 LEU 101 -10.327 -1.841 -15.478 1620 HD12 LEU 101 HD12 LEU 101 -8.898 -1.201 -14.669 1621 HD13 LEU 101 HD13 LEU 101 -10.300 -1.697 -13.720 1622 HD21 LEU 101 HD21 LEU 101 -7.355 -2.663 -13.514 1623 HD22 LEU 101 HD22 LEU 101 -7.721 -4.373 -13.286 1624 HD23 LEU 101 HD23 LEU 101 -8.645 -3.148 -12.416 1625 H GLU 102 HN GLU 102 -10.985 -7.120 -16.436 1626 HA GLU 102 HA GLU 102 -8.870 -6.400 -18.343 1627 HB2 GLU 102 HB2 GLU 102 -9.698 -8.788 -19.325 1628 HB3 GLU 102 HB1 GLU 102 -8.303 -8.575 -18.281 1629 HG2 GLU 102 HG2 GLU 102 -9.551 -10.410 -17.446 1630 HG3 GLU 102 HG1 GLU 102 -9.783 -9.068 -16.331 1631 H HIS 103 HN HIS 103 -12.218 -7.564 -18.070 1632 HA HIS 103 HA HIS 103 -13.020 -5.733 -20.174 1633 HB2 HIS 103 HB2 HIS 103 -12.303 -7.747 -21.400 1634 HB3 HIS 103 HB1 HIS 103 -13.427 -8.718 -20.458 1635 HD1 HIS 103 HD1 HIS 103 -15.215 -9.393 -22.022 1636 HD2 HIS 103 HD2 HIS 103 -14.159 -5.394 -22.508 1637 HE1 HIS 103 HE1 HIS 103 -16.807 -8.469 -23.739 1638 HE2 HIS 103 HE2 HIS 103 -16.113 -6.068 -24.071 1639 H HIS 104 HN HIS 104 -13.780 -7.884 -17.529 1640 HA HIS 104 HA HIS 104 -16.611 -7.626 -17.775 1641 HB2 HIS 104 HB2 HIS 104 -16.808 -8.775 -15.718 1642 HB3 HIS 104 HB1 HIS 104 -15.418 -9.478 -16.529 1643 HD1 HIS 104 HD1 HIS 104 -13.032 -8.816 -15.517 1644 HD2 HIS 104 HD2 HIS 104 -16.334 -7.756 -13.221 1645 HE1 HIS 104 HE1 HIS 104 -12.145 -8.387 -13.204 1646 HE2 HIS 104 HE2 HIS 104 -14.190 -8.005 -11.788 1647 H HIS 105 HN HIS 105 -17.936 -6.064 -17.160 1648 HA HIS 105 HA HIS 105 -17.003 -4.032 -15.259 1649 HB2 HIS 105 HB2 HIS 105 -18.206 -3.476 -17.979 1650 HB3 HIS 105 HB1 HIS 105 -18.035 -2.264 -16.717 1651 HD1 HIS 105 HD1 HIS 105 -15.349 -2.101 -15.865 1652 HD2 HIS 105 HD2 HIS 105 -16.173 -3.395 -19.729 1653 HE1 HIS 105 HE1 HIS 105 -13.228 -1.727 -17.174 1654 HE2 HIS 105 HE2 HIS 105 -13.839 -2.293 -19.559 1655 H HIS 106 HN HIS 106 -18.695 -2.922 -14.179 1656 HA HIS 106 HA HIS 106 -21.383 -4.059 -14.585 1657 HB2 HIS 106 HB2 HIS 106 -20.094 -3.197 -11.987 1658 HB3 HIS 106 HB1 HIS 106 -21.792 -3.610 -12.156 1659 HD1 HIS 106 HD1 HIS 106 -22.269 -6.169 -12.883 1660 HD2 HIS 106 HD2 HIS 106 -18.443 -5.308 -11.498 1661 HE1 HIS 106 HE1 HIS 106 -21.264 -8.385 -12.235 1662 HE2 HIS 106 HE2 HIS 106 -18.979 -7.835 -11.322 1663 H HIS 107 HN HIS 107 -20.101 -1.368 -12.661 1664 HA HIS 107 HA HIS 107 -21.128 0.566 -14.556 1665 HB2 HIS 107 HB2 HIS 107 -23.081 0.136 -13.080 1666 HB3 HIS 107 HB1 HIS 107 -22.100 0.572 -11.684 1667 HD1 HIS 107 HD1 HIS 107 -21.353 3.131 -11.532 1668 HD2 HIS 107 HD2 HIS 107 -24.185 2.250 -14.453 1669 HE1 HIS 107 HE1 HIS 107 -22.330 5.343 -12.223 1670 HE2 HIS 107 HE2 HIS 107 -24.026 4.795 -14.004 1671 H HIS 108 HN HIS 108 -19.158 1.455 -14.852 1672 HA HIS 108 HA HIS 108 -17.570 2.200 -12.520 1673 HB2 HIS 108 HB2 HIS 108 -16.448 1.152 -14.462 1674 HB3 HIS 108 HB1 HIS 108 -16.946 2.508 -15.469 1675 HD1 HIS 108 HD1 HIS 108 -15.172 4.192 -15.774 1676 HD2 HIS 108 HD2 HIS 108 -14.814 2.212 -12.133 1677 HE1 HIS 108 HE1 HIS 108 -13.108 5.135 -14.685 1678 HE2 HIS 108 HE2 HIS 108 -13.023 4.063 -12.403 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 -14.211 7.923 -31.514 2 H2 MET 1 HT2 MET 1 -13.756 6.843 -32.741 3 H3 MET 1 HT3 MET 1 -12.704 7.154 -31.446 4 HA MET 1 HA MET 1 -15.368 5.918 -31.165 5 HB2 MET 1 HB2 MET 1 -12.648 4.679 -31.484 6 HB3 MET 1 HB1 MET 1 -13.933 3.840 -30.623 7 HG2 MET 1 HG2 MET 1 -14.045 4.787 -33.477 8 HG3 MET 1 HG1 MET 1 -13.801 3.126 -32.938 9 HE1 MET 1 HE1 MET 1 -15.829 2.401 -34.539 10 HE2 MET 1 HE2 MET 1 -16.086 4.082 -35.010 11 HE3 MET 1 HE3 MET 1 -17.443 3.107 -34.443 12 H ALA 2 HN ALA 2 -12.168 5.727 -29.589 13 HA ALA 2 HA ALA 2 -13.573 6.247 -27.050 14 HB1 ALA 2 HB1 ALA 2 -11.981 4.762 -25.955 15 HB2 ALA 2 HB2 ALA 2 -11.190 4.454 -27.502 16 HB3 ALA 2 HB3 ALA 2 -12.851 3.920 -27.237 17 H GLY 3 HN GLY 3 -10.519 6.629 -28.827 18 HA2 GLY 3 HA2 GLY 3 -8.757 8.086 -28.525 19 HA3 GLY 3 HA1 GLY 3 -9.909 9.159 -27.738 20 H GLN 4 HN GLN 4 -8.468 6.000 -27.003 21 HA GLN 4 HA GLN 4 -8.683 6.636 -24.185 22 HB2 GLN 4 HB2 GLN 4 -9.427 4.453 -25.244 23 HB3 GLN 4 HB1 GLN 4 -7.723 4.058 -25.410 24 HG2 GLN 4 HG2 GLN 4 -7.422 4.084 -23.039 25 HG3 GLN 4 HG1 GLN 4 -9.059 4.697 -22.792 26 HE21 GLN 4 HE21 GLN 4 -10.814 3.329 -23.160 27 HE22 GLN 4 HE22 GLN 4 -10.640 1.607 -23.192 28 H SER 5 HN SER 5 -7.076 7.883 -23.485 29 HA SER 5 HA SER 5 -4.327 6.875 -23.852 30 HB2 SER 5 HB2 SER 5 -4.790 9.144 -24.853 31 HB3 SER 5 HB1 SER 5 -5.173 9.723 -23.230 32 HG SER 5 HG SER 5 -2.989 8.978 -22.669 33 H ASP 6 HN ASP 6 -6.741 6.642 -21.881 34 HA ASP 6 HA ASP 6 -5.443 7.480 -19.390 35 HB2 ASP 6 HB2 ASP 6 -8.288 6.605 -19.950 36 HB3 ASP 6 HB1 ASP 6 -7.680 7.115 -18.381 37 H ARG 7 HN ARG 7 -5.202 4.901 -21.199 38 HA ARG 7 HA ARG 7 -6.213 2.755 -19.669 39 HB2 ARG 7 HB2 ARG 7 -5.696 2.554 -22.061 40 HB3 ARG 7 HB1 ARG 7 -3.986 2.758 -21.713 41 HG2 ARG 7 HG2 ARG 7 -3.923 0.676 -20.519 42 HG3 ARG 7 HG1 ARG 7 -5.671 0.491 -20.668 43 HD2 ARG 7 HD2 ARG 7 -3.725 0.572 -22.970 44 HD3 ARG 7 HD1 ARG 7 -4.421 -0.893 -22.282 45 HE ARG 7 HE ARG 7 -6.502 0.848 -23.009 46 HH11 ARG 7 HH11 ARG 7 -4.045 -1.151 -24.512 47 HH12 ARG 7 HH12 ARG 7 -4.988 -1.446 -25.943 48 HH21 ARG 7 HH21 ARG 7 -7.722 0.480 -24.876 49 HH22 ARG 7 HH22 ARG 7 -7.078 -0.503 -26.158 50 H LYS 8 HN LYS 8 -2.887 4.038 -19.970 51 HA LYS 8 HA LYS 8 -1.814 2.279 -18.026 52 HB2 LYS 8 HB2 LYS 8 0.137 3.776 -17.995 53 HB3 LYS 8 HB1 LYS 8 -0.356 3.344 -19.626 54 HG2 LYS 8 HG2 LYS 8 -1.594 5.556 -19.677 55 HG3 LYS 8 HG1 LYS 8 -0.708 5.960 -18.204 56 HD2 LYS 8 HD2 LYS 8 0.674 5.038 -20.701 57 HD3 LYS 8 HD1 LYS 8 0.279 6.733 -20.430 58 HE2 LYS 8 HE2 LYS 8 2.485 6.536 -19.694 59 HE3 LYS 8 HE1 LYS 8 1.532 6.484 -18.215 60 HZ1 LYS 8 HZ1 LYS 8 1.771 4.095 -18.160 61 HZ2 LYS 8 HZ2 LYS 8 3.298 4.818 -18.252 62 HZ3 LYS 8 HZ3 LYS 8 2.618 4.103 -19.630 63 H ALA 9 HN ALA 9 -3.317 5.427 -17.839 64 HA ALA 9 HA ALA 9 -2.644 6.059 -15.180 65 HB1 ALA 9 HB1 ALA 9 -5.081 6.870 -16.764 66 HB2 ALA 9 HB2 ALA 9 -3.531 7.711 -16.745 67 HB3 ALA 9 HB3 ALA 9 -4.510 7.632 -15.281 68 H ALA 10 HN ALA 10 -5.228 4.157 -16.606 69 HA ALA 10 HA ALA 10 -6.777 3.841 -14.261 70 HB1 ALA 10 HB1 ALA 10 -6.625 2.041 -16.676 71 HB2 ALA 10 HB2 ALA 10 -7.664 3.457 -16.519 72 HB3 ALA 10 HB3 ALA 10 -7.911 2.063 -15.469 73 H LEU 11 HN LEU 11 -3.944 2.236 -15.492 74 HA LEU 11 HA LEU 11 -4.155 -0.123 -13.913 75 HB2 LEU 11 HB2 LEU 11 -2.750 0.011 -15.920 76 HB3 LEU 11 HB1 LEU 11 -1.725 1.192 -15.129 77 HG LEU 11 HG LEU 11 -1.085 -0.521 -13.456 78 HD11 LEU 11 HD11 LEU 11 -1.621 -2.872 -13.890 79 HD12 LEU 11 HD12 LEU 11 -2.674 -2.384 -15.217 80 HD13 LEU 11 HD13 LEU 11 -3.072 -1.923 -13.562 81 HD21 LEU 11 HD21 LEU 11 0.351 -1.816 -14.941 82 HD22 LEU 11 HD22 LEU 11 0.301 -0.122 -15.427 83 HD23 LEU 11 HD23 LEU 11 -0.623 -1.325 -16.325 84 H LEU 12 HN LEU 12 -2.275 2.871 -13.562 85 HA LEU 12 HA LEU 12 -1.253 2.259 -11.001 86 HB2 LEU 12 HB2 LEU 12 -1.675 4.924 -12.355 87 HB3 LEU 12 HB1 LEU 12 -0.813 4.717 -10.844 88 HG LEU 12 HG LEU 12 0.007 3.600 -13.525 89 HD11 LEU 12 HD11 LEU 12 0.359 5.994 -13.353 90 HD12 LEU 12 HD12 LEU 12 1.901 5.138 -13.298 91 HD13 LEU 12 HD13 LEU 12 1.194 5.778 -11.814 92 HD21 LEU 12 HD21 LEU 12 1.373 3.404 -10.841 93 HD22 LEU 12 HD22 LEU 12 2.040 2.859 -12.380 94 HD23 LEU 12 HD23 LEU 12 0.608 2.075 -11.713 95 H ASP 13 HN ASP 13 -4.268 3.583 -12.104 96 HA ASP 13 HA ASP 13 -5.117 4.798 -9.707 97 HB2 ASP 13 HB2 ASP 13 -6.186 5.233 -11.882 98 HB3 ASP 13 HB1 ASP 13 -6.795 3.581 -11.910 99 H GLN 14 HN GLN 14 -5.520 1.489 -10.948 100 HA GLN 14 HA GLN 14 -7.129 0.633 -8.758 101 HB2 GLN 14 HB2 GLN 14 -7.175 -0.602 -10.847 102 HB3 GLN 14 HB1 GLN 14 -5.463 -0.969 -10.701 103 HG2 GLN 14 HG2 GLN 14 -6.825 -2.889 -10.122 104 HG3 GLN 14 HG1 GLN 14 -5.895 -2.329 -8.737 105 HE21 GLN 14 HE21 GLN 14 -6.956 -1.444 -6.981 106 HE22 GLN 14 HE22 GLN 14 -8.664 -1.596 -6.762 107 H VAL 15 HN VAL 15 -3.653 0.490 -9.450 108 HA VAL 15 HA VAL 15 -2.854 -0.840 -7.108 109 HB VAL 15 HB VAL 15 -1.368 1.317 -8.629 110 HG11 VAL 15 HG11 VAL 15 0.656 0.362 -7.638 111 HG12 VAL 15 HG12 VAL 15 -0.333 -0.754 -6.695 112 HG13 VAL 15 HG13 VAL 15 -0.437 0.982 -6.399 113 HG21 VAL 15 HG21 VAL 15 -1.976 -0.572 -10.045 114 HG22 VAL 15 HG22 VAL 15 -1.253 -1.686 -8.887 115 HG23 VAL 15 HG23 VAL 15 -0.237 -0.537 -9.756 116 H ALA 16 HN ALA 16 -3.419 2.564 -7.809 117 HA ALA 16 HA ALA 16 -2.741 3.660 -5.334 118 HB1 ALA 16 HB1 ALA 16 -4.107 5.566 -5.994 119 HB2 ALA 16 HB2 ALA 16 -4.854 4.604 -7.271 120 HB3 ALA 16 HB3 ALA 16 -3.136 4.994 -7.349 121 H ARG 17 HN ARG 17 -5.820 2.349 -6.494 122 HA ARG 17 HA ARG 17 -7.357 2.987 -4.237 123 HB2 ARG 17 HB2 ARG 17 -8.321 2.244 -6.371 124 HB3 ARG 17 HB1 ARG 17 -7.635 0.645 -6.129 125 HG2 ARG 17 HG2 ARG 17 -9.031 0.355 -4.131 126 HG3 ARG 17 HG1 ARG 17 -9.739 1.947 -4.410 127 HD2 ARG 17 HD2 ARG 17 -9.881 -0.406 -6.291 128 HD3 ARG 17 HD1 ARG 17 -11.180 0.153 -5.240 129 HE ARG 17 HE ARG 17 -10.082 1.697 -7.510 130 HH11 ARG 17 HH11 ARG 17 -12.718 0.770 -5.407 131 HH12 ARG 17 HH12 ARG 17 -13.891 1.770 -6.208 132 HH21 ARG 17 HH21 ARG 17 -11.612 2.997 -8.591 133 HH22 ARG 17 HH22 ARG 17 -13.255 3.039 -8.038 134 H VAL 18 HN VAL 18 -5.275 0.223 -4.921 135 HA VAL 18 HA VAL 18 -6.020 -1.265 -2.609 136 HB VAL 18 HB VAL 18 -3.499 -1.455 -4.272 137 HG11 VAL 18 HG11 VAL 18 -3.312 -3.722 -3.328 138 HG12 VAL 18 HG12 VAL 18 -4.680 -3.379 -2.270 139 HG13 VAL 18 HG13 VAL 18 -3.179 -2.469 -2.095 140 HG21 VAL 18 HG21 VAL 18 -4.607 -3.333 -5.374 141 HG22 VAL 18 HG22 VAL 18 -5.521 -1.838 -5.585 142 HG23 VAL 18 HG23 VAL 18 -6.059 -3.044 -4.416 143 H GLY 19 HN GLY 19 -3.199 0.778 -3.379 144 HA2 GLY 19 HA2 GLY 19 -1.962 0.560 -0.850 145 HA3 GLY 19 HA1 GLY 19 -1.687 1.844 -2.018 146 H LYS 20 HN LYS 20 -4.305 2.860 -2.132 147 HA LYS 20 HA LYS 20 -4.316 4.644 0.040 148 HB2 LYS 20 HB2 LYS 20 -5.266 5.097 -2.209 149 HB3 LYS 20 HB1 LYS 20 -6.567 3.973 -1.862 150 HG2 LYS 20 HG2 LYS 20 -7.369 5.396 -0.090 151 HG3 LYS 20 HG1 LYS 20 -6.020 6.503 -0.333 152 HD2 LYS 20 HD2 LYS 20 -6.794 7.005 -2.575 153 HD3 LYS 20 HD1 LYS 20 -8.099 5.831 -2.411 154 HE2 LYS 20 HE2 LYS 20 -7.774 8.279 -0.684 155 HE3 LYS 20 HE1 LYS 20 -8.820 8.188 -2.099 156 HZ1 LYS 20 HZ1 LYS 20 -9.068 6.636 0.417 157 HZ2 LYS 20 HZ2 LYS 20 -9.968 6.302 -0.981 158 HZ3 LYS 20 HZ3 LYS 20 -10.147 7.792 -0.192 159 H ALA 21 HN ALA 21 -5.993 1.604 -0.520 160 HA ALA 21 HA ALA 21 -7.668 1.840 1.810 161 HB1 ALA 21 HB1 ALA 21 -8.380 0.488 -0.104 162 HB2 ALA 21 HB2 ALA 21 -8.276 -0.490 1.360 163 HB3 ALA 21 HB3 ALA 21 -7.006 -0.590 0.141 164 H LEU 22 HN LEU 22 -4.512 0.583 1.063 165 HA LEU 22 HA LEU 22 -4.193 -0.939 3.468 166 HB2 LEU 22 HB2 LEU 22 -2.965 -1.294 1.288 167 HB3 LEU 22 HB1 LEU 22 -2.042 0.150 1.653 168 HG LEU 22 HG LEU 22 -1.298 -1.001 3.782 169 HD11 LEU 22 HD11 LEU 22 -3.027 -2.697 3.904 170 HD12 LEU 22 HD12 LEU 22 -1.436 -3.451 3.800 171 HD13 LEU 22 HD13 LEU 22 -2.479 -3.396 2.379 172 HD21 LEU 22 HD21 LEU 22 0.160 -0.774 1.850 173 HD22 LEU 22 HD22 LEU 22 -0.527 -2.234 1.139 174 HD23 LEU 22 HD23 LEU 22 0.403 -2.335 2.632 175 H ALA 23 HN ALA 23 -3.433 2.310 2.413 176 HA ALA 23 HA ALA 23 -1.792 3.054 4.591 177 HB1 ALA 23 HB1 ALA 23 -1.740 4.257 2.483 178 HB2 ALA 23 HB2 ALA 23 -2.155 5.351 3.804 179 HB3 ALA 23 HB3 ALA 23 -3.412 4.768 2.712 180 H ASN 24 HN ASN 24 -2.582 2.798 6.574 181 HA ASN 24 HA ASN 24 -4.354 4.707 7.630 182 HB2 ASN 24 HB2 ASN 24 -6.108 3.367 6.593 183 HB3 ASN 24 HB1 ASN 24 -5.489 1.911 7.368 184 HD21 ASN 24 HD21 ASN 24 -7.150 4.935 7.873 185 HD22 ASN 24 HD22 ASN 24 -7.799 4.542 9.432 186 H GLY 25 HN GLY 25 -3.396 1.313 8.193 187 HA2 GLY 25 HA2 GLY 25 -1.783 0.722 9.867 188 HA3 GLY 25 HA1 GLY 25 -2.231 2.170 10.756 189 H ARG 26 HN ARG 26 -4.874 2.069 11.047 190 HA ARG 26 HA ARG 26 -5.242 -0.001 12.972 191 HB2 ARG 26 HB2 ARG 26 -6.674 2.387 12.088 192 HB3 ARG 26 HB1 ARG 26 -7.753 1.064 12.513 193 HG2 ARG 26 HG2 ARG 26 -7.099 1.057 14.714 194 HG3 ARG 26 HG1 ARG 26 -5.538 1.800 14.366 195 HD2 ARG 26 HD2 ARG 26 -8.148 3.254 14.011 196 HD3 ARG 26 HD1 ARG 26 -7.252 3.262 15.531 197 HE ARG 26 HE ARG 26 -5.386 4.018 13.733 198 HH11 ARG 26 HH11 ARG 26 -8.643 5.161 14.355 199 HH12 ARG 26 HH12 ARG 26 -8.271 6.816 13.961 200 HH21 ARG 26 HH21 ARG 26 -4.907 6.164 13.164 201 HH22 ARG 26 HH22 ARG 26 -6.145 7.385 13.257 202 H ARG 27 HN ARG 27 -6.408 0.548 9.690 203 HA ARG 27 HA ARG 27 -8.162 -1.678 9.615 204 HB2 ARG 27 HB2 ARG 27 -6.760 -0.242 7.349 205 HB3 ARG 27 HB1 ARG 27 -8.046 -1.424 7.142 206 HG2 ARG 27 HG2 ARG 27 -9.507 0.068 8.533 207 HG3 ARG 27 HG1 ARG 27 -8.230 1.280 8.439 208 HD2 ARG 27 HD2 ARG 27 -9.636 0.038 6.077 209 HD3 ARG 27 HD1 ARG 27 -10.007 1.619 6.758 210 HE ARG 27 HE ARG 27 -7.298 1.097 5.772 211 HH11 ARG 27 HH11 ARG 27 -10.371 2.749 5.405 212 HH12 ARG 27 HH12 ARG 27 -9.757 3.872 4.231 213 HH21 ARG 27 HH21 ARG 27 -6.498 2.602 4.247 214 HH22 ARG 27 HH22 ARG 27 -7.567 3.796 3.581 215 H LEU 28 HN LEU 28 -4.767 -1.436 9.541 216 HA LEU 28 HA LEU 28 -4.215 -3.855 8.126 217 HB2 LEU 28 HB2 LEU 28 -2.513 -2.368 10.128 218 HB3 LEU 28 HB1 LEU 28 -1.956 -3.647 9.066 219 HG LEU 28 HG LEU 28 -2.977 -0.952 8.169 220 HD11 LEU 28 HD11 LEU 28 -0.821 -0.780 9.257 221 HD12 LEU 28 HD12 LEU 28 -0.640 -0.573 7.515 222 HD13 LEU 28 HD13 LEU 28 -0.195 -2.102 8.273 223 HD21 LEU 28 HD21 LEU 28 -2.222 -1.635 5.961 224 HD22 LEU 28 HD22 LEU 28 -3.457 -2.739 6.570 225 HD23 LEU 28 HD23 LEU 28 -1.758 -3.214 6.595 226 H GLN 29 HN GLN 29 -4.840 -2.983 11.466 227 HA GLN 29 HA GLN 29 -4.107 -5.468 12.625 228 HB2 GLN 29 HB2 GLN 29 -4.452 -3.263 13.835 229 HB3 GLN 29 HB1 GLN 29 -6.180 -3.542 13.675 230 HG2 GLN 29 HG2 GLN 29 -5.947 -5.630 14.937 231 HG3 GLN 29 HG1 GLN 29 -4.224 -5.304 15.126 232 HE21 GLN 29 HE21 GLN 29 -3.578 -3.572 16.435 233 HE22 GLN 29 HE22 GLN 29 -4.617 -2.920 17.649 234 H ILE 30 HN ILE 30 -6.972 -4.236 11.085 235 HA ILE 30 HA ILE 30 -8.734 -6.341 11.778 236 HB ILE 30 HB ILE 30 -8.782 -4.579 9.315 237 HG12 ILE 30 HG12 ILE 30 -10.165 -4.245 11.990 238 HG13 ILE 30 HG11 ILE 30 -8.792 -3.298 11.429 239 HG21 ILE 30 HG21 ILE 30 -10.165 -6.602 9.117 240 HG22 ILE 30 HG22 ILE 30 -11.142 -5.135 9.185 241 HG23 ILE 30 HG23 ILE 30 -10.999 -6.165 10.609 242 HD11 ILE 30 HD11 ILE 30 -11.527 -3.357 10.176 243 HD12 ILE 30 HD12 ILE 30 -10.153 -2.409 9.607 244 HD13 ILE 30 HD13 ILE 30 -10.867 -2.070 11.183 245 H LEU 31 HN LEU 31 -6.589 -5.776 9.007 246 HA LEU 31 HA LEU 31 -7.188 -8.124 7.584 247 HB2 LEU 31 HB2 LEU 31 -4.637 -6.512 7.688 248 HB3 LEU 31 HB1 LEU 31 -4.955 -7.787 6.525 249 HG LEU 31 HG LEU 31 -6.577 -5.251 6.777 250 HD11 LEU 31 HD11 LEU 31 -4.306 -4.810 5.989 251 HD12 LEU 31 HD12 LEU 31 -5.497 -4.569 4.711 252 HD13 LEU 31 HD13 LEU 31 -4.505 -6.028 4.730 253 HD21 LEU 31 HD21 LEU 31 -7.538 -5.958 4.633 254 HD22 LEU 31 HD22 LEU 31 -7.869 -7.121 5.916 255 HD23 LEU 31 HD23 LEU 31 -6.618 -7.461 4.721 256 H ASP 32 HN ASP 32 -4.835 -7.433 10.108 257 HA ASP 32 HA ASP 32 -3.491 -9.872 10.219 258 HB2 ASP 32 HB2 ASP 32 -2.687 -8.003 11.486 259 HB3 ASP 32 HB1 ASP 32 -4.196 -7.881 12.379 260 H LEU 33 HN LEU 33 -6.552 -8.896 11.667 261 HA LEU 33 HA LEU 33 -6.942 -11.309 13.138 262 HB2 LEU 33 HB2 LEU 33 -8.013 -9.190 13.764 263 HB3 LEU 33 HB1 LEU 33 -8.935 -9.208 12.273 264 HG LEU 33 HG LEU 33 -10.051 -11.299 13.036 265 HD11 LEU 33 HD11 LEU 33 -8.276 -12.070 14.549 266 HD12 LEU 33 HD12 LEU 33 -9.846 -11.992 15.349 267 HD13 LEU 33 HD13 LEU 33 -8.644 -10.735 15.644 268 HD21 LEU 33 HD21 LEU 33 -11.112 -9.132 13.357 269 HD22 LEU 33 HD22 LEU 33 -10.277 -8.939 14.899 270 HD23 LEU 33 HD23 LEU 33 -11.479 -10.217 14.701 271 H LEU 34 HN LEU 34 -8.089 -10.083 10.016 272 HA LEU 34 HA LEU 34 -9.836 -12.273 9.512 273 HB2 LEU 34 HB2 LEU 34 -8.619 -10.332 7.546 274 HB3 LEU 34 HB1 LEU 34 -9.991 -11.381 7.245 275 HG LEU 34 HG LEU 34 -9.882 -9.037 9.136 276 HD11 LEU 34 HD11 LEU 34 -11.622 -8.136 7.668 277 HD12 LEU 34 HD12 LEU 34 -11.464 -9.549 6.625 278 HD13 LEU 34 HD13 LEU 34 -10.114 -8.428 6.801 279 HD21 LEU 34 HD21 LEU 34 -12.239 -9.511 9.603 280 HD22 LEU 34 HD22 LEU 34 -11.187 -10.820 10.144 281 HD23 LEU 34 HD23 LEU 34 -12.122 -10.999 8.660 282 H ALA 35 HN ALA 35 -6.451 -11.755 9.056 283 HA ALA 35 HA ALA 35 -6.040 -13.864 7.160 284 HB1 ALA 35 HB1 ALA 35 -4.085 -12.510 9.018 285 HB2 ALA 35 HB2 ALA 35 -4.438 -12.042 7.353 286 HB3 ALA 35 HB3 ALA 35 -3.660 -13.590 7.689 287 H GLN 36 HN GLN 36 -6.839 -13.821 10.402 288 HA GLN 36 HA GLN 36 -5.618 -16.442 10.919 289 HB2 GLN 36 HB2 GLN 36 -6.833 -14.388 12.772 290 HB3 GLN 36 HB1 GLN 36 -6.318 -15.985 13.296 291 HG2 GLN 36 HG2 GLN 36 -4.042 -15.504 12.700 292 HG3 GLN 36 HG1 GLN 36 -4.514 -13.956 11.999 293 HE21 GLN 36 HE21 GLN 36 -4.914 -12.231 13.315 294 HE22 GLN 36 HE22 GLN 36 -4.566 -12.231 15.013 295 H GLY 37 HN GLY 37 -8.306 -15.292 9.578 296 HA2 GLY 37 HA2 GLY 37 -9.839 -17.320 9.152 297 HA3 GLY 37 HA1 GLY 37 -10.116 -17.204 10.885 298 H GLU 38 HN GLU 38 -12.099 -16.944 8.806 299 HA GLU 38 HA GLU 38 -12.693 -14.157 8.513 300 HB2 GLU 38 HB2 GLU 38 -14.903 -15.001 7.632 301 HB3 GLU 38 HB1 GLU 38 -13.478 -15.539 6.759 302 HG2 GLU 38 HG2 GLU 38 -13.597 -17.695 7.871 303 HG3 GLU 38 HG1 GLU 38 -15.002 -17.156 8.787 304 H ARG 39 HN ARG 39 -13.744 -12.881 9.828 305 HA ARG 39 HA ARG 39 -15.210 -14.091 12.077 306 HB2 ARG 39 HB2 ARG 39 -13.615 -11.519 12.117 307 HB3 ARG 39 HB1 ARG 39 -14.495 -12.211 13.470 308 HG2 ARG 39 HG2 ARG 39 -12.103 -13.436 12.110 309 HG3 ARG 39 HG1 ARG 39 -12.104 -12.607 13.668 310 HD2 ARG 39 HD2 ARG 39 -13.515 -15.179 12.973 311 HD3 ARG 39 HD1 ARG 39 -12.118 -14.988 14.030 312 HE ARG 39 HE ARG 39 -14.895 -14.398 14.655 313 HH11 ARG 39 HH11 ARG 39 -11.538 -14.098 15.606 314 HH12 ARG 39 HH12 ARG 39 -11.897 -13.816 17.282 315 HH21 ARG 39 HH21 ARG 39 -15.378 -14.066 16.859 316 HH22 ARG 39 HH22 ARG 39 -14.091 -13.800 17.996 317 H ALA 40 HN ALA 40 -17.070 -12.989 12.790 318 HA ALA 40 HA ALA 40 -18.491 -11.549 10.771 319 HB1 ALA 40 HB1 ALA 40 -19.159 -12.002 13.680 320 HB2 ALA 40 HB2 ALA 40 -19.663 -13.013 12.323 321 HB3 ALA 40 HB3 ALA 40 -20.263 -11.359 12.462 322 H VAL 41 HN VAL 41 -19.190 -9.372 10.852 323 HA VAL 41 HA VAL 41 -17.302 -7.456 11.441 324 HB VAL 41 HB VAL 41 -20.294 -7.002 11.438 325 HG11 VAL 41 HG11 VAL 41 -19.741 -4.721 10.758 326 HG12 VAL 41 HG12 VAL 41 -18.021 -5.096 10.880 327 HG13 VAL 41 HG13 VAL 41 -19.031 -5.107 12.326 328 HG21 VAL 41 HG21 VAL 41 -18.324 -6.967 9.155 329 HG22 VAL 41 HG22 VAL 41 -20.014 -6.473 9.055 330 HG23 VAL 41 HG23 VAL 41 -19.606 -8.150 9.415 331 H GLU 42 HN GLU 42 -19.987 -8.545 13.445 332 HA GLU 42 HA GLU 42 -19.759 -6.797 15.594 333 HB2 GLU 42 HB2 GLU 42 -20.543 -9.721 15.617 334 HB3 GLU 42 HB1 GLU 42 -20.914 -8.549 16.876 335 HG2 GLU 42 HG2 GLU 42 -22.410 -7.382 15.505 336 HG3 GLU 42 HG1 GLU 42 -21.807 -8.156 14.044 337 H ALA 43 HN ALA 43 -18.082 -9.847 14.964 338 HA ALA 43 HA ALA 43 -16.675 -9.845 17.458 339 HB1 ALA 43 HB1 ALA 43 -15.467 -11.756 16.535 340 HB2 ALA 43 HB2 ALA 43 -16.177 -11.447 14.950 341 HB3 ALA 43 HB3 ALA 43 -17.208 -11.930 16.300 342 H ILE 44 HN ILE 44 -15.912 -8.983 14.115 343 HA ILE 44 HA ILE 44 -13.182 -8.459 14.377 344 HB ILE 44 HB ILE 44 -15.196 -7.045 12.615 345 HG12 ILE 44 HG12 ILE 44 -13.330 -9.346 11.991 346 HG13 ILE 44 HG11 ILE 44 -15.056 -9.509 12.302 347 HG21 ILE 44 HG21 ILE 44 -13.284 -6.415 11.227 348 HG22 ILE 44 HG22 ILE 44 -12.189 -7.158 12.394 349 HG23 ILE 44 HG23 ILE 44 -13.142 -5.746 12.854 350 HD11 ILE 44 HD11 ILE 44 -13.805 -7.985 10.028 351 HD12 ILE 44 HD12 ILE 44 -15.535 -8.139 10.339 352 HD13 ILE 44 HD13 ILE 44 -14.583 -9.565 9.925 353 H ALA 45 HN ALA 45 -15.942 -6.264 14.727 354 HA ALA 45 HA ALA 45 -14.555 -3.941 15.384 355 HB1 ALA 45 HB1 ALA 45 -16.667 -3.174 16.373 356 HB2 ALA 45 HB2 ALA 45 -17.291 -4.821 16.303 357 HB3 ALA 45 HB3 ALA 45 -16.922 -3.956 14.813 358 H THR 46 HN THR 46 -15.934 -6.412 17.529 359 HA THR 46 HA THR 46 -15.190 -5.236 19.952 360 HB THR 46 HB THR 46 -15.495 -8.191 19.376 361 HG1 THR 46 HG1 THR 46 -17.402 -7.286 18.762 362 HG21 THR 46 HG21 THR 46 -16.115 -8.358 21.730 363 HG22 THR 46 HG22 THR 46 -15.857 -6.624 21.937 364 HG23 THR 46 HG23 THR 46 -14.494 -7.682 21.566 365 H ALA 47 HN ALA 47 -13.508 -7.699 18.001 366 HA ALA 47 HA ALA 47 -11.408 -8.150 19.818 367 HB1 ALA 47 HB1 ALA 47 -11.460 -8.560 16.835 368 HB2 ALA 47 HB2 ALA 47 -11.957 -9.727 18.060 369 HB3 ALA 47 HB3 ALA 47 -10.267 -9.236 17.944 370 H THR 48 HN THR 48 -11.733 -5.835 17.167 371 HA THR 48 HA THR 48 -8.972 -5.010 17.414 372 HB THR 48 HB THR 48 -9.636 -3.258 15.717 373 HG1 THR 48 HG1 THR 48 -12.017 -4.777 15.432 374 HG21 THR 48 HG21 THR 48 -9.832 -4.864 13.869 375 HG22 THR 48 HG22 THR 48 -10.181 -6.147 15.027 376 HG23 THR 48 HG23 THR 48 -8.603 -5.358 15.034 377 H GLY 49 HN GLY 49 -11.897 -4.224 18.944 378 HA2 GLY 49 HA2 GLY 49 -12.171 -2.754 20.726 379 HA3 GLY 49 HA1 GLY 49 -10.590 -2.075 20.374 380 H MET 50 HN MET 50 -13.238 -2.401 18.076 381 HA MET 50 HA MET 50 -13.681 0.497 18.205 382 HB2 MET 50 HB2 MET 50 -13.681 0.682 15.768 383 HB3 MET 50 HB1 MET 50 -12.126 0.096 16.341 384 HG2 MET 50 HG2 MET 50 -12.803 -2.193 15.740 385 HG3 MET 50 HG1 MET 50 -14.316 -1.551 15.101 386 HE1 MET 50 HE1 MET 50 -10.418 -1.763 14.647 387 HE2 MET 50 HE2 MET 50 -10.677 -0.039 14.909 388 HE3 MET 50 HE3 MET 50 -10.147 -0.621 13.330 389 H ASN 51 HN ASN 51 -15.659 0.953 16.573 390 HA ASN 51 HA ASN 51 -17.730 -0.902 17.481 391 HB2 ASN 51 HB2 ASN 51 -19.323 0.935 16.930 392 HB3 ASN 51 HB1 ASN 51 -18.146 1.365 18.162 393 HD21 ASN 51 HD21 ASN 51 -18.154 3.498 17.910 394 HD22 ASN 51 HD22 ASN 51 -17.649 4.326 16.474 395 H LEU 52 HN LEU 52 -19.594 -1.230 15.974 396 HA LEU 52 HA LEU 52 -18.611 -2.579 13.718 397 HB2 LEU 52 HB2 LEU 52 -21.389 -1.870 14.607 398 HB3 LEU 52 HB1 LEU 52 -21.106 -2.702 13.092 399 HG LEU 52 HG LEU 52 -19.920 -4.499 14.427 400 HD11 LEU 52 HD11 LEU 52 -21.223 -3.065 16.735 401 HD12 LEU 52 HD12 LEU 52 -19.490 -3.229 16.455 402 HD13 LEU 52 HD13 LEU 52 -20.465 -4.656 16.804 403 HD21 LEU 52 HD21 LEU 52 -22.847 -3.990 14.940 404 HD22 LEU 52 HD22 LEU 52 -22.027 -5.537 15.147 405 HD23 LEU 52 HD23 LEU 52 -22.149 -4.813 13.544 406 H THR 53 HN THR 53 -20.170 0.571 14.043 407 HA THR 53 HA THR 53 -20.622 1.119 11.350 408 HB THR 53 HB THR 53 -19.819 3.115 13.476 409 HG1 THR 53 HG1 THR 53 -21.614 2.032 14.223 410 HG21 THR 53 HG21 THR 53 -19.756 4.066 11.237 411 HG22 THR 53 HG22 THR 53 -21.150 4.694 12.119 412 HG23 THR 53 HG23 THR 53 -21.369 3.437 10.900 413 H THR 54 HN THR 54 -17.734 1.870 13.312 414 HA THR 54 HA THR 54 -16.244 2.914 11.131 415 HB THR 54 HB THR 54 -15.408 1.908 13.854 416 HG1 THR 54 HG1 THR 54 -16.579 3.915 13.725 417 HG21 THR 54 HG21 THR 54 -13.210 2.926 13.427 418 HG22 THR 54 HG22 THR 54 -13.682 3.224 11.754 419 HG23 THR 54 HG23 THR 54 -13.527 1.569 12.345 420 H ALA 55 HN ALA 55 -16.303 -0.263 12.731 421 HA ALA 55 HA ALA 55 -14.211 -1.461 11.341 422 HB1 ALA 55 HB1 ALA 55 -15.209 -3.594 11.979 423 HB2 ALA 55 HB2 ALA 55 -16.716 -2.774 12.389 424 HB3 ALA 55 HB3 ALA 55 -15.252 -2.447 13.317 425 H SER 56 HN SER 56 -17.678 -1.414 10.559 426 HA SER 56 HA SER 56 -17.460 -3.013 8.241 427 HB2 SER 56 HB2 SER 56 -19.578 -2.652 9.478 428 HB3 SER 56 HB1 SER 56 -19.592 -0.975 8.936 429 HG SER 56 HG SER 56 -20.859 -2.073 7.519 430 H ALA 57 HN ALA 57 -17.278 0.476 8.772 431 HA ALA 57 HA ALA 57 -17.274 1.227 6.042 432 HB1 ALA 57 HB1 ALA 57 -16.361 3.359 6.832 433 HB2 ALA 57 HB2 ALA 57 -16.070 2.644 8.418 434 HB3 ALA 57 HB3 ALA 57 -17.719 2.830 7.823 435 H ASN 58 HN ASN 58 -14.736 0.344 8.321 436 HA ASN 58 HA ASN 58 -12.539 0.842 6.600 437 HB2 ASN 58 HB2 ASN 58 -12.844 -0.998 8.978 438 HB3 ASN 58 HB1 ASN 58 -11.322 -0.770 8.126 439 HD21 ASN 58 HD21 ASN 58 -11.891 -0.210 10.874 440 HD22 ASN 58 HD22 ASN 58 -11.597 1.478 11.110 441 H LEU 59 HN LEU 59 -14.407 -2.066 7.339 442 HA LEU 59 HA LEU 59 -13.021 -3.835 5.659 443 HB2 LEU 59 HB2 LEU 59 -15.900 -3.844 6.560 444 HB3 LEU 59 HB1 LEU 59 -15.124 -5.184 5.739 445 HG LEU 59 HG LEU 59 -14.181 -4.082 8.383 446 HD11 LEU 59 HD11 LEU 59 -16.418 -4.977 8.654 447 HD12 LEU 59 HD12 LEU 59 -15.233 -6.066 9.376 448 HD13 LEU 59 HD13 LEU 59 -15.950 -6.456 7.814 449 HD21 LEU 59 HD21 LEU 59 -12.485 -5.255 7.076 450 HD22 LEU 59 HD22 LEU 59 -13.562 -6.645 6.919 451 HD23 LEU 59 HD23 LEU 59 -12.944 -6.181 8.505 452 H GLN 60 HN GLN 60 -15.782 -1.721 5.052 453 HA GLN 60 HA GLN 60 -16.365 -2.601 2.451 454 HB2 GLN 60 HB2 GLN 60 -17.877 -1.192 3.776 455 HB3 GLN 60 HB1 GLN 60 -16.740 0.143 3.660 456 HG2 GLN 60 HG2 GLN 60 -18.566 0.438 2.108 457 HG3 GLN 60 HG1 GLN 60 -17.049 0.206 1.243 458 HE21 GLN 60 HE21 GLN 60 -16.750 -1.619 0.008 459 HE22 GLN 60 HE22 GLN 60 -18.043 -2.708 -0.385 460 H ALA 61 HN ALA 61 -14.150 -0.111 3.641 461 HA ALA 61 HA ALA 61 -13.378 0.925 1.144 462 HB1 ALA 61 HB1 ALA 61 -12.906 2.064 3.254 463 HB2 ALA 61 HB2 ALA 61 -11.431 1.824 2.318 464 HB3 ALA 61 HB3 ALA 61 -11.778 0.783 3.698 465 H LEU 62 HN LEU 62 -11.981 -1.622 3.164 466 HA LEU 62 HA LEU 62 -9.865 -2.304 1.427 467 HB2 LEU 62 HB2 LEU 62 -11.308 -4.063 3.415 468 HB3 LEU 62 HB1 LEU 62 -9.736 -4.386 2.711 469 HG LEU 62 HG LEU 62 -10.373 -2.061 4.531 470 HD11 LEU 62 HD11 LEU 62 -8.883 -4.624 5.073 471 HD12 LEU 62 HD12 LEU 62 -10.469 -4.189 5.710 472 HD13 LEU 62 HD13 LEU 62 -9.044 -3.268 6.188 473 HD21 LEU 62 HD21 LEU 62 -8.584 -1.558 2.955 474 HD22 LEU 62 HD22 LEU 62 -7.750 -3.044 3.410 475 HD23 LEU 62 HD23 LEU 62 -7.945 -1.745 4.588 476 H LYS 63 HN LYS 63 -13.193 -3.415 1.704 477 HA LYS 63 HA LYS 63 -13.016 -5.534 -0.157 478 HB2 LYS 63 HB2 LYS 63 -14.834 -5.380 1.460 479 HB3 LYS 63 HB1 LYS 63 -15.400 -3.890 0.717 480 HG2 LYS 63 HG2 LYS 63 -16.064 -5.041 -1.259 481 HG3 LYS 63 HG1 LYS 63 -15.288 -6.530 -0.717 482 HD2 LYS 63 HD2 LYS 63 -16.862 -6.711 1.123 483 HD3 LYS 63 HD1 LYS 63 -17.602 -5.177 0.665 484 HE2 LYS 63 HE2 LYS 63 -18.874 -7.189 -0.077 485 HE3 LYS 63 HE1 LYS 63 -18.417 -6.099 -1.386 486 HZ1 LYS 63 HZ1 LYS 63 -18.078 -8.605 -1.696 487 HZ2 LYS 63 HZ2 LYS 63 -16.726 -8.420 -0.703 488 HZ3 LYS 63 HZ3 LYS 63 -16.822 -7.569 -2.161 489 H SER 64 HN SER 64 -13.973 -2.131 -0.508 490 HA SER 64 HA SER 64 -14.543 -2.308 -3.278 491 HB2 SER 64 HB2 SER 64 -13.795 0.097 -1.595 492 HB3 SER 64 HB1 SER 64 -14.475 0.165 -3.222 493 HG SER 64 HG SER 64 -16.264 -1.133 -2.274 494 H GLY 65 HN GLY 65 -11.600 -1.794 -1.446 495 HA2 GLY 65 HA2 GLY 65 -9.951 -1.160 -3.689 496 HA3 GLY 65 HA1 GLY 65 -9.404 -1.786 -2.137 497 H GLY 66 HN GLY 66 -11.170 -4.123 -2.300 498 HA2 GLY 66 HA2 GLY 66 -11.408 -6.068 -3.705 499 HA3 GLY 66 HA1 GLY 66 -9.916 -5.612 -4.511 500 H LEU 67 HN LEU 67 -10.009 -5.329 -1.089 501 HA LEU 67 HA LEU 67 -7.903 -7.319 -0.929 502 HB2 LEU 67 HB2 LEU 67 -8.845 -5.100 0.825 503 HB3 LEU 67 HB1 LEU 67 -7.913 -6.401 1.538 504 HG LEU 67 HG LEU 67 -6.055 -5.922 0.006 505 HD11 LEU 67 HD11 LEU 67 -7.757 -3.627 -0.944 506 HD12 LEU 67 HD12 LEU 67 -7.308 -5.048 -1.889 507 HD13 LEU 67 HD13 LEU 67 -6.067 -3.906 -1.367 508 HD21 LEU 67 HD21 LEU 67 -5.393 -3.779 0.971 509 HD22 LEU 67 HD22 LEU 67 -6.109 -4.845 2.179 510 HD23 LEU 67 HD23 LEU 67 -7.052 -3.513 1.510 511 H VAL 68 HN VAL 68 -11.095 -6.759 0.549 512 HA VAL 68 HA VAL 68 -10.866 -9.456 1.703 513 HB VAL 68 HB VAL 68 -12.303 -8.736 3.566 514 HG11 VAL 68 HG11 VAL 68 -9.799 -7.094 3.203 515 HG12 VAL 68 HG12 VAL 68 -9.899 -8.727 3.864 516 HG13 VAL 68 HG13 VAL 68 -10.621 -7.377 4.737 517 HG21 VAL 68 HG21 VAL 68 -11.990 -5.979 2.381 518 HG22 VAL 68 HG22 VAL 68 -12.694 -6.344 3.955 519 HG23 VAL 68 HG23 VAL 68 -13.484 -6.909 2.483 520 H GLU 69 HN GLU 69 -12.770 -10.662 1.967 521 HA GLU 69 HA GLU 69 -14.995 -9.870 0.205 522 HB2 GLU 69 HB2 GLU 69 -13.461 -12.361 0.389 523 HB3 GLU 69 HB1 GLU 69 -15.200 -12.609 0.480 524 HG2 GLU 69 HG2 GLU 69 -13.709 -11.190 -1.715 525 HG3 GLU 69 HG1 GLU 69 -14.454 -12.788 -1.804 526 H ALA 70 HN ALA 70 -17.089 -10.940 0.838 527 HA ALA 70 HA ALA 70 -17.293 -11.094 3.770 528 HB1 ALA 70 HB1 ALA 70 -18.087 -8.919 2.981 529 HB2 ALA 70 HB2 ALA 70 -19.404 -9.879 3.656 530 HB3 ALA 70 HB3 ALA 70 -19.229 -9.726 1.907 531 H ARG 71 HN ARG 71 -18.260 -12.847 4.509 532 HA ARG 71 HA ARG 71 -19.959 -14.408 2.687 533 HB2 ARG 71 HB2 ARG 71 -18.134 -15.730 3.585 534 HB3 ARG 71 HB1 ARG 71 -18.526 -15.228 5.227 535 HG2 ARG 71 HG2 ARG 71 -20.670 -16.391 5.070 536 HG3 ARG 71 HG1 ARG 71 -20.272 -16.898 3.429 537 HD2 ARG 71 HD2 ARG 71 -18.428 -18.217 4.231 538 HD3 ARG 71 HD1 ARG 71 -18.649 -17.601 5.871 539 HE ARG 71 HE ARG 71 -20.993 -18.703 5.543 540 HH11 ARG 71 HH11 ARG 71 -17.910 -19.969 4.472 541 HH12 ARG 71 HH12 ARG 71 -18.406 -21.630 4.598 542 HH21 ARG 71 HH21 ARG 71 -21.654 -20.849 5.727 543 HH22 ARG 71 HH22 ARG 71 -20.556 -22.134 5.292 544 H ARG 72 HN ARG 72 -22.022 -13.900 2.910 545 HA ARG 72 HA ARG 72 -23.052 -12.942 5.441 546 HB2 ARG 72 HB2 ARG 72 -23.850 -11.915 3.377 547 HB3 ARG 72 HB1 ARG 72 -24.417 -13.472 2.793 548 HG2 ARG 72 HG2 ARG 72 -26.072 -13.564 4.557 549 HG3 ARG 72 HG1 ARG 72 -25.471 -12.046 5.226 550 HD2 ARG 72 HD2 ARG 72 -26.517 -12.310 2.419 551 HD3 ARG 72 HD1 ARG 72 -27.537 -11.883 3.789 552 HE ARG 72 HE ARG 72 -26.167 -9.882 4.057 553 HH11 ARG 72 HH11 ARG 72 -25.934 -11.588 1.010 554 HH12 ARG 72 HH12 ARG 72 -25.459 -10.181 0.111 555 HH21 ARG 72 HH21 ARG 72 -25.585 -8.013 2.877 556 HH22 ARG 72 HH22 ARG 72 -25.294 -8.140 1.159 557 H GLU 73 HN GLU 73 -23.098 -14.534 6.911 558 HA GLU 73 HA GLU 73 -24.307 -17.099 6.151 559 HB2 GLU 73 HB2 GLU 73 -22.010 -17.198 7.059 560 HB3 GLU 73 HB1 GLU 73 -22.570 -16.425 8.536 561 HG2 GLU 73 HG2 GLU 73 -22.296 -18.867 8.740 562 HG3 GLU 73 HG1 GLU 73 -23.939 -18.320 9.073 563 H GLY 74 HN GLY 74 -26.431 -16.972 6.491 564 HA2 GLY 74 HA2 GLY 74 -28.428 -16.745 7.601 565 HA3 GLY 74 HA1 GLY 74 -27.505 -16.734 9.097 566 H THR 75 HN THR 75 -27.645 -14.946 10.256 567 HA THR 75 HA THR 75 -28.437 -12.457 8.894 568 HB THR 75 HB THR 75 -28.582 -12.802 11.870 569 HG1 THR 75 HG1 THR 75 -30.727 -13.650 11.554 570 HG21 THR 75 HG21 THR 75 -30.291 -11.324 9.864 571 HG22 THR 75 HG22 THR 75 -29.036 -10.608 10.876 572 HG23 THR 75 HG23 THR 75 -30.488 -11.286 11.616 573 H ARG 76 HN ARG 76 -25.696 -13.769 9.427 574 HA ARG 76 HA ARG 76 -24.463 -11.425 10.715 575 HB2 ARG 76 HB2 ARG 76 -23.574 -14.308 10.801 576 HB3 ARG 76 HB1 ARG 76 -22.615 -12.958 11.394 577 HG2 ARG 76 HG2 ARG 76 -24.296 -12.442 13.046 578 HG3 ARG 76 HG1 ARG 76 -25.341 -13.720 12.415 579 HD2 ARG 76 HD2 ARG 76 -23.683 -15.391 13.020 580 HD3 ARG 76 HD1 ARG 76 -22.597 -14.126 13.596 581 HE ARG 76 HE ARG 76 -24.161 -13.683 15.380 582 HH11 ARG 76 HH11 ARG 76 -24.736 -16.621 13.553 583 HH12 ARG 76 HH12 ARG 76 -25.612 -17.403 14.832 584 HH21 ARG 76 HH21 ARG 76 -25.327 -14.694 17.056 585 HH22 ARG 76 HH22 ARG 76 -25.962 -16.294 16.822 586 H GLN 77 HN GLN 77 -22.615 -10.586 9.818 587 HA GLN 77 HA GLN 77 -21.928 -11.603 7.142 588 HB2 GLN 77 HB2 GLN 77 -21.666 -8.810 8.275 589 HB3 GLN 77 HB1 GLN 77 -21.054 -9.303 6.703 590 HG2 GLN 77 HG2 GLN 77 -23.328 -9.817 5.972 591 HG3 GLN 77 HG1 GLN 77 -23.944 -9.343 7.552 592 HE21 GLN 77 HE21 GLN 77 -22.520 -8.227 4.579 593 HE22 GLN 77 HE22 GLN 77 -22.906 -6.555 4.789 594 H TYR 78 HN TYR 78 -20.102 -12.689 7.095 595 HA TYR 78 HA TYR 78 -18.002 -12.084 9.058 596 HB2 TYR 78 HB2 TYR 78 -18.515 -14.514 7.331 597 HB3 TYR 78 HB1 TYR 78 -17.054 -14.302 8.287 598 HD1 TYR 78 HD2 TYR 78 -20.770 -14.426 8.625 599 HD2 TYR 78 HD1 TYR 78 -16.997 -15.044 10.494 600 HE1 TYR 78 HE2 TYR 78 -21.902 -15.403 10.577 601 HE2 TYR 78 HE1 TYR 78 -18.121 -16.024 12.451 602 HH TYR 78 HH TYR 78 -20.259 -16.043 13.538 603 H TYR 79 HN TYR 79 -15.980 -11.449 8.411 604 HA TYR 79 HA TYR 79 -15.617 -11.074 5.511 605 HB2 TYR 79 HB2 TYR 79 -15.021 -9.257 7.808 606 HB3 TYR 79 HB1 TYR 79 -13.996 -9.184 6.381 607 HD1 TYR 79 HD1 TYR 79 -17.464 -8.723 7.604 608 HD2 TYR 79 HD2 TYR 79 -14.747 -8.167 4.378 609 HE1 TYR 79 HE1 TYR 79 -19.091 -7.245 6.495 610 HE2 TYR 79 HE2 TYR 79 -16.361 -6.689 3.261 611 HH TYR 79 HH TYR 79 -18.959 -5.312 4.761 612 H ARG 80 HN ARG 80 -13.637 -11.477 4.618 613 HA ARG 80 HA ARG 80 -11.351 -12.191 6.209 614 HB2 ARG 80 HB2 ARG 80 -12.593 -14.298 6.302 615 HB3 ARG 80 HB1 ARG 80 -12.764 -14.302 4.554 616 HG2 ARG 80 HG2 ARG 80 -10.460 -14.724 4.237 617 HG3 ARG 80 HG1 ARG 80 -10.094 -14.386 5.928 618 HD2 ARG 80 HD2 ARG 80 -10.098 -16.807 5.356 619 HD3 ARG 80 HD1 ARG 80 -11.222 -16.368 6.639 620 HE ARG 80 HE ARG 80 -12.993 -16.471 4.901 621 HH11 ARG 80 HH11 ARG 80 -9.991 -18.223 4.425 622 HH12 ARG 80 HH12 ARG 80 -10.726 -19.450 3.433 623 HH21 ARG 80 HH21 ARG 80 -13.952 -18.080 3.601 624 HH22 ARG 80 HH22 ARG 80 -12.967 -19.349 2.933 625 H ILE 81 HN ILE 81 -9.451 -12.607 4.797 626 HA ILE 81 HA ILE 81 -9.163 -10.783 2.738 627 HB ILE 81 HB ILE 81 -7.624 -13.357 3.129 628 HG12 ILE 81 HG12 ILE 81 -7.086 -10.554 4.143 629 HG13 ILE 81 HG11 ILE 81 -7.624 -11.913 5.123 630 HG21 ILE 81 HG21 ILE 81 -7.252 -12.465 0.919 631 HG22 ILE 81 HG22 ILE 81 -5.821 -12.193 1.912 632 HG23 ILE 81 HG23 ILE 81 -6.933 -10.863 1.584 633 HD11 ILE 81 HD11 ILE 81 -5.241 -11.495 5.383 634 HD12 ILE 81 HD12 ILE 81 -5.005 -11.739 3.654 635 HD13 ILE 81 HD13 ILE 81 -5.540 -13.078 4.668 636 H ALA 82 HN ALA 82 -9.617 -10.761 0.616 637 HA ALA 82 HA ALA 82 -11.582 -12.539 -0.347 638 HB1 ALA 82 HB1 ALA 82 -11.510 -11.253 -2.388 639 HB2 ALA 82 HB2 ALA 82 -9.961 -10.550 -1.924 640 HB3 ALA 82 HB3 ALA 82 -11.413 -10.170 -0.998 641 H GLY 83 HN GLY 83 -8.265 -11.996 -1.574 642 HA2 GLY 83 HA2 GLY 83 -8.380 -14.740 -2.648 643 HA3 GLY 83 HA1 GLY 83 -7.751 -13.403 -3.599 644 H GLU 84 HN GLU 84 -6.186 -15.520 -3.324 645 HA GLU 84 HA GLU 84 -4.478 -15.570 -1.074 646 HB2 GLU 84 HB2 GLU 84 -4.696 -17.440 -2.664 647 HB3 GLU 84 HB1 GLU 84 -3.966 -16.458 -3.924 648 HG2 GLU 84 HG2 GLU 84 -1.891 -16.358 -2.608 649 HG3 GLU 84 HG1 GLU 84 -2.630 -17.407 -1.399 650 H ASP 85 HN ASP 85 -4.571 -13.693 -3.983 651 HA ASP 85 HA ASP 85 -1.982 -12.666 -4.053 652 HB2 ASP 85 HB2 ASP 85 -3.120 -10.687 -5.223 653 HB3 ASP 85 HB1 ASP 85 -3.317 -12.279 -5.949 654 H VAL 86 HN VAL 86 -4.869 -11.343 -2.441 655 HA VAL 86 HA VAL 86 -3.545 -9.114 -1.308 656 HB VAL 86 HB VAL 86 -6.043 -10.509 -0.329 657 HG11 VAL 86 HG11 VAL 86 -6.564 -8.355 0.724 658 HG12 VAL 86 HG12 VAL 86 -4.995 -7.730 0.209 659 HG13 VAL 86 HG13 VAL 86 -5.078 -9.056 1.369 660 HG21 VAL 86 HG21 VAL 86 -5.759 -8.132 -2.164 661 HG22 VAL 86 HG22 VAL 86 -7.267 -8.867 -1.615 662 HG23 VAL 86 HG23 VAL 86 -6.179 -9.767 -2.672 663 H ALA 87 HN ALA 87 -4.222 -12.374 -0.126 664 HA ALA 87 HA ALA 87 -3.380 -12.051 2.523 665 HB1 ALA 87 HB1 ALA 87 -4.620 -14.011 1.701 666 HB2 ALA 87 HB2 ALA 87 -3.165 -14.467 2.586 667 HB3 ALA 87 HB3 ALA 87 -3.182 -14.537 0.824 668 H ARG 88 HN ARG 88 -1.577 -13.046 -0.365 669 HA ARG 88 HA ARG 88 0.910 -13.351 0.968 670 HB2 ARG 88 HB2 ARG 88 0.255 -12.903 -1.945 671 HB3 ARG 88 HB1 ARG 88 1.872 -13.246 -1.344 672 HG2 ARG 88 HG2 ARG 88 1.103 -15.401 -0.492 673 HG3 ARG 88 HG1 ARG 88 -0.524 -15.051 -1.083 674 HD2 ARG 88 HD2 ARG 88 0.683 -16.500 -2.633 675 HD3 ARG 88 HD1 ARG 88 0.322 -14.939 -3.367 676 HE ARG 88 HE ARG 88 2.973 -15.647 -2.270 677 HH11 ARG 88 HH11 ARG 88 0.958 -14.152 -4.716 678 HH12 ARG 88 HH12 ARG 88 2.296 -13.554 -5.644 679 HH21 ARG 88 HH21 ARG 88 4.748 -14.853 -3.492 680 HH22 ARG 88 HH22 ARG 88 4.446 -13.961 -4.958 681 H LEU 89 HN LEU 89 -0.688 -10.655 -0.616 682 HA LEU 89 HA LEU 89 1.480 -8.885 -0.756 683 HB2 LEU 89 HB2 LEU 89 -0.887 -8.713 -1.763 684 HB3 LEU 89 HB1 LEU 89 -1.357 -8.038 -0.217 685 HG LEU 89 HG LEU 89 0.835 -6.827 -1.898 686 HD11 LEU 89 HD11 LEU 89 -0.855 -5.229 -2.692 687 HD12 LEU 89 HD12 LEU 89 -2.111 -6.188 -1.911 688 HD13 LEU 89 HD13 LEU 89 -1.181 -6.872 -3.245 689 HD21 LEU 89 HD21 LEU 89 -0.911 -5.703 0.293 690 HD22 LEU 89 HD22 LEU 89 0.321 -4.815 -0.602 691 HD23 LEU 89 HD23 LEU 89 0.785 -6.151 0.452 692 H PHE 90 HN PHE 90 -1.039 -9.221 1.747 693 HA PHE 90 HA PHE 90 0.085 -7.302 3.501 694 HB2 PHE 90 HB2 PHE 90 -2.263 -7.983 3.657 695 HB3 PHE 90 HB1 PHE 90 -1.777 -9.612 4.106 696 HD1 PHE 90 HD2 PHE 90 -1.393 -6.073 5.228 697 HD2 PHE 90 HD1 PHE 90 -1.660 -10.176 6.337 698 HE1 PHE 90 HE2 PHE 90 -1.419 -5.426 7.599 699 HE2 PHE 90 HE1 PHE 90 -1.686 -9.532 8.711 700 HZ PHE 90 HZ PHE 90 -1.566 -7.156 9.344 701 H ALA 91 HN ALA 91 0.521 -10.778 3.147 702 HA ALA 91 HA ALA 91 2.066 -11.159 5.492 703 HB1 ALA 91 HB1 ALA 91 1.010 -13.022 4.317 704 HB2 ALA 91 HB2 ALA 91 2.747 -13.275 4.484 705 HB3 ALA 91 HB3 ALA 91 2.076 -12.762 2.935 706 H LEU 92 HN LEU 92 2.908 -10.441 2.132 707 HA LEU 92 HA LEU 92 5.681 -10.689 2.324 708 HB2 LEU 92 HB2 LEU 92 4.497 -10.492 0.195 709 HB3 LEU 92 HB1 LEU 92 4.048 -8.842 0.580 710 HG LEU 92 HG LEU 92 6.454 -8.222 0.555 711 HD11 LEU 92 HD11 LEU 92 8.072 -9.747 -0.420 712 HD12 LEU 92 HD12 LEU 92 6.845 -11.013 -0.512 713 HD13 LEU 92 HD13 LEU 92 7.389 -10.421 1.060 714 HD21 LEU 92 HD21 LEU 92 5.070 -7.848 -1.400 715 HD22 LEU 92 HD22 LEU 92 5.394 -9.489 -1.965 716 HD23 LEU 92 HD23 LEU 92 6.703 -8.310 -1.879 717 H VAL 93 HN VAL 93 3.707 -7.719 2.569 718 HA VAL 93 HA VAL 93 5.892 -6.053 3.200 719 HB VAL 93 HB VAL 93 3.760 -5.181 2.343 720 HG11 VAL 93 HG11 VAL 93 2.680 -5.813 5.083 721 HG12 VAL 93 HG12 VAL 93 2.205 -6.573 3.565 722 HG13 VAL 93 HG13 VAL 93 1.850 -4.868 3.847 723 HG21 VAL 93 HG21 VAL 93 3.622 -3.194 3.791 724 HG22 VAL 93 HG22 VAL 93 5.284 -3.646 3.422 725 HG23 VAL 93 HG23 VAL 93 4.596 -4.029 5.000 726 H GLN 94 HN GLN 94 3.805 -8.044 5.186 727 HA GLN 94 HA GLN 94 4.592 -7.009 7.695 728 HB2 GLN 94 HB2 GLN 94 2.623 -8.408 7.511 729 HB3 GLN 94 HB1 GLN 94 3.592 -9.757 6.931 730 HG2 GLN 94 HG2 GLN 94 4.741 -9.861 9.080 731 HG3 GLN 94 HG1 GLN 94 3.772 -8.511 9.665 732 HE21 GLN 94 HE21 GLN 94 1.352 -9.441 8.339 733 HE22 GLN 94 HE22 GLN 94 0.787 -10.781 9.273 734 H VAL 95 HN VAL 95 5.806 -9.726 5.742 735 HA VAL 95 HA VAL 95 7.851 -10.510 7.513 736 HB VAL 95 HB VAL 95 7.702 -10.803 4.504 737 HG11 VAL 95 HG11 VAL 95 9.511 -12.211 6.466 738 HG12 VAL 95 HG12 VAL 95 10.015 -10.989 5.299 739 HG13 VAL 95 HG13 VAL 95 9.396 -12.543 4.737 740 HG21 VAL 95 HG21 VAL 95 5.884 -11.921 5.659 741 HG22 VAL 95 HG22 VAL 95 7.029 -12.709 6.742 742 HG23 VAL 95 HG23 VAL 95 7.022 -13.110 5.026 743 H VAL 96 HN VAL 96 7.815 -8.220 4.806 744 HA VAL 96 HA VAL 96 10.496 -7.463 4.830 745 HB VAL 96 HB VAL 96 8.066 -5.755 4.247 746 HG11 VAL 96 HG11 VAL 96 10.015 -4.367 4.774 747 HG12 VAL 96 HG12 VAL 96 9.584 -4.252 3.066 748 HG13 VAL 96 HG13 VAL 96 10.960 -5.237 3.566 749 HG21 VAL 96 HG21 VAL 96 8.619 -6.209 1.899 750 HG22 VAL 96 HG22 VAL 96 8.263 -7.692 2.786 751 HG23 VAL 96 HG23 VAL 96 9.935 -7.262 2.418 752 H ALA 97 HN ALA 97 7.770 -5.956 6.573 753 HA ALA 97 HA ALA 97 9.284 -4.109 8.028 754 HB1 ALA 97 HB1 ALA 97 6.840 -4.021 7.833 755 HB2 ALA 97 HB2 ALA 97 7.366 -3.954 9.515 756 HB3 ALA 97 HB3 ALA 97 6.716 -5.452 8.853 757 H ASP 98 HN ASP 98 8.240 -7.387 8.868 758 HA ASP 98 HA ASP 98 9.145 -7.383 11.511 759 HB2 ASP 98 HB2 ASP 98 7.552 -9.022 10.679 760 HB3 ASP 98 HB1 ASP 98 8.779 -9.708 9.619 761 H GLU 99 HN GLU 99 10.779 -8.709 8.609 762 HA GLU 99 HA GLU 99 13.008 -9.527 10.241 763 HB2 GLU 99 HB2 GLU 99 12.508 -9.697 7.279 764 HB3 GLU 99 HB1 GLU 99 14.000 -10.246 8.031 765 HG2 GLU 99 HG2 GLU 99 12.572 -11.722 9.496 766 HG3 GLU 99 HG1 GLU 99 11.220 -11.313 8.442 767 H HIS 100 HN HIS 100 12.276 -6.723 8.324 768 HA HIS 100 HA HIS 100 15.076 -5.960 8.147 769 HB2 HIS 100 HB2 HIS 100 12.532 -4.619 7.262 770 HB3 HIS 100 HB1 HIS 100 14.080 -3.784 7.224 771 HD1 HIS 100 HD1 HIS 100 15.444 -4.087 5.157 772 HD2 HIS 100 HD2 HIS 100 12.510 -7.014 5.555 773 HE1 HIS 100 HE1 HIS 100 15.469 -5.378 3.000 774 HE2 HIS 100 HE2 HIS 100 13.490 -6.933 3.159 775 H LEU 101 HN LEU 101 12.353 -5.352 10.226 776 HA LEU 101 HA LEU 101 13.701 -3.110 11.517 777 HB2 LEU 101 HB2 LEU 101 11.249 -3.068 11.066 778 HB3 LEU 101 HB1 LEU 101 11.057 -4.396 12.192 779 HG LEU 101 HG LEU 101 11.949 -2.940 14.000 780 HD11 LEU 101 HD11 LEU 101 13.253 -1.409 12.628 781 HD12 LEU 101 HD12 LEU 101 12.085 -0.532 13.614 782 HD13 LEU 101 HD13 LEU 101 11.775 -0.787 11.897 783 HD21 LEU 101 HD21 LEU 101 9.550 -3.207 13.687 784 HD22 LEU 101 HD22 LEU 101 9.541 -1.877 12.530 785 HD23 LEU 101 HD23 LEU 101 9.933 -1.572 14.222 786 H GLU 102 HN GLU 102 13.344 -6.494 11.869 787 HA GLU 102 HA GLU 102 13.655 -6.763 14.653 788 HB2 GLU 102 HB2 GLU 102 12.945 -8.626 13.238 789 HB3 GLU 102 HB1 GLU 102 14.501 -8.627 12.423 790 HG2 GLU 102 HG2 GLU 102 14.682 -8.916 15.327 791 HG3 GLU 102 HG1 GLU 102 13.807 -10.219 14.526 792 H HIS 103 HN HIS 103 16.045 -6.720 12.029 793 HA HIS 103 HA HIS 103 18.221 -6.778 13.934 794 HB2 HIS 103 HB2 HIS 103 17.913 -7.362 11.155 795 HB3 HIS 103 HB1 HIS 