*HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 01-APR-08 2K2E *TITLE SOLUTION NMR STRUCTURE OF BORDETELLA PERTUSSIS PROTEIN *TITLE 2 BP2786, A MTH938-LIKE DOMAIN. NORTHEAST STRUCTURAL *TITLE 3 GENOMICS CONSORTIUM TARGET BER31 *COMPND MOL_ID: 1; *COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN BP2786; *COMPND 3 CHAIN: A; *COMPND 4 ENGINEERED: YES *SOURCE MOL_ID: 1; *SOURCE 2 ORGANISM_SCIENTIFIC: BORDETELLA PERTUSSIS TOHAMA I; *SOURCE 3 ORGANISM_COMMON: BACTERIA; *SOURCE 4 STRAIN: TOHAMA I / NCTC 13251; *SOURCE 5 ATCC: BAA-589; *SOURCE 6 GENE: BP2786; *SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; *SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; *SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET21 *KEYWDS MTH938-LIKE FOLD, COG03737, DUF498, STRUCTURAL GENOMICS, *KEYWDS 2 UNKNOWN FUNCTION, PSI-2, PROTEIN STRUCTURE INITIATIVE, *KEYWDS 3 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG *EXPDTA NMR, 20 STRUCTURES *AUTHOR J.R.CORT, C.K.HO, C.NWOSU, M.MAGLAQUI, R.XIAO, J.LIU, *AUTHOR 2 M.C.BARAN, G.SWAPNA, T.B.ACTON, B.ROST, G.T.MONTELIONE, *AUTHOR 3 M.A.KENNEDY, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG) *REVDAT 1 22-APR-08 2K2E 0 remarks xplor NOE restraints remarks Ni-Ni+1 assign (resid 15 and name HN )(resid 16 and name HN ) 1.8 0.0 1.7 assign (resid 18 and name HN )(resid 19 and name HN ) 1.8 0.0 3.2 assign (resid 19 and name HN )(resid 20 and name HN ) 1.8 0.0 3.2 assign (resid 20 and name HN )(resid 21 and name HN ) 1.8 0.0 3.2 assign (resid 25 and name HN )(resid 26 and name HN ) 1.8 0.0 3.2 assign (resid 30 and name HN )(resid 31 and name HN ) 1.8 0.0 3.2 assign (resid 31 and name HN )(resid 32 and name HN ) 1.8 0.0 3.2 assign (resid 32 and name HN )(resid 33 and name HN ) 1.8 0.0 3.2 assign (resid 38 and name HN )(resid 39 and name HN ) 1.8 0.0 3.2 assign (resid 42 and name HN )(resid 43 and name HN ) 1.8 0.0 3.2 assign (resid 47 and name HN )(resid 48 and name HN ) 1.8 0.0 1.4 assign (resid 50 and name HN )(resid 51 and name HN ) 1.8 0.0 1.7 assign (resid 51 and name HN )(resid 52 and name HN ) 1.8 0.0 1.4 assign (resid 54 and name HN )(resid 55 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HN )(resid 56 and name HN ) 1.8 0.0 3.2 assign (resid 56 and name HN )(resid 57 and name HN ) 1.8 0.0 3.2 assign (resid 57 and name HN )(resid 58 and name HN ) 1.8 0.0 1.7 assign (resid 58 and name HN )(resid 59 and name HN ) 1.8 0.0 3.2 assign (resid 59 and name HN )(resid 60 and name HN ) 1.8 0.0 1.7 assign (resid 60 and name HN )(resid 61 and name HN ) 1.8 0.0 3.2 assign (resid 62 and name HN )(resid 63 and name HN ) 1.8 0.0 1.7 assign (resid 63 and name HN )(resid 64 and name HN ) 1.8 0.0 1.7 assign (resid 86 and name HN )(resid 87 and name HN ) 1.8 0.0 1.7 assign (resid 87 and name HN )(resid 88 and name HN ) 1.8 0.0 1.7 assign (resid 90 and name HN )(resid 91 and name HN ) 1.8 0.0 1.7 assign (resid 96 and name HN )(resid 97 and name HN ) 1.8 0.0 3.2 assign (resid 98 and name HN )(resid 99 and name HN ) 1.8 0.0 3.2 assign (resid 106 and name HN )(resid 107 and name HN ) 1.8 0.0 1.4 assign (resid 107 and name HN )(resid 108 and name HN ) 1.8 0.0 1.4 assign (resid 108 and name HN )(resid 109 and name HN ) 1.8 0.0 1.4 assign (resid 111 and name HN )(resid 112 and name HN ) 1.8 0.0 1.4 assign (resid 112 and name HN )(resid 113 and name HN ) 1.8 0.0 1.4 assign (resid 113 and name HN )(resid 114 and name HN ) 1.8 0.0 1.4 assign (resid 114 and name HN )(resid 115 and name HN ) 1.8 0.0 1.4 assign (resid 115 and name HN )(resid 116 and name HN ) 1.8 0.0 1.7 assign (resid 123 and name HN )(resid 124 and name HN ) 1.8 0.0 3.2 assign (resid 124 and name HN )(resid 125 and name HN ) 1.8 0.0 1.4 assign (resid 125 and name HN )(resid 126 and name HN ) 1.8 0.0 1.4 assign (resid 126 and name HN )(resid 127 and name HN ) 1.8 0.0 1.4 assign (resid 127 and name HN )(resid 128 and name HN ) 1.8 0.0 1.4 assign (resid 128 and name HN )(resid 129 and name HN ) 1.8 0.0 1.4 assign (resid 129 and name HN )(resid 130 and name HN ) 1.8 0.0 1.4 assign (resid 130 and name HN )(resid 131 and name HN ) 1.8 0.0 2.2 assign (resid 131 and name HN )(resid 132 and name HN ) 1.8 0.0 2.2 assign (resid 132 and name HN )(resid 133 and name HN ) 1.8 0.0 1.4 assign (resid 133 and name HN )(resid 134 and name HN ) 1.8 0.0 1.4 assign (resid 134 and name HN )(resid 135 and name HN ) 1.8 0.0 1.4 assign (resid 136 and name HN )(resid 137 and name HN ) 1.8 0.0 1.4 assign (resid 137 and name HN )(resid 138 and name HN ) 1.8 0.0 1.4 remarks Ni-Ni+2 assign (resid 113 and name HN )(resid 115 and name HN ) 1.8 0.0 3.2 assign (resid 114 and name HN )(resid 116 and name HN ) 1.8 0.0 3.2 remarks aiNi+1 assign (resid 11 and name HA )(resid 12 and name HN ) 1.8 0.0 1.7 assign (resid 12 and name HA )(resid 13 and name HN ) 1.8 0.0 1.7 assign (resid 13 and name HA )(resid 14 and name HN ) 1.8 0.0 1.7 assign (resid 14 and name HA )(resid 15 and name HN ) 1.8 0.0 1.7 assign (resid 16 and name HA )(resid 17 and name HN ) 1.8 0.0 0.9 assign (resid 19 and name HA )(resid 20 and name HN ) 1.8 0.0 1.7 assign (resid 22 and name HA )(resid 23 and name HN ) 1.8 0.0 0.9 assign (resid 23 and name HA )(resid 24 and name HN ) 1.8 0.0 1.7 assign (resid 24 and name HA )(resid 25 and name HN ) 1.8 0.0 1.7 assign (resid 27 and name HA )(resid 28 and name HN ) 1.8 0.0 0.9 assign (resid 28 and name HA )(resid 29 and name HN ) 1.8 0.0 0.9 assign (resid 29 and name HA )(resid 30 and name HN ) 1.8 0.0 0.9 assign (resid 31 and name HA )(resid 32 and name HN ) 1.8 0.0 1.7 assign (resid 32 and name HA )(resid 33 and name HN ) 1.8 0.0 0.9 assign (resid 33 and name HA )(resid 34 and name HN ) 1.8 0.0 0.9 assign (resid 34 and name HA )(resid 35 and name HN ) 1.8 0.0 0.9 assign (resid 35 and name HA )(resid 36 and name HN ) 1.8 0.0 0.9 assign (resid 38 and name HA )(resid 39 and name HN ) 1.8 0.0 1.2 assign (resid 40 and name HA )(resid 41 and name HN ) 1.8 0.0 1.1 assign (resid 41 and name HA )(resid 42 and name HN ) 1.8 0.0 1.7 assign (resid 45 and name HA )(resid 46 and name HN ) 1.8 0.0 1.7 assign (resid 46 and name HA )(resid 47 and name HN ) 1.8 0.0 0.9 assign (resid 52 and name HA )(resid 53 and name HN ) 1.8 0.0 0.9 assign (resid 87 and name HA )(resid 88 and name HN ) 1.8 0.0 1.7 assign (resid 89 and name HA )(resid 90 and name HN ) 1.8 0.0 1.7 assign (resid 91 and name HA )(resid 92 and name HN ) 1.8 0.0 0.9 assign (resid 93 and name HA )(resid 94 and name HN ) 1.8 0.0 0.9 assign (resid 94 and name HA )(resid 95 and name HN ) 1.8 0.0 0.9 assign (resid 99 and name HA )(resid 100 and name HN ) 1.8 0.0 1.7 assign (resid 100 and name HA )(resid 101 and name HN ) 1.8 0.0 0.9 assign (resid 101 and name HA )(resid 102 and name HN ) 1.8 0.0 1.7 assign (resid 102 and name HA )(resid 103 and name HN ) 1.8 0.0 0.9 assign (resid 103 and name HA )(resid 104 and name HN ) 1.8 0.0 1.7 assign (resid 116 and name HA )(resid 117 and name HN ) 1.8 0.0 1.7 assign (resid 117 and name HA1 )(resid 118 and name HN ) 1.8 0.0 1.7 assign (resid 117 and name HA2 )(resid 118 and name HN ) 1.8 0.0 1.7 assign (resid 118 and name HA )(resid 119 and name HN ) 1.8 0.0 0.9 assign (resid 119 and name HA )(resid 120 and name HN ) 1.8 0.0 1.1 assign (resid 120 and name HA )(resid 121 and name HN ) 1.8 0.0 0.9 assign (resid 121 and name HA )(resid 122 and name HN ) 1.8 0.0 1.7 assign (resid 122 and name HA )(resid 123 and name HN ) 1.8 0.0 1.7 assign (resid 136 and name HA )(resid 137 and name HN ) 1.8 0.0 1.7 assign (resid 138 and name HA )(resid 139 and name HN ) 1.8 0.0 0.9 assign (resid 139 and name HA )(resid 140 and name HN ) 1.8 0.0 0.9 assign (resid 140 and name HA )(resid 141 and name HN ) 1.8 0.0 1.7 assign (resid 141 and name HA )(resid 142 and name HN ) 1.8 0.0 1.7 assign (resid 142 and name HA )(resid 143 and name HN ) 1.8 0.0 1.7 assign (resid 146 and name HA )(resid 147 and name HN ) 1.8 0.0 1.7 assign (resid 147 and name HA )(resid 148 and name HN ) 1.8 0.0 1.7 remarks aiNi+2 assign (resid 19 and name HA )(resid 21 and name HN ) 1.8 0.0 3.2 assign (resid 29 and name HA )(resid 31 and name HN ) 1.8 0.0 3.2 assign (resid 46 and name HA )(resid 48 and name HN ) 1.8 0.0 3.2 assign (resid 53 and name HA )(resid 55 and name HN ) 1.8 0.0 3.2 assign (resid 86 and name HA )(resid 88 and name HN ) 1.8 0.0 3.2 assign (resid 97 and name HA# )(resid 99 and name HN ) 1.8 0.0 3.2 assign (resid 147 and name HA )(resid 149 and name HN ) 1.8 0.0 3.2 remarks aiNi+3 assign (resid 49 and name HA )(resid 52 and name HN ) 1.8 0.0 3.2 assign (resid 54 and name HA )(resid 57 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HA )(resid 58 and name HN ) 1.8 0.0 3.2 assign (resid 59 and name HA )(resid 62 and name HN ) 1.8 0.0 3.2 assign (resid 105 and name HA )(resid 108 and name HN ) 1.8 0.0 3.2 assign (resid 109 and name HA )(resid 112 and name HN ) 1.8 