103 19.164 -6.134 11.331 796 HD1 HIS 103 HD1 HIS 103 18.313 -9.377 13.172 797 HD2 HIS 103 HD2 HIS 103 21.572 -7.307 11.610 798 HE1 HIS 103 HE1 HIS 103 20.322 -10.832 13.610 799 HE2 HIS 103 HE2 HIS 103 22.255 -9.630 12.521 800 H HIS 104 HN HIS 104 19.477 -5.093 14.529 801 HA HIS 104 HA HIS 104 19.957 -2.948 15.087 802 HB2 HIS 104 HB2 HIS 104 20.491 -2.744 12.660 803 HB3 HIS 104 HB1 HIS 104 18.831 -2.254 12.355 804 HD1 HIS 104 HD1 HIS 104 21.770 -1.045 14.475 805 HD2 HIS 104 HD2 HIS 104 18.525 0.426 12.320 806 HE1 HIS 104 HE1 HIS 104 21.978 1.465 14.552 807 HE2 HIS 104 HE2 HIS 104 20.007 2.336 13.237 808 H HIS 105 HN HIS 105 17.729 -3.974 16.161 809 HA HIS 105 HA HIS 105 15.464 -2.252 15.719 810 HB2 HIS 105 HB2 HIS 105 14.378 -3.558 17.542 811 HB3 HIS 105 HB1 HIS 105 14.950 -4.544 16.207 812 HD1 HIS 105 HD1 HIS 105 16.850 -6.225 16.702 813 HD2 HIS 105 HD2 HIS 105 15.619 -4.037 20.017 814 HE1 HIS 105 HE1 HIS 105 17.855 -7.384 18.689 815 HE2 HIS 105 HE2 HIS 105 16.881 -6.197 20.689 816 H HIS 106 HN HIS 106 15.544 -0.275 16.391 817 HA HIS 106 HA HIS 106 17.006 0.541 18.727 818 HB2 HIS 106 HB2 HIS 106 16.953 2.065 16.878 819 HB3 HIS 106 HB1 HIS 106 15.201 1.994 16.786 820 HD1 HIS 106 HD1 HIS 106 14.841 4.488 17.064 821 HD2 HIS 106 HD2 HIS 106 17.004 2.787 20.177 822 HE1 HIS 106 HE1 HIS 106 14.935 6.242 18.862 823 HE2 HIS 106 HE2 HIS 106 15.959 5.055 20.831 824 H HIS 107 HN HIS 107 16.117 -0.442 20.494 825 HA HIS 107 HA HIS 107 13.306 -0.320 21.044 826 HB2 HIS 107 HB2 HIS 107 13.851 -1.364 23.181 827 HB3 HIS 107 HB1 HIS 107 14.683 -2.187 21.870 828 HD1 HIS 107 HD1 HIS 107 15.229 -0.647 25.108 829 HD2 HIS 107 HD2 HIS 107 17.539 -1.482 21.751 830 HE1 HIS 107 HE1 HIS 107 17.618 -0.524 25.880 831 HE2 HIS 107 HE2 HIS 107 18.991 -1.199 23.877 832 H HIS 108 HN HIS 108 12.229 1.296 21.867 833 HA HIS 108 HA HIS 108 11.720 3.401 22.385 834 HB2 HIS 108 HB2 HIS 108 12.087 4.088 24.557 835 HB3 HIS 108 HB1 HIS 108 12.314 2.356 24.672 836 HD1 HIS 108 HD1 HIS 108 14.555 1.533 25.526 837 HD2 HIS 108 HD2 HIS 108 14.453 5.641 24.896 838 HE1 HIS 108 HE1 HIS 108 16.630 2.441 26.625 839 HE2 HIS 108 HE2 HIS 108 16.436 4.942 26.407 840 H1 MET 1 HT1 MET 1 15.559 -0.912 34.465 841 H2 MET 1 HT2 MET 1 14.765 -1.913 33.348 842 H3 MET 1 HT3 MET 1 14.002 -1.499 34.806 843 HA MET 1 HA MET 1 13.941 0.818 34.136 844 HB2 MET 1 HB2 MET 1 15.087 -0.293 31.563 845 HB3 MET 1 HB1 MET 1 14.410 1.320 31.731 846 HG2 MET 1 HG2 MET 1 16.121 1.905 33.332 847 HG3 MET 1 HG1 MET 1 16.777 0.271 33.259 848 HE1 MET 1 HE1 MET 1 19.179 1.249 32.776 849 HE2 MET 1 HE2 MET 1 18.550 2.896 32.828 850 HE3 MET 1 HE3 MET 1 19.542 2.374 31.466 851 H ALA 2 HN ALA 2 12.389 1.590 32.280 852 HA ALA 2 HA ALA 2 10.548 -0.568 31.527 853 HB1 ALA 2 HB1 ALA 2 9.718 2.029 32.820 854 HB2 ALA 2 HB2 ALA 2 9.658 0.434 33.568 855 HB3 ALA 2 HB3 ALA 2 8.628 0.799 32.185 856 H GLY 3 HN GLY 3 8.767 0.500 30.044 857 HA2 GLY 3 HA2 GLY 3 8.628 2.641 28.617 858 HA3 GLY 3 HA1 GLY 3 10.219 2.131 28.069 859 H GLN 4 HN GLN 4 8.328 2.486 26.216 860 HA GLN 4 HA GLN 4 7.505 1.496 24.346 861 HB2 GLN 4 HB2 GLN 4 8.637 -1.045 25.535 862 HB3 GLN 4 HB1 GLN 4 8.014 -0.883 23.897 863 HG2 GLN 4 HG2 GLN 4 9.854 0.173 23.154 864 HG3 GLN 4 HG1 GLN 4 10.081 1.062 24.658 865 HE21 GLN 4 HE21 GLN 4 10.012 -1.344 26.299 866 HE22 GLN 4 HE22 GLN 4 11.547 -2.120 26.060 867 H SER 5 HN SER 5 5.992 -0.564 23.734 868 HA SER 5 HA SER 5 4.178 -1.200 25.902 869 HB2 SER 5 HB2 SER 5 3.157 0.262 23.455 870 HB3 SER 5 HB1 SER 5 2.200 -0.289 24.828 871 HG SER 5 HG SER 5 4.057 1.166 25.895 872 H ASP 6 HN ASP 6 3.564 -1.161 22.412 873 HA ASP 6 HA ASP 6 3.280 -4.086 22.521 874 HB2 ASP 6 HB2 ASP 6 2.135 -2.128 20.512 875 HB3 ASP 6 HB1 ASP 6 1.843 -3.863 20.545 876 H ARG 7 HN ARG 7 4.480 -5.363 21.201 877 HA ARG 7 HA ARG 7 6.552 -4.056 19.621 878 HB2 ARG 7 HB2 ARG 7 6.090 -6.988 20.216 879 HB3 ARG 7 HB1 ARG 7 7.458 -6.345 19.318 880 HG2 ARG 7 HG2 ARG 7 8.054 -5.015 21.347 881 HG3 ARG 7 HG1 ARG 7 6.799 -5.898 22.216 882 HD2 ARG 7 HD2 ARG 7 9.208 -7.099 20.855 883 HD3 ARG 7 HD1 ARG 7 8.996 -6.888 22.590 884 HE ARG 7 HE ARG 7 7.117 -8.577 21.071 885 HH11 ARG 7 HH11 ARG 7 9.558 -8.216 23.562 886 HH12 ARG 7 HH12 ARG 7 9.324 -9.812 24.206 887 HH21 ARG 7 HH21 ARG 7 6.795 -10.662 21.918 888 HH22 ARG 7 HH22 ARG 7 7.747 -11.211 23.269 889 H LYS 8 HN LYS 8 3.704 -6.044 19.270 890 HA LYS 8 HA LYS 8 3.851 -6.673 16.548 891 HB2 LYS 8 HB2 LYS 8 2.211 -7.610 18.166 892 HB3 LYS 8 HB1 LYS 8 1.380 -6.063 18.189 893 HG2 LYS 8 HG2 LYS 8 0.953 -6.332 15.750 894 HG3 LYS 8 HG1 LYS 8 1.640 -7.953 15.864 895 HD2 LYS 8 HD2 LYS 8 -0.063 -8.522 17.562 896 HD3 LYS 8 HD1 LYS 8 -0.769 -6.919 17.360 897 HE2 LYS 8 HE2 LYS 8 -2.081 -8.367 16.047 898 HE3 LYS 8 HE1 LYS 8 -1.050 -7.492 14.916 899 HZ1 LYS 8 HZ1 LYS 8 -0.678 -10.275 15.887 900 HZ2 LYS 8 HZ2 LYS 8 0.459 -9.446 14.938 901 HZ3 LYS 8 HZ3 LYS 8 -1.082 -9.788 14.309 902 H ALA 9 HN ALA 9 2.706 -3.790 18.202 903 HA ALA 9 HA ALA 9 1.481 -2.530 16.002 904 HB1 ALA 9 HB1 ALA 9 2.695 -1.251 18.445 905 HB2 ALA 9 HB2 ALA 9 1.057 -1.895 18.330 906 HB3 ALA 9 HB3 ALA 9 1.531 -0.511 17.345 907 H ALA 10 HN ALA 10 4.801 -2.845 16.932 908 HA ALA 10 HA ALA 10 5.829 -0.584 15.558 909 HB1 ALA 10 HB1 ALA 10 7.103 -1.752 17.297 910 HB2 ALA 10 HB2 ALA 10 8.003 -1.663 15.782 911 HB3 ALA 10 HB3 ALA 10 7.220 -3.172 16.257 912 H LEU 11 HN LEU 11 5.125 -3.905 14.621 913 HA LEU 11 HA LEU 11 6.359 -3.687 12.045 914 HB2 LEU 11 HB2 LEU 11 4.343 -5.666 13.112 915 HB3 LEU 11 HB1 LEU 11 5.073 -5.776 11.525 916 HG LEU 11 HG LEU 11 6.310 -7.280 12.781 917 HD11 LEU 11 HD11 LEU 11 7.783 -5.789 11.578 918 HD12 LEU 11 HD12 LEU 11 8.530 -6.297 13.093 919 HD13 LEU 11 HD13 LEU 11 7.827 -4.684 12.952 920 HD21 LEU 11 HD21 LEU 11 6.398 -5.275 15.029 921 HD22 LEU 11 HD22 LEU 11 7.150 -6.870 15.036 922 HD23 LEU 11 HD23 LEU 11 5.393 -6.723 14.965 923 H LEU 12 HN LEU 12 3.064 -3.442 13.292 924 HA LEU 12 HA LEU 12 1.774 -3.009 10.833 925 HB2 LEU 12 HB2 LEU 12 1.050 -2.081 13.611 926 HB3 LEU 12 HB1 LEU 12 -0.007 -1.922 12.221 927 HG LEU 12 HG LEU 12 0.981 -4.521 13.400 928 HD11 LEU 12 HD11 LEU 12 -0.676 -3.401 14.796 929 HD12 LEU 12 HD12 LEU 12 -1.347 -4.849 14.046 930 HD13 LEU 12 HD13 LEU 12 -1.753 -3.258 13.409 931 HD21 LEU 12 HD21 LEU 12 0.696 -4.689 10.984 932 HD22 LEU 12 HD22 LEU 12 -0.925 -4.005 11.117 933 HD23 LEU 12 HD23 LEU 12 -0.572 -5.579 11.829 934 H ASP 13 HN ASP 13 3.447 -0.841 13.026 935 HA ASP 13 HA ASP 13 2.730 1.592 11.823 936 HB2 ASP 13 HB2 ASP 13 3.803 1.648 13.959 937 HB3 ASP 13 HB1 ASP 13 5.205 0.773 13.348 938 H GLN 14 HN GLN 14 5.475 -0.579 11.204 939 HA GLN 14 HA GLN 14 6.653 1.048 9.208 940 HB2 GLN 14 HB2 GLN 14 7.627 -0.977 10.558 941 HB3 GLN 14 HB1 GLN 14 6.974 -1.936 9.238 942 HG2 GLN 14 HG2 GLN 14 8.868 0.364 8.836 943 HG3 GLN 14 HG1 GLN 14 9.392 -1.303 9.036 944 HE21 GLN 14 HE21 GLN 14 9.642 0.596 6.783 945 HE22 GLN 14 HE22 GLN 14 8.960 -0.218 5.422 946 H VAL 15 HN VAL 15 4.486 -1.763 9.036 947 HA VAL 15 HA VAL 15 4.213 -1.922 6.267 948 HB VAL 15 HB VAL 15 2.154 -2.513 8.409 949 HG11 VAL 15 HG11 VAL 15 1.005 -3.864 6.742 950 HG12 VAL 15 HG12 VAL 15 2.180 -3.378 5.518 951 HG13 VAL 15 HG13 VAL 15 1.094 -2.181 6.221 952 HG21 VAL 15 HG21 VAL 15 4.072 -4.311 6.927 953 HG22 VAL 15 HG22 VAL 15 2.846 -4.845 8.075 954 HG23 VAL 15 HG23 VAL 15 4.185 -3.837 8.621 955 H ALA 16 HN ALA 16 2.481 0.068 8.619 956 HA ALA 16 HA ALA 16 0.689 1.286 6.836 957 HB1 ALA 16 HB1 ALA 16 1.860 2.401 9.382 958 HB2 ALA 16 HB2 ALA 16 0.411 1.404 9.256 959 HB3 ALA 16 HB3 ALA 16 0.438 3.017 8.543 960 H ARG 17 HN ARG 17 4.002 2.115 7.773 961 HA ARG 17 HA ARG 17 4.178 4.629 6.543 962 HB2 ARG 17 HB2 ARG 17 6.328 2.532 6.911 963 HB3 ARG 17 HB1 ARG 17 6.629 4.200 6.442 964 HG2 ARG 17 HG2 ARG 17 5.703 4.969 8.562 965 HG3 ARG 17 HG1 ARG 17 5.388 3.295 9.031 966 HD2 ARG 17 HD2 ARG 17 7.784 2.814 8.878 967 HD3 ARG 17 HD1 ARG 17 8.090 4.493 8.430 968 HE ARG 17 HE ARG 17 6.958 3.680 11.046 969 HH11 ARG 17 HH11 ARG 17 9.055 5.681 9.078 970 HH12 ARG 17 HH12 ARG 17 9.648 6.608 10.421 971 HH21 ARG 17 HH21 ARG 17 7.736 4.895 12.812 972 HH22 ARG 17 HH22 ARG 17 8.903 6.154 12.547 973 H VAL 18 HN VAL 18 4.874 1.397 5.265 974 HA VAL 18 HA VAL 18 5.630 2.200 2.676 975 HB VAL 18 HB VAL 18 4.297 -0.394 3.495 976 HG11 VAL 18 HG11 VAL 18 5.980 0.276 1.080 977 HG12 VAL 18 HG12 VAL 18 4.246 -0.047 1.084 978 HG13 VAL 18 HG13 VAL 18 5.383 -1.328 1.504 979 HG21 VAL 18 HG21 VAL 18 7.227 0.302 3.304 980 HG22 VAL 18 HG22 VAL 18 6.561 -1.287 3.686 981 HG23 VAL 18 HG23 VAL 18 6.319 0.062 4.796 982 H GLY 19 HN GLY 19 2.499 1.247 4.029 983 HA2 GLY 19 HA2 GLY 19 1.003 1.443 1.653 984 HA3 GLY 19 HA1 GLY 19 0.354 1.531 3.283 985 H LYS 20 HN LYS 20 1.811 3.873 4.090 986 HA LYS 20 HA LYS 20 0.020 5.857 3.139 987 HB2 LYS 20 HB2 LYS 20 2.537 6.073 4.798 988 HB3 LYS 20 HB1 LYS 20 1.465 7.429 4.472 989 HG2 LYS 20 HG2 LYS 20 -0.311 6.431 5.683 990 HG3 LYS 20 HG1 LYS 20 0.540 4.889 5.783 991 HD2 LYS 20 HD2 LYS 20 2.284 6.000 7.160 992 HD3 LYS 20 HD1 LYS 20 1.319 7.476 7.134 993 HE2 LYS 20 HE2 LYS 20 -0.513 6.320 8.241 994 HE3 LYS 20 HE1 LYS 20 0.400 4.814 8.213 995 HZ1 LYS 20 HZ1 LYS 20 2.021 5.769 9.690 996 HZ2 LYS 20 HZ2 LYS 20 0.481 5.929 10.374 997 HZ3 LYS 20 HZ3 LYS 20 1.235 7.274 9.659 998 H ALA 21 HN ALA 21 3.375 5.080 2.383 999 HA ALA 21 HA ALA 21 3.721 7.387 0.701 1000 HB1 ALA 21 HB1 ALA 21 5.869 6.374 0.107 1001 HB2 ALA 21 HB2 ALA 21 5.409 4.898 0.957 1002 HB3 ALA 21 HB3 ALA 21 5.630 6.401 1.854 1003 H LEU 22 HN LEU 22 3.085 3.955 0.236 1004 HA LEU 22 HA LEU 22 2.908 4.273 -2.661 1005 HB2 LEU 22 HB2 LEU 22 3.781 2.231 -1.023 1006 HB3 LEU 22 HB1 LEU 22 2.186 1.680 -1.493 1007 HG LEU 22 HG LEU 22 4.330 2.479 -3.465 1008 HD11 LEU 22 HD11 LEU 22 5.058 0.551 -2.169 1009 HD12 LEU 22 HD12 LEU 22 4.658 0.087 -3.823 1010 HD13 LEU 22 HD13 LEU 22 3.532 -0.265 -2.512 1011 HD21 LEU 22 HD21 LEU 22 1.748 0.964 -3.822 1012 HD22 LEU 22 HD22 LEU 22 2.935 1.303 -5.080 1013 HD23 LEU 22 HD23 LEU 22 2.046 2.627 -4.327 1014 H ALA 23 HN ALA 23 0.964 5.495 -0.776 1015 HA ALA 23 HA ALA 23 -1.435 4.018 -0.737 1016 HB1 ALA 23 HB1 ALA 23 -0.993 5.898 0.783 1017 HB2 ALA 23 HB2 ALA 23 -2.528 6.071 -0.072 1018 HB3 ALA 23 HB3 ALA 23 -1.122 7.011 -0.580 1019 H ASN 24 HN ASN 24 -1.064 7.085 -2.493 1020 HA ASN 24 HA ASN 24 -2.010 6.008 -4.964 1021 HB2 ASN 24 HB2 ASN 24 -4.214 6.947 -4.995 1022 HB3 ASN 24 HB1 ASN 24 -4.078 5.996 -3.518 1023 HD21 ASN 24 HD21 ASN 24 -4.520 9.118 -4.879 1024 HD22 ASN 24 HD22 ASN 24 -4.775 9.975 -3.388 1025 H GLY 25 HN GLY 25 -2.428 7.754 -6.567 1026 HA2 GLY 25 HA2 GLY 25 -2.546 10.045 -7.134 1027 HA3 GLY 25 HA1 GLY 25 -1.652 10.420 -5.674 1028 H ARG 26 HN ARG 26 -0.346 11.782 -6.905 1029 HA ARG 26 HA ARG 26 1.081 10.985 -9.203 1030 HB2 ARG 26 HB2 ARG 26 1.311 13.269 -7.271 1031 HB3 ARG 26 HB1 ARG 26 2.507 13.051 -8.542 1032 HG2 ARG 26 HG2 ARG 26 0.981 13.471 -10.229 1033 HG3 ARG 26 HG1 ARG 26 -0.405 13.100 -9.202 1034 HD2 ARG 26 HD2 ARG 26 1.396 15.445 -8.674 1035 HD3 ARG 26 HD1 ARG 26 0.015 15.552 -9.768 1036 HE ARG 26 HE ARG 26 -0.340 14.680 -6.979 1037 HH11 ARG 26 HH11 ARG 26 -0.989 16.964 -9.551 1038 HH12 ARG 26 HH12 ARG 26 -2.339 17.696 -8.733 1039 HH21 ARG 26 HH21 ARG 26 -2.124 15.627 -5.903 1040 HH22 ARG 26 HH22 ARG 26 -2.993 16.928 -6.669 1041 H ARG 27 HN ARG 27 1.665 10.559 -5.824 1042 HA ARG 27 HA ARG 27 4.421 10.161 -5.757 1043 HB2 ARG 27 HB2 ARG 27 2.245 8.689 -4.254 1044 HB3 ARG 27 HB1 ARG 27 3.956 8.565 -3.882 1045 HG2 ARG 27 HG2 ARG 27 4.026 10.933 -3.335 1046 HG3 ARG 27 HG1 ARG 27 2.313 11.083 -3.734 1047 HD2 ARG 27 HD2 ARG 27 1.740 9.514 -1.970 1048 HD3 ARG 27 HD1 ARG 27 3.447 9.275 -1.603 1049 HE ARG 27 HE ARG 27 3.196 11.907 -1.236 1050 HH11 ARG 27 HH11 ARG 27 1.228 9.230 -0.130 1051 HH12 ARG 27 HH12 ARG 27 0.720 10.027 1.328 1052 HH21 ARG 27 HH21 ARG 27 2.565 12.960 0.681 1053 HH22 ARG 27 HH22 ARG 27 1.477 12.170 1.788 1054 H LEU 28 HN LEU 28 1.831 8.032 -6.829 1055 HA LEU 28 HA LEU 28 3.546 5.732 -7.042 1056 HB2 LEU 28 HB2 LEU 28 0.790 6.080 -8.205 1057 HB3 LEU 28 HB1 LEU 28 1.624 4.573 -7.879 1058 HG LEU 28 HG LEU 28 0.426 6.491 -5.901 1059 HD11 LEU 28 HD11 LEU 28 -1.075 4.862 -6.896 1060 HD12 LEU 28 HD12 LEU 28 -0.802 4.514 -5.188 1061 HD13 LEU 28 HD13 LEU 28 0.016 3.556 -6.426 1062 HD21 LEU 28 HD21 LEU 28 2.597 5.879 -5.024 1063 HD22 LEU 28 HD22 LEU 28 2.271 4.175 -5.338 1064 HD23 LEU 28 HD23 LEU 28 1.328 5.045 -4.129 1065 H GLN 29 HN GLN 29 2.366 8.247 -9.150 1066 HA GLN 29 HA GLN 29 3.077 7.066 -11.615 1067 HB2 GLN 29 HB2 GLN 29 1.660 9.132 -11.314 1068 HB3 GLN 29 HB1 GLN 29 3.135 10.017 -10.950 1069 HG2 GLN 29 HG2 GLN 29 4.006 9.461 -13.169 1070 HG3 GLN 29 HG1 GLN 29 2.514 8.593 -13.527 1071 HE21 GLN 29 HE21 GLN 29 0.856 10.560 -12.125 1072 HE22 GLN 29 HE22 GLN 29 0.780 11.935 -13.165 1073 H ILE 30 HN ILE 30 4.833 8.885 -9.197 1074 HA ILE 30 HA ILE 30 7.287 9.133 -10.562 1075 HB ILE 30 HB ILE 30 6.835 8.849 -7.585 1076 HG12 ILE 30 HG12 ILE 30 7.063 11.349 -9.273 1077 HG13 ILE 30 HG11 ILE 30 5.561 10.713 -8.607 1078 HG21 ILE 30 HG21 ILE 30 9.172 9.987 -9.113 1079 HG22 ILE 30 HG22 ILE 30 9.153 8.466 -8.219 1080 HG23 ILE 30 HG23 ILE 30 8.984 9.997 -7.358 1081 HD11 ILE 30 HD11 ILE 30 6.426 11.049 -6.348 1082 HD12 ILE 30 HD12 ILE 30 6.408 12.553 -7.271 1083 HD13 ILE 30 HD13 ILE 30 7.925 11.689 -7.021 1084 H LEU 31 HN LEU 31 6.012 6.635 -8.386 1085 HA LEU 31 HA LEU 31 8.282 5.001 -8.296 1086 HB2 LEU 31 HB2 LEU 31 5.358 4.320 -8.046 1087 HB3 LEU 31 HB1 LEU 31 6.646 3.172 -7.737 1088 HG LEU 31 HG LEU 31 6.254 5.758 -6.229 1089 HD11 LEU 31 HD11 LEU 31 5.526 4.331 -4.381 1090 HD12 LEU 31 HD12 LEU 31 5.624 2.919 -5.433 1091 HD13 LEU 31 HD13 LEU 31 4.451 4.192 -5.772 1092 HD21 LEU 31 HD21 LEU 31 7.906 4.801 -4.682 1093 HD22 LEU 31 HD22 LEU 31 8.577 5.051 -6.294 1094 HD23 LEU 31 HD23 LEU 31 8.119 3.430 -5.772 1095 H ASP 32 HN ASP 32 5.544 5.011 -10.543 1096 HA ASP 32 HA ASP 32 6.353 2.743 -12.030 1097 HB2 ASP 32 HB2 ASP 32 4.065 3.659 -12.128 1098 HB3 ASP 32 HB1 ASP 32 4.683 5.106 -12.918 1099 H LEU 33 HN LEU 33 7.272 6.095 -12.115 1100 HA LEU 33 HA LEU 33 8.675 5.913 -14.622 1101 HB2 LEU 33 HB2 LEU 33 7.707 8.032 -13.804 1102 HB3 LEU 33 HB1 LEU 33 8.824 8.011 -12.453 1103 HG LEU 33 HG LEU 33 10.711 8.159 -14.068 1104 HD11 LEU 33 HD11 LEU 33 8.515 8.604 -16.085 1105 HD12 LEU 33 HD12 LEU 33 9.576 7.198 -16.006 1106 HD13 LEU 33 HD13 LEU 33 10.246 8.787 -16.373 1107 HD21 LEU 33 HD21 LEU 33 8.647 10.351 -14.222 1108 HD22 LEU 33 HD22 LEU 33 10.355 10.523 -14.625 1109 HD23 LEU 33 HD23 LEU 33 9.873 10.154 -12.969 1110 H LEU 34 HN LEU 34 9.507 5.779 -11.193 1111 HA LEU 34 HA LEU 34 12.322 5.695 -11.609 1112 HB2 LEU 34 HB2 LEU 34 10.667 4.835 -9.238 1113 HB3 LEU 34 HB1 LEU 34 12.418 4.941 -9.246 1114 HG LEU 34 HG LEU 34 10.491 7.241 -9.585 1115 HD11 LEU 34 HD11 LEU 34 12.394 6.545 -7.353 1116 HD12 LEU 34 HD12 LEU 34 10.635 6.426 -7.294 1117 HD13 LEU 34 HD13 LEU 34 11.408 8.004 -7.451 1118 HD21 LEU 34 HD21 LEU 34 12.480 7.559 -10.954 1119 HD22 LEU 34 HD22 LEU 34 13.504 7.228 -9.554 1120 HD23 LEU 34 HD23 LEU 34 12.477 8.662 -9.577 1121 H ALA 35 HN ALA 35 9.845 3.364 -11.897 1122 HA ALA 35 HA ALA 35 11.473 1.045 -11.522 1123 HB1 ALA 35 HB1 ALA 35 9.605 -0.177 -12.496 1124 HB2 ALA 35 HB2 ALA 35 8.867 1.337 -13.016 1125 HB3 ALA 35 HB3 ALA 35 9.027 0.980 -11.298 1126 H GLN 36 HN GLN 36 11.520 3.418 -13.819 1127 HA GLN 36 HA GLN 36 12.183 1.647 -16.049 1128 HB2 GLN 36 HB2 GLN 36 11.898 4.653 -15.971 1129 HB3 GLN 36 HB1 GLN 36 12.116 3.675 -17.415 1130 HG2 GLN 36 HG2 GLN 36 9.979 2.636 -17.110 1131 HG3 GLN 36 HG1 GLN 36 9.773 3.422 -15.546 1132 HE21 GLN 36 HE21 GLN 36 7.874 4.424 -16.135 1133 HE22 GLN 36 HE22 GLN 36 7.830 5.738 -17.257 1134 H GLY 37 HN GLY 37 13.794 2.902 -13.500 1135 HA2 GLY 37 HA2 GLY 37 16.249 2.124 -13.920 1136 HA3 GLY 37 HA1 GLY 37 16.233 3.498 -15.013 1137 H GLU 38 HN GLU 38 17.346 5.083 -14.145 1138 HA GLU 38 HA GLU 38 16.804 5.851 -11.361 1139 HB2 GLU 38 HB2 GLU 38 18.934 4.579 -11.474 1140 HB3 GLU 38 HB1 GLU 38 19.543 5.740 -12.644 1141 HG2 GLU 38 HG2 GLU 38 19.421 7.507 -10.982 1142 HG3 GLU 38 HG1 GLU 38 18.755 6.369 -9.810 1143 H ARG 39 HN ARG 39 16.099 7.921 -11.337 1144 HA ARG 39 HA ARG 39 17.071 9.684 -13.488 1145 HB2 ARG 39 HB2 ARG 39 14.188 9.306 -12.679 1146 HB3 ARG 39 HB1 ARG 39 14.757 10.608 -13.712 1147 HG2 ARG 39 HG2 ARG 39 15.608 8.895 -15.301 1148 HG3 ARG 39 HG1 ARG 39 14.851 7.658 -14.296 1149 HD2 ARG 39 HD2 ARG 39 12.670 8.682 -14.660 1150 HD3 ARG 39 HD1 ARG 39 13.416 9.957 -15.623 1151 HE ARG 39 HE ARG 39 13.687 7.158 -16.476 1152 HH11 ARG 39 HH11 ARG 39 12.460 10.385 -17.032 1153 HH12 ARG 39 HH12 ARG 39 11.979 10.070 -18.668 1154 HH21 ARG 39 HH21 ARG 39 13.045 6.719 -18.614 1155 HH22 ARG 39 HH22 ARG 39 12.310 7.971 -19.576 1156 H ALA 40 HN ALA 40 17.218 11.842 -13.048 1157 HA ALA 40 HA ALA 40 17.501 12.576 -10.292 1158 HB1 ALA 40 HB1 ALA 40 17.642 14.277 -12.778 1159 HB2 ALA 40 HB2 ALA 40 19.001 13.466 -12.001 1160 HB3 ALA 40 HB3 ALA 40 18.152 14.767 -11.164 1161 H VAL 41 HN VAL 41 16.384 14.277 -9.217 1162 HA VAL 41 HA VAL 41 13.631 14.136 -9.241 1163 HB VAL 41 HB VAL 41 15.223 16.556 -8.373 1164 HG11 VAL 41 HG11 VAL 41 12.533 15.540 -7.458 1165 HG12 VAL 41 HG12 VAL 41 12.808 16.940 -8.496 1166 HG13 VAL 41 HG13 VAL 41 13.381 16.953 -6.829 1167 HG21 VAL 41 HG21 VAL 41 14.502 14.080 -6.809 1168 HG22 VAL 41 HG22 VAL 41 15.296 15.515 -6.164 1169 HG23 VAL 41 HG23 VAL 41 16.116 14.519 -7.366 1170 H GLU 42 HN GLU 42 15.690 16.510 -10.882 1171 HA GLU 42 HA GLU 42 13.720 18.161 -11.945 1172 HB2 GLU 42 HB2 GLU 42 16.498 17.435 -12.774 1173 HB3 GLU 42 HB1 GLU 42 15.505 18.404 -13.854 1174 HG2 GLU 42 HG2 GLU 42 15.763 19.212 -11.002 1175 HG3 GLU 42 HG1 GLU 42 17.089 19.537 -12.119 1176 H ALA 43 HN ALA 43 15.156 15.222 -13.333 1177 HA ALA 43 HA ALA 43 13.665 15.277 -15.739 1178 HB1 ALA 43 HB1 ALA 43 15.740 13.992 -15.494 1179 HB2 ALA 43 HB2 ALA 43 14.406 12.975 -16.037 1180 HB3 ALA 43 HB3 ALA 43 14.935 12.913 -14.356 1181 H ILE 44 HN ILE 44 13.166 13.675 -12.624 1182 HA ILE 44 HA ILE 44 10.831 12.252 -13.257 1183 HB ILE 44 HB ILE 44 11.604 13.477 -10.599 1184 HG12 ILE 44 HG12 ILE 44 12.068 10.669 -11.622 1185 HG13 ILE 44 HG11 ILE 44 13.298 11.928 -11.598 1186 HG21 ILE 44 HG21 ILE 44 9.257 12.866 -10.653 1187 HG22 ILE 44 HG22 ILE 44 10.155 11.747 -9.624 1188 HG23 ILE 44 HG23 ILE 44 9.670 11.259 -11.249 1189 HD11 ILE 44 HD11 ILE 44 13.559 10.435 -9.716 1190 HD12 ILE 44 HD12 ILE 44 11.903 10.761 -9.202 1191 HD13 ILE 44 HD13 ILE 44 13.108 12.047 -9.160 1192 H ALA 45 HN ALA 45 11.273 15.465 -11.848 1193 HA ALA 45 HA ALA 45 8.598 16.167 -11.523 1194 HB1 ALA 45 HB1 ALA 45 10.483 17.371 -10.521 1195 HB2 ALA 45 HB2 ALA 45 9.409 18.460 -11.400 1196 HB3 ALA 45 HB3 ALA 45 10.944 17.966 -12.117 1197 H THR 46 HN THR 46 10.781 16.755 -14.262 1198 HA THR 46 HA THR 46 8.994 18.242 -15.826 1199 HB THR 46 HB THR 46 11.201 16.431 -16.822 1200 HG1 THR 46 HG1 THR 46 11.904 17.987 -15.228 1201 HG21 THR 46 HG21 THR 46 9.952 18.898 -18.038 1202 HG22 THR 46 HG22 THR 46 9.704 17.242 -18.586 1203 HG23 THR 46 HG23 THR 46 11.300 17.983 -18.715 1204 H ALA 47 HN ALA 47 9.721 14.755 -15.843 1205 HA ALA 47 HA ALA 47 8.048 14.105 -18.009 1206 HB1 ALA 47 HB1 ALA 47 8.328 11.792 -17.320 1207 HB2 ALA 47 HB2 ALA 47 8.970 12.320 -15.765 1208 HB3 ALA 47 HB3 ALA 47 9.863 12.658 -17.247 1209 H THR 48 HN THR 48 7.421 14.248 -14.541 1210 HA THR 48 HA THR 48 4.810 13.053 -14.806 1211 HB THR 48 HB THR 48 4.577 13.794 -12.374 1212 HG1 THR 48 HG1 THR 48 7.381 14.228 -12.553 1213 HG21 THR 48 HG21 THR 48 5.196 11.516 -12.968 1214 HG22 THR 48 HG22 THR 48 6.112 12.045 -11.557 1215 HG23 THR 48 HG23 THR 48 6.883 11.999 -13.142 1216 H GLY 49 HN GLY 49 6.085 16.188 -15.196 1217 HA2 GLY 49 HA2 GLY 49 5.029 18.203 -15.639 1218 HA3 GLY 49 HA1 GLY 49 3.484 17.366 -15.527 1219 H MET 50 HN MET 50 5.999 17.404 -13.104 1220 HA MET 50 HA MET 50 4.229 18.885 -11.289 1221 HB2 MET 50 HB2 MET 50 4.056 16.592 -10.674 1222 HB3 MET 50 HB1 MET 50 5.781 16.334 -10.863 1223 HG2 MET 50 HG2 MET 50 6.276 17.469 -8.887 1224 HG3 MET 50 HG1 MET 50 4.660 18.161 -8.782 1225 HE1 MET 50 HE1 MET 50 6.643 14.718 -8.756 1226 HE2 MET 50 HE2 MET 50 5.273 14.431 -9.830 1227 HE3 MET 50 HE3 MET 50 5.354 13.615 -8.268 1228 H ASN 51 HN ASN 51 5.276 20.295 -9.859 1229 HA ASN 51 HA ASN 51 7.772 21.302 -10.856 1230 HB2 ASN 51 HB2 ASN 51 5.903 22.733 -9.993 1231 HB3 ASN 51 HB1 ASN 51 6.266 22.150 -8.373 1232 HD21 ASN 51 HD21 ASN 51 7.353 24.087 -11.039 1233 HD22 ASN 51 HD22 ASN 51 8.564 24.970 -10.157 1234 H LEU 52 HN LEU 52 9.703 21.643 -9.590 1235 HA LEU 52 HA LEU 52 10.791 19.408 -8.441 1236 HB2 LEU 52 HB2 LEU 52 11.472 22.311 -8.157 1237 HB3 LEU 52 HB1 LEU 52 12.377 21.094 -7.278 1238 HG LEU 52 HG LEU 52 12.124 21.284 -10.283 1239 HD11 LEU 52 HD11 LEU 52 13.540 23.021 -9.316 1240 HD12 LEU 52 HD12 LEU 52 14.505 21.836 -10.198 1241 HD13 LEU 52 HD13 LEU 52 14.454 21.795 -8.435 1242 HD21 LEU 52 HD21 LEU 52 12.282 18.962 -9.508 1243 HD22 LEU 52 HD22 LEU 52 13.722 19.375 -8.577 1244 HD23 LEU 52 HD23 LEU 52 13.753 19.472 -10.338 1245 H THR 53 HN THR 53 9.277 22.131 -6.722 1246 HA THR 53 HA THR 53 9.889 21.272 -4.125 1247 HB THR 53 HB THR 53 7.926 22.696 -3.438 1248 HG1 THR 53 HG1 THR 53 6.499 23.067 -4.945 1249 HG21 THR 53 HG21 THR 53 8.954 24.806 -4.163 1250 HG22 THR 53 HG22 THR 53 9.899 23.930 -5.367 1251 HG23 THR 53 HG23 THR 53 10.171 23.640 -3.648 1252 H THR 54 HN THR 54 7.013 20.705 -6.120 1253 HA THR 54 HA THR 54 5.613 19.215 -4.166 1254 HB THR 54 HB THR 54 5.241 18.898 -7.139 1255 HG1 THR 54 HG1 THR 54 4.707 21.124 -5.466 1256 HG21 THR 54 HG21 THR 54 2.897 18.648 -6.530 1257 HG22 THR 54 HG22 THR 54 3.284 18.951 -4.837 1258 HG23 THR 54 HG23 THR 54 3.882 17.494 -5.631 1259 H ALA 55 HN ALA 55 7.703 18.294 -6.877 1260 HA ALA 55 HA ALA 55 7.324 15.509 -6.690 1261 HB1 ALA 55 HB1 ALA 55 9.695 17.026 -7.770 1262 HB2 ALA 55 HB2 ALA 55 8.242 16.594 -8.673 1263 HB3 ALA 55 HB3 ALA 55 9.320 15.331 -8.080 1264 H SER 56 HN SER 56 9.964 17.563 -5.424 1265 HA SER 56 HA SER 56 11.421 15.445 -4.289 1266 HB2 SER 56 HB2 SER 56 12.524 17.255 -2.925 1267 HB3 SER 56 HB1 SER 56 12.531 17.537 -4.667 1268 HG SER 56 HG SER 56 10.912 19.030 -4.429 1269 H ALA 57 HN ALA 57 8.858 17.482 -2.983 1270 HA ALA 57 HA ALA 57 8.961 16.624 -0.320 1271 HB1 ALA 57 HB1 ALA 57 6.530 17.439 -1.912 1272 HB2 ALA 57 HB2 ALA 57 7.622 18.537 -1.067 1273 HB3 ALA 57 HB3 ALA 57 6.650 17.383 -0.153 1274 H ASN 58 HN ASN 58 7.120 15.334 -3.076 1275 HA ASN 58 HA ASN 58 5.939 13.197 -1.641 1276 HB2 ASN 58 HB2 ASN 58 6.417 13.635 -4.591 1277 HB3 ASN 58 HB1 ASN 58 5.621 12.193 -3.970 1278 HD21 ASN 58 HD21 ASN 58 4.573 14.271 -5.707 1279 HD22 ASN 58 HD22 ASN 58 3.186 14.922 -4.902 1280 H LEU 59 HN LEU 59 8.932 13.512 -3.454 1281 HA LEU 59 HA LEU 59 9.703 10.804 -3.404 1282 HB2 LEU 59 HB2 LEU 59 11.282 13.359 -3.594 1283 HB3 LEU 59 HB1 LEU 59 12.042 11.779 -3.662 1284 HG LEU 59 HG LEU 59 9.904 12.698 -5.581 1285 HD11 LEU 59 HD11 LEU 59 11.705 13.010 -7.189 1286 HD12 LEU 59 HD12 LEU 59 12.893 12.621 -5.948 1287 HD13 LEU 59 HD13 LEU 59 11.909 14.077 -5.801 1288 HD21 LEU 59 HD21 LEU 59 10.050 10.286 -5.330 1289 HD22 LEU 59 HD22 LEU 59 11.793 10.346 -5.612 1290 HD23 LEU 59 HD23 LEU 59 10.672 10.784 -6.904 1291 H GLN 60 HN GLN 60 10.340 13.472 -1.155 1292 HA GLN 60 HA GLN 60 12.024 12.093 0.609 1293 HB2 GLN 60 HB2 GLN 60 11.721 14.532 0.650 1294 HB3 GLN 60 HB1 GLN 60 10.069 14.326 1.210 1295 HG2 GLN 60 HG2 GLN 60 11.429 14.925 3.073 1296 HG3 GLN 60 HG1 GLN 60 10.942 13.242 3.255 1297 HE21 GLN 60 HE21 GLN 60 13.194 14.695 4.427 1298 HE22 GLN 60 HE22 GLN 60 14.615 13.820 3.970 1299 H ALA 61 HN ALA 61 8.514 12.264 0.409 1300 HA ALA 61 HA ALA 61 7.933 10.870 2.795 1301 HB1 ALA 61 HB1 ALA 61 6.313 11.004 0.254 1302 HB2 ALA 61 HB2 ALA 61 6.256 12.177 1.570 1303 HB3 ALA 61 HB3 ALA 61 5.720 10.517 1.842 1304 H LEU 62 HN LEU 62 8.296 9.786 -0.568 1305 HA LEU 62 HA LEU 62 7.840 7.045 -0.121 1306 HB2 LEU 62 HB2 LEU 62 9.568 8.362 -2.222 1307 HB3 LEU 62 HB1 LEU 62 8.992 6.708 -2.271 1308 HG LEU 62 HG LEU 62 7.207 9.144 -2.336 1309 HD11 LEU 62 HD11 LEU 62 8.576 8.991 -4.349 1310 HD12 LEU 62 HD12 LEU 62 6.889 8.618 -4.695 1311 HD13 LEU 62 HD13 LEU 62 8.073 7.316 -4.572 1312 HD21 LEU 62 HD21 LEU 62 5.468 7.556 -2.976 1313 HD22 LEU 62 HD22 LEU 62 6.134 7.160 -1.391 1314 HD23 LEU 62 HD23 LEU 62 6.613 6.224 -2.809 1315 H LYS 63 HN LYS 63 10.764 9.006 -0.020 1316 HA LYS 63 HA LYS 63 12.616 6.907 0.311 1317 HB2 LYS 63 HB2 LYS 63 13.143 9.279 -0.327 1318 HB3 LYS 63 HB1 LYS 63 12.866 9.731 1.348 1319 HG2 LYS 63 HG2 LYS 63 14.670 8.166 2.017 1320 HG3 LYS 63 HG1 LYS 63 14.994 7.875 0.307 1321 HD2 LYS 63 HD2 LYS 63 15.406 10.310 0.030 1322 HD3 LYS 63 HD1 LYS 63 15.209 10.504 1.772 1323 HE2 LYS 63 HE2 LYS 63 17.341 8.958 0.313 1324 HE3 LYS 63 HE1 LYS 63 17.546 10.381 1.332 1325 HZ1 LYS 63 HZ1 LYS 63 16.855 7.620 2.166 1326 HZ2 LYS 63 HZ2 LYS 63 16.649 8.962 3.190 1327 HZ3 LYS 63 HZ3 LYS 63 18.194 8.557 2.631 1328 H SER 64 HN SER 64 10.920 8.961 2.652 1329 HA SER 64 HA SER 64 12.144 7.829 4.944 1330 HB2 SER 64 HB2 SER 64 9.499 9.285 4.717 1331 HB3 SER 64 HB1 SER 64 10.406 9.007 6.206 1332 HG SER 64 HG SER 64 11.089 10.636 3.990 1333 H GLY 65 HN GLY 65 9.425 6.893 2.988 1334 HA2 GLY 65 HA2 GLY 65 8.315 5.028 4.837 1335 HA3 GLY 65 HA1 GLY 65 8.032 5.064 3.100 1336 H GLY 66 HN GLY 66 10.948 4.949 2.563 1337 HA2 GLY 66 HA2 GLY 66 12.695 3.315 2.799 1338 HA3 GLY 66 HA1 GLY 66 11.486 2.167 3.360 1339 H LEU 67 HN LEU 67 10.428 4.034 0.762 1340 HA LEU 67 HA LEU 67 10.322 1.666 -0.883 1341 HB2 LEU 67 HB2 LEU 67 9.117 4.396 -1.019 1342 HB3 LEU 67 HB1 LEU 67 9.137 3.392 -2.453 1343 HG LEU 67 HG LEU 67 7.839 1.666 -1.289 1344 HD11 LEU 67 HD11 LEU 67 8.630 2.069 0.991 1345 HD12 LEU 67 HD12 LEU 67 6.869 2.086 0.899 1346 HD13 LEU 67 HD13 LEU 67 7.760 3.604 1.021 1347 HD21 LEU 67 HD21 LEU 67 6.626 4.414 -1.091 1348 HD22 LEU 67 HD22 LEU 67 5.740 2.890 -1.140 1349 HD23 LEU 67 HD23 LEU 67 6.681 3.408 -2.537 1350 H VAL 68 HN VAL 68 11.724 4.924 -1.159 1351 HA VAL 68 HA VAL 68 13.509 3.866 -3.236 1352 HB VAL 68 HB VAL 68 13.353 5.984 -4.493 1353 HG11 VAL 68 HG11 VAL 68 12.016 4.074 -5.190 1354 HG12 VAL 68 HG12 VAL 68 11.162 5.585 -5.506 1355 HG13 VAL 68 HG13 VAL 68 10.706 4.587 -4.125 1356 HG21 VAL 68 HG21 VAL 68 11.083 6.619 -2.610 1357 HG22 VAL 68 HG22 VAL 68 11.508 7.540 -4.053 1358 HG23 VAL 68 HG23 VAL 68 12.631 7.461 -2.695 1359 H GLU 69 HN GLU 69 15.485 5.023 -3.490 1360 HA GLU 69 HA GLU 69 16.213 6.677 -1.167 1361 HB2 GLU 69 HB2 GLU 69 17.592 4.338 -2.383 1362 HB3 GLU 69 HB1 GLU 69 18.599 5.665 -1.825 1363 HG2 GLU 69 HG2 GLU 69 16.568 4.229 -0.131 1364 HG3 GLU 69 HG1 GLU 69 18.298 3.882 -0.147 1365 H ALA 70 HN ALA 70 18.188 8.026 -1.617 1366 HA ALA 70 HA ALA 70 17.944 9.149 -4.324 1367 HB1 ALA 70 HB1 ALA 70 18.754 10.515 -1.759 1368 HB2 ALA 70 HB2 ALA 70 17.204 10.675 -2.584 1369 HB3 ALA 70 HB3 ALA 70 18.675 11.279 -3.346 1370 H ARG 71 HN ARG 71 19.683 9.367 -5.567 1371 HA ARG 71 HA ARG 71 22.330 8.736 -4.423 1372 HB2 ARG 71 HB2 ARG 71 21.476 7.031 -6.036 1373 HB3 ARG 71 HB1 ARG 71 21.367 8.287 -7.262 1374 HG2 ARG 71 HG2 ARG 71 23.806 8.630 -7.078 1375 HG3 ARG 71 HG1 ARG 71 23.874 7.289 -5.931 1376 HD2 ARG 71 HD2 ARG 71 22.989 5.781 -7.639 1377 HD3 ARG 71 HD1 ARG 71 22.902 7.118 -8.785 1378 HE ARG 71 HE ARG 71 25.452 6.187 -7.622 1379 HH11 ARG 71 HH11 ARG 71 23.453 7.031 -10.383 1380 HH12 ARG 71 HH12 ARG 71 24.796 7.043 -11.497 1381 HH21 ARG 71 HH21 ARG 71 27.198 6.169 -9.097 1382 HH22 ARG 71 HH22 ARG 71 26.906 6.521 -10.770 1383 H ARG 72 HN ARG 72 24.083 10.114 -5.131 1384 HA ARG 72 HA ARG 72 23.138 12.510 -6.552 1385 HB2 ARG 72 HB2 ARG 72 24.739 12.426 -4.003 1386 HB3 ARG 72 HB1 ARG 72 24.617 13.863 -5.009 1387 HG2 ARG 72 HG2 ARG 72 22.158 13.797 -4.728 1388 HG3 ARG 72 HG1 ARG 72 22.359 12.440 -3.617 1389 HD2 ARG 72 HD2 ARG 72 23.542 15.191 -3.262 1390 HD3 ARG 72 HD1 ARG 72 22.110 14.578 -2.435 1391 HE ARG 72 HE ARG 72 23.879 12.755 -1.704 1392 HH11 ARG 72 HH11 ARG 72 24.265 16.237 -1.882 1393 HH12 ARG 72 HH12 ARG 72 25.423 16.292 -0.584 1394 HH21 ARG 72 HH21 ARG 72 25.375 12.837 -0.008 1395 HH22 ARG 72 HH22 ARG 72 26.054 14.366 0.475 1396 H GLU 73 HN GLU 73 24.267 12.992 -8.242 1397 HA GLU 73 HA GLU 73 27.169 12.489 -8.229 1398 HB2 GLU 73 HB2 GLU 73 25.299 12.481 -10.609 1399 HB3 GLU 73 HB1 GLU 73 27.048 12.371 -10.706 1400 HG2 GLU 73 HG2 GLU 73 26.944 10.249 -9.443 1401 HG3 GLU 73 HG1 GLU 73 25.182 10.354 -9.477 1402 H GLY 74 HN GLY 74 28.072 14.403 -7.811 1403 HA2 GLY 74 HA2 GLY 74 28.719 16.586 -8.197 1404 HA3 GLY 74 HA1 GLY 74 27.658 16.609 -9.600 1405 H THR 75 HN THR 75 25.638 17.469 -9.440 1406 HA THR 75 HA THR 75 24.782 18.352 -6.765 1407 HB THR 75 HB THR 75 25.707 20.287 -7.999 1408 HG1 THR 75 HG1 THR 75 22.915 20.196 -7.463 1409 HG21 THR 75 HG21 THR 75 23.497 19.697 -9.972 1410 HG22 THR 75 HG22 THR 75 25.232 19.597 -10.278 1411 HG23 THR 75 HG23 THR 75 24.485 21.160 -9.955 1412 H ARG 76 HN ARG 76 24.079 16.356 -9.211 1413 HA ARG 76 HA ARG 76 21.223 16.961 -9.301 1414 HB2 ARG 76 HB2 ARG 76 22.894 14.980 -10.836 1415 HB3 ARG 76 HB1 ARG 76 21.143 15.062 -10.950 1416 HG2 ARG 76 HG2 ARG 76 21.441 17.489 -11.605 1417 HG3 ARG 76 HG1 ARG 76 23.154 17.115 -11.795 1418 HD2 ARG 76 HD2 ARG 76 20.863 15.775 -13.222 1419 HD3 ARG 76 HD1 ARG 76 21.982 16.946 -13.922 1420 HE ARG 76 HE ARG 76 22.816 14.281 -12.951 1421 HH11 ARG 76 HH11 ARG 76 22.978 16.900 -15.261 1422 HH12 ARG 76 HH12 ARG 76 24.180 16.132 -16.247 1423 HH21 ARG 76 HH21 ARG 76 24.363 13.249 -14.263 1424 HH22 ARG 76 HH22 ARG 76 24.949 14.040 -15.699 1425 H GLN 77 HN GLN 77 19.738 15.869 -8.271 1426 HA GLN 77 HA GLN 77 20.607 13.676 -6.535 1427 HB2 GLN 77 HB2 GLN 77 19.609 15.706 -5.488 1428 HB3 GLN 77 HB1 GLN 77 18.117 15.384 -6.357 1429 HG2 GLN 77 HG2 GLN 77 17.776 13.348 -5.139 1430 HG3 GLN 77 HG1 GLN 77 19.361 13.490 -4.378 1431 HE21 GLN 77 HE21 GLN 77 16.690 13.338 -3.165 1432 HE22 GLN 77 HE22 GLN 77 16.537 14.753 -2.190 1433 H TYR 78 HN TYR 78 20.258 11.766 -7.403 1434 HA TYR 78 HA TYR 78 18.040 11.330 -9.244 1435 HB2 TYR 78 HB2 TYR 78 20.243 9.444 -8.395 1436 HB3 TYR 78 HB1 TYR 78 19.094 9.180 -9.700 1437 HD1 TYR 78 HD2 TYR 78 19.325 10.391 -11.818 1438 HD2 TYR 78 HD1 TYR 78 22.146 10.897 -8.673 1439 HE1 TYR 78 HE2 TYR 78 20.914 11.398 -13.402 1440 HE2 TYR 78 HE1 TYR 78 23.725 11.896 -10.239 1441 HH TYR 78 HH TYR 78 24.165 11.785 -12.708 1442 H TYR 79 HN TYR 79 16.497 9.710 -8.928 1443 HA TYR 79 HA TYR 79 16.455 8.506 -6.253 1444 HB2 TYR 79 HB2 TYR 79 14.301 9.958 -7.687 1445 HB3 TYR 79 HB1 TYR 79 13.834 8.519 -6.782 1446 HD1 TYR 79 HD2 TYR 79 15.444 11.842 -6.479 1447 HD2 TYR 79 HD1 TYR 79 13.715 8.544 -4.425 1448 HE1 TYR 79 HE2 TYR 79 15.462 13.138 -4.389 1449 HE2 TYR 79 HE1 TYR 79 13.732 9.827 -2.331 1450 HH TYR 79 HH TYR 79 14.774 11.691 -1.323 1451 H ARG 80 HN ARG 80 15.649 6.454 -6.078 1452 HA ARG 80 HA ARG 80 14.802 4.909 -8.334 1453 HB2 ARG 80 HB2 ARG 80 17.352 5.230 -8.553 1454 HB3 ARG 80 HB1 ARG 80 17.478 4.182 -7.151 1455 HG2 ARG 80 HG2 ARG 80 16.455 2.370 -8.346 1456 HG3 ARG 80 HG1 ARG 80 16.136 3.420 -9.730 1457 HD2 ARG 80 HD2 ARG 80 18.616 3.805 -9.863 1458 HD3 ARG 80 HD1 ARG 80 18.805 2.522 -8.673 1459 HE ARG 80 HE ARG 80 17.269 1.466 -10.709 1460 HH11 ARG 80 HH11 ARG 80 20.455 2.861 -10.380 1461 HH12 ARG 80 HH12 ARG 80 21.152 1.911 -11.662 1462 HH21 ARG 80 HH21 ARG 80 18.160 0.206 -12.395 1463 HH22 ARG 80 HH22 ARG 80 19.850 0.377 -12.788 1464 H ILE 81 HN ILE 81 14.283 2.693 -7.646 1465 HA ILE 81 HA ILE 81 13.086 2.595 -5.124 1466 HB ILE 81 HB ILE 81 13.871 0.275 -6.897 1467 HG12 ILE 81 HG12 ILE 81 11.291 1.849 -6.691 1468 HG13 ILE 81 HG11 ILE 81 12.444 1.942 -8.019 1469 HG21 ILE 81 HG21 ILE 81 11.840 0.418 -4.667 1470 HG22 ILE 81 HG22 ILE 81 13.380 -0.438 -4.610 1471 HG23 ILE 81 HG23 ILE 81 12.119 -0.967 -5.723 1472 HD11 ILE 81 HD11 ILE 81 11.984 -0.370 -8.597 1473 HD12 ILE 81 HD12 ILE 81 10.502 0.586 -8.584 1474 HD13 ILE 81 HD13 ILE 81 10.865 -0.497 -7.238 1475 H ALA 82 HN ALA 82 13.731 1.944 -3.155 1476 HA ALA 82 HA ALA 82 16.535 1.935 -2.662 1477 HB1 ALA 82 HB1 ALA 82 15.928 1.808 -0.316 1478 HB2 ALA 82 HB2 ALA 82 14.265 1.417 -0.753 1479 HB3 ALA 82 HB3 ALA 82 14.932 2.999 -1.151 1480 H GLY 83 HN GLY 83 14.013 -0.526 -2.047 1481 HA2 GLY 83 HA2 GLY 83 16.184 -2.522 -1.984 1482 HA3 GLY 83 HA1 GLY 83 14.925 -2.502 -0.761 1483 H GLU 84 HN GLU 84 15.617 -4.665 -2.424 1484 HA GLU 84 HA GLU 84 14.002 -5.077 -4.655 1485 HB2 GLU 84 HB2 GLU 84 15.910 -6.516 -3.760 1486 HB3 GLU 84 HB1 GLU 84 14.741 -7.196 -2.637 1487 HG2 GLU 84 HG2 GLU 84 14.901 -8.696 -4.441 1488 HG3 GLU 84 HG1 GLU 84 13.363 -7.854 -4.626 1489 H ASP 85 HN ASP 85 13.343 -5.361 -1.244 1490 HA ASP 85 HA ASP 85 11.000 -6.828 -1.187 1491 HB2 ASP 85 HB2 ASP 85 11.510 -4.397 0.533 1492 HB3 ASP 85 HB1 ASP 85 10.588 -5.836 0.949 1493 H VAL 86 HN VAL 86 11.404 -3.327 -1.529 1494 HA VAL 86 HA VAL 86 8.630 -2.752 -1.735 1495 HB VAL 86 HB VAL 86 10.980 -1.072 -2.621 1496 HG11 VAL 86 HG11 VAL 86 8.873 -0.321 -3.590 1497 HG12 VAL 86 HG12 VAL 86 9.449 0.819 -2.376 1498 HG13 VAL 86 HG13 VAL 86 8.135 -0.292 -1.987 1499 HG21 VAL 86 HG21 VAL 86 9.506 -1.097 0.011 1500 HG22 VAL 86 HG22 VAL 86 10.812 -0.001 -0.440 1501 HG23 VAL 86 HG23 VAL 86 11.130 -1.727 -0.267 1502 H ALA 87 HN ALA 87 11.226 -3.192 -4.087 1503 HA ALA 87 HA ALA 87 9.813 -2.436 -6.389 1504 HB1 ALA 87 HB1 ALA 87 12.234 -2.680 -6.363 1505 HB2 ALA 87 HB2 ALA 87 11.525 -3.687 -7.626 1506 HB3 ALA 87 HB3 ALA 87 12.072 -4.419 -6.118 1507 H ARG 88 HN ARG 88 10.256 -5.619 -4.890 1508 HA ARG 88 HA ARG 88 8.671 -6.991 -6.817 1509 HB2 ARG 88 HB2 ARG 88 9.619 -7.758 -4.059 1510 HB3 ARG 88 HB1 ARG 88 8.702 -8.842 -5.097 1511 HG2 ARG 88 HG2 ARG 88 10.441 -8.848 -6.740 1512 HG3 ARG 88 HG1 ARG 88 11.326 -7.590 -5.875 1513 HD2 ARG 88 HD2 ARG 88 12.294 -9.811 -5.502 1514 HD3 ARG 88 HD1 ARG 88 11.695 -9.094 -4.010 1515 HE ARG 88 HE ARG 88 10.011 -11.012 -5.468 1516 HH11 ARG 88 HH11 ARG 88 11.898 -10.159 -2.652 1517 HH12 ARG 88 HH12 ARG 88 11.323 -11.481 -1.684 1518 HH21 ARG 88 HH21 ARG 88 9.228 -12.766 -4.218 1519 HH22 ARG 88 HH22 ARG 88 9.789 -12.972 -2.575 1520 H LEU 89 HN LEU 89 7.970 -5.329 -3.826 1521 HA LEU 89 HA LEU 89 5.367 -6.411 -3.444 1522 HB2 LEU 89 HB2 LEU 89 6.856 -5.149 -1.769 1523 HB3 LEU 89 HB1 LEU 89 6.276 -3.685 -2.532 1524 HG LEU 89 HG LEU 89 4.402 -5.709 -1.310 1525 HD11 LEU 89 HD11 LEU 89 5.981 -4.959 0.405 1526 HD12 LEU 89 HD12 LEU 89 4.362 -4.322 0.691 1527 HD13 LEU 89 HD13 LEU 89 5.612 -3.281 0.009 1528 HD21 LEU 89 HD21 LEU 89 3.375 -4.119 -2.849 1529 HD22 LEU 89 HD22 LEU 89 4.096 -2.777 -1.958 1530 HD23 LEU 89 HD23 LEU 89 2.879 -3.792 -1.187 1531 H PHE 90 HN PHE 90 6.567 -3.409 -4.941 1532 HA PHE 90 HA PHE 90 4.053 -2.441 -5.778 1533 HB2 PHE 90 HB2 PHE 90 6.059 -1.022 -5.690 1534 HB3 PHE 90 HB1 PHE 90 6.789 -1.956 -6.989 1535 HD1 PHE 90 HD1 PHE 90 3.952 0.302 -6.183 1536 HD2 PHE 90 HD2 PHE 90 6.377 -1.425 -9.230 1537 HE1 PHE 90 HE1 PHE 90 2.955 1.821 -7.838 1538 HE2 PHE 90 HE2 PHE 90 5.377 0.092 -10.889 1539 HZ PHE 90 HZ PHE 90 3.665 1.716 -10.193 1540 H ALA 91 HN ALA 91 6.377 -4.627 -7.269 1541 HA ALA 91 HA ALA 91 5.037 -4.904 -9.747 1542 HB1 ALA 91 HB1 ALA 91 6.810 -6.896 -8.332 1543 HB2 ALA 91 HB2 ALA 91 7.366 -5.604 -9.397 1544 HB3 ALA 91 HB3 ALA 91 6.376 -6.915 -10.042 1545 H LEU 92 HN LEU 92 4.859 -6.697 -6.696 1546 HA LEU 92 HA LEU 92 3.134 -8.728 -7.546 1547 HB2 LEU 92 HB2 LEU 92 4.481 -8.679 -5.433 1548 HB3 LEU 92 HB1 LEU 92 3.316 -7.551 -4.773 1549 HG LEU 92 HG LEU 92 2.373 -10.223 -5.753 1550 HD11 LEU 92 HD11 LEU 92 2.783 -11.166 -3.542 1551 HD12 LEU 92 HD12 LEU 92 3.602 -9.684 -3.051 1552 HD13 LEU 92 HD13 LEU 92 4.298 -10.698 -4.315 1553 HD21 LEU 92 HD21 LEU 92 0.733 -8.514 -5.084 1554 HD22 LEU 92 HD22 LEU 92 1.490 -8.428 -3.493 1555 HD23 LEU 92 HD23 LEU 92 0.699 -9.917 -4.013 1556 H VAL 93 HN VAL 93 2.374 -5.620 -5.947 1557 HA VAL 93 HA VAL 93 -0.418 -6.052 -5.919 1558 HB VAL 93 HB VAL 93 0.662 -4.378 -4.478 1559 HG11 VAL 93 HG11 VAL 93 2.300 -3.472 -6.004 1560 HG12 VAL 93 HG12 VAL 93 1.277 -2.178 -5.377 1561 HG13 VAL 93 HG13 VAL 93 1.024 -2.790 -7.012 1562 HG21 VAL 93 HG21 VAL 93 -1.015 -2.588 -4.750 1563 HG22 VAL 93 HG22 VAL 93 -1.713 -4.204 -4.833 1564 HG23 VAL 93 HG23 VAL 93 -1.460 -3.276 -6.312 1565 H GLN 94 HN GLN 94 1.749 -4.754 -8.346 1566 HA GLN 94 HA GLN 94 -0.233 -3.768 -10.107 1567 HB2 GLN 94 HB2 GLN 94 2.200 -3.231 -10.254 1568 HB3 GLN 94 HB1 GLN 94 2.494 -4.873 -10.813 1569 HG2 GLN 94 HG2 GLN 94 1.117 -4.460 -12.777 1570 HG3 GLN 94 HG1 GLN 94 0.783 -2.825 -12.206 1571 HE21 GLN 94 HE21 GLN 94 3.900 -4.381 -11.886 1572 HE22 GLN 94 HE22 GLN 94 4.735 -3.364 -13.010 1573 H VAL 95 HN VAL 95 1.358 -6.903 -9.754 1574 HA VAL 95 HA VAL 95 0.069 -8.232 -11.872 1575 HB VAL 95 HB VAL 95 1.115 -9.353 -9.261 1576 HG11 VAL 95 HG11 VAL 95 1.129 -11.529 -10.393 1577 HG12 VAL 95 HG12 VAL 95 0.337 -10.802 -11.790 1578 HG13 VAL 95 HG13 VAL 95 -0.504 -10.882 -10.243 1579 HG21 VAL 95 HG21 VAL 95 3.057 -10.016 -10.592 1580 HG22 VAL 95 HG22 VAL 95 2.827 -8.268 -10.617 1581 HG23 VAL 95 HG23 VAL 95 2.349 -9.241 -12.010 1582 H VAL 96 HN VAL 96 -0.842 -7.761 -8.475 1583 HA VAL 96 HA VAL 96 -3.150 -9.315 -8.402 1584 HB VAL 96 HB VAL 96 -2.644 -6.672 -7.020 1585 HG11 VAL 96 HG11 VAL 96 -4.687 -8.798 -6.393 1586 HG12 VAL 96 HG12 VAL 96 -5.028 -7.201 -7.056 1587 HG13 VAL 96 HG13 VAL 96 -4.365 -7.357 -5.430 1588 HG21 VAL 96 HG21 VAL 96 -2.033 -8.058 -5.098 1589 HG22 VAL 96 HG22 VAL 96 -0.987 -8.367 -6.484 1590 HG23 VAL 96 HG23 VAL 96 -2.267 -9.509 -6.074 1591 H ALA 97 HN ALA 97 -2.769 -5.935 -9.416 1592 HA ALA 97 HA ALA 97 -5.507 -5.530 -10.037 1593 HB1 ALA 97 HB1 ALA 97 -4.782 -3.490 -11.127 1594 HB2 ALA 97 HB2 ALA 97 -3.105 -4.041 -11.092 1595 HB3 ALA 97 HB3 ALA 97 -3.948 -3.686 -9.584 1596 H ASP 98 HN ASP 98 -2.685 -6.414 -11.994 1597 HA ASP 98 HA ASP 98 -3.973 -6.400 -14.495 1598 HB2 ASP 98 HB2 ASP 98 -1.530 -6.427 -14.239 1599 HB3 ASP 98 HB1 ASP 98 -1.614 -8.060 -13.584 1600 H GLU 99 HN GLU 99 -3.715 -8.853 -12.010 1601 HA GLU 99 HA GLU 99 -4.858 -10.951 -13.582 1602 HB2 GLU 99 HB2 GLU 99 -3.339 -11.376 -11.687 1603 HB3 GLU 99 HB1 GLU 99 -4.531 -10.704 -10.586 1604 HG2 GLU 99 HG2 GLU 99 -4.624 -13.081 -10.460 1605 HG3 GLU 99 HG1 GLU 99 -6.092 -12.504 -11.246 1606 H HIS 100 HN HIS 100 -6.095 -8.830 -10.987 1607 HA HIS 100 HA HIS 100 -8.656 -10.148 -11.055 1608 HB2 HIS 100 HB2 HIS 100 -7.508 -7.917 -9.425 1609 HB3 HIS 100 HB1 HIS 100 -9.246 -8.214 -9.420 1610 HD1 HIS 100 HD1 HIS 100 -10.091 -10.344 -8.272 1611 HD2 HIS 100 HD2 HIS 100 -5.954 -9.891 -8.147 1612 HE1 HIS 100 HE1 HIS 100 -9.267 -12.061 -6.628 1613 HE2 HIS 100 HE2 HIS 100 -6.782 -11.663 -6.445 1614 H LEU 101 HN LEU 101 -7.300 -7.404 -12.644 1615 HA LEU 101 HA LEU 101 -9.999 -6.665 -13.568 1616 HB2 LEU 101 HB2 LEU 101 -7.465 -5.124 -14.107 1617 HB3 LEU 101 HB1 LEU 101 -9.115 -4.590 -14.341 1618 HG LEU 101 HG LEU 101 -7.713 -5.001 -11.702 1619 HD11 LEU 101 HD11 LEU 101 -8.753 -2.533 -13.086 1620 HD12 LEU 101 HD12 LEU 101 -7.059 -2.988 -12.897 1621 HD13 LEU 101 HD13 LEU 101 -8.029 -2.588 -11.478 1622 HD21 LEU 101 HD21 LEU 101 -10.050 -5.667 -11.504 1623 HD22 LEU 101 HD22 LEU 101 -10.556 -4.151 -12.250 1624 HD23 LEU 101 HD23 LEU 101 -9.760 -4.136 -10.677 1625 H GLU 102 HN GLU 102 -10.138 -8.517 -14.942 1626 HA GLU 102 HA GLU 102 -8.683 -8.188 -17.445 1627 HB2 GLU 102 HB2 GLU 102 -7.252 -9.666 -16.085 1628 HB3 GLU 102 HB1 GLU 102 -8.603 -10.773 -15.876 1629 HG2 GLU 102 HG2 GLU 102 -8.605 -10.773 -18.492 1630 HG3 GLU 102 HG1 GLU 102 -6.935 -10.240 -18.279 1631 H HIS 103 HN HIS 103 -10.599 -10.797 -15.928 1632 HA HIS 103 HA HIS 103 -11.848 -11.225 -18.493 1633 HB2 HIS 103 HB2 HIS 103 -11.236 -12.846 -16.238 1634 HB3 HIS 103 HB1 HIS 103 -12.967 -12.960 -16.550 1635 HD1 HIS 103 HD1 HIS 103 -9.645 -13.877 -17.955 1636 HD2 HIS 103 HD2 HIS 103 -13.652 -14.058 -19.064 1637 HE1 HIS 103 HE1 HIS 103 -9.738 -15.430 -19.933 1638 HE2 HIS 103 HE2 HIS 103 -12.125 -15.316 -20.731 1639 H HIS 104 HN HIS 104 -12.791 -8.961 -18.073 1640 HA HIS 104 HA HIS 104 -15.537 -9.509 -18.282 1641 HB2 HIS 104 HB2 HIS 104 -16.533 -8.392 -16.488 1642 HB3 HIS 104 HB1 HIS 104 -15.230 -9.282 -15.724 1643 HD1 HIS 104 HD1 HIS 104 -16.804 -6.154 -15.607 1644 HD2 HIS 104 HD2 HIS 104 -12.835 -7.382 -15.426 1645 HE1 HIS 104 HE1 HIS 104 -15.564 -4.271 -14.496 1646 HE2 HIS 104 HE2 HIS 104 -13.217 -5.126 -14.201 1647 H HIS 105 HN HIS 105 -16.182 -8.273 -19.882 1648 HA HIS 105 HA HIS 105 -14.374 -6.193 -20.764 1649 HB2 HIS 105 HB2 HIS 105 -15.778 -6.209 -22.852 1650 HB3 HIS 105 HB1 HIS 105 -14.975 -7.727 -22.481 1651 HD1 HIS 105 HD1 HIS 105 -18.232 -6.289 -23.242 1652 HD2 HIS 105 HD2 HIS 105 -16.812 -9.734 -21.396 1653 HE1 HIS 105 HE1 HIS 105 -20.175 -7.891 -23.201 1654 HE2 HIS 105 HE2 HIS 105 -19.268 -10.008 -22.171 1655 H HIS 106 HN HIS 106 -14.760 -4.569 -19.317 1656 HA HIS 106 HA HIS 106 -17.154 -2.996 -19.904 1657 HB2 HIS 106 HB2 HIS 106 -17.540 -4.263 -17.770 1658 HB3 HIS 106 HB1 HIS 106 -16.144 -3.447 -17.083 1659 HD1 HIS 106 HD1 HIS 106 -19.679 -3.234 -17.128 1660 HD2 HIS 106 HD2 HIS 106 -16.599 -0.436 -17.239 1661 HE1 HIS 106 HE1 HIS 106 -20.718 -1.046 -16.435 1662 HE2 HIS 106 HE2 HIS 106 -18.849 0.648 -16.556 1663 H HIS 107 HN HIS 107 -16.074 -1.454 -21.011 1664 HA HIS 107 HA HIS 107 -13.937 -0.014 -19.574 1665 HB2 HIS 107 HB2 HIS 107 -14.678 0.064 -22.512 1666 HB3 HIS 107 HB1 HIS 107 -13.404 1.020 -21.766 1667 HD1 HIS 107 HD1 HIS 107 -13.974 -2.101 -23.485 1668 HD2 HIS 107 HD2 HIS 107 -11.278 -0.715 -20.633 1669 HE1 HIS 107 HE1 HIS 107 -12.040 -3.710 -23.537 1670 HE2 HIS 107 HE2 HIS 107 -10.354 -2.770 -21.919 1671 H HIS 108 HN HIS 108 -17.126 0.062 -20.747 1672 HA HIS 108 HA HIS 108 -17.649 2.598 -19.486 1673 HB2 HIS 108 HB2 HIS 108 -16.907 3.264 -21.763 1674 HB3 HIS 108 HB1 HIS 108 -18.159 2.239 -22.452 1675 HD1 HIS 108 HD1 HIS 108 -20.008 3.641 -23.287 1676 HD2 HIS 108 HD2 HIS 108 -18.364 5.170 -19.780 1677 HE1 HIS 108 HE1 HIS 108 -21.344 5.708 -22.750 1678 HE2 HIS 108 HE2 HIS 108 -20.399 6.558 -20.572 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 -11.665 6.136 -30.204 2 H2 MET 1 HT2 MET 1 -13.054 5.747 -29.317 3 H3 MET 1 HT3 MET 1 -13.171 6.044 -30.982 4 HA MET 1 HA MET 1 -13.306 3.707 -30.615 5 HB2 MET 1 HB2 MET 1 -10.635 4.590 -31.728 6 HB3 MET 1 HB1 MET 1 -11.262 2.955 -31.878 7 HG2 MET 1 HG2 MET 1 -13.185 3.809 -33.118 8 HG3 MET 1 HG1 MET 1 -12.544 5.444 -32.979 9 HE1 MET 1 HE1 MET 1 -12.784 5.675 -35.621 10 HE2 MET 1 HE2 MET 1 -13.372 4.018 -35.740 11 HE3 MET 1 HE3 MET 1 -12.050 4.561 -36.772 12 H ALA 2 HN ALA 2 -11.833 1.741 -30.165 13 HA ALA 2 HA ALA 2 -11.347 1.594 -27.428 14 HB1 ALA 2 HB1 ALA 2 -10.227 -0.180 -29.593 15 HB2 ALA 2 HB2 ALA 2 -11.817 -0.343 -28.847 16 HB3 ALA 2 HB3 ALA 2 -10.361 -0.581 -27.881 17 H GLY 3 HN GLY 3 -9.457 1.413 -26.199 18 HA2 GLY 3 HA2 GLY 3 -6.838 1.627 -27.176 19 HA3 GLY 3 HA1 GLY 3 -7.409 3.241 -26.779 20 H GLN 4 HN GLN 4 -5.255 1.858 -25.515 21 HA GLN 4 HA GLN 4 -6.236 1.008 -22.919 22 HB2 GLN 4 HB2 GLN 4 -3.943 0.489 -22.399 23 HB3 GLN 4 HB1 GLN 4 -4.284 -0.099 -24.019 24 HG2 GLN 4 HG2 GLN 4 -2.888 2.500 -23.422 25 HG3 GLN 4 HG1 GLN 4 -2.061 0.981 -23.750 26 HE21 GLN 4 HE21 GLN 4 -2.083 3.574 -25.162 27 HE22 GLN 4 HE22 GLN 4 -2.514 3.186 -26.800 28 H SER 5 HN SER 5 -6.338 3.865 -24.083 29 HA SER 5 HA SER 5 -4.674 5.498 -22.480 30 HB2 SER 5 HB2 SER 5 -6.508 7.237 -23.172 31 HB3 SER 5 HB1 SER 5 -5.452 6.549 -24.407 32 HG SER 5 HG SER 5 -8.039 6.523 -24.435 33 H ASP 6 HN ASP 6 -5.126 6.651 -20.622 34 HA ASP 6 HA ASP 6 -6.129 7.305 -18.691 35 HB2 ASP 6 HB2 ASP 6 -8.226 7.683 -19.843 36 HB3 ASP 6 HB1 ASP 6 -8.601 5.964 -19.806 37 H ARG 7 HN ARG 7 -6.443 3.979 -19.714 38 HA ARG 7 HA ARG 7 -7.010 2.779 -17.262 39 HB2 ARG 7 HB2 ARG 7 -7.187 1.461 -19.236 40 HB3 ARG 7 HB1 ARG 7 -5.509 1.760 -19.670 41 HG2 ARG 7 HG2 ARG 7 -4.729 0.394 -17.868 42 HG3 ARG 7 HG1 ARG 7 -6.363 0.231 -17.223 43 HD2 ARG 7 HD2 ARG 7 -5.662 -0.694 -19.991 44 HD3 ARG 7 HD1 ARG 7 -5.393 -1.719 -18.582 45 HE ARG 7 HE ARG 7 -8.035 -0.780 -18.505 46 HH11 ARG 7 HH11 ARG 7 -6.052 -2.813 -20.551 47 HH12 ARG 7 HH12 ARG 7 -7.346 -3.917 -20.920 48 HH21 ARG 7 HH21 ARG 7 -9.736 -2.221 -18.993 49 HH22 ARG 7 HH22 ARG 7 -9.436 -3.595 -20.018 50 H LYS 8 HN LYS 8 -3.888 3.791 -18.615 51 HA LYS 8 HA LYS 8 -2.262 2.558 -16.675 52 HB2 LYS 8 HB2 LYS 8 -1.447 3.581 -18.814 53 HB3 LYS 8 HB1 LYS 8 -1.687 5.167 -18.091 54 HG2 LYS 8 HG2 LYS 8 -0.058 4.629 -16.354 55 HG3 LYS 8 HG1 LYS 8 0.175 3.030 -17.066 56 HD2 LYS 8 HD2 LYS 8 0.918 4.123 -19.159 57 HD3 LYS 8 HD1 LYS 8 0.793 5.687 -18.352 58 HE2 LYS 8 HE2 LYS 8 2.576 3.406 -17.507 59 HE3 LYS 8 HE1 LYS 8 3.097 4.842 -18.382 60 HZ1 LYS 8 HZ1 LYS 8 2.283 6.163 -16.448 61 HZ2 LYS 8 HZ2 LYS 8 3.605 5.150 -16.100 62 HZ3 LYS 8 HZ3 LYS 8 2.046 4.704 -15.616 63 H ALA 9 HN ALA 9 -3.732 5.775 -16.798 64 HA ALA 9 HA ALA 9 -2.754 6.650 -14.292 65 HB1 ALA 9 HB1 ALA 9 -4.461 8.390 -14.447 66 HB2 ALA 9 HB2 ALA 9 -5.227 7.529 -15.783 67 HB3 ALA 9 HB3 ALA 9 -3.608 8.200 -15.979 68 H ALA 10 HN ALA 10 -5.522 4.778 -15.302 69 HA ALA 10 HA ALA 10 -6.878 4.830 -12.796 70 HB1 ALA 10 HB1 ALA 10 -8.279 3.078 -13.729 71 HB2 ALA 10 HB2 ALA 10 -7.141 2.849 -15.056 72 HB3 ALA 10 HB3 ALA 10 -8.033 4.364 -14.914 73 H LEU 11 HN LEU 11 -4.224 2.999 -14.063 74 HA LEU 11 HA LEU 11 -4.433 0.806 -12.233 75 HB2 LEU 11 HB2 LEU 11 -2.094 1.847 -13.838 76 HB3 LEU 11 HB1 LEU 11 -2.050 0.380 -12.882 77 HG LEU 11 HG LEU 11 -3.845 0.865 -15.261 78 HD11 LEU 11 HD11 LEU 11 -1.407 -0.883 -14.955 79 HD12 LEU 11 HD12 LEU 11 -1.490 0.624 -15.867 80 HD13 LEU 11 HD13 LEU 11 -2.436 -0.773 -16.384 81 HD21 LEU 11 HD21 LEU 11 -3.420 -1.606 -13.583 82 HD22 LEU 11 HD22 LEU 11 -4.392 -1.510 -15.052 83 HD23 LEU 11 HD23 LEU 11 -4.875 -0.609 -13.614 84 H LEU 12 HN LEU 12 -2.464 3.753 -12.357 85 HA LEU 12 HA LEU 12 -1.270 3.404 -9.808 86 HB2 LEU 12 HB2 LEU 12 -1.787 5.954 -11.347 87 HB3 LEU 12 HB1 LEU 12 -0.690 5.787 -9.991 88 HG LEU 12 HG LEU 12 -0.383 4.411 -12.664 89 HD11 LEU 12 HD11 LEU 12 0.012 6.825 -12.775 90 HD12 LEU 12 HD12 LEU 12 1.500 5.905 -13.000 91 HD13 LEU 12 HD13 LEU 12 1.173 6.690 -11.455 92 HD21 LEU 12 HD21 LEU 12 1.445 4.475 -10.266 93 HD22 LEU 12 HD22 LEU 12 1.806 3.733 -11.825 94 HD23 LEU 12 HD23 LEU 12 0.510 3.085 -10.818 95 H ASP 13 HN ASP 13 -4.227 4.892 -10.944 96 HA ASP 13 HA ASP 13 -5.125 5.988 -8.509 97 HB2 ASP 13 HB2 ASP 13 -6.179 6.579 -10.601 98 HB3 ASP 13 HB1 ASP 13 -6.619 4.905 -10.908 99 H GLN 14 HN GLN 14 -5.352 2.774 -9.910 100 HA GLN 14 HA GLN 14 -7.229 1.713 -8.090 101 HB2 GLN 14 HB2 GLN 14 -6.579 0.783 -10.365 102 HB3 GLN 14 HB1 GLN 14 -5.138 0.139 -9.589 103 HG2 GLN 14 HG2 GLN 14 -6.768 -1.593 -9.706 104 HG3 GLN 14 HG1 GLN 14 -6.609 -1.096 -8.020 105 HE21 GLN 14 HE21 GLN 14 -8.648 -1.162 -10.801 106 HE22 GLN 14 HE22 GLN 14 -10.099 -0.624 -10.021 107 H VAL 15 HN VAL 15 -3.676 1.486 -8.237 108 HA VAL 15 HA VAL 15 -3.465 -0.093 -5.889 109 HB VAL 15 HB VAL 15 -1.074 0.418 -5.914 110 HG11 VAL 15 HG11 VAL 15 -2.219 -0.150 -8.643 111 HG12 VAL 15 HG12 VAL 15 -1.882 -1.333 -7.378 112 HG13 VAL 15 HG13 VAL 15 -0.555 -0.464 -8.153 113 HG21 VAL 15 HG21 VAL 15 -1.752 2.345 -8.132 114 HG22 VAL 15 HG22 VAL 15 -0.122 1.871 -7.651 115 HG23 VAL 15 HG23 VAL 15 -1.148 2.764 -6.527 116 H ALA 16 HN ALA 16 -3.700 3.333 -6.445 117 HA ALA 16 HA ALA 16 -2.875 4.211 -3.882 118 HB1 ALA 16 HB1 ALA 16 -3.072 5.711 -5.823 119 HB2 ALA 16 HB2 ALA 16 -3.985 6.298 -4.433 120 HB3 ALA 16 HB3 ALA 16 -4.825 5.522 -5.776 121 H ARG 17 HN ARG 17 -5.949 3.164 -5.221 122 HA ARG 17 HA ARG 17 -7.611 3.730 -3.025 123 HB2 ARG 17 HB2 ARG 17 -8.678 3.193 -5.054 124 HB3 ARG 17 HB1 ARG 17 -7.710 1.750 -5.292 125 HG2 ARG 17 HG2 ARG 17 -8.923 0.651 -3.462 126 HG3 ARG 17 HG1 ARG 17 -9.914 2.101 -3.269 127 HD2 ARG 17 HD2 ARG 17 -10.934 1.828 -5.354 128 HD3 ARG 17 HD1 ARG 17 -9.695 0.705 -5.917 129 HE ARG 17 HE ARG 17 -11.755 0.058 -3.897 130 HH11 ARG 17 HH11 ARG 17 -9.644 -0.881 -6.536 131 HH12 ARG 17 HH12 ARG 17 -10.269 -2.497 -6.616 132 HH21 ARG 17 HH21 ARG 17 -12.608 -2.057 -4.048 133 HH22 ARG 17 HH22 ARG 17 -11.945 -3.164 -5.204 134 H VAL 18 HN VAL 18 -5.662 0.891 -3.829 135 HA VAL 18 HA VAL 18 -6.431 -0.679 -1.606 136 HB VAL 18 HB VAL 18 -3.834 -0.785 -3.157 137 HG11 VAL 18 HG11 VAL 18 -3.716 -1.971 -1.027 138 HG12 VAL 18 HG12 VAL 18 -3.707 -3.100 -2.383 139 HG13 VAL 18 HG13 VAL 18 -5.178 -2.867 -1.439 140 HG21 VAL 18 HG21 VAL 18 -6.400 -2.311 -3.593 141 HG22 VAL 18 HG22 VAL 18 -4.898 -2.523 -4.494 142 HG23 VAL 18 HG23 VAL 18 -5.792 -1.007 -4.611 143 H GLY 19 HN GLY 19 -3.590 1.388 -2.189 144 HA2 GLY 19 HA2 GLY 19 -2.407 1.024 0.347 145 HA3 GLY 19 HA1 GLY 19 -2.089 2.361 -0.750 146 H LYS 20 HN LYS 20 -4.882 3.233 -0.772 147 HA LYS 20 HA LYS 20 -4.798 5.033 1.394 148 HB2 LYS 20 HB2 LYS 20 -5.919 5.504 -0.753 149 HB3 LYS 20 HB1 LYS 20 -7.138 4.296 -0.374 150 HG2 LYS 20 HG2 LYS 20 -7.961 5.595 1.440 151 HG3 LYS 20 HG1 LYS 20 -6.625 6.739 1.300 152 HD2 LYS 20 HD2 LYS 20 -7.423 7.356 -0.945 153 HD3 LYS 20 HD1 LYS 20 -8.785 6.251 -0.750 154 HE2 LYS 20 HE2 LYS 20 -8.196 8.643 0.991 155 HE3 LYS 20 HE1 LYS 20 -9.408 8.580 -0.287 156 HZ1 LYS 20 HZ1 LYS 20 -10.504 8.220 1.757 157 HZ2 LYS 20 HZ2 LYS 20 -9.381 7.050 2.253 158 HZ3 LYS 20 HZ3 LYS 20 -10.447 6.715 0.973 159 H ALA 21 HN ALA 21 -6.742 2.108 0.831 160 HA ALA 21 HA ALA 21 -8.100 2.240 3.335 161 HB1 ALA 21 HB1 ALA 21 -7.631 -0.123 1.516 162 HB2 ALA 21 HB2 ALA 21 -9.006 0.978 1.449 163 HB3 ALA 21 HB3 ALA 21 -8.779 -0.066 2.852 164 H LEU 22 HN LEU 22 -5.046 1.067 2.277 165 HA LEU 22 HA LEU 22 -4.483 -0.702 4.448 166 HB2 LEU 22 HB2 LEU 22 -3.471 -0.652 2.098 167 HB3 LEU 22 HB1 LEU 22 -2.499 0.694 2.655 168 HG LEU 22 HG LEU 22 -1.752 -0.966 4.530 169 HD11 LEU 22 HD11 LEU 22 -3.353 -2.725 3.987 170 HD12 LEU 22 HD12 LEU 22 -1.697 -3.291 3.770 171 HD13 LEU 22 HD13 LEU 22 -2.673 -2.858 2.365 172 HD21 LEU 22 HD21 LEU 22 -0.817 -1.259 1.675 173 HD22 LEU 22 HD22 LEU 22 0.095 -1.694 3.122 174 HD23 LEU 22 HD23 LEU 22 -0.301 -0.005 2.804 175 H ALA 23 HN ALA 23 -4.147 2.714 3.880 176 HA ALA 23 HA ALA 23 -1.959 3.128 5.684 177 HB1 ALA 23 HB1 ALA 23 -2.201 5.473 5.120 178 HB2 ALA 23 HB2 ALA 23 -3.748 5.142 4.341 179 HB3 ALA 23 HB3 ALA 23 -2.260 4.475 3.667 180 H ASN 24 HN ASN 24 -4.769 2.201 6.700 181 HA ASN 24 HA ASN 24 -5.367 4.394 8.534 182 HB2 ASN 24 HB2 ASN 24 -7.146 2.928 7.387 183 HB3 ASN 24 HB1 ASN 24 -6.693 1.685 8.542 184 HD21 ASN 24 HD21 ASN 24 -6.190 3.848 10.613 185 HD22 ASN 24 HD22 ASN 24 -7.777 4.293 11.158 186 H GLY 25 HN GLY 25 -3.914 1.202 8.528 187 HA2 GLY 25 HA2 GLY 25 -2.355 0.449 10.115 188 HA3 GLY 25 HA1 GLY 25 -2.890 1.714 11.210 189 H ARG 26 HN ARG 26 -5.324 1.394 11.894 190 HA ARG 26 HA ARG 26 -5.337 -1.048 13.331 191 HB2 ARG 26 HB2 ARG 26 -7.367 -0.341 14.338 192 HB3 ARG 26 HB1 ARG 26 -6.370 1.090 14.135 193 HG2 ARG 26 HG2 ARG 26 -7.679 1.796 12.244 194 HG3 ARG 26 HG1 ARG 26 -8.614 0.298 12.290 195 HD2 ARG 26 HD2 ARG 26 -9.384 0.899 14.563 196 HD3 ARG 26 HD1 ARG 26 -8.522 2.429 14.419 197 HE ARG 26 HE ARG 26 -10.585 1.777 12.441 198 HH11 ARG 26 HH11 ARG 26 -9.482 3.709 15.148 199 HH12 ARG 26 HH12 ARG 26 -10.745 4.887 14.985 200 HH21 ARG 26 HH21 ARG 26 -12.262 3.328 12.236 201 HH22 ARG 26 HH22 ARG 26 -12.330 4.669 13.329 202 H ARG 27 HN ARG 27 -6.646 -0.148 10.261 203 HA ARG 27 HA ARG 27 -8.538 -2.276 10.060 204 HB2 ARG 27 HB2 ARG 27 -7.153 -0.665 7.905 205 HB3 ARG 27 HB1 ARG 27 -8.450 -1.814 7.607 206 HG2 ARG 27 HG2 ARG 27 -9.927 -0.451 9.055 207 HG3 ARG 27 HG1 ARG 27 -8.629 0.737 9.196 208 HD2 ARG 27 HD2 ARG 27 -8.634 0.920 6.702 209 HD3 ARG 27 HD1 ARG 27 -10.061 -0.115 6.685 210 HE ARG 27 HE ARG 27 -10.592 2.003 8.410 211 HH11 ARG 27 HH11 ARG 27 -9.955 1.534 5.002 212 HH12 ARG 27 HH12 ARG 27 -10.883 2.919 4.502 213 HH21 ARG 27 HH21 ARG 27 -11.771 3.853 7.764 214 HH22 ARG 27 HH22 ARG 27 -11.875 4.264 6.080 215 H LEU 28 HN LEU 28 -5.144 -2.045 9.833 216 HA LEU 28 HA LEU 28 -4.760 -4.410 8.229 217 HB2 LEU 28 HB2 LEU 28 -2.737 -2.980 9.950 218 HB3 LEU 28 HB1 LEU 28 -2.416 -4.056 8.601 219 HG LEU 28 HG LEU 28 -3.704 -1.332 8.404 220 HD11 LEU 28 HD11 LEU 28 -1.327 -1.215 8.928 221 HD12 LEU 28 HD12 LEU 28 -1.648 -0.673 7.281 222 HD13 LEU 28 HD13 LEU 28 -0.967 -2.276 7.568 223 HD21 LEU 28 HD21 LEU 28 -2.908 -3.292 6.260 224 HD22 LEU 28 HD22 LEU 28 -3.517 -1.659 5.992 225 HD23 LEU 28 HD23 LEU 28 -4.556 -2.878 6.730 226 H GLN 29 HN GLN 29 -5.069 -3.553 11.561 227 HA GLN 29 HA GLN 29 -4.108 -5.929 12.740 228 HB2 GLN 29 HB2 GLN 29 -4.685 -3.754 13.919 229 HB3 GLN 29 HB1 GLN 29 -6.376 -4.204 13.754 230 HG2 GLN 29 HG2 GLN 29 -5.865 -6.287 15.028 231 HG3 GLN 29 HG1 GLN 29 -4.248 -5.642 15.314 232 HE21 GLN 29 HE21 GLN 29 -4.001 -3.848 16.666 233 HE22 GLN 29 HE22 GLN 29 -5.244 -3.347 17.754 234 H ILE 30 HN ILE 30 -7.144 -4.988 11.283 235 HA ILE 30 HA ILE 30 -8.669 -7.247 11.990 236 HB ILE 30 HB ILE 30 -8.925 -5.536 9.507 237 HG12 ILE 30 HG12 ILE 30 -10.286 -5.258 12.199 238 HG13 ILE 30 HG11 ILE 30 -8.991 -4.223 11.608 239 HG21 ILE 30 HG21 ILE 30 -10.918 -7.336 10.885 240 HG22 ILE 30 HG22 ILE 30 -10.153 -7.625 9.323 241 HG23 ILE 30 HG23 ILE 30 -11.271 -6.275 9.520 242 HD11 ILE 30 HD11 ILE 30 -11.736 -4.495 10.406 243 HD12 ILE 30 HD12 ILE 30 -10.439 -3.477 9.781 244 HD13 ILE 30 HD13 ILE 30 -11.138 -3.142 11.365 245 H LEU 31 HN LEU 31 -6.644 -6.522 9.160 246 HA LEU 31 HA LEU 31 -7.033 -8.968 7.815 247 HB2 LEU 31 HB2 LEU 31 -4.635 -7.128 7.780 248 HB3 LEU 31 HB1 LEU 31 -4.936 -8.412 6.626 249 HG LEU 31 HG LEU 31 -6.693 -5.985 7.004 250 HD11 LEU 31 HD11 LEU 31 -4.539 -5.381 6.054 251 HD12 LEU 31 HD12 LEU 31 -5.803 -5.282 4.830 252 HD13 LEU 31 HD13 LEU 31 -4.696 -6.655 4.846 253 HD21 LEU 31 HD21 LEU 31 -6.745 -8.184 4.942 254 HD22 LEU 31 HD22 LEU 31 -7.775 -6.752 4.951 255 HD23 LEU 31 HD23 LEU 31 -7.917 -7.950 6.237 256 H ASP 32 HN ASP 32 -4.655 -7.917 10.194 257 HA ASP 32 HA ASP 32 -3.042 -10.181 10.326 258 HB2 ASP 32 HB2 ASP 32 -2.456 -8.120 11.462 259 HB3 ASP 32 HB1 ASP 32 -3.867 -8.245 12.504 260 H LEU 33 HN LEU 33 -6.136 -9.497 11.832 261 HA LEU 33 HA LEU 33 -6.213 -11.915 13.369 262 HB2 LEU 33 HB2 LEU 33 -7.405 -9.895 14.068 263 HB3 LEU 33 HB1 LEU 33 -8.388 -9.960 12.618 264 HG LEU 33 HG LEU 33 -9.291 -12.155 13.415 265 HD11 LEU 33 HD11 LEU 33 -7.491 -12.774 14.923 266 HD12 LEU 33 HD12 LEU 33 -9.029 -12.707 15.783 267 HD13 LEU 33 HD13 LEU 33 -7.863 -11.395 15.957 268 HD21 LEU 33 HD21 LEU 33 -10.537 -10.080 13.683 269 HD22 LEU 33 HD22 LEU 33 -9.716 -9.774 15.215 270 HD23 LEU 33 HD23 LEU 33 -10.799 -11.155 15.055 271 H LEU 34 HN LEU 34 -7.673 -10.811 10.317 272 HA LEU 34 HA LEU 34 -9.246 -13.174 9.984 273 HB2 LEU 34 HB2 LEU 34 -8.512 -11.025 8.002 274 HB3 LEU 34 HB1 LEU 34 -9.701 -12.280 7.722 275 HG LEU 34 HG LEU 34 -9.868 -10.057 9.753 276 HD11 LEU 34 HD11 LEU 34 -10.318 -9.339 7.486 277 HD12 LEU 34 HD12 LEU 34 -11.808 -9.361 8.426 278 HD13 LEU 34 HD13 LEU 34 -11.476 -10.653 7.274 279 HD21 LEU 34 HD21 LEU 34 -10.813 -12.109 10.668 280 HD22 LEU 34 HD22 LEU 34 -11.803 -12.309 9.222 281 HD23 LEU 34 HD23 LEU 34 -12.080 -10.938 10.299 282 H ALA 35 HN ALA 35 -5.990 -12.692 9.663 283 HA ALA 35 HA ALA 35 -5.363 -14.195 7.365 284 HB1 ALA 35 HB1 ALA 35 -3.140 -14.408 8.313 285 HB2 ALA 35 HB2 ALA 35 -3.742 -13.904 9.891 286 HB3 ALA 35 HB3 ALA 35 -3.746 -12.767 8.542 287 H GLN 36 HN GLN 36 -6.595 -15.153 10.426 288 HA GLN 36 HA GLN 36 -5.644 -17.883 10.235 289 HB2 GLN 36 HB2 GLN 36 -6.875 -18.288 12.277 290 HB3 GLN 36 HB1 GLN 36 -5.962 -16.795 12.437 291 HG2 GLN 36 HG2 GLN 36 -7.944 -15.485 12.090 292 HG3 GLN 36 HG1 GLN 36 -8.887 -16.934 11.746 293 HE21 GLN 36 HE21 GLN 36 -7.318 -15.051 14.208 294 HE22 GLN 36 HE22 GLN 36 -8.060 -15.833 15.568 295 H GLY 37 HN GLY 37 -8.225 -16.076 8.994 296 HA2 GLY 37 HA2 GLY 37 -9.476 -17.657 7.327 297 HA3 GLY 37 HA1 GLY 37 -10.039 -18.373 8.836 298 H GLU 38 HN GLU 38 -12.132 -17.624 7.623 299 HA GLU 38 HA GLU 38 -12.620 -14.780 7.873 300 HB2 GLU 38 HB2 GLU 38 -14.861 -15.255 6.993 301 HB3 GLU 38 HB1 GLU 38 -13.603 -15.914 5.964 302 HG2 GLU 38 HG2 GLU 38 -14.984 -17.614 8.004 303 HG3 GLU 38 HG1 GLU 38 -15.699 -17.317 6.421 304 H ARG 39 HN ARG 39 -13.581 -13.782 9.489 305 HA ARG 39 HA ARG 39 -14.818 -15.432 11.596 306 HB2 ARG 39 HB2 ARG 39 -13.520 -12.715 11.893 307 HB3 ARG 39 HB1 ARG 39 -14.226 -13.670 13.188 308 HG2 ARG 39 HG2 ARG 39 -11.822 -14.449 11.549 309 HG3 ARG 39 HG1 ARG 39 -11.786 -13.783 13.182 310 HD2 ARG 39 HD2 ARG 39 -13.131 -16.369 12.401 311 HD3 ARG 39 HD1 ARG 39 -11.525 -16.246 13.116 312 HE ARG 39 HE ARG 39 -13.641 -15.005 14.649 313 HH11 ARG 39 HH11 ARG 39 -11.753 -17.886 14.072 314 HH12 ARG 39 HH12 ARG 39 -12.103 -18.586 15.620 315 HH21 ARG 39 HH21 ARG 39 -14.109 -15.938 16.729 316 HH22 ARG 39 HH22 ARG 39 -13.421 -17.490 17.121 317 H ALA 40 HN ALA 40 -16.770 -14.704 12.482 318 HA ALA 40 HA ALA 40 -18.497 -13.332 10.703 319 HB1 ALA 40 HB1 ALA 40 -19.330 -14.981 12.292 320 HB2 ALA 40 HB2 ALA 40 -20.133 -13.429 12.532 321 HB3 ALA 40 HB3 ALA 40 -18.858 -13.941 13.638 322 H VAL 41 HN VAL 41 -19.458 -11.265 10.908 323 HA VAL 41 HA VAL 41 -17.793 -9.139 11.501 324 HB VAL 41 HB VAL 41 -20.811 -9.078 11.623 325 HG11 VAL 41 HG11 VAL 41 -20.560 -6.731 10.961 326 HG12 VAL 41 HG12 VAL 41 -18.807 -6.896 11.057 327 HG13 VAL 41 HG13 VAL 41 -19.791 -7.059 12.513 328 HG21 VAL 41 HG21 VAL 41 -18.963 -8.733 9.265 329 HG22 VAL 41 HG22 VAL 41 -20.709 -8.477 9.245 330 HG23 VAL 41 HG23 VAL 41 -20.057 -10.087 9.547 331 H GLU 42 HN GLU 42 -20.208 -10.674 13.562 332 HA GLU 42 HA GLU 42 -20.063 -8.985 15.780 333 HB2 GLU 42 HB2 GLU 42 -21.774 -10.757 15.380 334 HB3 GLU 42 HB1 GLU 42 -20.560 -11.973 15.743 335 HG2 GLU 42 HG2 GLU 42 -21.265 -9.859 17.738 336 HG3 GLU 42 HG1 GLU 42 -22.250 -11.306 17.555 337 H ALA 43 HN ALA 43 -18.166 -11.838 14.927 338 HA ALA 43 HA ALA 43 -16.610 -11.927 17.289 339 HB1 ALA 43 HB1 ALA 43 -15.192 -13.476 16.066 340 HB2 ALA 43 HB2 ALA 43 -15.952 -13.001 14.548 341 HB3 ALA 43 HB3 ALA 43 -16.892 -13.846 15.776 342 H ILE 44 HN ILE 44 -16.024 -10.570 14.063 343 HA ILE 44 HA ILE 44 -13.385 -9.746 14.423 344 HB ILE 44 HB ILE 44 -15.517 -8.435 12.729 345 HG12 ILE 44 HG12 ILE 44 -13.408 -10.480 12.001 346 HG13 ILE 44 HG11 ILE 44 -15.118 -10.832 12.230 347 HG21 ILE 44 HG21 ILE 44 -13.645 -7.516 11.430 348 HG22 ILE 44 HG22 ILE 44 -12.511 -8.196 12.599 349 HG23 ILE 44 HG23 ILE 44 -13.639 -6.934 13.096 350 HD11 ILE 44 HD11 ILE 44 -14.526 -10.655 9.874 351 HD12 ILE 44 HD12 ILE 44 -13.975 -9.001 10.136 352 HD13 ILE 44 HD13 ILE 44 -15.678 -9.407 10.350 353 H ALA 45 HN ALA 45 -16.388 -7.921 14.938 354 HA ALA 45 HA ALA 45 -15.257 -5.496 15.714 355 HB1 ALA 45 HB1 ALA 45 -17.850 -6.702 16.682 356 HB2 ALA 45 HB2 ALA 45 -17.636 -5.810 15.175 357 HB3 ALA 45 HB3 ALA 45 -17.410 -4.995 16.723 358 H THR 46 HN THR 46 -16.378 -8.177 17.762 359 HA THR 46 HA THR 46 -15.675 -7.019 20.216 360 HB THR 46 HB THR 46 -15.878 -9.963 19.544 361 HG1 THR 46 HG1 THR 46 -17.904 -9.419 19.209 362 HG21 THR 46 HG21 THR 46 -14.814 -9.559 21.712 363 HG22 THR 46 HG22 THR 46 -16.431 -10.231 21.922 364 HG23 THR 46 HG23 THR 46 -16.152 -8.509 22.180 365 H ALA 47 HN ALA 47 -13.878 -9.245 18.100 366 HA ALA 47 HA ALA 47 -11.756 -9.694 19.919 367 HB1 ALA 47 HB1 ALA 47 -10.609 -10.730 18.048 368 HB2 ALA 47 HB2 ALA 47 -11.772 -10.023 16.926 369 HB3 ALA 47 HB3 ALA 47 -12.300 -11.230 18.098 370 H THR 48 HN THR 48 -12.348 -7.146 17.614 371 HA THR 48 HA THR 48 -9.572 -6.246 17.791 372 HB THR 48 HB THR 48 -10.327 -4.476 16.161 373 HG1 THR 48 HG1 THR 48 -12.625 -6.100 15.803 374 HG21 THR 48 HG21 THR 48 -9.182 -6.493 15.411 375 HG22 THR 48 HG22 THR 48 -10.420 -6.013 14.248 376 HG23 THR 48 HG23 THR 48 -10.719 -7.357 15.351 377 H GLY 49 HN GLY 49 -12.485 -5.763 19.395 378 HA2 GLY 49 HA2 GLY 49 -12.940 -4.349 21.173 379 HA3 GLY 49 HA1 GLY 49 -11.400 -3.550 20.890 380 H MET 50 HN MET 50 -13.903 -4.009 18.481 381 HA MET 50 HA MET 50 -14.489 -1.127 18.585 382 HB2 MET 50 HB2 MET 50 -13.968 -2.862 16.174 383 HB3 MET 50 HB1 MET 50 -14.854 -1.347 16.051 384 HG2 MET 50 HG2 MET 50 -12.914 -0.160 16.983 385 HG3 MET 50 HG1 MET 50 -12.029 -1.682 17.043 386 HE1 MET 50 HE1 MET 50 -12.484 -3.208 14.509 387 HE2 MET 50 HE2 MET 50 -10.844 -2.782 15.007 388 HE3 MET 50 HE3 MET 50 -11.361 -2.513 13.341 389 H ASN 51 HN ASN 51 -16.609 -0.544 17.759 390 HA ASN 51 HA ASN 51 -18.617 -2.391 18.656 391 HB2 ASN 51 HB2 ASN 51 -18.759 0.360 17.434 392 HB3 ASN 51 HB1 ASN 51 -20.201 -0.571 17.819 393 HD21 ASN 51 HD21 ASN 51 -20.659 -1.052 19.983 394 HD22 ASN 51 HD22 ASN 51 -19.986 -0.116 21.274 395 H LEU 52 HN LEU 52 -20.474 -3.044 17.383 396 HA LEU 52 HA LEU 52 -19.818 -4.379 15.028 397 HB2 LEU 52 HB2 LEU 52 -22.377 -3.642 16.360 398 HB3 LEU 52 HB1 LEU 52 -22.453 -4.205 14.704 399 HG LEU 52 HG LEU 52 -22.872 -6.038 16.232 400 HD11 LEU 52 HD11 LEU 52 -21.722 -6.522 14.137 401 HD12 LEU 52 HD12 LEU 52 -21.207 -7.617 15.419 402 HD13 LEU 52 HD13 LEU 52 -20.166 -6.280 14.930 403 HD21 LEU 52 HD21 LEU 52 -21.166 -6.849 17.772 404 HD22 LEU 52 HD22 LEU 52 -21.648 -5.199 18.176 405 HD23 LEU 52 HD23 LEU 52 -20.122 -5.491 17.343 406 H THR 53 HN THR 53 -21.347 -1.232 15.485 407 HA THR 53 HA THR 53 -21.826 -0.690 12.752 408 HB THR 53 HB THR 53 -21.842 1.745 13.638 409 HG1 THR 53 HG1 THR 53 -21.626 2.006 15.788 410 HG21 THR 53 HG21 THR 53 -24.040 1.417 14.664 411 HG22 THR 53 HG22 THR 53 -23.712 -0.309 14.825 412 HG23 THR 53 HG23 THR 53 -23.862 0.414 13.225 413 H THR 54 HN THR 54 -19.230 0.256 14.969 414 HA THR 54 HA THR 54 -17.724 1.790 13.174 415 HB THR 54 HB THR 54 -16.547 0.154 15.418 416 HG1 THR 54 HG1 THR 54 -17.729 2.728 15.697 417 HG21 THR 54 HG21 THR 54 -15.061 2.118 15.636 418 HG22 THR 54 HG22 THR 54 -15.858 2.853 14.246 419 HG23 THR 54 HG23 THR 54 -14.940 1.361 14.048 420 H ALA 55 HN ALA 55 -17.451 -1.639 14.076 421 HA ALA 55 HA ALA 55 -15.225 -2.250 12.480 422 HB1 ALA 55 HB1 ALA 55 -17.439 -4.103 13.347 423 HB2 ALA 55 HB2 ALA 55 -16.027 -3.675 14.314 424 HB3 ALA 55 HB3 ALA 55 -15.826 -4.575 12.810 425 H SER 56 HN SER 56 -18.711 -2.607 11.809 426 HA SER 56 HA SER 56 -18.439 -3.749 9.266 427 HB2 SER 56 HB2 SER 56 -20.654 -1.969 10.308 428 HB3 SER 56 HB1 SER 56 -20.752 -2.976 8.864 429 HG SER 56 HG SER 56 -20.664 -3.728 11.573 430 H ALA 57 HN ALA 57 -18.486 -0.372 10.292 431 HA ALA 57 HA ALA 57 -18.564 0.786 7.727 432 HB1 ALA 57 HB1 ALA 57 -19.018 2.059 9.759 433 HB2 ALA 57 HB2 ALA 57 -17.732 2.812 8.815 434 HB3 ALA 57 HB3 ALA 57 -17.335 1.878 10.258 435 H ASN 58 HN ASN 58 -15.910 -0.407 9.712 436 HA ASN 58 HA ASN 58 -13.886 0.575 7.898 437 HB2 ASN 58 HB2 ASN 58 -13.778 -1.162 10.356 438 HB3 ASN 58 HB1 ASN 58 -12.365 -0.938 9.330 439 HD21 ASN 58 HD21 ASN 58 -14.792 1.508 9.967 440 HD22 ASN 58 HD22 ASN 58 -13.763 2.575 10.857 441 H LEU 59 HN LEU 59 -15.470 -2.502 8.573 442 HA LEU 59 HA LEU 59 -13.940 -4.097 6.834 443 HB2 LEU 59 HB2 LEU 59 -16.827 -4.346 7.680 444 HB3 LEU 59 HB1 LEU 59 -15.966 -5.569 6.765 445 HG LEU 59 HG LEU 59 -15.217 -4.644 9.540 446 HD11 LEU 59 HD11 LEU 59 -16.023 -6.849 10.249 447 HD12 LEU 59 HD12 LEU 59 -16.585 -7.165 8.608 448 HD13 LEU 59 HD13 LEU 59 -17.315 -5.869 9.556 449 HD21 LEU 59 HD21 LEU 59 -13.301 -5.406 8.236 450 HD22 LEU 59 HD22 LEU 59 -14.155 -6.899 7.843 451 HD23 LEU 59 HD23 LEU 59 -13.699 -6.557 9.511 452 H GLN 60 HN GLN 60 -16.944 -2.286 6.316 453 HA GLN 60 HA GLN 60 -17.244 -2.959 3.594 454 HB2 GLN 60 HB2 GLN 60 -19.008 -1.986 5.097 455 HB3 GLN 60 HB1 GLN 60 -18.197 -0.435 4.955 456 HG2 GLN 60 HG2 GLN 60 -18.628 -0.368 2.594 457 HG3 GLN 60 HG1 GLN 60 -19.301 -1.997 2.635 458 HE21 GLN 60 HE21 GLN 60 -19.829 1.347 3.400 459 HE22 GLN 60 HE22 GLN 60 -21.528 1.212 3.726 460 H ALA 61 HN ALA 61 -15.432 -0.454 5.241 461 HA ALA 61 HA ALA 61 -14.694 1.033 2.946 462 HB1 ALA 61 HB1 ALA 61 -14.496 1.911 5.228 463 HB2 ALA 61 HB2 ALA 61 -12.965 2.000 4.357 464 HB3 ALA 61 HB3 ALA 61 -13.220 0.739 5.561 465 H LEU 62 HN LEU 62 -13.105 -1.605 4.726 466 HA LEU 62 HA LEU 62 -10.867 -1.826 3.008 467 HB2 LEU 62 HB2 LEU 62 -12.176 -3.815 4.862 468 HB3 LEU 62 HB1 LEU 62 -10.702 -4.158 3.980 469 HG LEU 62 HG LEU 62 -11.026 -1.952 6.018 470 HD11 LEU 62 HD11 LEU 62 -9.553 -3.352 7.404 471 HD12 LEU 62 HD12 LEU 62 -9.638 -4.627 6.187 472 HD13 LEU 62 HD13 LEU 62 -11.091 -4.147 7.064 473 HD21 LEU 62 HD21 LEU 62 -8.600 -1.728 5.811 474 HD22 LEU 62 HD22 LEU 62 -9.393 -1.427 4.264 475 HD23 LEU 62 HD23 LEU 62 -8.586 -2.968 4.559 476 H LYS 63 HN LYS 63 -14.091 -3.184 2.946 477 HA LYS 63 HA LYS 63 -13.630 -5.015 0.823 478 HB2 LYS 63 HB2 LYS 63 -15.595 -4.945 2.484 479 HB3 LYS 63 HB1 LYS 63 -16.281 -3.716 1.428 480 HG2 LYS 63 HG2 LYS 63 -16.194 -5.311 -0.441 481 HG3 LYS 63 HG1 LYS 63 -15.575 -6.538 0.664 482 HD2 LYS 63 HD2 LYS 63 -17.647 -6.242 2.029 483 HD3 LYS 63 HD1 LYS 63 -18.267 -5.188 0.756 484 HE2 LYS 63 HE2 LYS 63 -17.464 -8.077 0.443 485 HE3 LYS 63 HE1 LYS 63 -19.112 -7.456 0.492 486 HZ1 LYS 63 HZ1 LYS 63 -18.939 -6.558 -1.595 487 HZ2 LYS 63 HZ2 LYS 63 -17.944 -7.930 -1.770 488 HZ3 LYS 63 HZ3 LYS 63 -17.252 -6.401 -1.525 489 H SER 64 HN SER 64 -14.592 -1.637 0.999 490 HA SER 64 HA SER 64 -15.054 -1.292 -1.782 491 HB2 SER 64 HB2 SER 64 -14.263 0.754 0.310 492 HB3 SER 64 HB1 SER 64 -14.859 1.122 -1.308 493 HG SER 64 HG SER 64 -16.253 -0.169 0.811 494 H GLY 65 HN GLY 65 -12.208 -1.339 0.231 495 HA2 GLY 65 HA2 GLY 65 -10.471 -0.301 -1.826 496 HA3 GLY 65 HA1 GLY 65 -9.974 -1.026 -0.302 497 H GLY 66 HN GLY 66 -11.902 -3.315 -1.133 498 HA2 GLY 66 HA2 GLY 66 -11.834 -5.211 -2.486 499 HA3 GLY 66 HA1 GLY 66 -10.419 -4.558 -3.296 500 H LEU 67 HN LEU 67 -10.457 -4.623 0.152 501 HA LEU 67 HA LEU 67 -8.223 -6.483 0.076 502 HB2 LEU 67 HB2 LEU 67 -9.217 -4.444 1.989 503 HB3 LEU 67 HB1 LEU 67 -8.320 -5.796 2.651 504 HG LEU 67 HG LEU 67 -6.387 -5.238 1.272 505 HD11 LEU 67 HD11 LEU 67 -8.057 -2.945 0.252 506 HD12 LEU 67 HD12 LEU 67 -7.525 -4.345 -0.682 507 HD13 LEU 67 HD13 LEU 67 -6.340 -3.192 -0.067 508 HD21 LEU 67 HD21 LEU 67 -7.482 -2.849 2.749 509 HD22 LEU 67 HD22 LEU 67 -5.793 -3.107 2.311 510 HD23 LEU 67 HD23 LEU 67 -6.580 -4.189 3.459 511 H VAL 68 HN VAL 68 -11.512 -6.319 1.314 512 HA VAL 68 HA VAL 68 -11.215 -9.111 2.190 513 HB VAL 68 HB VAL 68 -12.754 -8.698 4.077 514 HG11 VAL 68 HG11 VAL 68 -10.239 -7.035 4.095 515 HG12 VAL 68 HG12 VAL 68 -10.377 -8.745 4.509 516 HG13 VAL 68 HG13 VAL 68 -11.142 -7.526 5.529 517 HG21 VAL 68 HG21 VAL 68 -12.401 -5.786 3.364 518 HG22 VAL 68 HG22 VAL 68 -13.171 -6.396 4.828 519 HG23 VAL 68 HG23 VAL 68 -13.895 -6.718 3.252 520 H GLU 69 HN GLU 69 -13.076 -10.396 2.085 521 HA GLU 69 HA GLU 69 -15.332 -9.274 0.556 522 HB2 GLU 69 HB2 GLU 69 -13.566 -11.337 -0.248 523 HB3 GLU 69 HB1 GLU 69 -15.086 -12.117 0.164 524 HG2 GLU 69 HG2 GLU 69 -14.689 -9.897 -1.833 525 HG3 GLU 69 HG1 GLU 69 -15.040 -11.588 -2.184 526 H ALA 70 HN ALA 70 -17.210 -11.103 0.730 527 HA ALA 70 HA ALA 70 -17.486 -11.587 3.627 528 HB1 ALA 70 HB1 ALA 70 -19.809 -10.864 3.487 529 HB2 ALA 70 HB2 ALA 70 -19.603 -10.504 1.772 530 HB3 ALA 70 HB3 ALA 70 -18.715 -9.576 2.982 531 H ARG 71 HN ARG 71 -17.610 -13.684 3.948 532 HA ARG 71 HA ARG 71 -19.142 -15.339 2.050 533 HB2 ARG 71 HB2 ARG 71 -16.938 -16.070 3.987 534 HB3 ARG 71 HB1 ARG 71 -17.908 -17.262 3.132 535 HG2 ARG 71 HG2 ARG 71 -17.106 -16.458 1.009 536 HG3 ARG 71 HG1 ARG 71 -16.220 -15.157 1.802 537 HD2 ARG 71 HD2 ARG 71 -14.769 -17.045 1.162 538 HD3 ARG 71 HD1 ARG 71 -14.778 -16.751 2.900 539 HE ARG 71 HE ARG 71 -16.136 -18.706 3.180 540 HH11 ARG 71 HH11 ARG 71 -14.878 -18.261 -0.074 541 HH12 ARG 71 HH12 ARG 71 -15.038 -19.942 -0.487 542 HH21 ARG 71 HH21 ARG 71 -16.297 -20.921 2.629 543 HH22 ARG 71 HH22 ARG 71 -15.842 -21.440 1.033 544 H ARG 72 HN ARG 72 -21.152 -15.610 2.741 545 HA ARG 72 HA ARG 72 -21.706 -15.478 5.590 546 HB2 ARG 72 HB2 ARG 72 -24.042 -15.241 5.019 547 HB3 ARG 72 HB1 ARG 72 -23.088 -14.109 4.080 548 HG2 ARG 72 HG2 ARG 72 -24.016 -16.742 2.969 549 HG3 ARG 72 HG1 ARG 72 -24.997 -15.281 2.899 550 HD2 ARG 72 HD2 ARG 72 -22.368 -15.846 1.558 551 HD3 ARG 72 HD1 ARG 72 -23.903 -15.394 0.829 552 HE ARG 72 HE ARG 72 -22.960 -13.351 2.563 553 HH11 ARG 72 HH11 ARG 72 -22.537 -14.702 -0.643 554 HH12 ARG 72 HH12 ARG 72 -21.859 -13.241 -1.303 555 HH21 ARG 72 HH21 ARG 72 -22.059 -11.445 1.710 556 HH22 ARG 72 HH22 ARG 72 -21.556 -11.402 0.043 557 H GLU 73 HN GLU 73 -22.544 -17.060 6.797 558 HA GLU 73 HA GLU 73 -23.078 -19.668 5.559 559 HB2 GLU 73 HB2 GLU 73 -20.734 -19.604 6.477 560 HB3 GLU 73 HB1 GLU 73 -21.415 -19.285 8.064 561 HG2 GLU 73 HG2 GLU 73 -20.901 -21.589 7.963 562 HG3 GLU 73 HG1 GLU 73 -22.655 -21.442 7.875 563 H GLY 74 HN GLY 74 -25.092 -20.202 6.114 564 HA2 GLY 74 HA2 GLY 74 -27.005 -20.453 7.375 565 HA3 GLY 74 HA1 GLY 74 -26.062 -20.026 8.798 566 H THR 75 HN THR 75 -26.563 -18.170 9.759 567 HA THR 75 HA THR 75 -27.957 -16.134 8.147 568 HB THR 75 HB THR 75 -28.924 -15.317 10.277 569 HG1 THR 75 HG1 THR 75 -27.950 -15.984 12.027 570 HG21 THR 75 HG21 THR 75 -30.207 -16.875 8.907 571 HG22 THR 75 HG22 THR 75 -30.501 -17.171 10.621 572 HG23 THR 75 HG23 THR 75 -29.434 -18.241 9.712 573 H ARG 76 HN ARG 76 -25.051 -16.860 9.498 574 HA ARG 76 HA ARG 76 -24.426 -14.101 10.276 575 HB2 ARG 76 HB2 ARG 76 -23.058 -16.731 10.792 576 HB3 ARG 76 HB1 ARG 76 -22.236 -15.200 11.047 577 HG2 ARG 76 HG2 ARG 76 -23.880 -14.550 12.690 578 HG3 ARG 76 HG1 ARG 76 -24.801 -16.024 12.384 579 HD2 ARG 76 HD2 ARG 76 -23.083 -17.390 13.280 580 HD3 ARG 76 HD1 ARG 76 -21.939 -16.048 13.305 581 HE ARG 76 HE ARG 76 -22.909 -15.264 15.257 582 HH11 ARG 76 HH11 ARG 76 -24.747 -17.969 13.985 583 HH12 ARG 76 HH12 ARG 76 -25.717 -18.151 15.417 584 HH21 ARG 76 HH21 ARG 76 -24.158 -15.505 17.135 585 HH22 ARG 76 HH22 ARG 76 -25.359 -16.761 17.230 586 H GLN 77 HN GLN 77 -22.752 -12.959 9.324 587 HA GLN 77 HA GLN 77 -21.729 -14.137 6.822 588 HB2 GLN 77 HB2 GLN 77 -23.242 -12.073 6.694 589 HB3 GLN 77 HB1 GLN 77 -21.893 -11.182 7.389 590 HG2 GLN 77 HG2 GLN 77 -20.517 -11.615 5.519 591 HG3 GLN 77 HG1 GLN 77 -21.634 -12.824 4.890 592 HE21 GLN 77 HE21 GLN 77 -22.635 -9.745 6.208 593 HE22 GLN 77 HE22 GLN 77 -23.209 -9.076 4.723 594 H TYR 78 HN TYR 78 -19.653 -14.511 6.706 595 HA TYR 78 HA TYR 78 -17.920 -13.485 8.838 596 HB2 TYR 78 HB2 TYR 78 -17.537 -15.861 6.999 597 HB3 TYR 78 HB1 TYR 78 -16.467 -15.399 8.316 598 HD1 TYR 78 HD1 TYR 78 -19.979 -16.452 7.627 599 HD2 TYR 78 HD2 TYR 78 -16.796 -16.300 10.442 600 HE1 TYR 78 HE1 TYR 78 -21.279 -17.862 9.161 601 HE2 TYR 78 HE2 TYR 78 -18.087 -17.709 11.986 602 HH TYR 78 HH TYR 78 -20.951 -19.343 11.030 603 H TYR 79 HN TYR 79 -16.111 -12.330 8.367 604 HA TYR 79 HA TYR 79 -15.713 -11.663 5.531 605 HB2 TYR 79 HB2 TYR 79 -15.448 -10.079 8.039 606 HB3 TYR 79 HB1 TYR 79 -14.346 -9.710 6.717 607 HD1 TYR 79 HD1 TYR 79 -17.961 -9.991 7.560 608 HD2 TYR 79 HD2 TYR 79 -15.038 -8.396 4.913 609 HE1 TYR 79 HE1 TYR 79 -19.695 -8.618 6.481 610 HE2 TYR 79 HE2 TYR 79 -16.760 -7.020 3.828 611 HH TYR 79 HH TYR 79 -19.828 -6.518 5.149 612 H ARG 80 HN ARG 80 -13.781 -11.844 4.593 613 HA ARG 80 HA ARG 80 -11.376 -12.332 6.123 614 HB2 ARG 80 HB2 ARG 80 -12.153 -14.605 5.979 615 HB3 ARG 80 HB1 ARG 80 -12.575 -14.418 4.285 616 HG2 ARG 80 HG2 ARG 80 -10.372 -14.542 3.585 617 HG3 ARG 80 HG1 ARG 80 -9.737 -14.115 5.172 618 HD2 ARG 80 HD2 ARG 80 -9.394 -16.492 4.551 619 HD3 ARG 80 HD1 ARG 80 -10.293 -16.266 6.046 620 HE ARG 80 HE ARG 80 -12.286 -16.913 4.878 621 HH11 ARG 80 HH11 ARG 80 -9.338 -17.375 3.047 622 HH12 ARG 80 HH12 ARG 80 -9.978 -18.678 2.102 623 HH21 ARG 80 HH21 ARG 80 -13.126 -18.654 3.685 624 HH22 ARG 80 HH22 ARG 80 -12.144 -19.410 2.452 625 H ILE 81 HN ILE 81 -9.461 -12.264 4.696 626 HA ILE 81 HA ILE 81 -9.361 -10.194 2.919 627 HB ILE 81 HB ILE 81 -7.684 -12.710 2.770 628 HG12 ILE 81 HG12 ILE 81 -7.212 -10.145 4.311 629 HG13 ILE 81 HG11 ILE 81 -7.696 -11.681 5.019 630 HG21 ILE 81 HG21 ILE 81 -5.994 -11.286 1.736 631 HG22 ILE 81 HG22 ILE 81 -7.099 -9.914 1.802 632 HG23 ILE 81 HG23 ILE 81 -7.478 -11.303 0.783 633 HD11 ILE 81 HD11 ILE 81 -5.328 -11.292 5.329 634 HD12 ILE 81 HD12 ILE 81 -5.109 -11.123 3.587 635 HD13 ILE 81 HD13 ILE 81 -5.589 -12.677 4.268 636 H ALA 82 HN ALA 82 -9.864 -9.853 0.830 637 HA ALA 82 HA ALA 82 -11.905 -11.351 -0.319 638 HB1 ALA 82 HB1 ALA 82 -10.086 -9.420 -1.743 639 HB2 ALA 82 HB2 ALA 82 -11.476 -8.964 -0.757 640 HB3 ALA 82 HB3 ALA 82 -11.711 -9.902 -2.232 641 H GLY 83 HN GLY 83 -8.446 -11.479 -0.918 642 HA2 GLY 83 HA2 GLY 83 -8.707 -14.060 -2.130 643 HA3 GLY 83 HA1 GLY 83 -8.279 -12.811 -3.290 644 H GLU 84 HN GLU 84 -6.562 -14.831 -2.990 645 HA GLU 84 HA GLU 84 -4.621 -14.507 -0.961 646 HB2 GLU 84 HB2 GLU 84 -4.969 -16.548 -2.388 647 HB3 GLU 84 HB1 GLU 84 -4.184 -15.688 -3.705 648 HG2 GLU 84 HG2 GLU 84 -2.140 -15.529 -2.422 649 HG3 GLU 84 HG1 GLU 84 -2.922 -16.305 -1.045 650 H ASP 85 HN ASP 85 -5.185 -12.914 -3.971 651 HA ASP 85 HA ASP 85 -2.804 -11.678 -4.576 652 HB2 ASP 85 HB2 ASP 85 -5.541 -10.371 -4.535 653 HB3 ASP 85 HB1 ASP 85 -4.150 -9.812 -5.454 654 H VAL 86 HN VAL 86 -5.313 -10.436 -2.396 655 HA VAL 86 HA VAL 86 -3.747 -8.272 -1.421 656 HB VAL 86 HB VAL 86 -6.195 -9.507 -0.145 657 HG11 VAL 86 HG11 VAL 86 -5.033 -6.732 0.077 658 HG12 VAL 86 HG12 VAL 86 -4.950 -7.988 1.312 659 HG13 VAL 86 HG13 VAL 86 -6.511 -7.304 0.855 660 HG21 VAL 86 HG21 VAL 86 -6.661 -8.936 -2.466 661 HG22 VAL 86 HG22 VAL 86 -6.015 -7.315 -2.213 662 HG23 VAL 86 HG23 VAL 86 -7.483 -7.820 -1.376 663 H ALA 87 HN ALA 87 -4.410 -11.546 -0.323 664 HA ALA 87 HA ALA 87 -3.391 -11.372 2.278 665 HB1 ALA 87 HB1 ALA 87 -3.143 -13.796 2.172 666 HB2 ALA 87 HB2 ALA 87 -3.345 -13.751 0.421 667 HB3 ALA 87 HB3 ALA 87 -4.680 -13.287 1.478 668 H ARG 88 HN ARG 88 -1.751 -12.326 -0.741 669 HA ARG 88 HA ARG 88 0.801 -12.585 0.500 670 HB2 ARG 88 HB2 ARG 88 0.007 -12.314 -2.400 671 HB3 ARG 88 HB1 ARG 88 1.660 -12.586 -1.864 672 HG2 ARG 88 HG2 ARG 88 0.892 -14.680 -0.762 673 HG3 ARG 88 HG1 ARG 88 -0.695 -14.424 -1.492 674 HD2 ARG 88 HD2 ARG 88 0.710 -15.979 -2.793 675 HD3 ARG 88 HD1 ARG 88 0.265 -14.540 -3.710 676 HE ARG 88 HE ARG 88 2.625 -13.792 -2.779 677 HH11 ARG 88 HH11 ARG 88 1.696 -16.879 -4.157 678 HH12 ARG 88 HH12 ARG 88 3.284 -17.212 -4.785 679 HH21 ARG 88 HH21 ARG 88 4.677 -14.212 -3.613 680 HH22 ARG 88 HH22 ARG 88 4.976 -15.682 -4.501 681 H LEU 89 HN LEU 89 -0.922 -9.959 -1.036 682 HA LEU 89 HA LEU 89 1.236 -8.165 -1.319 683 HB2 LEU 89 HB2 LEU 89 -0.996 -7.874 -2.367 684 HB3 LEU 89 HB1 LEU 89 -1.672 -7.532 -0.787 685 HG LEU 89 HG LEU 89 -0.119 -5.560 -0.640 686 HD11 LEU 89 HD11 LEU 89 0.832 -4.726 -2.742 687 HD12 LEU 89 HD12 LEU 89 0.334 -6.215 -3.547 688 HD13 LEU 89 HD13 LEU 89 1.536 -6.269 -2.257 689 HD21 LEU 89 HD21 LEU 89 -1.468 -4.154 -2.128 690 HD22 LEU 89 HD22 LEU 89 -2.464 -5.287 -1.215 691 HD23 LEU 89 HD23 LEU 89 -2.102 -5.602 -2.913 692 H PHE 90 HN PHE 90 -1.165 -8.562 1.270 693 HA PHE 90 HA PHE 90 -0.122 -6.607 3.004 694 HB2 PHE 90 HB2 PHE 90 -2.375 -7.479 3.282 695 HB3 PHE 90 HB1 PHE 90 -1.746 -9.091 3.604 696 HD1 PHE 90 HD1 PHE 90 -1.495 -5.603 4.925 697 HD2 PHE 90 HD2 PHE 90 -1.544 -9.770 5.790 698 HE1 PHE 90 HE1 PHE 90 -1.445 -5.099 7.331 699 HE2 PHE 90 HE2 PHE 90 -1.492 -9.273 8.197 700 HZ PHE 90 HZ PHE 90 -1.444 -6.936 8.971 701 H ALA 91 HN ALA 91 0.599 -10.034 2.609 702 HA ALA 91 HA ALA 91 2.327 -10.279 4.830 703 HB1 ALA 91 HB1 ALA 91 2.350 -11.819 2.235 704 HB2 ALA 91 HB2 ALA 91 1.403 -12.219 3.668 705 HB3 ALA 91 HB3 ALA 91 3.164 -12.292 3.726 706 H LEU 92 HN LEU 92 2.926 -9.489 1.425 707 HA LEU 92 HA LEU 92 5.728 -9.376 1.592 708 HB2 LEU 92 HB2 LEU 92 4.533 -9.559 -0.523 709 HB3 LEU 92 HB1 LEU 92 3.836 -7.969 -0.290 710 HG LEU 92 HG LEU 92 6.034 -6.936 -0.510 711 HD11 LEU 92 HD11 LEU 92 7.047 -9.743 -0.951 712 HD12 LEU 92 HD12 LEU 92 7.393 -8.722 0.444 713 HD13 LEU 92 HD13 LEU 92 7.983 -8.263 -1.153 714 HD21 LEU 92 HD21 LEU 92 4.700 -7.290 -2.518 715 HD22 LEU 92 HD22 LEU 92 5.425 -8.884 -2.731 716 HD23 LEU 92 HD23 LEU 92 6.423 -7.436 -2.870 717 H VAL 93 HN VAL 93 3.299 -6.757 1.797 718 HA VAL 93 HA VAL 93 5.231 -4.716 2.177 719 HB VAL 93 HB VAL 93 2.918 -4.272 1.402 720 HG11 VAL 93 HG11 VAL 93 1.098 -4.110 3.016 721 HG12 VAL 93 HG12 VAL 93 2.149 -4.765 4.272 722 HG13 VAL 93 HG13 VAL 93 1.703 -5.761 2.886 723 HG21 VAL 93 HG21 VAL 93 2.596 -2.203 2.677 724 HG22 VAL 93 HG22 VAL 93 4.284 -2.452 2.231 725 HG23 VAL 93 HG23 VAL 93 3.750 -2.774 3.881 726 H GLN 94 HN GLN 94 3.622 -6.918 4.340 727 HA GLN 94 HA GLN 94 4.314 -5.688 6.785 728 HB2 GLN 94 HB2 GLN 94 2.649 -7.492 6.576 729 HB3 GLN 94 HB1 GLN 94 3.926 -8.619 6.150 730 HG2 GLN 94 HG2 GLN 94 4.936 -8.297 8.356 731 HG3 GLN 94 HG1 GLN 94 3.627 -7.197 8.783 732 HE21 GLN 94 HE21 GLN 94 1.646 -8.800 7.326 733 HE22 GLN 94 HE22 GLN 94 1.343 -10.181 8.317 734 H VAL 95 HN VAL 95 5.934 -8.099 4.757 735 HA VAL 95 HA VAL 95 8.200 -8.537 6.337 736 HB VAL 95 HB VAL 95 7.922 -8.589 3.324 737 HG11 VAL 95 HG11 VAL 95 10.145 -9.671 5.053 738 HG12 VAL 95 HG12 VAL 95 10.265 -8.338 3.902 739 HG13 VAL 95 HG13 VAL 95 9.952 -9.976 3.327 740 HG21 VAL 95 HG21 VAL 95 6.473 -10.171 4.463 741 HG22 VAL 95 HG22 VAL 95 7.843 -10.790 5.383 742 HG23 VAL 95 HG23 VAL 95 7.778 -11.023 3.636 743 H VAL 96 HN VAL 96 7.533 -6.085 3.880 744 HA VAL 96 HA VAL 96 9.997 -4.839 3.702 745 HB VAL 96 HB VAL 96 7.301 -3.462 3.655 746 HG11 VAL 96 HG11 VAL 96 9.103 -1.862 3.857 747 HG12 VAL 96 HG12 VAL 96 8.450 -1.807 2.219 748 HG13 VAL 96 HG13 VAL 96 9.978 -2.632 2.534 749 HG21 VAL 96 HG21 VAL 96 7.340 -5.291 2.070 750 HG22 VAL 96 HG22 VAL 96 8.886 -4.735 1.427 751 HG23 VAL 96 HG23 VAL 96 7.438 -3.753 1.208 752 H ALA 97 HN ALA 97 7.360 -4.170 5.988 753 HA ALA 97 HA ALA 97 8.832 -2.158 7.391 754 HB1 ALA 97 HB1 ALA 97 6.359 -3.682 8.197 755 HB2 ALA 97 HB2 ALA 97 6.397 -2.148 7.325 756 HB3 ALA 97 HB3 ALA 97 6.980 -2.233 8.988 757 H ASP 98 HN ASP 98 8.049 -5.553 8.020 758 HA ASP 98 HA ASP 98 8.881 -5.694 10.667 759 HB2 ASP 98 HB2 ASP 98 7.531 -7.412 9.547 760 HB3 ASP 98 HB1 ASP 98 8.926 -7.883 8.584 761 H GLU 99 HN GLU 99 10.746 -6.813 7.821 762 HA GLU 99 HA GLU 99 12.969 -7.465 9.495 763 HB2 GLU 99 HB2 GLU 99 12.803 -7.402 6.483 764 HB3 GLU 99 HB1 GLU 99 14.089 -8.141 7.430 765 HG2 GLU 99 HG2 GLU 99 12.260 -9.577 8.473 766 HG3 GLU 99 HG1 GLU 99 11.232 -9.006 7.160 767 H HIS 100 HN HIS 100 12.058 -4.624 7.782 768 HA HIS 100 HA HIS 100 14.793 -3.709 7.495 769 HB2 HIS 100 HB2 HIS 100 12.143 -2.516 6.731 770 HB3 HIS 100 HB1 HIS 100 13.631 -1.581 6.649 771 HD1 HIS 100 HD1 HIS 100 14.532 -1.540 4.354 772 HD2 HIS 100 HD2 HIS 100 12.676 -5.167 5.225 773 HE1 HIS 100 HE1 HIS 100 14.767 -2.945 2.282 774 HE2 HIS 100 HE2 HIS 100 13.553 -5.097 2.789 775 H LEU 101 HN LEU 101 12.055 -3.110 9.612 776 HA LEU 101 HA LEU 101 13.082 -0.744 10.776 777 HB2 LEU 101 HB2 LEU 101 10.892 -2.621 11.352 778 HB3 LEU 101 HB1 LEU 101 11.518 -1.765 12.748 779 HG LEU 101 HG LEU 101 9.565 -0.648 11.706 780 HD11 LEU 101 HD11 LEU 101 11.156 0.652 13.001 781 HD12 LEU 101 HD12 LEU 101 10.534 1.597 11.650 782 HD13 LEU 101 HD13 LEU 101 12.150 0.895 11.565 783 HD21 LEU 101 HD21 LEU 101 11.445 -0.260 9.379 784 HD22 LEU 101 HD22 LEU 101 9.881 0.530 9.572 785 HD23 LEU 101 HD23 LEU 101 9.965 -1.220 9.381 786 H GLU 102 HN GLU 102 13.248 -4.146 11.816 787 HA GLU 102 HA GLU 102 14.883 -3.382 14.085 788 HB2 GLU 102 HB2 GLU 102 14.840 -5.740 14.696 789 HB3 GLU 102 HB1 GLU 102 13.219 -5.147 14.370 790 HG2 GLU 102 HG2 GLU 102 13.253 -6.194 12.185 791 HG3 GLU 102 HG1 GLU 102 14.903 -6.751 12.466 792 H HIS 103 HN HIS 103 15.686 -3.362 11.070 793 HA HIS 103 HA HIS 103 18.110 -4.943 11.091 794 HB2 HIS 103 HB2 HIS 103 16.666 -4.167 9.039 795 HB3 HIS 103 HB1 HIS 103 17.576 -2.673 9.187 796 HD1 HIS 103 HD1 HIS 103 17.917 -4.150 6.617 797 HD2 HIS 103 HD2 HIS 103 20.271 -4.958 9.956 798 HE1 HIS 103 HE1 HIS 103 20.007 -5.228 5.733 799 HE2 HIS 103 HE2 HIS 103 21.476 -5.571 7.746 800 H HIS 104 HN HIS 104 17.077 -2.234 12.563 801 HA HIS 104 HA HIS 104 19.671 -1.547 13.544 802 HB2 HIS 104 HB2 HIS 104 19.352 0.936 12.998 803 HB3 HIS 104 HB1 HIS 104 19.856 -0.094 11.665 804 HD1 HIS 104 HD1 HIS 104 18.423 -0.095 9.615 805 HD2 HIS 104 HD2 HIS 104 16.538 1.697 12.868 806 HE1 HIS 104 HE1 HIS 104 16.311 0.915 8.705 807 HE2 HIS 104 HE2 HIS 104 15.237 2.087 10.657 808 H HIS 105 HN HIS 105 19.462 -0.312 15.532 809 HA HIS 105 HA HIS 105 16.711 -0.531 16.537 810 HB2 HIS 105 HB2 HIS 105 19.363 -0.659 17.956 811 HB3 HIS 105 HB1 HIS 105 17.839 -0.483 18.820 812 HD1 HIS 105 HD1 HIS 105 20.085 -3.023 18.127 813 HD2 HIS 105 HD2 HIS 105 15.977 -2.683 17.573 814 HE1 HIS 105 HE1 HIS 105 19.224 -5.380 17.956 815 HE2 HIS 105 HE2 HIS 105 16.718 -5.152 17.783 816 H HIS 106 HN HIS 106 19.525 1.513 17.341 817 HA HIS 106 HA HIS 106 17.722 3.835 17.260 818 HB2 HIS 106 HB2 HIS 106 19.620 3.124 19.505 819 HB3 HIS 106 HB1 HIS 106 18.938 4.731 19.294 820 HD1 HIS 106 HD1 HIS 106 16.696 5.149 20.336 821 HD2 HIS 106 HD2 HIS 106 17.607 1.095 20.102 822 HE1 HIS 106 HE1 HIS 106 14.888 3.972 21.619 823 HE2 HIS 106 HE2 HIS 106 15.549 1.540 21.610 824 H HIS 107 HN HIS 107 18.731 5.820 16.782 825 HA HIS 107 HA HIS 107 21.400 5.564 15.603 826 HB2 HIS 107 HB2 HIS 107 21.027 7.674 14.517 827 HB3 HIS 107 HB1 HIS 107 