0.0 3.2 assign (resid 110 and name HA )(resid 113 and name HN ) 1.8 0.0 3.2 assign (resid 111 and name HA )(resid 114 and name HN ) 1.8 0.0 1.7 assign (resid 125 and name HA )(resid 128 and name HN ) 1.8 0.0 3.2 assign (resid 126 and name HA )(resid 129 and name HN ) 1.8 0.0 3.2 assign (resid 127 and name HA )(resid 130 and name HN ) 1.8 0.0 3.2 assign (resid 128 and name HA )(resid 131 and name HN ) 1.8 0.0 3.2 assign (resid 133 and name HA )(resid 136 and name HN ) 1.8 0.0 3.2 assign (resid 134 and name HA )(resid 137 and name HN ) 1.8 0.0 3.2 remarks aiNi+4 assign (resid 54 and name HA )(resid 58 and name HN ) 1.8 0.0 3.2 assign (resid 112 and name HA )(resid 116 and name HN ) 1.8 0.0 3.2 assign (resid 125 and name HA )(resid 129 and name HN ) 1.8 0.0 3.2 assign (resid 126 and name HA )(resid 130 and name HN ) 1.8 0.0 3.2 assign (resid 127 and name HA )(resid 131 and name HN ) 1.8 0.0 3.2 assign (resid 129 and name HA )(resid 133 and name HN ) 1.8 0.0 3.2 assign (resid 134 and name HA )(resid 138 and name HN ) 1.8 0.0 3.2 remarks biNi+1 assign (resid 11 and name HB1 )(resid 12 and name HN ) 1.8 0.0 3.2 assign (resid 11 and name HB2 )(resid 12 and name HN ) 1.8 0.0 3.2 assign (resid 13 and name HB )(resid 14 and name HN ) 1.8 0.0 3.2 assign (resid 15 and name HB )(resid 16 and name HN ) 1.8 0.0 3.2 assign (resid 21 and name HB1 )(resid 22 and name HN ) 1.8 0.0 3.2 assign (resid 21 and name HB2 )(resid 22 and name HN ) 1.8 0.0 3.2 assign (resid 22 and name HB )(resid 23 and name HN ) 1.8 0.0 3.2 assign (resid 23 and name HB1 )(resid 24 and name HN ) 1.8 0.0 3.2 assign (resid 23 and name HB2 )(resid 24 and name HN ) 1.8 0.0 3.2 assign (resid 31 and name HB1 )(resid 32 and name HN ) 1.8 0.0 3.2 assign (resid 31 and name HB2 )(resid 32 and name HN ) 1.8 0.0 3.2 assign (resid 33 and name HB )(resid 34 and name HN ) 1.8 0.0 3.2 assign (resid 35 and name HB1 )(resid 36 and name HN ) 1.8 0.0 3.2 assign (resid 35 and name HB2 )(resid 36 and name HN ) 1.8 0.0 3.2 assign (resid 38 and name HB1 )(resid 39 and name HN ) 1.8 0.0 3.2 assign (resid 38 and name HB2 )(resid 39 and name HN ) 1.8 0.0 3.2 assign (resid 40 and name HB1 )(resid 41 and name HN ) 1.8 0.0 3.2 assign (resid 40 and name HB2 )(resid 41 and name HN ) 1.8 0.0 3.2 assign (resid 46 and name HB )(resid 47 and name HN ) 1.8 0.0 3.2 assign (resid 47 and name HB1 )(resid 48 and name HN ) 1.8 0.0 3.2 assign (resid 47 and name HB2 )(resid 48 and name HN ) 1.8 0.0 3.2 assign (resid 49 and name HB1 )(resid 50 and name HN ) 1.8 0.0 3.2 assign (resid 49 and name HB2 )(resid 50 and name HN ) 1.8 0.0 3.2 assign (resid 52 and name HB )(resid 53 and name HN ) 1.8 0.0 3.2 assign (resid 53 and name HB )(resid 54 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HB1 )(resid 56 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HB2 )(resid 56 and name HN ) 1.8 0.0 3.2 assign (resid 58 and name HB1 )(resid 59 and name HN ) 1.8 0.0 3.2 assign (resid 58 and name HB2 )(resid 59 and name HN ) 1.8 0.0 3.2 assign (resid 59 and name HB1 )(resid 60 and name HN ) 1.8 0.0 3.2 assign (resid 59 and name HB2 )(resid 60 and name HN ) 1.8 0.0 3.2 assign (resid 63 and name HB1 )(resid 64 and name HN ) 1.8 0.0 3.2 assign (resid 63 and name HB2 )(resid 64 and name HN ) 1.8 0.0 3.2 assign (resid 90 and name HB# )(resid 91 and name HN ) 1.8 0.0 2.7 assign (resid 91 and name HB )(resid 92 and name HN ) 1.8 0.0 3.2 assign (resid 92 and name HB1 )(resid 93 and name HN ) 1.8 0.0 3.2 assign (resid 92 and name HB2 )(resid 93 and name HN ) 1.8 0.0 3.2 assign (resid 93 and name HB1 )(resid 94 and name HN ) 1.8 0.0 3.2 assign (resid 93 and name HB2 )(resid 94 and name HN ) 1.8 0.0 3.2 assign (resid 98 and name HB1 )(resid 99 and name HN ) 1.8 0.0 3.2 assign (resid 98 and name HB2 )(resid 99 and name HN ) 1.8 0.0 3.2 assign (resid 99 and name HB1 )(resid 100 and name HN ) 1.8 0.0 3.2 assign (resid 99 and name HB2 )(resid 100 and name HN ) 1.8 0.0 3.2 assign (resid 103 and name HB1 )(resid 104 and name HN ) 1.8 0.0 3.2 assign (resid 103 and name HB2 )(resid 104 and name HN ) 1.8 0.0 3.2 assign (resid 105 and name HB1 )(resid 106 and name HN ) 1.8 0.0 3.2 assign (resid 105 and name HB2 )(resid 106 and name HN ) 1.8 0.0 3.2 assign (resid 106 and name HB1 )(resid 107 and name HN ) 1.8 0.0 3.2 assign (resid 106 and name HB2 )(resid 107 and name HN ) 1.8 0.0 3.2 assign (resid 112 and name HB# )(resid 113 and name HN ) 1.8 0.0 2.2 assign (resid 116 and name HB )(resid 117 and name HN ) 1.8 0.0 3.2 assign (resid 118 and name HB )(resid 119 and name HN ) 1.8 0.0 3.2 assign (resid 119 and name HB1 )(resid 120 and name HN ) 1.8 0.0 3.2 assign (resid 119 and name HB2 )(resid 120 and name HN ) 1.8 0.0 3.2 assign (resid 122 and name HB1 )(resid 123 and name HN ) 1.8 0.0 3.2 assign (resid 122 and name HB2 )(resid 123 and name HN ) 1.8 0.0 3.2 assign (resid 123 and name HB )(resid 124 and name HN ) 1.8 0.0 3.2 assign (resid 124 and name HB# )(resid 125 and name HN ) 1.8 0.0 2.7 assign (resid 128 and name HB1 )(resid 129 and name HN ) 1.8 0.0 3.2 assign (resid 128 and name HB2 )(resid 129 and name HN ) 1.8 0.0 3.2 assign (resid 129 and name HB )(resid 130 and name HN ) 1.8 0.0 3.2 assign (resid 130 and name HB1 )(resid 131 and name HN ) 1.8 0.0 3.2 assign (resid 130 and name HB2 )(resid 131 and name HN ) 1.8 0.0 3.2 assign (resid 132 and name HB )(resid 133 and name HN ) 1.8 0.0 3.2 assign (resid 140 and name HB )(resid 141 and name HN ) 1.8 0.0 3.2 assign (resid 141 and name HB )(resid 142 and name HN ) 1.8 0.0 3.2 assign (resid 142 and name HB )(resid 143 and name HN ) 1.8 0.0 3.2 assign (resid 147 and name HB# )(resid 148 and name HN ) 1.8 0.0 3.2 remarks (gdez)i-Ni+1 assign (resid 11 and name HD2# )(resid 12 and name HN ) 1.8 0.0 3.7 assign (resid 13 and name HG2# )(resid 14 and name HN ) 1.8 0.0 3.7 assign (resid 14 and name HG1# )(resid 15 and name HN ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 15 and name HN ) 1.8 0.0 3.7 assign (resid 17 and name HD# )(resid 18 and name HN ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 23 and name HN ) 1.8 0.0 3.7 assign (resid 23 and name HG1 )(resid 24 and name HN ) 1.8 0.0 3.2 assign (resid 23 and name HG2 )(resid 24 and name HN ) 1.8 0.0 3.2 assign (resid 24 and name HG1# )(resid 25 and name HN ) 1.8 0.0 3.7 assign (resid 27 and name HG1# )(resid 28 and name HN ) 1.8 0.0 3.7 assign (resid 27 and name HG2# )(resid 28 and name HN ) 1.8 0.0 3.7 assign (resid 29 and name HD# )(resid 30 and name HN ) 1.8 0.0 3.7 assign (resid 33 and name HD1# )(resid 34 and name HN ) 1.8 0.0 3.7 assign (resid 33 and name HG2# )(resid 34 and name HN ) 1.8 0.0 3.7 assign (resid 37 and name HD# )(resid 38 and name HN ) 1.8 0.0 3.7 assign (resid 38 and name HG# )(resid 39 and name HN ) 1.8 0.0 3.7 assign (resid 41 and name HG1# )(resid 42 and name HN ) 1.8 0.0 3.7 assign (resid 41 and name HG2# )(resid 42 and name HN ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 47 and name HN ) 1.8 0.0 3.7 assign (resid 46 and name HG2# )(resid 47 and name HN ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 53 and name HN ) 1.8 0.0 3.7 assign (resid 53 and name HG2# )(resid 54 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HG )(resid 56 and name HN ) 1.8 0.0 3.2 assign (resid 56 and name HD1# )(resid 57 and name HN ) 1.8 0.0 3.7 assign (resid 63 and name HD1# )(resid 64 and name HN ) 1.8 0.0 3.7 assign (resid 63 and name HD2# )(resid 64 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HG1# )(resid 92 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 92 and name HN ) 1.8 0.0 3.7 assign (resid 92 and name HD1# )(resid 93 and name HN ) 1.8 0.0 3.7 assign (resid 93 and name HD2# )(resid 94 and name HN ) 1.8 0.0 3.7 assign (resid 94 and name HG1# )(resid 95 and name HN ) 1.8 0.0 3.7 assign (resid 100 and name HG# )(resid 101 and name HN ) 1.8 0.0 3.7 assign (resid 103 and name HD2# )(resid 104 and name HN ) 1.8 0.0 3.7 assign (resid 107 and name HG# )(resid 108 and name HN ) 1.8 0.0 3.2 assign (resid 108 and name HG1# )(resid 109 and name HN ) 1.8 0.0 3.7 assign (resid 108 and name HG2# )(resid 109 and name HN ) 1.8 0.0 3.7 assign (resid 110 and name HD1 )(resid 111 and name HN ) 1.8 0.0 3.2 assign (resid 110 and name HD2 )(resid 111 and name HN ) 1.8 0.0 3.2 assign (resid 110 and name HG# )(resid 111 and name HN ) 1.8 0.0 3.7 assign (resid 111 and name HD2# )(resid 112 and name HN ) 1.8 0.0 3.7 assign (resid 111 and name HG )(resid 112 and name HN ) 1.8 0.0 3.2 assign (resid 112 and name HD1# )(resid 113 and name HN ) 1.8 0.0 3.7 assign (resid 116 and name HG1# )(resid 117 and name HN ) 1.8 0.0 3.2 assign (resid 116 and name HG2# )(resid 117 and name HN ) 1.8 0.0 3.7 assign (resid 118 and name HG1# )(resid 119 and name HN ) 1.8 0.0 3.2 assign (resid 118 and name HG2# )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 119 and name HG# )(resid 120 and