19.582 6.705 14.287 828 HD1 HIS 107 HD1 HIS 107 20.813 9.559 16.512 829 HD2 HIS 107 HD2 HIS 107 17.270 7.980 14.981 830 HE1 HIS 107 HE1 HIS 107 19.011 11.194 17.137 831 HE2 HIS 107 HE2 HIS 107 16.907 10.299 16.088 832 H HIS 108 HN HIS 108 23.108 7.011 16.216 833 HA HIS 108 HA HIS 108 22.809 7.946 18.979 834 HB2 HIS 108 HB2 HIS 108 24.767 6.471 18.212 835 HB3 HIS 108 HB1 HIS 108 25.367 7.900 17.379 836 HD1 HIS 108 HD1 HIS 108 24.898 6.439 20.790 837 HD2 HIS 108 HD2 HIS 108 26.424 9.898 19.049 838 HE1 HIS 108 HE1 HIS 108 26.150 7.625 22.615 839 HE2 HIS 108 HE2 HIS 108 27.202 9.620 21.506 840 H1 MET 1 HT1 MET 1 11.293 -2.084 31.224 841 H2 MET 1 HT2 MET 1 11.515 -2.298 32.891 842 H3 MET 1 HT3 MET 1 10.172 -2.990 32.119 843 HA MET 1 HA MET 1 13.013 -3.715 31.708 844 HB2 MET 1 HB2 MET 1 10.694 -5.198 32.964 845 HB3 MET 1 HB1 MET 1 12.239 -5.938 32.571 846 HG2 MET 1 HG2 MET 1 13.359 -4.398 34.113 847 HG3 MET 1 HG1 MET 1 11.801 -3.681 34.518 848 HE1 MET 1 HE1 MET 1 9.898 -4.908 35.858 849 HE2 MET 1 HE2 MET 1 9.972 -6.602 36.346 850 HE3 MET 1 HE3 MET 1 9.867 -6.180 34.636 851 H ALA 2 HN ALA 2 12.895 -6.048 30.623 852 HA ALA 2 HA ALA 2 12.235 -5.669 27.968 853 HB1 ALA 2 HB1 ALA 2 12.604 -8.056 27.683 854 HB2 ALA 2 HB2 ALA 2 12.479 -8.292 29.426 855 HB3 ALA 2 HB3 ALA 2 13.816 -7.356 28.757 856 H GLY 3 HN GLY 3 10.448 -5.863 26.772 857 HA2 GLY 3 HA2 GLY 3 8.364 -7.633 27.077 858 HA3 GLY 3 HA1 GLY 3 7.923 -6.231 28.039 859 H GLN 4 HN GLN 4 6.824 -4.706 27.059 860 HA GLN 4 HA GLN 4 5.780 -3.473 25.485 861 HB2 GLN 4 HB2 GLN 4 8.286 -4.138 24.002 862 HB3 GLN 4 HB1 GLN 4 6.951 -3.390 23.139 863 HG2 GLN 4 HG2 GLN 4 6.985 -1.587 24.896 864 HG3 GLN 4 HG1 GLN 4 8.500 -2.292 25.461 865 HE21 GLN 4 HE21 GLN 4 6.901 -0.668 22.814 866 HE22 GLN 4 HE22 GLN 4 8.347 -0.150 22.013 867 H SER 5 HN SER 5 3.957 -4.722 25.380 868 HA SER 5 HA SER 5 3.774 -6.787 23.337 869 HB2 SER 5 HB2 SER 5 1.335 -6.818 24.160 870 HB3 SER 5 HB1 SER 5 2.576 -7.330 25.304 871 HG SER 5 HG SER 5 0.801 -5.537 25.753 872 H ASP 6 HN ASP 6 3.827 -3.575 23.352 873 HA ASP 6 HA ASP 6 1.719 -3.063 21.405 874 HB2 ASP 6 HB2 ASP 6 2.550 -0.709 21.576 875 HB3 ASP 6 HB1 ASP 6 2.057 -1.387 23.126 876 H ARG 7 HN ARG 7 4.344 -4.661 21.064 877 HA ARG 7 HA ARG 7 6.133 -3.233 19.463 878 HB2 ARG 7 HB2 ARG 7 6.552 -5.401 20.642 879 HB3 ARG 7 HB1 ARG 7 5.615 -6.204 19.391 880 HG2 ARG 7 HG2 ARG 7 7.213 -5.661 17.724 881 HG3 ARG 7 HG1 ARG 7 8.070 -4.566 18.813 882 HD2 ARG 7 HD2 ARG 7 7.858 -7.565 19.028 883 HD3 ARG 7 HD1 ARG 7 9.304 -6.621 18.670 884 HE ARG 7 HE ARG 7 8.008 -6.931 21.273 885 HH11 ARG 7 HH11 ARG 7 10.576 -5.500 19.355 886 HH12 ARG 7 HH12 ARG 7 11.498 -5.013 20.746 887 HH21 ARG 7 HH21 ARG 7 9.224 -6.271 23.096 888 HH22 ARG 7 HH22 ARG 7 10.730 -5.428 22.864 889 H LYS 8 HN LYS 8 3.471 -5.410 18.518 890 HA LYS 8 HA LYS 8 3.944 -5.271 15.757 891 HB2 LYS 8 HB2 LYS 8 1.683 -6.156 15.480 892 HB3 LYS 8 HB1 LYS 8 2.587 -7.020 16.714 893 HG2 LYS 8 HG2 LYS 8 1.412 -5.664 18.434 894 HG3 LYS 8 HG1 LYS 8 0.423 -4.979 17.139 895 HD2 LYS 8 HD2 LYS 8 0.680 -7.918 17.705 896 HD3 LYS 8 HD1 LYS 8 -0.628 -6.905 18.325 897 HE2 LYS 8 HE2 LYS 8 -1.399 -6.442 16.104 898 HE3 LYS 8 HE1 LYS 8 0.019 -7.218 15.397 899 HZ1 LYS 8 HZ1 LYS 8 -2.126 -8.566 16.951 900 HZ2 LYS 8 HZ2 LYS 8 -0.733 -9.322 16.350 901 HZ3 LYS 8 HZ3 LYS 8 -1.877 -8.681 15.276 902 H ALA 9 HN ALA 9 2.320 -3.066 17.885 903 HA ALA 9 HA ALA 9 0.647 -1.774 16.027 904 HB1 ALA 9 HB1 ALA 9 1.918 -0.635 18.512 905 HB2 ALA 9 HB2 ALA 9 0.392 -1.516 18.444 906 HB3 ALA 9 HB3 ALA 9 0.545 0.049 17.643 907 H ALA 10 HN ALA 10 4.032 -1.354 16.844 908 HA ALA 10 HA ALA 10 4.407 1.083 15.427 909 HB1 ALA 10 HB1 ALA 10 5.945 0.374 17.181 910 HB2 ALA 10 HB2 ALA 10 6.799 0.623 15.657 911 HB3 ALA 10 HB3 ALA 10 6.432 -1.013 16.206 912 H LEU 11 HN LEU 11 4.514 -2.304 14.547 913 HA LEU 11 HA LEU 11 5.783 -1.864 12.013 914 HB2 LEU 11 HB2 LEU 11 4.391 -4.216 13.263 915 HB3 LEU 11 HB1 LEU 11 4.861 -4.244 11.575 916 HG LEU 11 HG LEU 11 6.545 -5.381 12.847 917 HD11 LEU 11 HD11 LEU 11 8.527 -4.077 12.293 918 HD12 LEU 11 HD12 LEU 11 7.528 -2.639 12.078 919 HD13 LEU 11 HD13 LEU 11 7.339 -4.015 10.993 920 HD21 LEU 11 HD21 LEU 11 6.765 -2.878 14.512 921 HD22 LEU 11 HD22 LEU 11 7.814 -4.290 14.633 922 HD23 LEU 11 HD23 LEU 11 6.104 -4.424 15.041 923 H LEU 12 HN LEU 12 2.465 -2.274 13.148 924 HA LEU 12 HA LEU 12 1.240 -2.291 10.608 925 HB2 LEU 12 HB2 LEU 12 0.180 -1.441 13.299 926 HB3 LEU 12 HB1 LEU 12 -0.810 -1.550 11.857 927 HG LEU 12 HG LEU 12 0.610 -3.842 13.215 928 HD11 LEU 12 HD11 LEU 12 -1.657 -4.644 13.662 929 HD12 LEU 12 HD12 LEU 12 -2.315 -3.172 12.947 930 HD13 LEU 12 HD13 LEU 12 -1.352 -3.082 14.424 931 HD21 LEU 12 HD21 LEU 12 0.583 -4.120 10.780 932 HD22 LEU 12 HD22 LEU 12 -1.159 -3.843 10.770 933 HD23 LEU 12 HD23 LEU 12 -0.498 -5.267 11.574 934 H ASP 13 HN ASP 13 2.185 0.337 12.767 935 HA ASP 13 HA ASP 13 0.984 2.432 11.284 936 HB2 ASP 13 HB2 ASP 13 1.811 2.692 13.623 937 HB3 ASP 13 HB1 ASP 13 3.462 2.589 13.018 938 H GLN 14 HN GLN 14 4.087 0.804 11.097 939 HA GLN 14 HA GLN 14 5.281 2.557 9.224 940 HB2 GLN 14 HB2 GLN 14 6.550 0.973 10.631 941 HB3 GLN 14 HB1 GLN 14 5.857 -0.366 9.730 942 HG2 GLN 14 HG2 GLN 14 8.131 0.143 9.023 943 HG3 GLN 14 HG1 GLN 14 6.968 0.363 7.718 944 HE21 GLN 14 HE21 GLN 14 6.594 2.393 6.907 945 HE22 GLN 14 HE22 GLN 14 7.595 3.749 7.289 946 H VAL 15 HN VAL 15 3.373 -0.404 8.886 947 HA VAL 15 HA VAL 15 3.518 -0.552 6.056 948 HB VAL 15 HB VAL 15 1.339 -1.580 7.894 949 HG11 VAL 15 HG11 VAL 15 0.797 -3.118 6.063 950 HG12 VAL 15 HG12 VAL 15 2.001 -2.327 5.046 951 HG13 VAL 15 HG13 VAL 15 0.579 -1.434 5.585 952 HG21 VAL 15 HG21 VAL 15 2.503 -3.729 7.734 953 HG22 VAL 15 HG22 VAL 15 3.533 -2.489 8.451 954 HG23 VAL 15 HG23 VAL 15 3.771 -2.968 6.772 955 H ALA 16 HN ALA 16 1.313 1.044 8.303 956 HA ALA 16 HA ALA 16 -0.519 2.020 6.409 957 HB1 ALA 16 HB1 ALA 16 -1.191 3.612 8.118 958 HB2 ALA 16 HB2 ALA 16 0.271 3.263 9.042 959 HB3 ALA 16 HB3 ALA 16 -0.953 2.012 8.823 960 H ARG 17 HN ARG 17 2.525 3.328 7.636 961 HA ARG 17 HA ARG 17 2.410 5.855 6.434 962 HB2 ARG 17 HB2 ARG 17 4.070 5.317 8.136 963 HB3 ARG 17 HB1 ARG 17 4.821 4.140 7.066 964 HG2 ARG 17 HG2 ARG 17 5.312 6.016 5.487 965 HG3 ARG 17 HG1 ARG 17 4.745 7.128 6.735 966 HD2 ARG 17 HD2 ARG 17 7.012 5.160 7.039 967 HD3 ARG 17 HD1 ARG 17 7.196 6.886 6.725 968 HE ARG 17 HE ARG 17 6.034 5.748 9.200 969 HH11 ARG 17 HH11 ARG 17 7.849 8.203 7.488 970 HH12 ARG 17 HH12 ARG 17 8.178 9.147 8.911 971 HH21 ARG 17 HH21 ARG 17 6.494 6.968 11.088 972 HH22 ARG 17 HH22 ARG 17 7.447 8.415 10.960 973 H VAL 18 HN VAL 18 3.932 2.854 5.217 974 HA VAL 18 HA VAL 18 4.766 4.051 2.789 975 HB VAL 18 HB VAL 18 5.179 1.779 1.951 976 HG11 VAL 18 HG11 VAL 18 6.850 1.130 3.611 977 HG12 VAL 18 HG12 VAL 18 6.095 2.201 4.794 978 HG13 VAL 18 HG13 VAL 18 6.847 2.873 3.347 979 HG21 VAL 18 HG21 VAL 18 3.949 0.847 4.546 980 HG22 VAL 18 HG22 VAL 18 4.766 -0.172 3.361 981 HG23 VAL 18 HG23 VAL 18 3.256 0.636 2.937 982 H GLY 19 HN GLY 19 1.825 2.420 3.784 983 HA2 GLY 19 HA2 GLY 19 0.637 2.256 1.209 984 HA3 GLY 19 HA1 GLY 19 -0.220 2.240 2.745 985 H LYS 20 HN LYS 20 0.631 4.729 3.726 986 HA LYS 20 HA LYS 20 -1.175 6.498 2.493 987 HB2 LYS 20 HB2 LYS 20 -0.644 6.818 4.806 988 HB3 LYS 20 HB1 LYS 20 1.072 6.969 4.455 989 HG2 LYS 20 HG2 LYS 20 0.715 9.070 3.352 990 HG3 LYS 20 HG1 LYS 20 -1.032 8.906 3.531 991 HD2 LYS 20 HD2 LYS 20 -0.854 9.093 5.922 992 HD3 LYS 20 HD1 LYS 20 0.910 9.069 5.833 993 HE2 LYS 20 HE2 LYS 20 0.918 11.175 4.645 994 HE3 LYS 20 HE1 LYS 20 -0.845 11.179 4.583 995 HZ1 LYS 20 HZ1 LYS 20 0.714 11.231 7.112 996 HZ2 LYS 20 HZ2 LYS 20 -0.956 11.475 6.921 997 HZ3 LYS 20 HZ3 LYS 20 0.142 12.621 6.327 998 H ALA 21 HN ALA 21 2.370 6.290 2.349 999 HA ALA 21 HA ALA 21 2.730 8.498 0.620 1000 HB1 ALA 21 HB1 ALA 21 4.499 6.078 0.990 1001 HB2 ALA 21 HB2 ALA 21 4.568 7.561 1.943 1002 HB3 ALA 21 HB3 ALA 21 4.973 7.595 0.227 1003 H LEU 22 HN LEU 22 1.963 5.144 0.082 1004 HA LEU 22 HA LEU 22 2.421 5.114 -2.732 1005 HB2 LEU 22 HB2 LEU 22 2.382 3.109 -1.249 1006 HB3 LEU 22 HB1 LEU 22 0.653 3.316 -1.068 1007 HG LEU 22 HG LEU 22 0.511 3.059 -3.607 1008 HD11 LEU 22 HD11 LEU 22 2.352 1.847 -4.657 1009 HD12 LEU 22 HD12 LEU 22 3.297 1.988 -3.173 1010 HD13 LEU 22 HD13 LEU 22 2.873 3.433 -4.090 1011 HD21 LEU 22 HD21 LEU 22 1.455 0.728 -1.943 1012 HD22 LEU 22 HD22 LEU 22 0.561 0.622 -3.459 1013 HD23 LEU 22 HD23 LEU 22 -0.198 1.332 -2.035 1014 H ALA 23 HN ALA 23 -0.204 6.130 -0.706 1015 HA ALA 23 HA ALA 23 -2.228 5.837 -2.727 1016 HB1 ALA 23 HB1 ALA 23 -3.742 6.791 -1.100 1017 HB2 ALA 23 HB2 ALA 23 -2.385 7.253 -0.070 1018 HB3 ALA 23 HB3 ALA 23 -2.742 5.547 -0.349 1019 H ASN 24 HN ASN 24 -0.660 7.235 -4.141 1020 HA ASN 24 HA ASN 24 -2.241 9.459 -4.827 1021 HB2 ASN 24 HB2 ASN 24 -1.051 10.616 -3.021 1022 HB3 ASN 24 HB1 ASN 24 0.496 10.180 -3.743 1023 HD21 ASN 24 HD21 ASN 24 0.964 12.450 -3.822 1024 HD22 ASN 24 HD22 ASN 24 0.289 13.441 -5.074 1025 H GLY 25 HN GLY 25 -2.295 9.131 -6.905 1026 HA2 GLY 25 HA2 GLY 25 -0.529 7.598 -8.388 1027 HA3 GLY 25 HA1 GLY 25 -1.665 8.748 -9.069 1028 H ARG 26 HN ARG 26 -0.448 11.093 -7.857 1029 HA ARG 26 HA ARG 26 1.323 11.772 -9.900 1030 HB2 ARG 26 HB2 ARG 26 0.129 13.041 -7.642 1031 HB3 ARG 26 HB1 ARG 26 1.843 13.434 -7.663 1032 HG2 ARG 26 HG2 ARG 26 0.568 15.088 -8.877 1033 HG3 ARG 26 HG1 ARG 26 1.642 14.209 -9.964 1034 HD2 ARG 26 HD2 ARG 26 -0.322 12.736 -10.521 1035 HD3 ARG 26 HD1 ARG 26 -1.329 13.878 -9.632 1036 HE ARG 26 HE ARG 26 0.284 14.660 -11.981 1037 HH11 ARG 26 HH11 ARG 26 -2.674 14.760 -10.109 1038 HH12 ARG 26 HH12 ARG 26 -3.526 15.757 -11.254 1039 HH21 ARG 26 HH21 ARG 26 -0.816 15.965 -13.500 1040 HH22 ARG 26 HH22 ARG 26 -2.445 16.480 -13.173 1041 H ARG 27 HN ARG 27 1.944 10.577 -6.638 1042 HA ARG 27 HA ARG 27 4.802 10.929 -6.901 1043 HB2 ARG 27 HB2 ARG 27 3.199 9.456 -4.796 1044 HB3 ARG 27 HB1 ARG 27 4.922 9.802 -4.710 1045 HG2 ARG 27 HG2 ARG 27 4.336 12.236 -4.843 1046 HG3 ARG 27 HG1 ARG 27 2.647 11.764 -4.658 1047 HD2 ARG 27 HD2 ARG 27 4.858 11.141 -2.709 1048 HD3 ARG 27 HD1 ARG 27 3.686 12.445 -2.535 1049 HE ARG 27 HE ARG 27 2.884 9.604 -2.619 1050 HH11 ARG 27 HH11 ARG 27 2.683 12.813 -1.233 1051 HH12 ARG 27 HH12 ARG 27 1.579 12.336 0.018 1052 HH21 ARG 27 HH21 ARG 27 1.374 9.004 -1.002 1053 HH22 ARG 27 HH22 ARG 27 0.836 10.188 0.149 1054 H LEU 28 HN LEU 28 2.439 8.531 -7.570 1055 HA LEU 28 HA LEU 28 4.214 6.285 -7.581 1056 HB2 LEU 28 HB2 LEU 28 1.507 6.619 -8.870 1057 HB3 LEU 28 HB1 LEU 28 2.358 5.100 -8.647 1058 HG LEU 28 HG LEU 28 1.300 6.883 -6.453 1059 HD11 LEU 28 HD11 LEU 28 0.433 4.162 -7.408 1060 HD12 LEU 28 HD12 LEU 28 -0.442 5.673 -7.651 1061 HD13 LEU 28 HD13 LEU 28 -0.226 5.030 -6.022 1062 HD21 LEU 28 HD21 LEU 28 2.697 4.217 -6.275 1063 HD22 LEU 28 HD22 LEU 28 2.009 5.126 -4.930 1064 HD23 LEU 28 HD23 LEU 28 3.389 5.772 -5.816 1065 H GLN 29 HN GLN 29 3.356 8.773 -9.813 1066 HA GLN 29 HA GLN 29 4.099 7.551 -12.231 1067 HB2 GLN 29 HB2 GLN 29 4.298 10.455 -11.414 1068 HB3 GLN 29 HB1 GLN 29 4.429 9.862 -13.064 1069 HG2 GLN 29 HG2 GLN 29 2.156 9.061 -12.996 1070 HG3 GLN 29 HG1 GLN 29 2.010 9.531 -11.305 1071 HE21 GLN 29 HE21 GLN 29 3.671 11.451 -13.697 1072 HE22 GLN 29 HE22 GLN 29 2.523 12.741 -13.743 1073 H ILE 30 HN ILE 30 5.963 8.933 -9.644 1074 HA ILE 30 HA ILE 30 8.462 8.993 -11.015 1075 HB ILE 30 HB ILE 30 7.896 8.840 -8.049 1076 HG12 ILE 30 HG12 ILE 30 8.514 11.212 -9.824 1077 HG13 ILE 30 HG11 ILE 30 6.938 10.831 -9.142 1078 HG21 ILE 30 HG21 ILE 30 10.433 9.558 -9.516 1079 HG22 ILE 30 HG22 ILE 30 10.159 8.104 -8.557 1080 HG23 ILE 30 HG23 ILE 30 10.189 9.684 -7.774 1081 HD11 ILE 30 HD11 ILE 30 8.038 12.592 -7.892 1082 HD12 ILE 30 HD12 ILE 30 9.410 11.529 -7.580 1083 HD13 ILE 30 HD13 ILE 30 7.829 11.152 -6.898 1084 H LEU 31 HN LEU 31 6.910 6.706 -8.791 1085 HA LEU 31 HA LEU 31 8.973 4.774 -8.812 1086 HB2 LEU 31 HB2 LEU 31 6.013 4.423 -8.315 1087 HB3 LEU 31 HB1 LEU 31 7.250 3.238 -7.937 1088 HG LEU 31 HG LEU 31 7.013 5.975 -6.684 1089 HD11 LEU 31 HD11 LEU 31 6.391 3.235 -5.596 1090 HD12 LEU 31 HD12 LEU 31 5.231 4.516 -5.954 1091 HD13 LEU 31 HD13 LEU 31 6.407 4.729 -4.657 1092 HD21 LEU 31 HD21 LEU 31 8.887 3.688 -6.097 1093 HD22 LEU 31 HD22 LEU 31 8.751 5.175 -5.157 1094 HD23 LEU 31 HD23 LEU 31 9.322 5.235 -6.825 1095 H ASP 32 HN ASP 32 6.186 5.347 -10.841 1096 HA ASP 32 HA ASP 32 6.200 3.038 -12.411 1097 HB2 ASP 32 HB2 ASP 32 4.421 4.748 -12.448 1098 HB3 ASP 32 HB1 ASP 32 5.526 5.880 -13.216 1099 H LEU 33 HN LEU 33 7.974 6.079 -12.769 1100 HA LEU 33 HA LEU 33 9.372 5.320 -15.122 1101 HB2 LEU 33 HB2 LEU 33 9.084 7.655 -14.493 1102 HB3 LEU 33 HB1 LEU 33 10.011 7.395 -13.027 1103 HG LEU 33 HG LEU 33 12.000 6.872 -14.438 1104 HD11 LEU 33 HD11 LEU 33 10.264 7.858 -16.697 1105 HD12 LEU 33 HD12 LEU 33 10.810 6.197 -16.468 1106 HD13 LEU 33 HD13 LEU 33 11.983 7.475 -16.789 1107 HD21 LEU 33 HD21 LEU 33 12.459 9.187 -15.052 1108 HD22 LEU 33 HD22 LEU 33 11.681 9.083 -13.472 1109 HD23 LEU 33 HD23 LEU 33 10.746 9.574 -14.884 1110 H LEU 34 HN LEU 34 10.119 5.157 -11.669 1111 HA LEU 34 HA LEU 34 12.813 4.338 -11.961 1112 HB2 LEU 34 HB2 LEU 34 10.895 3.935 -9.670 1113 HB3 LEU 34 HB1 LEU 34 12.614 3.610 -9.592 1114 HG LEU 34 HG LEU 34 11.339 6.311 -10.031 1115 HD11 LEU 34 HD11 LEU 34 12.294 6.829 -7.836 1116 HD12 LEU 34 HD12 LEU 34 12.852 5.162 -7.694 1117 HD13 LEU 34 HD13 LEU 34 11.126 5.511 -7.748 1118 HD21 LEU 34 HD21 LEU 34 13.441 6.109 -11.260 1119 HD22 LEU 34 HD22 LEU 34 14.248 5.557 -9.792 1120 HD23 LEU 34 HD23 LEU 34 13.607 7.197 -9.882 1121 H ALA 35 HN ALA 35 9.800 2.616 -12.071 1122 HA ALA 35 HA ALA 35 10.859 -0.008 -11.770 1123 HB1 ALA 35 HB1 ALA 35 8.349 0.880 -13.193 1124 HB2 ALA 35 HB2 ALA 35 8.477 0.495 -11.478 1125 HB3 ALA 35 HB3 ALA 35 8.731 -0.765 -12.687 1126 H GLN 36 HN GLN 36 11.054 2.304 -14.224 1127 HA GLN 36 HA GLN 36 11.729 0.305 -16.268 1128 HB2 GLN 36 HB2 GLN 36 11.326 3.292 -16.543 1129 HB3 GLN 36 HB1 GLN 36 11.585 2.158 -17.861 1130 HG2 GLN 36 HG2 GLN 36 9.477 1.090 -17.429 1131 HG3 GLN 36 HG1 GLN 36 9.230 2.079 -15.991 1132 HE21 GLN 36 HE21 GLN 36 10.285 4.476 -17.264 1133 HE22 GLN 36 HE22 GLN 36 9.062 5.022 -18.360 1134 H GLY 37 HN GLY 37 13.229 1.662 -13.825 1135 HA2 GLY 37 HA2 GLY 37 15.721 1.206 -13.985 1136 HA3 GLY 37 HA1 GLY 37 15.676 2.350 -15.320 1137 H GLU 38 HN GLU 38 17.153 2.482 -12.792 1138 HA GLU 38 HA GLU 38 15.927 4.449 -11.129 1139 HB2 GLU 38 HB2 GLU 38 18.243 4.668 -10.173 1140 HB3 GLU 38 HB1 GLU 38 17.586 3.038 -10.147 1141 HG2 GLU 38 HG2 GLU 38 18.875 2.538 -12.202 1142 HG3 GLU 38 HG1 GLU 38 19.610 4.136 -12.082 1143 H ARG 39 HN ARG 39 16.488 6.690 -10.957 1144 HA ARG 39 HA ARG 39 17.681 7.839 -13.369 1145 HB2 ARG 39 HB2 ARG 39 14.941 7.435 -13.169 1146 HB3 ARG 39 HB1 ARG 39 15.148 9.122 -12.720 1147 HG2 ARG 39 HG2 ARG 39 14.714 8.918 -15.085 1148 HG3 ARG 39 HG1 ARG 39 16.348 9.522 -14.812 1149 HD2 ARG 39 HD2 ARG 39 17.269 7.329 -15.223 1150 HD3 ARG 39 HD1 ARG 39 15.653 6.644 -15.373 1151 HE ARG 39 HE ARG 39 16.672 8.680 -17.253 1152 HH11 ARG 39 HH11 ARG 39 15.166 5.603 -16.575 1153 HH12 ARG 39 HH12 ARG 39 14.793 5.252 -18.234 1154 HH21 ARG 39 HH21 ARG 39 16.195 8.247 -19.453 1155 HH22 ARG 39 HH22 ARG 39 15.396 6.760 -19.883 1156 H ALA 40 HN ALA 40 18.090 10.116 -13.223 1157 HA ALA 40 HA ALA 40 18.513 11.041 -10.499 1158 HB1 ALA 40 HB1 ALA 40 19.241 12.331 -13.127 1159 HB2 ALA 40 HB2 ALA 40 20.302 11.325 -12.141 1160 HB3 ALA 40 HB3 ALA 40 19.744 12.882 -11.528 1161 H VAL 41 HN VAL 41 17.932 13.283 -9.931 1162 HA VAL 41 HA VAL 41 15.217 13.643 -9.846 1163 HB VAL 41 HB VAL 41 17.284 15.841 -9.659 1164 HG11 VAL 41 HG11 VAL 41 15.638 16.969 -8.233 1165 HG12 VAL 41 HG12 VAL 41 14.480 15.679 -8.559 1166 HG13 VAL 41 HG13 VAL 41 15.027 16.724 -9.870 1167 HG21 VAL 41 HG21 VAL 41 16.161 14.027 -7.526 1168 HG22 VAL 41 HG22 VAL 41 17.243 15.392 -7.248 1169 HG23 VAL 41 HG23 VAL 41 17.805 13.993 -8.162 1170 H GLU 42 HN GLU 42 17.471 15.283 -12.077 1171 HA GLU 42 HA GLU 42 15.593 16.963 -13.290 1172 HB2 GLU 42 HB2 GLU 42 18.099 15.772 -14.489 1173 HB3 GLU 42 HB1 GLU 42 17.188 17.108 -15.174 1174 HG2 GLU 42 HG2 GLU 42 17.665 18.443 -13.172 1175 HG3 GLU 42 HG1 GLU 42 18.615 17.105 -12.523 1176 H ALA 43 HN ALA 43 16.674 13.712 -14.198 1177 HA ALA 43 HA ALA 43 15.123 13.582 -16.567 1178 HB1 ALA 43 HB1 ALA 43 17.106 12.189 -16.194 1179 HB2 ALA 43 HB2 ALA 43 15.686 11.222 -16.591 1180 HB3 ALA 43 HB3 ALA 43 16.247 11.319 -14.923 1181 H ILE 44 HN ILE 44 14.573 12.546 -13.233 1182 HA ILE 44 HA ILE 44 12.136 11.203 -13.640 1183 HB ILE 44 HB ILE 44 13.103 12.719 -11.206 1184 HG12 ILE 44 HG12 ILE 44 13.128 9.760 -11.858 1185 HG13 ILE 44 HG11 ILE 44 14.530 10.823 -11.897 1186 HG21 ILE 44 HG21 ILE 44 11.429 11.451 -9.948 1187 HG22 ILE 44 HG22 ILE 44 10.832 10.746 -11.449 1188 HG23 ILE 44 HG23 ILE 44 10.674 12.479 -11.165 1189 HD11 ILE 44 HD11 ILE 44 12.907 10.117 -9.465 1190 HD12 ILE 44 HD12 ILE 44 14.289 11.214 -9.493 1191 HD13 ILE 44 HD13 ILE 44 14.511 9.505 -9.873 1192 H ALA 45 HN ALA 45 12.794 14.583 -12.752 1193 HA ALA 45 HA ALA 45 10.121 15.430 -12.610 1194 HB1 ALA 45 HB1 ALA 45 11.990 16.714 -11.689 1195 HB2 ALA 45 HB2 ALA 45 11.011 17.692 -12.781 1196 HB3 ALA 45 HB3 ALA 45 12.563 17.052 -13.322 1197 H THR 46 HN THR 46 12.443 15.525 -15.288 1198 HA THR 46 HA THR 46 10.781 16.865 -17.111 1199 HB THR 46 HB THR 46 13.016 14.930 -17.741 1200 HG1 THR 46 HG1 THR 46 13.946 16.477 -16.506 1201 HG21 THR 46 HG21 THR 46 13.251 16.246 -19.802 1202 HG22 THR 46 HG22 THR 46 11.852 17.217 -19.340 1203 HG23 THR 46 HG23 THR 46 11.655 15.502 -19.697 1204 H ALA 47 HN ALA 47 11.280 13.396 -16.525 1205 HA ALA 47 HA ALA 47 9.730 12.521 -18.730 1206 HB1 ALA 47 HB1 ALA 47 11.395 11.105 -17.608 1207 HB2 ALA 47 HB2 ALA 47 9.817 10.325 -17.720 1208 HB3 ALA 47 HB3 ALA 47 10.351 11.022 -16.190 1209 H THR 48 HN THR 48 8.923 13.354 -15.426 1210 HA THR 48 HA THR 48 6.215 12.349 -15.717 1211 HB THR 48 HB THR 48 5.931 13.276 -13.383 1212 HG1 THR 48 HG1 THR 48 8.757 13.477 -13.327 1213 HG21 THR 48 HG21 THR 48 7.255 11.507 -12.324 1214 HG22 THR 48 HG22 THR 48 8.170 11.295 -13.817 1215 HG23 THR 48 HG23 THR 48 6.447 10.921 -13.777 1216 H GLY 49 HN GLY 49 7.840 15.138 -16.544 1217 HA2 GLY 49 HA2 GLY 49 7.070 17.136 -17.390 1218 HA3 GLY 49 HA1 GLY 49 5.431 16.532 -17.183 1219 H MET 50 HN MET 50 7.859 16.827 -14.656 1220 HA MET 50 HA MET 50 6.202 18.930 -13.426 1221 HB2 MET 50 HB2 MET 50 7.615 16.650 -12.021 1222 HB3 MET 50 HB1 MET 50 6.804 17.982 -11.209 1223 HG2 MET 50 HG2 MET 50 4.700 17.276 -12.386 1224 HG3 MET 50 HG1 MET 50 5.567 15.831 -12.901 1225 HE1 MET 50 HE1 MET 50 7.392 15.236 -10.294 1226 HE2 MET 50 HE2 MET 50 6.527 14.003 -11.212 1227 HE3 MET 50 HE3 MET 50 6.340 14.090 -9.460 1228 H ASN 51 HN ASN 51 7.449 20.116 -11.677 1229 HA ASN 51 HA ASN 51 9.945 21.030 -12.845 1230 HB2 ASN 51 HB2 ASN 51 8.229 22.627 -12.039 1231 HB3 ASN 51 HB1 ASN 51 8.434 22.004 -10.407 1232 HD21 ASN 51 HD21 ASN 51 8.961 24.082 -9.707 1233 HD22 ASN 51 HD22 ASN 51 10.525 24.769 -9.999 1234 H LEU 52 HN LEU 52 11.903 21.262 -11.575 1235 HA LEU 52 HA LEU 52 12.762 18.844 -10.529 1236 HB2 LEU 52 HB2 LEU 52 13.940 21.586 -10.102 1237 HB3 LEU 52 HB1 LEU 52 14.759 20.079 -9.743 1238 HG LEU 52 HG LEU 52 13.889 20.999 -12.484 1239 HD11 LEU 52 HD11 LEU 52 15.774 22.272 -11.633 1240 HD12 LEU 52 HD12 LEU 52 16.296 21.181 -12.915 1241 HD13 LEU 52 HD13 LEU 52 16.621 20.780 -11.229 1242 HD21 LEU 52 HD21 LEU 52 15.105 19.054 -13.304 1243 HD22 LEU 52 HD22 LEU 52 13.778 18.572 -12.247 1244 HD23 LEU 52 HD23 LEU 52 15.436 18.552 -11.647 1245 H THR 53 HN THR 53 12.066 21.832 -8.695 1246 HA THR 53 HA THR 53 12.563 20.652 -6.176 1247 HB THR 53 HB THR 53 12.604 23.092 -6.566 1248 HG1 THR 53 HG1 THR 53 12.078 21.983 -4.431 1249 HG21 THR 53 HG21 THR 53 10.625 23.280 -8.001 1250 HG22 THR 53 HG22 THR 53 10.526 24.370 -6.618 1251 HG23 THR 53 HG23 THR 53 9.594 22.873 -6.629 1252 H THR 54 HN THR 54 9.746 20.732 -8.202 1253 HA THR 54 HA THR 54 7.913 19.875 -6.185 1254 HB THR 54 HB THR 54 7.662 19.614 -9.190 1255 HG1 THR 54 HG1 THR 54 7.168 21.738 -7.372 1256 HG21 THR 54 HG21 THR 54 5.243 19.590 -8.740 1257 HG22 THR 54 HG22 THR 54 5.572 19.630 -7.006 1258 HG23 THR 54 HG23 THR 54 6.060 18.233 -7.964 1259 H ALA 55 HN ALA 55 9.932 18.296 -8.607 1260 HA