name HN ) 1.8 0.0 3.7 assign (resid 121 and name HE# )(resid 122 and name HN ) 1.8 0.0 3.7 assign (resid 121 and name HG# )(resid 122 and name HN ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 124 and name HN ) 1.8 0.0 3.7 assign (resid 124 and name HG# )(resid 125 and name HN ) 1.8 0.0 3.7 assign (resid 129 and name HG2# )(resid 130 and name HN ) 1.8 0.0 3.7 assign (resid 132 and name HD1# )(resid 133 and name HN ) 1.8 0.0 3.7 assign (resid 132 and name HG2# )(resid 133 and name HN ) 1.8 0.0 3.7 assign (resid 134 and name HE# )(resid 135 and name HN ) 1.8 0.0 3.7 assign (resid 138 and name HG# )(resid 139 and name HN ) 1.8 0.0 3.7 assign (resid 139 and name HG# )(resid 140 and name HN ) 1.8 0.0 3.7 assign (resid 140 and name HG1# )(resid 141 and name HN ) 1.8 0.0 3.7 assign (resid 140 and name HG2# )(resid 141 and name HN ) 1.8 0.0 2.2 assign (resid 141 and name HG1# )(resid 142 and name HN ) 1.8 0.0 3.7 assign (resid 142 and name HG2# )(resid 143 and name HN ) 1.8 0.0 2.2 assign (resid 146 and name HD# )(resid 147 and name HN ) 1.8 0.0 3.7 assign (resid 146 and name HG# )(resid 147 and name HN ) 1.8 0.0 3.7 remarks (bgdez)iNi-1 assign (resid 35 and name HN )(resid 36 and name HB# ) 1.8 0.0 3.7 assign (resid 39 and name HN )(resid 40 and name HD# ) 1.8 0.0 3.7 assign (resid 88 and name HN )(resid 89 and name HD# ) 1.8 0.0 3.7 assign (resid 90 and name HN )(resid 91 and name HG1# ) 1.8 0.0 3.7 assign (resid 98 and name HN )(resid 99 and name HB# ) 1.8 0.0 3.7 assign (resid 109 and name HN )(resid 110 and name HD# ) 1.8 0.0 3.2 assign (resid 140 and name HN )(resid 141 and name HG2# ) 1.8 0.0 3.7 remarks biNi+2 assign (resid 29 and name HB# )(resid 31 and name HN ) 1.8 0.0 3.2 assign (resid 36 and name HB# )(resid 38 and name HN ) 1.8 0.0 3.7 assign (resid 44 and name HB# )(resid 46 and name HN ) 1.8 0.0 3.2 assign (resid 48 and name HB# )(resid 50 and name HN ) 1.8 0.0 3.2 assign (resid 49 and name HB# )(resid 51 and name HN ) 1.8 0.0 3.7 assign (resid 50 and name HB# )(resid 52 and name HN ) 1.8 0.0 3.7 assign (resid 53 and name HB )(resid 55 and name HN ) 1.8 0.0 3.2 assign (resid 61 and name HB# )(resid 63 and name HN ) 1.8 0.0 3.7 assign (resid 89 and name HB# )(resid 91 and name HN ) 1.8 0.0 3.7 assign (resid 96 and name HB )(resid 98 and name HN ) 1.8 0.0 3.2 assign (resid 133 and name HB# )(resid 135 and name HN ) 1.8 0.0 3.7 remarks (gdez)i-Ni+2 assign (resid 13 and name HG2# )(resid 15 and name HN ) 1.8 0.0 3.7 assign (resid 14 and name HG1# )(resid 16 and name HN ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 48 and name HN ) 1.8 0.0 3.2 assign (resid 46 and name HG2# )(resid 48 and name HN ) 1.8 0.0 3.7 assign (resid 53 and name HG2# )(resid 55 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 93 and name HN ) 1.8 0.0 3.7 assign (resid 118 and name HG1# )(resid 120 and name HN ) 1.8 0.0 3.7 remarks biNi+3 assign (resid 96 and name HB )(resid 99 and name HN ) 1.8 0.0 3.2 remarks (gdez)i-Ni+3 assign (resid 14 and name HG1# )(resid 17 and name HN ) 1.8 0.0 3.7 assign (resid 23 and name HG# )(resid 26 and name HN ) 1.8 0.0 3.7 assign (resid 53 and name HG2# )(resid 56 and name HN ) 1.8 0.0 3.7 remarks biNi+4 assign (resid 108 and name HB )(resid 112 and name HN ) 1.8 0.0 3.2 remarks (gdez)i-Ni+4 assign (resid 23 and name HG# )(resid 27 and name HN ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 56 and name HN ) 1.8 0.0 3.7 assign (resid 132 and name HG2# )(resid 136 and name HN ) 1.8 0.0 3.7 remarks ai-bi+3 assign (resid 54 and name HA )(resid 57 and name HB# ) 1.8 0.0 3.2 assign (resid 55 and name HA )(resid 58 and name HB1 ) 1.8 0.0 3.2 assign (resid 55 and name HA )(resid 58 and name HB2 ) 1.8 0.0 3.2 assign (resid 56 and name HA )(resid 59 and name HB# ) 1.8 0.0 3.2 assign (resid 57 and name HA )(resid 60 and name HB# ) 1.8 0.0 3.2 assign (resid 58 and name HA )(resid 61 and name HB# ) 1.8 0.0 3.2 assign (resid 106 and name HA )(resid 109 and name HB# ) 1.8 0.0 3.2 assign (resid 110 and name HA )(resid 113 and name HB# ) 1.8 0.0 3.2 assign (resid 111 and name HA )(resid 114 and name HB# ) 1.8 0.0 3.7 assign (resid 123 and name HA )(resid 126 and name HB# ) 1.8 0.0 3.2 assign (resid 124 and name HA )(resid 127 and name HB# ) 1.8 0.0 3.2 assign (resid 125 and name HA )(resid 128 and name HB# ) 1.8 0.0 3.2 assign (resid 126 and name HA )(resid 129 and name HB ) 1.8 0.0 3.2 assign (resid 127 and name HA )(resid 130 and name HB1 ) 1.8 0.0 3.2 assign (resid 127 and name HA )(resid 130 and name HB2 ) 1.8 0.0 3.2 assign (resid 128 and name HA )(resid 131 and name HB# ) 1.8 0.0 3.7 assign (resid 129 and name HA )(resid 132 and name HB ) 1.8 0.0 3.2 assign (resid 130 and name HA )(resid 133 and name HB# ) 1.8 0.0 3.7 assign (resid 131 and name HA )(resid 134 and name HB# ) 1.8 0.0 3.7 assign (resid 132 and name HA )(resid 135 and name HB# ) 1.8 0.0 3.2 assign (resid 133 and name HA )(resid 136 and name HB# ) 1.8 0.0 3.7 remarks ai-(gdez)i+3 assign (resid 49 and name HA )(resid 52 and name HD1# ) 1.8 0.0 3.2 assign (resid 54 and name HA )(resid 57 and name HD1# ) 1.8 0.0 3.2 assign (resid 56 and name HA )(resid 59 and name HG# ) 1.8 0.0 3.2 assign (resid 105 and name HA )(resid 108 and name HG2# ) 1.8 0.0 3.2 assign (resid 108 and name HA )(resid 111 and name HD1# ) 1.8 0.0 3.2 assign (resid 108 and name HA )(resid 111 and name HG ) 1.8 0.0 3.2 assign (resid 109 and name HA )(resid 112 and name HD1# ) 1.8 0.0 3.2 assign (resid 111 and name HA )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 111 and name HA )(resid 114 and name HG# ) 1.8 0.0 3.7 assign (resid 129 and name HA )(resid 132 and name HD1# ) 1.8 0.0 3.7 assign (resid 131 and name HA )(resid 134 and name HE# ) 1.8 0.0 3.2 assign (resid 133 and name HA )(resid 136 and name HG# ) 1.8 0.0 3.7 remarks med and long range Ni-Ni+n (n>2) assign (resid 22 and name HN )(resid 29 and name HN ) 1.8 0.0 3.2 assign (resid 24 and name HN )(resid 27 and name HN ) 1.8 0.0 3.2 assign (resid 33 and name HN )(resid 144 and name HN ) 1.8 0.0 3.2 assign (resid 34 and name HN )(resid 42 and name HN ) 1.8 0.0 3.2 assign (resid 53 and name HN )(resid 56 and name HN ) 1.8 0.0 3.2 assign (resid 91 and name HN )(resid 141 and name HN ) 1.8 0.0 3.2 assign (resid 92 and name HN )(resid 117 and name HN ) 1.8 0.0 3.7 assign (resid 92 and name HN )(resid 119 and name HN ) 1.8 0.0 3.2 assign (resid 93 and name HN )(resid 141 and name HN ) 1.8 0.0 3.2 assign (resid 94 and name HN )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 94 and name HN )(resid 121 and name HN ) 1.8 0.0 3.2 assign (resid 97 and name HN )(resid 123 and name HN ) 1.8 0.0 3.2 assign (resid 122 and name HN )(resid 126 and name HN ) 1.8 0.0 3.2 remarks long range a-N, aiNi+n (n>4) assign (resid 23 and name HA )(resid 29 and name HN ) 1.8 0.0 3.2 assign (resid 33 and name HA )(resid 42 and name HN ) 1.8 0.0 3.2 assign (resid 34 and name HA )(resid 144 and name HN ) 1.8 0.0 3.2 assign (resid 36 and name HA )(resid 142 and name HN ) 1.8 0.0 3.2 assign (resid 91 and name HA )(resid 117 and name HN ) 1.8 0.0 2.2 assign (resid 93 and name HA )(resid 119 and name HN ) 1.8 0.0 3.2 assign (resid 94 and name HA )(resid 143 and name HN ) 1.8 0.0 3.2 remarks med and long range a-N, aiNi-n (n>1) assign (resid 15 and name HN )(resid 24 and name HA ) 1.8 0.0 3.2 assign (resid 33 and name HN )(resid 145 and name HA ) 1.8 0.0 3.2 assign (resid 35 and name HN )(resid 143 and name HA ) 1.8 0.0 3.2 assign (resid 54 and name HN )(resid 107 and name HA ) 1.8 0.0 3.2 assign (resid 91 and name HN )(resid 140 and name HA ) 1.8 0.0 3.2 assign (resid 92 and name HN )(resid 118 and name HA ) 1.8 0.0 3.2 assign (resid 93 and name HN )(resid 142 and name HA ) 1.8 0.0 3.2 assign (resid 94 and name HN )(resid 120 and name HA ) 1.8 0.0 3.2 assign (resid 95 and name HN )(resid 144 and name HA ) 1.8 0.0 3.2 remarks med and long range a-a assign (resid 14 and name HA )(resid 24 and name HA ) 1.8 0.0 3.2 assign (resid 21 and name HA )(resid 30 and name HA ) 1.8 0.0 3.2 assign (resid 23 and name HA )(resid 28 and name HA ) 1.8 0.0 3.2 assign (resid 32 and name HA )(resid 145 and name HA ) 1.8 0.0 3.2 assign (resid 33 and name HA )(resid 43 and name HA ) 1.8 0.0 3.2 assign (resid 34 and name HA )(resid 143 and name HA ) 1.8 0.0 3.2 assign (resid 35 and name HA )(resid 41 and name HA ) 1.8 0.0 3.2 assign (resid 36 and name HA )(resid 141 and name HA ) 1.8 0.0 3.2 assign (resid 95 and name HA1 )(resid 123 and name HA ) 1.8 0.0 3.2 assign (resid 95 and name HA2 )(resid 123 and name HA ) 1.8 0.0 3.2 remarks long side chain to NH, (bgdez)iNi+n, n>4 assign (resid 14 and name HG2# )(resid 23 and name HN ) 1.8 0.0 3.7 assign (resid 15 and name HG2# )(resid 25 and name HN ) 1.8 0.0 3.2 assign (resid 15 and name HG2# )(resid 26 and name HN ) 1.8 0.0 3.2 assign (resid 16 and name HB# )(resid 23 and name HN ) 1.8 0.0 3.2 assign (resid 22 and name HD1# )(resid 33 and name HN ) 1.8 0.0 3.7 assign (resid 32 and name HB# )(resid 46 and name HN ) 1.8 0.0 3.2 assign (resid 33 and name HG2# )(resid 42 and name HN ) 1.8 0.0 3.7 assign (resid 34 and name HB# )(resid 144 and name HN ) 1.8 0.0 3.7 assign (resid 35 and name HB# )(resid 42 and name HN ) 1.8 0.0 3.7 assign (resid 36 and name HB# )(resid 140 and name HN ) 1.8 0.0 3.7 assign (resid 36 and name HB# )(resid 142 and name HN ) 1.8 0.0 3.7 assign (resid 44 and name HE1 )(resid 60 and name HN ) 1.8 0.0 3.2 assign (resid 52 and name HG2# )(resid 57 and name HN ) 1.8 0.0 3.7 assign (resid 54 and name HB# )(resid 109 and name HN ) 1.8 0.0 3.7 assign (resid 58 and name HG# )(resid 111 and name HN ) 1.8 0.0 3.7 assign (resid 89 and name HB# )(resid 141 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HB )(resid 117 and name HN ) 1.8 0.0 3.2 assign (resid 91 and name HG1# )(resid 141 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 117 and name HN ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 92 and name HD1# )(resid 141 and name HN ) 1.8 0.0 3.7 assign (resid 92 and name HD1# )(resid 143 and name HN ) 1.8 0.0 3.7 assign (resid 92 and name HD2# )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 93 and name HD1# )(resid 130 and name HN ) 1.8 0.0 3.7 assign (resid 93 and name HD2# )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 94 and name HG2# )(resid 119 and name HN ) 1.8 0.0 3.7 assign (resid 94 and name HG2# )(resid 143 and name HN ) 1.8 0.0 3.7 assign (resid 96 and name HB )(resid 101 and name HN ) 1.8 0.0 3.2 assign (resid 96 and name HG2# )(resid 101 and name HN ) 1.8 0.0 3.7 assign (resid 108 and name HG1# )(resid 118 and name HN ) 1.8 0.0 3.7 assign (resid 111 and name HB# )(resid 116 and name HN ) 1.8 0.0 3.7 assign (resid 112 and name HD2# )(resid 118 and name HN ) 1.8 0.0 3.2 assign (resid 121 and name HB# )(resid 126 and name HN ) 1.8 0.0 3.2 assign (resid 121 and name HE# )(resid 130 and name HN ) 1.8 0.0 3.7 remarks med, long side chain to NH, (bgdez)iNi-n, n>1 assign (resid 13 and name HN )(resid 24 and name HG1# ) 1.8 0.0 3.2 assign (resid 14 and name HN )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 16 and name HN )(resid 23 and name HB# ) 1.8 0.0 3.7 assign (resid 24 and name HN )(resid 29 and name HD# ) 1.8 0.0 3.7 assign (resid 24 and name HN )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 34 and name HN )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 34 and name HN )(resid 42 and name HB# ) 1.8 0.0 3.7 assign (resid 35 and name HN )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 35 and name HN )(resid 142 and name HG1# ) 1.8 0.0 3.2 assign (resid 36 and name HN )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 48 and name HN )(resid 145 and name HD2# ) 1.8 0.0 3.7 assign (resid 48 and name HN )(resid 51 and name HB# ) 1.8 0.0 3.2 assign (resid 53 and name HN )(resid 56 and name HB1 ) 1.8 0.0 3.2 assign (resid 53 and name HN )(resid 56 and name HB2 ) 1.8 0.0 3.2 assign (resid 53 and name HN )(resid 56 and name HD1# ) 1.8 0.0 3.2 assign (resid 58 and name HN )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 88 and name HN )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 90 and name HN )(resid 139 and name HB# ) 1.8 0.0 3.7 assign (resid 92 and name HN )(resid 116 and name HG1# ) 1.8 0.0 3.7 assign (resid 92 and name HN )(resid 118 and name HG2# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 140 and name HG2# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 142 and name HG2# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 143 and name HB# ) 1.8 0.0 3.7 assign (resid 94 and name HN )(resid 120 and name HB# ) 1.8 0.0 3.7 assign (resid 94 and name HN )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 94 and name HN )(resid 143 and name HB# ) 1.8 0.0 3.7 assign (resid 95 and name HN )(resid 143 and name HB# ) 1.8 0.0 3.7 assign (resid 95 and name HN )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 97 and name HN )(resid 123 and name HB ) 1.8 0.0 3.2 assign (resid 97 and name HN )(resid 123 and name HG2# ) 1.8 0.0 3.7 assign (resid 97 and name HN )(resid 145 and name HB# ) 1.8 0.0 3.7 assign (resid 103 and name HN )(resid 120 and name HB# ) 1.8 0.0 3.2 assign (resid 122 and name HN )(resid 125 and name HB# ) 1.8 0.0 3.2 assign (resid 127 and name HN )(resid 144 and name HD2# ) 1.8 0.0 3.7 assign (resid 129 and name HN )(resid 132 and name HD1# ) 1.8 0.0 3.7 assign (resid 133 and name HN )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 134 and name HN )(resid 140 and name HG1# ) 1.8 0.0 3.7 remarks med and long range side chain to alpha, except ai-(bgde)i+3 assign (resid 11 and name HD2# )(resid 135 and name HA ) 1.8 0.0 3.7 assign (resid 11 and name HD2# )(resid 37 and name HA ) 1.8 0.0 3.7 assign (resid 12 and name HB# )(resid 37 and name HA ) 1.8 0.0 3.7 assign (resid 13 and name HA )(resid 134 and name HE# ) 1.8 0.0 3.2 assign (resid 13 and name HG2# )(resid 131 and name HA ) 1.8 0.0 3.7 assign (resid 13 and name HG2# )(resid 15 and name HA ) 1.8 0.0 3.7 assign (resid 14 and name HA )(resid 22 and name HG2# ) 1.8 0.0 3.7 assign (resid 14 and name HA )(resid 24 and name HG2# ) 1.8 0.0 3.7 assign (resid 14 and name HG1# )(resid 16 and name HA ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 24 and name HA ) 1.8 0.0 3.7 assign (resid 14 and name HG## )(resid 127 and name HA ) 1.8 0.0 3.7 assign (resid 15 and name HG2# )(resid 25 and name HA ) 1.8 0.0 3.2 assign (resid 17 and name HB# )(resid 22 and name HA ) 1.8 0.0 3.2 assign (resid 17 and name HD# )(resid 124 and name HA ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 144 and name HA ) 1.8 0.0 3.7 assign (resid 23 and name HB# )(resid 28 and name HA ) 1.8 0.0 2.7 assign (resid 23 and name HG# )(resid 26 and name HA ) 1.8 0.0 3.2 assign (resid 23 and name HG# )(resid 28 and name HA ) 1.8 0.0 3.2 assign (resid 32 and name HA )(resid 146 and name HD1 ) 1.8 0.0 3.2 assign (resid 32 and name HA )(resid 146 and name HD2 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 145 and name HA ) 1.8 0.0 3.2 assign (resid 33 and name HA )(resid 44 and name HB# ) 1.8 0.0 3.7 assign (resid 33 and name HG2# )(resid 43 and name HA ) 1.8 0.0 3.2 assign (resid 34 and name HA )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 34 and name HA )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 34 and name HB# )(resid 143 and name HA ) 1.8 0.0 3.2 assign (resid 34 and name HB# )(resid 60 and name HA ) 1.8 0.0 3.2 assign (resid 35 and name HA )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 35 and name HB1 )(resid 41 and name HA ) 1.8 0.0 3.2 assign (resid 35 and name HB2 )(resid 41 and name HA ) 1.8 0.0 3.2 assign (resid 35 and name HB# )(resid 41 and name HA ) 1.8 0.0 3.2 assign (resid 36 and name HA )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 36 and name HB# )(resid 141 and name HA ) 1.8 0.0 3.7 assign (resid 37 and name HB# )(resid 134 and name HA ) 1.8 0.0 3.7 assign (resid 44 and name HE1 )(resid 56 and name HA ) 1.8 0.0 3.7 assign (resid 44 and name HZ2 )(resid 57 and name HA ) 1.8 0.0 3.2 assign (resid 46 and name HA )(resid 51 and name HB# ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 52 and name HA ) 1.8 0.0 3.7 assign (resid 46 and name HG2# )(resid 52 and name HA ) 1.8 0.0 3.2 assign (resid 47 and name HA )(resid 145 and name HD2# ) 1.8 0.0 3.7 assign (resid 47 and name HA )(resid 146 and name HD# ) 1.8 0.0 3.7 assign (resid 48 and name HA )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 48 and name HA )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 49 and name HA )(resid 145 and name HD1# ) 1.8 0.0 3.7 assign (resid 49 and name HA )(resid 145 and name HD2# ) 1.8 0.0 3.7 assign (resid 52 and name HA )(resid 56 and name HD1# ) 1.8 0.0 3.2 assign (resid 52 and name HD1# )(resid 96 and name HA ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 57 and name HA ) 1.8 0.0 3.7 assign (resid 53 and name HA )(resid 107 and name HG# ) 1.8 0.0 3.2 assign (resid 54 and name HA )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 54 and name HB# )(resid 107 and name HA ) 1.8 0.0 3.2 assign (resid 55 and name HA )(resid 59 and name HG# ) 1.8 0.0 3.7 assign (resid 57 and name HA )(resid 61 and name HB# ) 1.8 0.0 3.7 assign (resid 57 and name HA )(resid 92 and name HD2# ) 1.8 0.0 3.7 assign (resid 58 and name HA )(resid 111 and name HD1# ) 1.8 0.0 3.2 assign (resid 59 and name HA )(resid 64 and name HB# ) 1.8 0.0 3.7 assign (resid 61 and name HA )(resid 141 and name HB ) 1.8 0.0 3.2 assign (resid 61 and name HA )(resid 141 and name HG1# ) 1.8 0.0 3.2 assign (resid 61 and name HA )(resid 141 and name HG2# ) 1.8 0.0 3.2 assign (resid 61 and name HA )(resid 92 and name HD1# ) 1.8 0.0 3.7 assign (resid 88 and name HA )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 