ALA 55 HA ALA 55 9.013 15.664 -8.177 1261 HB1 ALA 55 HB1 ALA 55 11.097 14.953 -9.241 1262 HB2 ALA 55 HB2 ALA 55 11.736 16.590 -9.090 1263 HB3 ALA 55 HB3 ALA 55 10.345 16.280 -10.129 1264 H SER 56 HN SER 56 11.682 17.521 -6.727 1265 HA SER 56 HA SER 56 12.608 15.432 -5.070 1266 HB2 SER 56 HB2 SER 56 13.734 17.286 -3.795 1267 HB3 SER 56 HB1 SER 56 14.068 17.279 -5.526 1268 HG SER 56 HG SER 56 13.558 19.345 -5.141 1269 H ALA 57 HN ALA 57 10.136 17.898 -4.621 1270 HA ALA 57 HA ALA 57 9.636 17.480 -1.887 1271 HB1 ALA 57 HB1 ALA 57 7.469 18.507 -2.290 1272 HB2 ALA 57 HB2 ALA 57 7.660 18.274 -4.028 1273 HB3 ALA 57 HB3 ALA 57 8.730 19.378 -3.166 1274 H ASN 58 HN ASN 58 8.262 15.932 -4.767 1275 HA ASN 58 HA ASN 58 6.561 14.161 -3.339 1276 HB2 ASN 58 HB2 ASN 58 7.632 14.179 -6.152 1277 HB3 ASN 58 HB1 ASN 58 6.683 12.826 -5.554 1278 HD21 ASN 58 HD21 ASN 58 6.637 16.169 -6.489 1279 HD22 ASN 58 HD22 ASN 58 4.911 16.332 -6.531 1280 H LEU 59 HN LEU 59 9.854 13.929 -4.572 1281 HA LEU 59 HA LEU 59 10.323 11.231 -3.909 1282 HB2 LEU 59 HB2 LEU 59 12.200 13.580 -4.163 1283 HB3 LEU 59 HB1 LEU 59 12.749 11.934 -3.908 1284 HG LEU 59 HG LEU 59 11.086 12.795 -6.273 1285 HD11 LEU 59 HD11 LEU 59 14.065 12.384 -6.096 1286 HD12 LEU 59 HD12 LEU 59 13.248 13.934 -6.288 1287 HD13 LEU 59 HD13 LEU 59 13.145 12.719 -7.562 1288 HD21 LEU 59 HD21 LEU 59 12.666 10.291 -5.697 1289 HD22 LEU 59 HD22 LEU 59 11.839 10.659 -7.212 1290 HD23 LEU 59 HD23 LEU 59 10.909 10.435 -5.731 1291 H GLN 60 HN GLN 60 10.613 14.213 -2.067 1292 HA GLN 60 HA GLN 60 11.820 13.204 0.241 1293 HB2 GLN 60 HB2 GLN 60 11.591 15.570 -0.067 1294 HB3 GLN 60 HB1 GLN 60 9.840 15.445 -0.153 1295 HG2 GLN 60 HG2 GLN 60 9.812 14.725 2.208 1296 HG3 GLN 60 HG1 GLN 60 11.557 14.966 2.271 1297 HE21 GLN 60 HE21 GLN 60 9.328 16.251 3.726 1298 HE22 GLN 60 HE22 GLN 60 9.518 17.954 3.445 1299 H ALA 61 HN ALA 61 8.406 13.358 -0.684 1300 HA ALA 61 HA ALA 61 7.357 12.275 1.700 1301 HB1 ALA 61 HB1 ALA 61 6.248 12.160 -1.102 1302 HB2 ALA 61 HB2 ALA 61 5.948 13.424 0.092 1303 HB3 ALA 61 HB3 ALA 61 5.349 11.788 0.369 1304 H LEU 62 HN LEU 62 8.495 10.777 -1.291 1305 HA LEU 62 HA LEU 62 7.794 8.122 -0.536 1306 HB2 LEU 62 HB2 LEU 62 9.807 9.108 -2.559 1307 HB3 LEU 62 HB1 LEU 62 9.263 7.448 -2.408 1308 HG LEU 62 HG LEU 62 7.510 9.796 -3.144 1309 HD11 LEU 62 HD11 LEU 62 9.096 9.251 -4.907 1310 HD12 LEU 62 HD12 LEU 62 7.457 8.789 -5.365 1311 HD13 LEU 62 HD13 LEU 62 8.606 7.558 -4.838 1312 HD21 LEU 62 HD21 LEU 62 5.828 8.095 -3.657 1313 HD22 LEU 62 HD22 LEU 62 6.283 8.057 -1.952 1314 HD23 LEU 62 HD23 LEU 62 6.914 6.840 -3.061 1315 H LYS 63 HN LYS 63 10.640 10.131 -0.134 1316 HA LYS 63 HA LYS 63 12.396 8.088 0.757 1317 HB2 LYS 63 HB2 LYS 63 12.969 10.474 -0.024 1318 HB3 LYS 63 HB1 LYS 63 12.549 10.978 1.606 1319 HG2 LYS 63 HG2 LYS 63 14.885 10.728 1.593 1320 HG3 LYS 63 HG1 LYS 63 14.260 9.300 2.424 1321 HD2 LYS 63 HD2 LYS 63 14.470 8.000 0.366 1322 HD3 LYS 63 HD1 LYS 63 15.066 9.426 -0.483 1323 HE2 LYS 63 HE2 LYS 63 16.936 8.036 0.101 1324 HE3 LYS 63 HE1 LYS 63 16.987 9.499 1.080 1325 HZ1 LYS 63 HZ1 LYS 63 15.649 7.133 2.183 1326 HZ2 LYS 63 HZ2 LYS 63 16.514 8.355 2.983 1327 HZ3 LYS 63 HZ3 LYS 63 17.340 7.143 2.128 1328 H SER 64 HN SER 64 10.362 10.448 2.474 1329 HA SER 64 HA SER 64 11.066 9.522 5.061 1330 HB2 SER 64 HB2 SER 64 9.025 10.859 5.769 1331 HB3 SER 64 HB1 SER 64 10.269 11.753 4.894 1332 HG SER 64 HG SER 64 8.997 11.856 3.139 1333 H GLY 65 HN GLY 65 8.573 8.596 2.767 1334 HA2 GLY 65 HA2 GLY 65 7.163 6.882 4.548 1335 HA3 GLY 65 HA1 GLY 65 7.128 6.814 2.790 1336 H GLY 66 HN GLY 66 10.064 6.534 2.626 1337 HA2 GLY 66 HA2 GLY 66 11.723 4.905 3.074 1338 HA3 GLY 66 HA1 GLY 66 10.495 3.902 3.832 1339 H LEU 67 HN LEU 67 10.056 5.397 0.692 1340 HA LEU 67 HA LEU 67 9.773 2.716 -0.442 1341 HB2 LEU 67 HB2 LEU 67 8.917 5.424 -1.454 1342 HB3 LEU 67 HB1 LEU 67 8.771 3.958 -2.400 1343 HG LEU 67 HG LEU 67 6.634 4.358 -1.501 1344 HD11 LEU 67 HD11 LEU 67 6.242 2.459 -0.007 1345 HD12 LEU 67 HD12 LEU 67 7.981 2.308 0.247 1346 HD13 LEU 67 HD13 LEU 67 7.297 2.034 -1.355 1347 HD21 LEU 67 HD21 LEU 67 7.266 5.995 0.201 1348 HD22 LEU 67 HD22 LEU 67 7.902 4.699 1.214 1349 HD23 LEU 67 HD23 LEU 67 6.176 4.770 0.853 1350 H VAL 68 HN VAL 68 11.799 5.556 -0.689 1351 HA VAL 68 HA VAL 68 13.362 4.186 -2.764 1352 HB VAL 68 HB VAL 68 13.760 6.317 -3.939 1353 HG11 VAL 68 HG11 VAL 68 12.049 4.816 -4.781 1354 HG12 VAL 68 HG12 VAL 68 11.577 6.496 -5.033 1355 HG13 VAL 68 HG13 VAL 68 10.850 5.561 -3.724 1356 HG21 VAL 68 HG21 VAL 68 12.312 8.247 -3.498 1357 HG22 VAL 68 HG22 VAL 68 13.342 7.863 -2.117 1358 HG23 VAL 68 HG23 VAL 68 11.636 7.411 -2.101 1359 H GLU 69 HN GLU 69 15.547 4.992 -3.013 1360 HA GLU 69 HA GLU 69 16.593 6.446 -0.668 1361 HB2 GLU 69 HB2 GLU 69 17.871 4.163 -2.187 1362 HB3 GLU 69 HB1 GLU 69 18.750 5.194 -1.067 1363 HG2 GLU 69 HG2 GLU 69 16.414 3.425 -0.386 1364 HG3 GLU 69 HG1 GLU 69 18.106 3.095 -0.030 1365 H ALA 70 HN ALA 70 18.907 7.325 -1.297 1366 HA ALA 70 HA ALA 70 18.734 8.478 -3.997 1367 HB1 ALA 70 HB1 ALA 70 19.347 10.664 -3.111 1368 HB2 ALA 70 HB2 ALA 70 19.317 10.013 -1.472 1369 HB3 ALA 70 HB3 ALA 70 17.829 10.097 -2.415 1370 H ARG 71 HN ARG 71 20.669 9.012 -4.970 1371 HA ARG 71 HA ARG 71 23.143 8.262 -3.552 1372 HB2 ARG 71 HB2 ARG 71 22.487 6.472 -5.128 1373 HB3 ARG 71 HB1 ARG 71 22.451 7.648 -6.434 1374 HG2 ARG 71 HG2 ARG 71 24.900 8.071 -5.937 1375 HG3 ARG 71 HG1 ARG 71 24.837 6.631 -4.918 1376 HD2 ARG 71 HD2 ARG 71 24.254 6.797 -7.872 1377 HD3 ARG 71 HD1 ARG 71 25.644 6.028 -7.107 1378 HE ARG 71 HE ARG 71 23.927 4.487 -6.072 1379 HH11 ARG 71 HH11 ARG 71 23.472 5.999 -9.206 1380 HH12 ARG 71 HH12 ARG 71 22.345 4.791 -9.752 1381 HH21 ARG 71 HH21 ARG 71 22.493 2.890 -6.827 1382 HH22 ARG 71 HH22 ARG 71 21.811 3.035 -8.429 1383 H ARG 72 HN ARG 72 24.707 9.789 -3.659 1384 HA ARG 72 HA ARG 72 24.233 12.109 -5.361 1385 HB2 ARG 72 HB2 ARG 72 26.131 11.606 -3.072 1386 HB3 ARG 72 HB1 ARG 72 26.257 13.032 -4.091 1387 HG2 ARG 72 HG2 ARG 72 25.049 13.747 -2.237 1388 HG3 ARG 72 HG1 ARG 72 23.822 13.476 -3.473 1389 HD2 ARG 72 HD2 ARG 72 23.371 11.253 -2.477 1390 HD3 ARG 72 HD1 ARG 72 24.531 11.620 -1.198 1391 HE ARG 72 HE ARG 72 22.276 13.446 -1.601 1392 HH11 ARG 72 HH11 ARG 72 23.855 11.005 0.372 1393 HH12 ARG 72 HH12 ARG 72 22.830 11.284 1.745 1394 HH21 ARG 72 HH21 ARG 72 20.966 13.836 0.212 1395 HH22 ARG 72 HH22 ARG 72 21.174 12.890 1.656 1396 H GLU 73 HN GLU 73 25.051 12.068 -7.347 1397 HA GLU 73 HA GLU 73 27.735 10.920 -7.710 1398 HB2 GLU 73 HB2 GLU 73 26.161 9.340 -8.651 1399 HB3 GLU 73 HB1 GLU 73 25.355 10.616 -9.553 1400 HG2 GLU 73 HG2 GLU 73 27.293 10.928 -10.942 1401 HG3 GLU 73 HG1 GLU 73 28.215 9.780 -9.974 1402 H GLY 74 HN GLY 74 29.035 12.571 -8.113 1403 HA2 GLY 74 HA2 GLY 74 29.913 14.443 -9.113 1404 HA3 GLY 74 HA1 GLY 74 28.710 14.239 -10.379 1405 H THR 75 HN THR 75 27.205 15.737 -10.551 1406 HA THR 75 HA THR 75 26.878 17.664 -8.352 1407 HB THR 75 HB THR 75 25.963 17.975 -11.218 1408 HG1 THR 75 HG1 THR 75 28.096 17.943 -11.530 1409 HG21 THR 75 HG21 THR 75 24.920 19.498 -9.602 1410 HG22 THR 75 HG22 THR 75 25.997 20.371 -10.693 1411 HG23 THR 75 HG23 THR 75 26.516 20.006 -9.048 1412 H ARG 76 HN ARG 76 25.375 15.066 -9.895 1413 HA ARG 76 HA ARG 76 22.676 16.082 -9.345 1414 HB2 ARG 76 HB2 ARG 76 23.692 14.081 -11.353 1415 HB3 ARG 76 HB1 ARG 76 21.980 14.296 -11.001 1416 HG2 ARG 76 HG2 ARG 76 22.017 16.541 -11.757 1417 HG3 ARG 76 HG1 ARG 76 23.775 16.542 -11.861 1418 HD2 ARG 76 HD2 ARG 76 23.754 15.096 -13.737 1419 HD3 ARG 76 HD1 ARG 76 22.042 14.724 -13.516 1420 HE ARG 76 HE ARG 76 21.474 16.741 -14.491 1421 HH11 ARG 76 HH11 ARG 76 24.959 16.506 -14.161 1422 HH12 ARG 76 HH12 ARG 76 25.260 18.025 -14.959 1423 HH21 ARG 76 HH21 ARG 76 21.854 18.706 -15.516 1424 HH22 ARG 76 HH22 ARG 76 23.481 19.292 -15.726 1425 H GLN 77 HN GLN 77 21.106 14.707 -8.492 1426 HA GLN 77 HA GLN 77 22.215 12.537 -6.852 1427 HB2 GLN 77 HB2 GLN 77 21.307 14.579 -5.671 1428 HB3 GLN 77 HB1 GLN 77 19.722 14.151 -6.295 1429 HG2 GLN 77 HG2 GLN 77 19.637 12.181 -5.011 1430 HG3 GLN 77 HG1 GLN 77 21.357 12.270 -4.624 1431 HE21 GLN 77 HE21 GLN 77 18.185 13.493 -3.896 1432 HE22 GLN 77 HE22 GLN 77 18.624 14.335 -2.449 1433 H TYR 78 HN TYR 78 21.522 10.562 -7.263 1434 HA TYR 78 HA TYR 78 19.310 10.205 -9.150 1435 HB2 TYR 78 HB2 TYR 78 21.547 8.375 -8.270 1436 HB3 TYR 78 HB1 TYR 78 20.213 7.840 -9.283 1437 HD1 TYR 78 HD1 TYR 78 22.926 10.397 -9.151 1438 HD2 TYR 78 HD2 TYR 78 20.380 8.017 -11.593 1439 HE1 TYR 78 HE1 TYR 78 24.153 11.142 -11.147 1440 HE2 TYR 78 HE2 TYR 78 21.601 8.756 -13.595 1441 HH TYR 78 HH TYR 78 24.589 10.337 -13.431 1442 H TYR 79 HN TYR 79 17.656 8.707 -8.761 1443 HA TYR 79 HA TYR 79 17.384 7.847 -5.962 1444 HB2 TYR 79 HB2 TYR 79 15.369 9.177 -7.742 1445 HB3 TYR 79 HB1 TYR 79 14.845 8.117 -6.440 1446 HD1 TYR 79 HD1 TYR 79 16.773 11.205 -7.160 1447 HD2 TYR 79 HD2 TYR 79 14.765 8.882 -4.218 1448 HE1 TYR 79 HE1 TYR 79 16.962 13.069 -5.566 1449 HE2 TYR 79 HE2 TYR 79 14.946 10.737 -2.616 1450 HH TYR 79 HH TYR 79 16.342 12.717 -2.234 1451 H ARG 80 HN ARG 80 16.573 5.869 -5.593 1452 HA ARG 80 HA ARG 80 15.458 4.301 -7.775 1453 HB2 ARG 80 HB2 ARG 80 16.955 2.406 -7.419 1454 HB3 ARG 80 HB1 ARG 80 17.878 3.823 -7.896 1455 HG2 ARG 80 HG2 ARG 80 18.549 4.189 -5.592 1456 HG3 ARG 80 HG1 ARG 80 17.577 2.811 -5.077 1457 HD2 ARG 80 HD2 ARG 80 19.930 2.699 -6.966 1458 HD3 ARG 80 HD1 ARG 80 19.958 2.242 -5.263 1459 HE ARG 80 HE ARG 80 18.175 0.850 -7.144 1460 HH11 ARG 80 HH11 ARG 80 20.834 0.801 -4.870 1461 HH12 ARG 80 HH12 ARG 80 20.917 -0.934 -4.798 1462 HH21 ARG 80 HH21 ARG 80 18.288 -1.455 -7.069 1463 HH22 ARG 80 HH22 ARG 80 19.497 -2.210 -6.067 1464 H ILE 81 HN ILE 81 14.667 2.154 -6.877 1465 HA ILE 81 HA ILE 81 12.978 2.619 -4.685 1466 HB ILE 81 HB ILE 81 13.807 -0.053 -5.845 1467 HG12 ILE 81 HG12 ILE 81 11.487 1.757 -6.563 1468 HG13 ILE 81 HG11 ILE 81 12.926 1.510 -7.544 1469 HG21 ILE 81 HG21 ILE 81 11.356 0.728 -4.266 1470 HG22 ILE 81 HG22 ILE 81 12.706 -0.238 -3.669 1471 HG23 ILE 81 HG23 ILE 81 11.679 -0.860 -4.962 1472 HD11 ILE 81 HD11 ILE 81 12.340 -0.821 -7.859 1473 HD12 ILE 81 HD12 ILE 81 11.018 0.232 -8.368 1474 HD13 ILE 81 HD13 ILE 81 10.926 -0.617 -6.825 1475 H ALA 82 HN ALA 82 13.072 1.998 -2.550 1476 HA ALA 82 HA ALA 82 15.602 2.217 -1.360 1477 HB1 ALA 82 HB1 ALA 82 14.449 1.915 0.757 1478 HB2 ALA 82 HB2 ALA 82 13.016 1.335 -0.095 1479 HB3 ALA 82 HB3 ALA 82 13.552 3.004 -0.303 1480 H GLY 83 HN GLY 83 13.768 -0.605 -2.243 1481 HA2 GLY 83 HA2 GLY 83 15.996 -2.300 -1.741 1482 HA3 GLY 83 HA1 GLY 83 14.765 -2.500 -0.503 1483 H GLU 84 HN GLU 84 15.301 -4.677 -1.827 1484 HA GLU 84 HA GLU 84 14.003 -5.055 -4.301 1485 HB2 GLU 84 HB2 GLU 84 15.805 -6.502 -3.264 1486 HB3 GLU 84 HB1 GLU 84 14.557 -7.175 -2.226 1487 HG2 GLU 84 HG2 GLU 84 15.006 -8.619 -4.124 1488 HG3 GLU 84 HG1 GLU 84 13.356 -7.997 -4.170 1489 H ASP 85 HN ASP 85 12.948 -5.392 -0.971 1490 HA ASP 85 HA ASP 85 10.562 -6.808 -1.429 1491 HB2 ASP 85 HB2 ASP 85 10.785 -4.761 0.757 1492 HB3 ASP 85 HB1 ASP 85 9.990 -6.331 0.787 1493 H VAL 86 HN VAL 86 11.255 -3.335 -1.290 1494 HA VAL 86 HA VAL 86 8.568 -2.493 -1.658 1495 HB VAL 86 HB VAL 86 11.112 -0.991 -2.311 1496 HG11 VAL 86 HG11 VAL 86 8.313 0.033 -1.851 1497 HG12 VAL 86 HG12 VAL 86 9.158 -0.017 -3.399 1498 HG13 VAL 86 HG13 VAL 86 9.749 1.023 -2.103 1499 HG21 VAL 86 HG21 VAL 86 10.774 0.079 -0.111 1500 HG22 VAL 86 HG22 VAL 86 11.094 -1.651 0.013 1501 HG23 VAL 86 HG23 VAL 86 9.450 -1.043 0.203 1502 H ALA 87 HN ALA 87 11.225 -3.215 -3.849 1503 HA ALA 87 HA ALA 87 10.035 -2.330 -6.239 1504 HB1 ALA 87 HB1 ALA 87 12.412 -2.893 -6.067 1505 HB2 ALA 87 HB2 ALA 87 11.633 -3.791 -7.370 1506 HB3 ALA 87 HB3 ALA 87 11.994 -4.591 -5.841 1507 H ARG 88 HN ARG 88 10.008 -5.497 -4.628 1508 HA ARG 88 HA ARG 88 8.369 -6.792 -6.538 1509 HB2 ARG 88 HB2 ARG 88 8.635 -7.412 -3.589 1510 HB3 ARG 88 HB1 ARG 88 7.989 -8.488 -4.819 1511 HG2 ARG 88 HG2 ARG 88 10.830 -7.526 -4.564 1512 HG3 ARG 88 HG1 ARG 88 10.226 -9.157 -4.279 1513 HD2 ARG 88 HD2 ARG 88 10.274 -7.692 -6.914 1514 HD3 ARG 88 HD1 ARG 88 11.321 -9.029 -6.440 1515 HE ARG 88 HE ARG 88 8.575 -9.763 -6.268 1516 HH11 ARG 88 HH11 ARG 88 11.218 -9.305 -8.516 1517 HH12 ARG 88 HH12 ARG 88 10.526 -10.321 -9.741 1518 HH21 ARG 88 HH21 ARG 88 7.666 -11.117 -7.863 1519 HH22 ARG 88 HH22 ARG 88 8.491 -11.345 -9.378 1520 H LEU 89 HN LEU 89 7.687 -4.935 -3.638 1521 HA LEU 89 HA LEU 89 4.962 -5.442 -3.369 1522 HB2 LEU 89 HB2 LEU 89 6.325 -4.266 -1.697 1523 HB3 LEU 89 HB1 LEU 89 6.468 -2.891 -2.775 1524 HG LEU 89 HG LEU 89 3.992 -2.598 -2.640 1525 HD11 LEU 89 HD11 LEU 89 4.204 -4.678 -0.469 1526 HD12 LEU 89 HD12 LEU 89 3.415 -4.895 -2.032 1527 HD13 LEU 89 HD13 LEU 89 2.769 -3.734 -0.870 1528 HD21 LEU 89 HD21 LEU 89 5.514 -2.515 -0.040 1529 HD22 LEU 89 HD22 LEU 89 4.006 -1.662 -0.367 1530 HD23 LEU 89 HD23 LEU 89 5.465 -1.251 -1.268 1531 H PHE 90 HN PHE 90 6.568 -2.784 -5.116 1532 HA PHE 90 HA PHE 90 4.216 -1.601 -6.102 1533 HB2 PHE 90 HB2 PHE 90 6.402 -0.457 -6.039 1534 HB3 PHE 90 HB1 PHE 90 6.996 -1.532 -7.299 1535 HD1 PHE 90 HD2 PHE 90 4.359 0.996 -6.601 1536 HD2 PHE 90 HD1 PHE 90 6.753 -0.954 -9.532 1537 HE1 PHE 90 HE2 PHE 90 3.533 2.563 -8.312 1538 HE2 PHE 90 HE1 PHE 90 5.933 0.608 -11.244 1539 HZ PHE 90 HZ PHE 90 4.323 2.369 -10.638 1540 H ALA 91 HN ALA 91 6.305 -4.119 -7.417 1541 HA ALA 91 HA ALA 91 5.045 -4.279 -9.955 1542 HB1 ALA 91 HB1 ALA 91 7.287 -5.157 -9.570 1543 HB2 ALA 91 HB2 ALA 91 6.215 -6.416 -10.184 1544 HB3 ALA 91 HB3 ALA 91 6.635 -6.372 -8.472 1545 H LEU 92 HN LEU 92 4.632 -6.103 -6.939 1546 HA LEU 92 HA LEU 92 2.744 -7.945 -7.932 1547 HB2 LEU 92 HB2 LEU 92 4.022 -8.306 -5.874 1548 HB3 LEU 92 HB1 LEU 92 3.178 -6.977 -5.106 1549 HG LEU 92 HG LEU 92 1.061 -8.233 -5.281 1550 HD11 LEU 92 HD11 LEU 92 1.569 -9.578 -7.243 1551 HD12 LEU 92 HD12 LEU 92 1.120 -10.608 -5.883 1552 HD13 LEU 92 HD13 LEU 92 2.814 -10.446 -6.344 1553 HD21 LEU 92 HD21 LEU 92 2.399 -8.375 -3.251 1554 HD22 LEU 92 HD22 LEU 92 3.300 -9.732 -3.928 1555 HD23 LEU 92 HD23 LEU 92 1.580 -9.903 -3.573 1556 H VAL 93 HN VAL 93 2.318 -4.896 -6.125 1557 HA VAL 93 HA VAL 93 -0.498 -5.096 -5.990 1558 HB VAL 93 HB VAL 93 0.912 -3.621 -4.526 1559 HG11 VAL 93 HG11 VAL 93 0.907 -1.781 -6.912 1560 HG12 VAL 93 HG12 VAL 93 2.313 -2.611 -6.247 1561 HG13 VAL 93 HG13 VAL 93 1.482 -1.383 -5.293 1562 HG21 VAL 93 HG21 VAL 93 -0.761 -1.839 -4.354 1563 HG22 VAL 93 HG22 VAL 93 -1.506 -3.426 -4.554 1564 HG23 VAL 93 HG23 VAL 93 -1.417 -2.313 -5.921 1565 H GLN 94 HN GLN 94 1.678 -3.867 -8.434 1566 HA GLN 94 HA GLN 94 -0.249 -2.496 -9.989 1567 HB2 GLN 94 HB2 GLN 94 2.162 -2.153 -10.288 1568 HB3 GLN 94 HB1 GLN 94 2.337 -3.810 -10.852 1569 HG2 GLN 94 HG2 GLN 94 0.951 -3.315 -12.789 1570 HG3 GLN 94 HG1 GLN 94 0.718 -1.666 -12.217 1571 HE21 GLN 94 HE21 GLN 94 3.468 -1.411 -11.292 1572 HE22 GLN 94 HE22 GLN 94 4.432 -1.222 -12.712 1573 H VAL 95 HN VAL 95 0.938 -5.824 -9.980 1574 HA VAL 95 HA VAL 95 -0.544 -6.751 -12.192 1575 HB VAL 95 HB VAL 95 0.361 -8.297 -9.749 1576 HG11 VAL 95 HG11 VAL 95 0.131 -10.288 -11.163 1577 HG12 VAL 95 HG12 VAL 95 -0.554 -9.290 -12.446 1578 HG13 VAL 95 HG13 VAL 95 -1.415 -9.476 -10.918 1579 HG21 VAL 95 HG21 VAL 95 2.213 -7.267 -10.941 1580 HG22 VAL 95 HG22 VAL 95 1.638 -7.956 -12.459 1581 HG23 VAL 95 HG23 VAL 95 2.222 -9.015 -11.175 1582 H VAL 96 HN VAL 96 -1.276 -6.667 -8.723 1583 HA VAL 96 HA VAL 96 -3.781 -7.893 -8.791 1584 HB VAL 96 HB VAL 96 -2.854 -5.663 -6.966 1585 HG11 VAL 96 HG11 VAL 96 -4.540 -6.504 -5.393 1586 HG12 VAL 96 HG12 VAL 96 -5.100 -7.648 -6.613 1587 HG13 VAL 96 HG13 VAL 96 -5.274 -5.915 -6.885 1588 HG21 VAL 96 HG21 VAL 96 -1.361 -7.584 -6.903 1589 HG22 VAL 96 HG22 VAL 96 -2.732 -8.658 -6.626 1590 HG23 VAL 96 HG23 VAL 96 -2.285 -7.468 -5.405 1591 H ALA 97 HN ALA 97 -2.885 -4.492 -9.219 1592 HA ALA 97 HA ALA 97 -5.494 -3.473 -9.531 1593 HB1 ALA 97 HB1 ALA 97 -2.886 -2.430 -10.634 1594 HB2 ALA 97 HB2 ALA 97 -3.587 -2.034 -9.065 1595 HB3 ALA 97 HB3 ALA 97 -4.398 -1.527 -10.546 1596 H ASP 98 HN ASP 98 -3.047 -4.357 -11.955 1597 HA ASP 98 HA ASP 98 -4.505 -3.771 -14.250 1598 HB2 ASP 98 HB2 ASP 98 -2.151 -4.180 -14.388 1599 HB3 ASP 98 HB1 ASP 98 -2.333 -5.802 -13.737 1600 H GLU 99 HN GLU 99 -4.269 -6.860 -12.510 1601 HA GLU 99 HA GLU 99 -5.914 -8.345 -14.240 1602 HB2 GLU 99 HB2 GLU 99 -5.070 -8.662 -11.383 1603 HB3 GLU 99 HB1 GLU 99 -6.293 -9.732 -12.054 1604 HG2 GLU 99 HG2 GLU 99 -3.561 -9.339 -13.239 1605 HG3 GLU 99 HG1 GLU 99 -3.979 -10.627 -12.110 1606 H HIS 100 HN HIS 100 -6.755 -6.873 -11.090 1607 HA HIS 100 HA HIS 100 -9.445 -7.838 -11.350 1608 HB2 HIS 100 HB2 HIS 100 -8.142 -6.115 -9.244 1609 HB3 HIS 100 HB1 HIS 100 -9.804 -6.689 -9.155 1610 HD1 HIS 100 HD1 HIS 100 -10.148 -9.279 -8.828 1611 HD2 HIS 100 HD2 HIS 100 -6.201 -7.980 -8.594 1612 HE1 HIS 100 HE1 HIS 100 -8.859 -11.185 -7.797 1613 HE2 HIS 100 HE2 HIS 100 -6.445 -10.441 -7.830 1614 H LEU 101 HN LEU 101 -7.939 -5.133 -12.575 1615 HA LEU 101 HA LEU 101 -10.310 -3.451 -12.521 1616 HB2 LEU 101 HB2 LEU 101 -8.092 -2.413 -12.447 1617 HB3 LEU 101 HB1 LEU 101 -7.675 -3.158 -13.976 1618 HG LEU 101 HG LEU 101 -9.448 -1.815 -15.078 1619 HD11 LEU 101 HD11 LEU 101 -10.433 0.067 -13.892 1620 HD12 LEU 101 HD12 LEU 101 -9.644 -0.447 -12.400 1621 HD13 LEU 101 HD13 LEU 101 -10.884 -1.461 -13.138 1622 HD21 LEU 101 HD21 LEU 101 -7.146 -1.061 -15.112 1623 HD22 LEU 101 HD22 LEU 101 -7.361 -0.259 -13.556 1624 HD23 LEU 101 HD23 LEU 101 -8.235 0.317 -14.976 1625 H GLU 102 HN GLU 102 -8.803 -5.830 -14.522 1626 HA GLU 102 HA GLU 102 -10.248 -5.065 -16.911 1627 HB2 GLU 102 HB2 GLU 102 -8.033 -5.823 -17.289 1628 HB3 GLU 102 HB1 GLU 102 -8.265 -7.244 -16.283 1629 HG2 GLU 102 HG2 GLU 102 -9.991 -6.975 -18.676 1630 HG3 GLU 102 HG1 GLU 102 -8.286 -7.332 -18.937 1631 H HIS 103 HN HIS 103 -10.284 -7.705 -14.562 1632 HA HIS 103 HA HIS 103 -11.877 -9.448 -16.025 1633 HB2 HIS 103 HB2 HIS 103 -11.392 -9.191 -13.076 1634 HB3 HIS 103 HB1 HIS 103 -12.478 -10.420 -13.720 1635 HD1 HIS 103 HD1 HIS 103 -11.425 -12.485 -14.758 1636 HD2 HIS 103 HD2 HIS 103 -8.657 -9.510 -13.873 1637 HE1 HIS 103 HE1 HIS 103 -9.158 -13.534 -15.102 1638 HE2 HIS 103 HE2 HIS 103 -7.495 -11.740 -14.465 1639 H HIS 104 HN HIS 104 -13.900 -9.732 -16.397 1640 HA HIS 104 HA HIS 104 -16.143 -9.493 -16.496 1641 HB2 HIS 104 HB2 HIS 104 -15.854 -8.967 -13.893 1642 HB3 HIS 104 HB1 HIS 104 -16.365 -7.368 -14.428 1643 HD1 HIS 104 HD1 HIS 104 -18.172 -9.099 -12.590 1644 HD2 HIS 104 HD2 HIS 104 -18.445 -8.989 -16.743 1645 HE1 HIS 104 HE1 HIS 104 -20.497 -9.876 -13.144 1646 HE2 HIS 104 HE2 HIS 104 -20.575 -9.976 -15.659 1647 H HIS 105 HN HIS 105 -14.254 -6.573 -16.096 1648 HA HIS 105 HA HIS 105 -13.988 -4.708 -17.294 1649 HB2 HIS 105 HB2 HIS 105 -14.019 -4.890 -19.735 1650 HB3 HIS 105 HB1 HIS 105 -13.215 -6.252 -18.974 1651 HD1 HIS 105 HD1 HIS 105 -13.885 -8.483 -19.820 1652 HD2 HIS 105 HD2 HIS 105 -16.771 -5.589 -20.582 1653 HE1 HIS 105 HE1 HIS 105 -15.670 -9.640 -21.164 1654 HE2 HIS 105 HE2 HIS 105 -17.504 -7.926 -21.396 1655 H HIS 106 HN HIS 106 -17.116 -5.604 -16.769 1656 HA HIS 106 HA HIS 106 -18.006 -2.962 -17.596 1657 HB2 HIS 106 HB2 HIS 106 -19.148 -5.512 -18.687 1658 HB3 HIS 106 HB1 HIS 106 -20.199 -4.124 -18.444 1659 HD1 HIS 106 HD1 HIS 106 -19.069 -5.576 -21.177 1660 HD2 HIS 106 HD2 HIS 106 -18.166 -1.810 -19.655 1661 HE1 HIS 106 HE1 HIS 106 -18.310 -4.209 -23.150 1662 HE2 HIS 106 HE2 HIS 106 -17.890 -1.900 -22.231 1663 H HIS 107 HN HIS 107 -19.639 -2.134 -16.380 1664 HA HIS 107 HA HIS 107 -20.797 -3.891 -14.316 1665 HB2 HIS 107 HB2 HIS 107 -19.218 -2.315 -13.290 1666 HB3 HIS 107 HB1 HIS 107 -20.045 -0.963 -14.056 1667 HD1 HIS 107 HD1 HIS 107 -22.055 -0.008 -12.875 1668 HD2 HIS 107 HD2 HIS 107 -20.719 -3.563 -11.175 1669 HE1 HIS 107 HE1 HIS 107 -23.361 -0.273 -10.744 1670 HE2 HIS 107 HE2 HIS 107 -22.601 -2.468 -9.764 1671 H HIS 108 HN HIS 108 -22.996 -3.822 -14.120 1672 HA HIS 108 HA HIS 108 -24.417 -1.735 -15.604 1673 HB2 HIS 108 HB2 HIS 108 -26.063 -3.488 -16.382 1674 HB3 HIS 108 HB1 HIS 108 -24.477 -3.556 -17.136 1675 HD1 HIS 108 HD1 HIS 108 -26.818 -5.507 -15.005 1676 HD2 HIS 108 HD2 HIS 108 -22.917 -5.821 -16.423 1677 HE1 HIS 108 HE1 HIS 108 -26.147 -7.902 -14.635 1678 HE2 HIS 108 HE2 HIS 108 -23.728 -8.022 -15.322