89 and name HA )(resid 139 and name HB# ) 1.8 0.0 2.7 assign (resid 89 and name HA )(resid 139 and name HG# ) 1.8 0.0 3.7 assign (resid 89 and name HB# )(resid 140 and name HA ) 1.8 0.0 3.7 assign (resid 91 and name HA )(resid 116 and name HG1# ) 1.8 0.0 3.2 assign (resid 91 and name HG1# )(resid 140 and name HA ) 1.8 0.0 3.2 assign (resid 91 and name HG2# )(resid 117 and name HA1 ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 117 and name HA2 ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 118 and name HA ) 1.8 0.0 3.7 assign (resid 91 and name HG2# )(resid 93 and name HA ) 1.8 0.0 3.7 assign (resid 92 and name HA )(resid 141 and name HB ) 1.8 0.0 3.2 assign (resid 92 and name HA )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 92 and name HA )(resid 141 and name HG2# ) 1.8 0.0 3.7 assign (resid 92 and name HB# )(resid 118 and name HA ) 1.8 0.0 3.2 assign (resid 92 and name HD1# )(resid 142 and name HA ) 1.8 0.0 3.7 assign (resid 93 and name HA )(resid 119 and name HB1 ) 1.8 0.0 3.2 assign (resid 93 and name HA )(resid 119 and name HB2 ) 1.8 0.0 3.2 assign (resid 93 and name HA )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 93 and name HB# )(resid 142 and name HA ) 1.8 0.0 3.7 assign (resid 93 and name HD1# )(resid 126 and name HA ) 1.8 0.0 3.2 assign (resid 93 and name HD1# )(resid 130 and name HA ) 1.8 0.0 3.2 assign (resid 93 and name HD2# )(resid 126 and name HA ) 1.8 0.0 3.7 assign (resid 94 and name HA )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 94 and name HB )(resid 120 and name HA ) 1.8 0.0 3.2 assign (resid 94 and name HG1# )(resid 120 and name HA ) 1.8 0.0 3.2 assign (resid 94 and name HG1# )(resid 96 and name HA ) 1.8 0.0 3.7 assign (resid 94 and name HG2# )(resid 120 and name HA ) 1.8 0.0 3.7 assign (resid 95 and name HA# )(resid 126 and name HB# ) 1.8 0.0 3.2 assign (resid 95 and name HA# )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 96 and name HA )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 96 and name HA )(resid 145 and name HD2# ) 1.8 0.0 3.7 assign (resid 96 and name HG2# )(resid 100 and name HA ) 1.8 0.0 3.7 assign (resid 96 and name HG2# )(resid 101 and name HA ) 1.8 0.0 3.7 assign (resid 102 and name HA )(resid 120 and name HB# ) 1.8 0.0 3.2 assign (resid 106 and name HA )(resid 110 and name HD# ) 1.8 0.0 3.7 assign (resid 108 and name HA )(resid 110 and name HD# ) 1.8 0.0 3.7 assign (resid 111 and name HA )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 112 and name HD2# )(resid 117 and name HA# ) 1.8 0.0 3.2 assign (resid 119 and name HA )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HA )(resid 125 and name HB# ) 1.8 0.0 3.7 assign (resid 121 and name HB# )(resid 126 and name HA ) 1.8 0.0 3.2 assign (resid 121 and name HE# )(resid 126 and name HA ) 1.8 0.0 3.7 assign (resid 121 and name HG# )(resid 126 and name HA ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 144 and name HA ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 146 and name HA ) 1.8 0.0 3.7 assign (resid 127 and name HA )(resid 142 and name HG2# ) 1.8 0.0 3.7 assign (resid 127 and name HA )(resid 144 and name HD1# ) 1.8 0.0 3.7 assign (resid 127 and name HA )(resid 144 and name HD2# ) 1.8 0.0 3.7 assign (resid 130 and name HA )(resid 140 and name HG1# ) 1.8 0.0 3.2 assign (resid 130 and name HA )(resid 140 and name HG2# ) 1.8 0.0 3.7 assign (resid 132 and name HG2# )(resid 136 and name HA ) 1.8 0.0 3.7 assign (resid 133 and name HA )(resid 135 and name HB# ) 1.8 0.0 3.7 assign (resid 134 and name HA )(resid 140 and name HG1# ) 1.8 0.0 3.2 assign (resid 141 and name HG1# )(resid 143 and name HA ) 1.8 0.0 3.7 remarks med and long range side chain to side chain assign (resid 11 and name HB1 )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 11 and name HB2 )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 11 and name HD1# )(resid 134 and name HE# ) 1.8 0.0 3.2 assign (resid 11 and name HD2# )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 11 and name HD2# )(resid 134 and name HG# ) 1.8 0.0 3.7 assign (resid 11 and name HD2# )(resid 37 and name HB# ) 1.8 0.0 3.7 assign (resid 13 and name HB )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 13 and name HB )(resid 15 and name HG2# ) 1.8 0.0 3.2 assign (resid 13 and name HG2# )(resid 134 and name HE# ) 1.8 0.0 3.2 assign (resid 13 and name HG2# )(resid 15 and name HG2# ) 1.8 0.0 3.2 assign (resid 14 and name HB )(resid 127 and name HB# ) 1.8 0.0 3.7 assign (resid 14 and name HG1# )(resid 17 and name HD# ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 22 and name HD1# ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 24 and name HG1# ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 24 and name HG2# ) 1.8 0.0 3.7 assign (resid 14 and name HG2# )(resid 35 and name HZ ) 1.8 0.0 3.7 assign (resid 14 and name HG# )(resid 127 and name HB# ) 1.8 0.0 3.2 assign (resid 14 and name HG# )(resid 17 and name HD# ) 1.8 0.0 3.2 assign (resid 14 and name HG# )(resid 17 and name HE# ) 1.8 0.0 3.2 assign (resid 14 and name HG# )(resid 22 and name HG2# ) 1.8 0.0 3.2 assign (resid 14 and name HG# )(resid 24 and name HG2# ) 1.8 0.0 3.2 assign (resid 14 and name HG# )(resid 35 and name HZ ) 1.8 0.0 3.2 assign (resid 15 and name HG2# )(resid 26 and name HG# ) 1.8 0.0 3.2 assign (resid 16 and name HB# )(resid 21 and name HE# ) 1.8 0.0 3.2 assign (resid 16 and name HB# )(resid 23 and name HB# ) 1.8 0.0 3.2 assign (resid 17 and name HD# )(resid 127 and name HB# ) 1.8 0.0 3.2 assign (resid 17 and name HE# )(resid 127 and name HB# ) 1.8 0.0 3.2 assign (resid 17 and name HE# )(resid 22 and name HD1# ) 1.8 0.0 3.2 assign (resid 21 and name HB# )(resid 28 and name HB# ) 1.8 0.0 3.7 assign (resid 21 and name HD# )(resid 23 and name HG# ) 1.8 0.0 3.7 assign (resid 22 and name HB )(resid 33 and name HD1# ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 123 and name HG2# ) 1.8 0.0 3.2 assign (resid 22 and name HD1# )(resid 146 and name HD# ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 146 and name HG# ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 29 and name HB# ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 33 and name HD1# ) 1.8 0.0 3.7 assign (resid 22 and name HD1# )(resid 33 and name HG2# ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 127 and name HB# ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 144 and name HB# ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 144 and name HD1# ) 1.8 0.0 3.2 assign (resid 22 and name HG2# )(resid 24 and name HG2# ) 1.8 0.0 3.2 assign (resid 22 and name HG2# )(resid 29 and name HB# ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 33 and name HD1# ) 1.8 0.0 3.2 assign (resid 22 and name HG2# )(resid 33 and name HG1# ) 1.8 0.0 3.7 assign (resid 22 and name HG2# )(resid 35 and name HE# ) 1.8 0.0 3.7 assign (resid 23 and name HG# )(resid 28 and name HB# ) 1.8 0.0 3.7 assign (resid 24 and name HB )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 24 and name HG1# )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 24 and name HG1# )(resid 35 and name HD# ) 1.8 0.0 3.2 assign (resid 24 and name HG1# )(resid 35 and name HE# ) 1.8 0.0 3.2 assign (resid 24 and name HG2# )(resid 29 and name HD# ) 1.8 0.0 3.7 assign (resid 24 and name HG2# )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 24 and name HG2# )(resid 33 and name HD1# ) 1.8 0.0 3.2 assign (resid 24 and name HG2# )(resid 35 and name HE# ) 1.8 0.0 3.2 assign (resid 24 and name HG2# )(resid 35 and name HZ ) 1.8 0.0 3.7 assign (resid 27 and name HB )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 27 and name HG1# )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 27 and name HG2# )(resid 29 and name HE# ) 1.8 0.0 3.2 assign (resid 29 and name HB# )(resid 33 and name HD1# ) 1.8 0.0 3.7 assign (resid 29 and name HB# )(resid 33 and name HG2# ) 1.8 0.0 3.2 assign (resid 29 and name HD# )(resid 33 and name HD1# ) 1.8 0.0 3.2 assign (resid 29 and name HD# )(resid 33 and name HG2# ) 1.8 0.0 3.2 assign (resid 29 and name HE# )(resid 33 and name HG2# ) 1.8 0.0 3.7 assign (resid 29 and name HE# )(resid 41 and name HB ) 1.8 0.0 3.2 assign (resid 29 and name HE# )(resid 41 and name HG1# ) 1.8 0.0 3.2 assign (resid 29 and name HE# )(resid 41 and name HG2# ) 1.8 0.0 3.2 assign (resid 31 and name HE1 )(resid 33 and name HG2# ) 1.8 0.0 3.2 assign (resid 31 and name HE1 )(resid 43 and name HB# ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 145 and name HG ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 146 and name HD1 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 146 and name HD# ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 146 and name HD2 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 44 and name HB1 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 44 and name HB# ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 44 and name HB2 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 44 and name HE3 ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 46 and name HB ) 1.8 0.0 3.2 assign (resid 32 and name HB# )(resid 46 and name HG2# ) 1.8 0.0 3.2 assign (resid 33 and name HB )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 33 and name HD1# )(resid 35 and name HD# ) 1.8 0.0 3.2 assign (resid 33 and name HD1# )(resid 35 and name HE# ) 1.8 0.0 3.2 assign (resid 33 and name HD1# )(resid 41 and name HG1# ) 1.8 0.0 3.2 assign (resid 33 and name HG1# )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 33 and name HG2# )(resid 41 and name HG1# ) 1.8 0.0 3.2 assign (resid 33 and name HG2# )(resid 43 and name HB# ) 1.8 0.0 3.7 assign (resid 34 and name HB# )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 34 and name HB# )(resid 42 and name HB# ) 1.8 0.0 3.7 assign (resid 34 and name HB# )(resid 44 and name HB# ) 1.8 0.0 3.2 assign (resid 34 and name HB# )(resid 60 and name HB# ) 1.8 0.0 3.2 assign (resid 35 and name HB# )(resid 41 and name HG2# ) 1.8 0.0 3.2 assign (resid 35 and name HD# )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 35 and name HE# )(resid 142 and name HG1# ) 1.8 0.0 3.2 assign (resid 35 and name HE# )(resid 144 and name HD1# ) 1.8 0.0 3.2 assign (resid 35 and name HZ )(resid 142 and name HG1# ) 1.8 0.0 3.7 assign (resid 36 and name HB# )(resid 141 and name HG1# ) 1.8 0.0 3.2 assign (resid 36 and name HB# )(resid 141 and name HG2# ) 1.8 0.0 3.2 assign (resid 36 and name HB# )(resid 38 and name HB# ) 1.8 0.0 3.7 assign (resid 36 and name HB# )(resid 38 and name HG# ) 1.8 0.0 3.7 assign (resid 37 and name HD# )(resid 134 and name HB# ) 1.8 0.0 3.7 assign (resid 37 and name HD# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 44 and name HD1 )(resid 56 and name HD2# ) 1.8 0.0 3.2 assign (resid 44 and name HE1 )(resid 56 and name HB# ) 1.8 0.0 3.7 assign (resid 44 and name HE1 )(resid 56 and name HD2# ) 1.8 0.0 3.2 assign (resid 44 and name HE1 )(resid 59 and name HB# ) 1.8 0.0 3.2 assign (resid 44 and name HE1 )(resid 60 and name HB# ) 1.8 0.0 3.2 assign (resid 44 and name HE3 )(resid 143 and name HB# ) 1.8 0.0 3.7 assign (resid 44 and name HE3 )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 44 and name HE3 )(resid 46 and name HG1# ) 1.8 0.0 3.2 assign (resid 44 and name HH2 )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 44 and name HH2 )(resid 145 and name HD1# ) 1.8 0.0 3.7 assign (resid 44 and name HH2 )(resid 46 and name HG1# ) 1.8 0.0 3.2 assign (resid 44 and name HH2 )(resid 46 and name HG2# ) 1.8 0.0 3.7 assign (resid 44 and name HH2 )(resid 52 and name HD1# ) 1.8 0.0 3.2 assign (resid 44 and name HH2 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0.0 3.2 assign (resid 46 and name HB )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 46 and name HB )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 46 and name HG1# )(resid 145 and name HD1# ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 46 and name HG1# )(resid 51 and name HB1 ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 51 and name HB2 ) 1.8 0.0 3.7 assign (resid 46 and name HG1# )(resid 52 and name HD1# ) 1.8 0.0 3.2 assign (resid 46 and name HG1# )(resid 56 and name HD1# ) 1.8 0.0 3.2 assign (resid 46 and name HG2# )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 46 and name HG2# )(resid 145 and name HD2# ) 1.8 0.0 3.2 assign (resid 46 and name HG2# )(resid 51 and name HB1 ) 1.8 0.0 3.7 assign (resid 46 and name HG2# )(resid 51 and name HB2 ) 1.8 0.0 3.7 assign (resid 46 and name HG2# )(resid 52 and name HD1# ) 1.8 0.0 3.7 assign (resid 46 and name HG2# )(resid 56 and name HB# ) 1.8 0.0 3.7 assign (resid 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and name HG2# ) 1.8 0.0 3.7 assign (resid 52 and name HD1# )(resid 96 and name HG2# ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 103 and name HD2# ) 1.8 0.0 3.2 assign (resid 52 and name HG2# )(resid 56 and name HB# ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 56 and name HD2# ) 1.8 0.0 3.7 assign (resid 52 and name HG2# )(resid 94 and name HG2# ) 1.8 0.0 3.7 assign (resid 53 and name HG2# )(resid 55 and name HG ) 1.8 0.0 3.2 assign (resid 53 and name HG2# )(resid 56 and name HD1# ) 1.8 0.0 3.2 assign (resid 53 and name HG2# )(resid 56 and name HG ) 1.8 0.0 3.7 assign (resid 54 and name HB# )(resid 110 and name HD# ) 1.8 0.0 3.2 assign (resid 54 and name HB# )(resid 110 and name HG# ) 1.8 0.0 3.2 assign (resid 56 and name HD2# )(resid 59 and name HB1 ) 1.8 0.0 3.7 assign (resid 56 and name HD2# )(resid 59 and name HB2 ) 1.8 0.0 3.7 assign (resid 57 and name HB# )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 57 and name HB# )(resid 92 and name HD2# ) 1.8 0.0 3.2 assign (resid 57 and name HD2# )(resid 92 and name HD2# ) 1.8 0.0 3.2 assign (resid 57 and name HD2# )(resid 92 and name HG ) 1.8 0.0 3.7 assign (resid 57 and name HD2# )(resid 94 and name HB ) 1.8 0.0 3.7 assign (resid 57 and name HD2# )(resid 94 and name HG2# ) 1.8 0.0 3.2 assign (resid 58 and name HB# )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 58 and name HE2# )(resid 110 and name HB# ) 1.8 0.0 3.7 assign (resid 58 and name HE2# )(resid 111 and name HD2# ) 1.8 0.0 3.7 assign (resid 58 and name HE2# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 58 and name HG# )(resid 110 and name HG# ) 1.8 0.0 3.7 assign (resid 58 and name HG# )(resid 111 and name HB# ) 1.8 0.0 3.7 assign (resid 58 and name HG# )(resid 111 and name HD1# ) 1.8 0.0 3.2 assign (resid 60 and name HB# )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 60 and name HB# )(resid 92 and name HD1# ) 1.8 0.0 3.2 assign (resid 61 and name HB# )(resid 111 and name HB# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 111 and name HD1# ) 1.8 0.0 3.2 assign (resid 61 and name HB# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 116 and name HG1# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 141 and name HG1# ) 1.8 0.0 3.2 assign (resid 61 and name HB# )(resid 141 and name HG2# ) 1.8 0.0 3.2 assign (resid 61 and name HB# )(resid 63 and name HD1# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 89 and name HD# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 89 and name HG# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 92 and name HB# ) 1.8 0.0 3.7 assign (resid 61 and name HB# )(resid 92 and name HD1# ) 1.8 0.0 3.2 assign (resid 63 and name HB# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 63 and name HB# )(resid 88 and name HB# ) 1.8 0.0 3.7 assign (resid 63 and name HD1# )(resid 111 and name HB# ) 1.8 0.0 3.7 assign (resid 63 and name HD1# )(resid 114 and name HB# ) 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assign (resid 94 and name HG2# )(resid 143 and name HB# ) 1.8 0.0 3.2 assign (resid 96 and name HB )(resid 101 and name HB# ) 1.8 0.0 3.2 assign (resid 96 and name HG2# )(resid 101 and name HB# ) 1.8 0.0 3.2 assign (resid 96 and name HG2# )(resid 103 and name HD2# ) 1.8 0.0 3.2 assign (resid 96 and name HG2# )(resid 145 and name HB# ) 1.8 0.0 3.7 assign (resid 96 and name HG2# )(resid 145 and name HD1# ) 1.8 0.0 3.2 assign (resid 100 and name HG# )(resid 120 and name HB# ) 1.8 0.0 3.7 assign (resid 101 and name HB# )(resid 103 and name HG ) 1.8 0.0 3.7 assign (resid 101 and name HB# )(resid 120 and name HB# ) 1.8 0.0 3.7 assign (resid 101 and name HD1 )(resid 103 and name HD2# ) 1.8 0.0 3.2 assign (resid 103 and name HB# )(resid 108 and name HG1# ) 1.8 0.0 3.7 assign (resid 103 and name HB# )(resid 108 and name HG2# ) 1.8 0.0 3.7 assign (resid 103 and name HB# )(resid 120 and name HB# ) 1.8 0.0 3.7 assign (resid 103 and name HD1# )(resid 120 and name HB# ) 1.8 0.0 3.2 assign (resid 103 and name HD2# )(resid 107 and name HE2# ) 1.8 0.0 3.2 assign (resid 103 and name HD2# )(resid 120 and name HB# ) 1.8 0.0 3.2 assign (resid 103 and name HG )(resid 120 and name HB# ) 1.8 0.0 3.2 assign (resid 105 and name HB# )(resid 108 and name HG2# ) 1.8 0.0 3.7 assign (resid 105 and name HB# )(resid 109 and name HB# ) 1.8 0.0 3.7 assign (resid 108 and name HB )(resid 112 and name HD1# ) 1.8 0.0 3.2 assign (resid 108 and name HB )(resid 112 and name HD2# ) 1.8 0.0 3.7 assign (resid 108 and name HG1# )(resid 118 and name HB ) 1.8 0.0 3.7 assign (resid 110 and name HB# )(resid 113 and name HB# ) 1.8 0.0 3.7 assign (resid 110 and name HB# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 111 and name HB# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 111 and name HD1# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 111 and name HD1# )(resid 116 and name HG1# ) 1.8 0.0 3.2 assign (resid 111 and name HD1# )(resid 118 and name HG2# ) 1.8 0.0 3.2 assign (resid 111 and name HD2# )(resid 114 and name HE# ) 1.8 0.0 3.7 assign (resid 111 and name HG )(resid 118 and name HG2# ) 1.8 0.0 3.7 assign (resid 114 and name HB# )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 114 and name HE# )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 114 and name HG1 )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 114 and name HG2 )(resid 116 and name HG2# ) 1.8 0.0 3.7 assign (resid 118 and name HG1# )(resid 120 and name HB# ) 1.8 0.0 3.7 assign (resid 119 and name HB# )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HB# )(resid 125 and name HB# ) 1.8 0.0 3.2 assign (resid 121 and name HB# )(resid 126 and name HB# ) 1.8 0.0 3.2 assign (resid 121 and name HE# )(resid 125 and name HB# ) 1.8 0.0 3.7 assign (resid 121 and name HE# )(resid 126 and name HB# ) 1.8 0.0 3.2 assign (resid 121 and name HE# )(resid 129 and name HB ) 1.8 0.0 3.7 assign (resid 121 and name HE# )(resid 129 and name HG2# ) 1.8 0.0 3.2 assign (resid 121 and name HG# )(resid 125 and name HB# ) 1.8 0.0 3.7 assign (resid 121 and name HG# )(resid 126 and name HB# ) 1.8 0.0 3.2 assign (resid 122 and name HB# )(resid 124 and name HB# ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 127 and name HB# ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 144 and name HB# ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 144 and name HD1# ) 1.8 0.0 3.7 assign (resid 123 and name HG2# )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 124 and name HG# )(resid 128 and name HB# ) 1.8 0.0 3.7 assign (resid 126 and name HB# )(resid 142 and name HG2# ) 1.8 0.0 3.2 assign (resid 126 and name HB# )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 127 and name HB# )(resid 130 and name HD# ) 1.8 0.0 3.7 assign (resid 127 and name HB# )(resid 142 and name HG2# ) 1.8 0.0 3.7 assign (resid 127 and name HB# )(resid 144 and name HD1# ) 1.8 0.0 3.2 assign (resid 127 and name HB# )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 128 and name HG# )(resid 132 and name HD1# ) 1.8 0.0 3.7 assign (resid 129 and name HG2# )(resid 133 and name HD1# ) 1.8 0.0 3.2 assign (resid 129 and name HG2# )(resid 133 and name HD2# ) 1.8 0.0 3.2 assign (resid 129 and name HG2# )(resid 133 and name HG ) 1.8 0.0 3.7 assign (resid 130 and name HB# )(resid 134 and name HB# ) 1.8 0.0 3.7 assign (resid 130 and name HB# )(resid 142 and name HB ) 1.8 0.0 3.7 assign (resid 130 and name HD# )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 130 and name HD# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 130 and name HE# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 130 and name HE# )(resid 141 and name HG1# ) 1.8 0.0 3.2 assign (resid 131 and name HB# )(resid 134 and name HE# ) 1.8 0.0 3.2 assign (resid 132 and name HG2# )(resid 135 and name HB# ) 1.8 0.0 3.7 assign (resid 132 and name HG2# )(resid 136 and name HB# ) 1.8 0.0 3.7 assign (resid 132 and name HG2# )(resid 136 and name HG# ) 1.8 0.0 3.7 assign (resid 133 and name HB# )(resid 140 and name HG2# ) 1.8 0.0 3.7 assign (resid 133 and name HD1# )(resid 138 and name HB# ) 1.8 0.0 3.7 assign (resid 133 and name HD2# )(resid 136 and name HB# ) 1.8 0.0 3.7 assign (resid 133 and name HD2# )(resid 136 and name HG# ) 1.8 0.0 3.7 assign (resid 133 and name HG )(resid 140 and name HG2# ) 1.8 0.0 3.7 assign (resid 134 and name HB# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 134 and name HE# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 138 and name HB# )(resid 140 and name HG1# ) 1.8 0.0 3.7 assign (resid 140 and name HG1# )(resid 142 and name HB ) 1.8 0.0 3.7 assign (resid 140 and name HG2# )(resid 142 and name HB ) 1.8 0.0 3.7 assign (resid 141 and name HG1# )(resid 143 and name HB# ) 1.8 0.0 3.7 assign (resid 142 and name HG1# )(resid 144 and name HD2# ) 1.8 0.0 3.2 assign (resid 142 and name HG2# )(resid 144 and name HB# ) 1.8 0.0 3.7 assign (resid 142 and name HG2# )(resid 144 and name HD1# ) 1.8 0.0 3.2 assign (resid 142 and name HG2# )(resid 144 and name HD2# ) 1.8 0.0 3.2 remarks intraresidue assign (resid 11 and name HA )(resid 11 and name HD1# ) 1.8 0.0 3.7 assign (resid 11 and name HA )(resid 11 and name HD2# ) 1.8 0.0 3.7 assign (resid 11 and name HN )(resid 11 and name HD1# ) 1.8 0.0 3.7 assign (resid 11 and name HN )(resid 11 and name HD2# ) 1.8 0.0 3.7 assign (resid 13 and name HN )(resid 13 and name HB ) 1.8 0.0 1.7 assign (resid 14 and name HN )(resid 14 and name HG1# ) 1.8 0.0 3.7 assign (resid 14 and name HN )(resid 14 and name HG2# ) 1.8 0.0 3.7 assign (resid 15 and name HN )(resid 15 and name HG2# ) 1.8 0.0 3.7 assign (resid 17 and name HA )(resid 17 and name HD# ) 1.8 0.0 3.7 assign (resid 17 and name HN )(resid 17 and name HD# ) 1.8 0.0 3.7 assign (resid 19 and name HN )(resid 19 and name HB1 ) 1.8 0.0 1.7 assign (resid 19 and name HN )(resid 19 and name HB2 ) 1.8 0.0 1.7 assign (resid 21 and name HA )(resid 21 and name HD# ) 1.8 0.0 3.7 assign (resid 21 and name HB# )(resid 21 and name HE# ) 1.8 0.0 3.7 assign (resid 21 and name HN )(resid 21 and name HD# ) 1.8 0.0 3.7 assign (resid 21 and name HN )(resid 21 and name HE# ) 1.8 0.0 3.7 assign (resid 22 and name HA )(resid 22 and name HD1# ) 1.8 0.0 2.2 assign (resid 22 and name HG11 )(resid 22 and name HG2# ) 1.8 0.0 3.7 assign (resid 22 and name HG12 )(resid 22 and name HG2# ) 1.8 0.0 3.7 assign (resid 23 and name HN )(resid 23 and name HG1 ) 1.8 0.0 3.2 assign (resid 23 and name HN )(resid 23 and name HG2 ) 1.8 0.0 3.2 assign (resid 24 and name HN )(resid 24 and name HG2# ) 1.8 0.0 3.7 assign (resid 26 and name HN )(resid 26 and name HG# ) 1.8 0.0 3.7 assign (resid 27 and name HN )(resid 27 and name HB ) 1.8 0.0 1.7 assign (resid 27 and name HN )(resid 27 and name HG1# ) 1.8 0.0 3.7 assign (resid 27 and name HN )(resid 27 and name HG2# ) 1.8 0.0 3.7 assign (resid 29 and name HA )(resid 29 and name HD# ) 1.8 0.0 3.7 assign (resid 29 and name HN )(resid 29 and name HD# ) 1.8 0.0 3.7 assign (resid 33 and name HN )(resid 33 and name HD1# ) 1.8 0.0 3.7 assign (resid 33 and name HN )(resid 33 and name HG11 ) 1.8 0.0 3.2 assign (resid 33 and name HN )(resid 33 and name HG12 ) 1.8 0.0 3.2 assign (resid 35 and name HB# )(resid 35 and name HD# ) 1.8 0.0 3.7 assign (resid 38 and name HN )(resid 38 and name HG# ) 1.8 0.0 3.7 assign (resid 41 and name HA )(resid 41 and name HG1# ) 1.8 0.0 1.2 assign (resid 41 and name HN )(resid 41 and name HB ) 1.8 0.0 1.7 assign (resid 41 and name HN )(resid 41 and name HG1# ) 1.8 0.0 3.7 assign (resid 41 and name HN )(resid 41 and name HG2# ) 1.8 0.0 3.7 assign (resid 44 and name HA )(resid 44 and name HD1 ) 1.8 0.0 1.2 assign (resid 44 and name HB# )(resid 44 and name HE3 ) 1.8 0.0 3.7 assign (resid 46 and name HN )(resid 46 and name HB ) 1.8 0.0 1.7 assign (resid 46 and name HN )(resid 46 and name HG1# ) 1.8 0.0 3.7 assign (resid 46 and name HN )(resid 46 and name HG2# ) 1.8 0.0 3.7 assign (resid 47 and name HN )(resid 47 and name HG# ) 1.8 0.0 3.7 assign (resid 48 and name HN )(resid 48 and name HG1 ) 1.8 0.0 3.2 assign (resid 48 and name HN )(resid 48 and name HG2 ) 1.8 0.0 3.2 assign (resid 52 and name HA )(resid 52 and name HD1# ) 1.8 0.0 3.7 assign (resid 52 and name HN )(resid 52 and name HD1# ) 1.8 0.0 3.7 assign (resid 52 and name HN )(resid 52 and name HG1# ) 1.8 0.0 3.7 assign (resid 53 and name HN )(resid 53 and name HG2# ) 1.8 0.0 3.7 assign (resid 55 and name HN )(resid 55 and name HB# ) 1.8 0.0 1.7 assign (resid 55 and name HN )(resid 55 and name HG ) 1.8 0.0 3.2 assign (resid 56 and name HA )(resid 56 and name HD1# ) 1.8 0.0 3.7 assign (resid 56 and name HA )(resid 56 and name HD2# ) 1.8 0.0 3.7 assign (resid 56 and name HN )(resid 56 and name HD1# ) 1.8 0.0 3.7 assign (resid 56 and name HN )(resid 56 and name HD2# ) 1.8 0.0 3.7 assign (resid 56 and name HN )(resid 56 and name HG ) 1.8 0.0 3.2 assign (resid 57 and name HA )(resid 57 and name HD2# ) 1.8 0.0 3.7 assign (resid 57 and name HB# )(resid 57 and name HD2# ) 1.8 0.0 3.7 assign (resid 57 and name HN )(resid 57 and name HD2# ) 1.8 0.0 3.7 assign (resid 57 and name HN )(resid 57 and name HG ) 1.8 0.0 3.2 assign (resid 58 and name HB# )(resid 58 and name HE2# ) 1.8 0.0 3.7 assign (resid 58 and name HG# )(resid 58 and name HE2# ) 1.8 0.0 3.7 assign (resid 58 and name HN )(resid 58 and name HG# ) 1.8 0.0 3.7 assign (resid 59 and name HN )(resid 59 and name HG1 ) 1.8 0.0 3.2 assign (resid 59 and name HN )(resid 59 and name HG2 ) 1.8 0.0 3.2 assign (resid 63 and name HA )(resid 63 and name HD1# ) 1.8 0.0 3.7 assign (resid 63 and name HA )(resid 63 and name HD2# ) 1.8 0.0 3.7 assign (resid 63 and name HN )(resid 63 and name HD1# ) 1.8 0.0 3.7 assign (resid 63 and name HN )(resid 63 and name HD2# ) 1.8 0.0 3.7 assign (resid 91 and name HA )(resid 91 and name HG2# ) 1.8 0.0 1.2 assign (resid 91 and name HN )(resid 91 and name HG1# ) 1.8 0.0 3.7 assign (resid 91 and name HN )(resid 91 and name HG2# ) 1.8 0.0 3.7 assign (resid 92 and name HA )(resid 92 and name HD1# ) 1.8 0.0 3.7 assign (resid 92 and name HN )(resid 92 and name HD2# ) 1.8 0.0 3.7 assign (resid 93 and name HA )(resid 93 and name HD1# ) 1.8 0.0 3.7 assign (resid 93 and name HA )(resid 93 and name HD2# ) 1.8 0.0 2.2 assign (resid 93 and name HN )(resid 93 and name HD1# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 93 and name HD2# ) 1.8 0.0 3.7 assign (resid 93 and name HN )(resid 93 and name HG ) 1.8 0.0 3.2 assign (resid 94 and name HN )(resid 94 and name HG1# ) 1.8 0.0 3.7 assign (resid 94 and name HN )(resid 94 and name HG2# ) 1.8 0.0 3.7 assign (resid 96 and name HN )(resid 96 and name HG2# ) 1.8 0.0 3.7 assign (resid 100 and name HN )(resid 100 and name HB1 ) 1.8 0.0 1.7 assign (resid 100 and name HN )(resid 100 and name HB2 ) 1.8 0.0 1.7 assign (resid 100 and name HN )(resid 100 and name HG# ) 1.8 0.0 3.7 assign (resid 103 and name HA )(resid 103 and name HD1# ) 1.8 0.0 3.7 assign (resid 103 and name HA )(resid 103 and name HD2# ) 1.8 0.0 2.2 assign (resid 103 and name HN )(resid 103 and name HD1# ) 1.8 0.0 3.7 assign (resid 103 and name HN )(resid 103 and name HD2# ) 1.8 0.0 3.7 assign (resid 103 and name HN )(resid 103 and name HG ) 1.8 0.0 3.2 assign (resid 106 and name HN )(resid 106 and name HG1 ) 1.8 0.0 3.2 assign (resid 106 and name HN )(resid 106 and name HG2 ) 1.8 0.0 3.2 assign (resid 107 and name HN )(resid 107 and name HG1 ) 1.8 0.0 3.2 assign (resid 107 and name HN )(resid 107 and name HG2 ) 1.8 0.0 3.2 assign (resid 108 and name HN )(resid 108 and name HG1# ) 1.8 0.0 3.7 assign (resid 108 and name HN )(resid 108 and name HG2# ) 1.8 0.0 3.7 assign (resid 109 and name HN )(resid 109 and name HB1 ) 1.8 0.0 1.7 assign (resid 109 and name HN )(resid 109 and name HB2 ) 1.8 0.0 1.7 assign (resid 111 and name HA )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 111 and name HN )(resid 111 and name HD1# ) 1.8 0.0 3.7 assign (resid 111 and name HN )(resid 111 and name HD2# ) 1.8 0.0 3.7 assign (resid 111 and name HN )(resid 111 and name HG ) 1.8 0.0 3.2 assign (resid 112 and name HA 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1.8 0.0 3.7 assign (resid 118 and name HN )(resid 118 and name HG2# ) 1.8 0.0 3.7 assign (resid 119 and name HN )(resid 119 and name HG# ) 1.8 0.0 3.7 assign (resid 121 and name HA )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HB# )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HG# )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HN )(resid 121 and name HB# ) 1.8 0.0 1.7 assign (resid 121 and name HN )(resid 121 and name HE# ) 1.8 0.0 3.7 assign (resid 121 and name HN )(resid 121 and name HG1 ) 1.8 0.0 3.2 assign (resid 121 and name HN )(resid 121 and name HG2 ) 1.8 0.0 3.2 assign (resid 123 and name HN )(resid 123 and name HG2# ) 1.8 0.0 3.7 assign (resid 124 and name HN )(resid 124 and name HG1 ) 1.8 0.0 3.2 assign (resid 124 and name HN )(resid 124 and name HG2 ) 1.8 0.0 3.2 assign (resid 129 and name HN )(resid 129 and name HG2# ) 1.8 0.0 3.7 assign (resid 132 and name HA )(resid 132 and name HD1# ) 1.8 0.0 3.7 assign (resid 132 and name HG11 )(resid 132 and name HG2# ) 1.8 0.0 3.7 assign (resid 132 and name HG12 )(resid 132 and name HG2# ) 1.8 0.0 3.7 assign (resid 132 and name HN )(resid 132 and name HB ) 1.8 0.0 1.7 assign (resid 132 and name HN )(resid 132 and name HD1# ) 1.8 0.0 3.7 assign (resid 132 and name HN )(resid 132 and name HG11 ) 1.8 0.0 3.2 assign (resid 132 and name HN )(resid 132 and name HG12 ) 1.8 0.0 3.2 assign (resid 133 and name HA )(resid 133 and name HD1# ) 1.8 0.0 3.7 assign (resid 133 and name HA )(resid 133 and name HD2# ) 1.8 0.0 2.2 assign (resid 133 and name HN )(resid 133 and name HD1# ) 1.8 0.0 3.7 assign (resid 133 and name HN )(resid 133 and name HD2# ) 1.8 0.0 3.7 assign (resid 133 and name HN )(resid 133 and name HG ) 1.8 0.0 3.2 assign (resid 134 and name HA )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 134 and name HB1 )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 134 and name HB2 )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 134 and name HG# )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 134 and name HN )(resid 134 and name HE# ) 1.8 0.0 3.7 assign (resid 136 and name HN )(resid 136 and name HG1 ) 1.8 0.0 3.2 assign (resid 136 and name HN )(resid 136 and name HG2 ) 1.8 0.0 3.2 assign (resid 138 and name HN )(resid 138 and name HB1 ) 1.8 0.0 1.7 assign (resid 138 and name HN )(resid 138 and name HB2 ) 1.8 0.0 1.7 assign (resid 139 and name HA )(resid 139 and name HD# ) 1.8 0.0 3.7 assign (resid 139 and name HN )(resid 139 and name HG# ) 1.8 0.0 3.7 assign (resid 140 and name HN )(resid 140 and name HG1# ) 1.8 0.0 2.2 assign (resid 140 and name HN )(resid 140 and name HG2# ) 1.8 0.0 3.7 assign (resid 141 and name HN )(resid 141 and name HG1# ) 1.8 0.0 3.7 assign (resid 141 and name HN )(resid 141 and name HG2# ) 1.8 0.0 3.7 assign (resid 142 and name HN )(resid 142 and name HG1# ) 1.8 0.0 3.7 assign (resid 142 and name HN )(resid 142 and name HG2# ) 1.8 0.0 3.7 assign (resid 144 and name HA )(resid 144 and name HD1# ) 1.8 0.0 3.7 assign (resid 144 and name HA )(resid 144 and name HD2# ) 1.8 0.0 3.7 assign (resid 144 and name HN )(resid 144 and name HD1# ) 1.8 0.0 3.7 assign (resid 144 and name HN )(resid 144 and name HD2# ) 1.8 0.0 3.7 assign (resid 145 and name HA )(resid 145 and name HD2# ) 1.8 0.0 3.7 remarks other sequential assign (resid 44 and name HD1 )(resid 45 and name HD# ) 1.8 0.0 3.2 ! assign (resid 22 and name O )(resid 29 and name N ) 2.70 0.00 0.60 assign (resid 22 and name O )(resid 29 and name HN ) 1.70 0.00 0.60 assign (resid 33 and name O )(resid 144 and name N ) 2.70 0.00 0.60 assign (resid 33 and name O )(resid 144 and name HN ) 1.70 0.00 0.60 assign (resid 34 and name O )(resid 42 and name N ) 2.70 0.00 0.60 assign (resid 34 and name O )(resid 42 and name HN ) 1.70 0.00 0.60 assign (resid 35 and name O )(resid 142 and name N ) 2.70 0.00 0.60 assign (resid 35 and name O )(resid 142 and name HN ) 1.70 0.00 0.60 assign (resid 42 and name O )(resid 34 and name N ) 2.70 0.00 0.60 assign (resid 42 and name O )(resid 34 and name HN ) 1.70 0.00 0.60 assign (resid 53 and name O )(resid 57 and name N ) 2.70 0.00 0.60 assign (resid 53 and name O )(resid 57 and name HN ) 1.70 0.00 0.60 assign (resid 54 and name O )(resid 58 and name N ) 2.70 0.00 0.60 assign (resid 54 and name O )(resid 58 and name HN ) 1.70 0.00 0.60 assign (resid 55 and name O )(resid 59 and name N ) 2.70 0.00 0.60 assign (resid 55 and name O )(resid 59 and name HN ) 1.70 0.00 0.60 assign (resid 56 and name O )(resid 60 and name N ) 2.70 0.00 0.60 assign (resid 56 and name O )(resid 60 and name HN ) 1.70 0.00 0.60 assign (resid 57 and name O )(resid 61 and name N ) 2.70 0.00 0.60 assign (resid 57 and name O )(resid 61 and name HN ) 1.70 0.00 0.60 assign (resid 90 and name O )(resid 117 and name N ) 2.70 0.00 0.60 assign (resid 90 and name O )(resid 117 and name HN ) 1.70 0.00 0.60 assign (resid 91 and name O )(resid 141 and name N ) 2.70 0.00 0.60 assign (resid 91 and name O )(resid 141 and name HN 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name O )(resid 127 and name N ) 2.70 0.00 0.60 assign (resid 123 and name O )(resid 127 and name HN ) 1.70 0.00 0.60 assign (resid 124 and name O )(resid 128 and name N ) 2.70 0.00 0.60 assign (resid 124 and name O )(resid 128 and name HN ) 1.70 0.00 0.60 assign (resid 125 and name O )(resid 129 and name N ) 2.70 0.00 0.60 assign (resid 125 and name O )(resid 129 and name HN ) 1.70 0.00 0.60 assign (resid 126 and name O )(resid 130 and name N ) 2.70 0.00 0.60 assign (resid 126 and name O )(resid 130 and name HN ) 1.70 0.00 0.60 assign (resid 127 and name O )(resid 131 and name N ) 2.70 0.00 0.60 assign (resid 127 and name O )(resid 131 and name HN ) 1.70 0.00 0.60 assign (resid 128 and name O )(resid 132 and name N ) 2.70 0.00 0.60 assign (resid 128 and name O )(resid 132 and name HN ) 1.70 0.00 0.60 assign (resid 129 and name O )(resid 133 and name N ) 2.70 0.00 0.60 assign (resid 129 and name O )(resid 133 and name HN ) 1.70 0.00 0.60 assign (resid 130 and name O )(resid 134 and name N ) 2.70 0.00 0.60 assign (resid 130 and name O )(resid 134 and name HN ) 1.70 0.00 0.60 assign (resid 132 and name O )(resid 136 and name N ) 2.70 0.00 0.60 assign (resid 132 and name O )(resid 136 and name HN ) 1.70 0.00 0.60 assign (resid 139 and name O )(resid 91 and name N ) 2.70 0.00 0.60 assign (resid 139 and name O )(resid 91 and name HN ) 1.70 0.00 0.60 assign (resid 141 and name O )(resid 93 and name N ) 2.70 0.00 0.60 assign (resid 141 and name O )(resid 93 and name HN ) 1.70 0.00 0.60 assign (resid 142 and name O )(resid 35 and name N ) 2.70 0.00 0.60 assign (resid 142 and name O )(resid 35 and name HN ) 1.70 0.00 0.60 assign (resid 143 and name O )(resid 95 and name N ) 2.70 0.00 0.60 assign (resid 143 and name O )(resid 95 and name HN ) 1.70 0.00 0.60 assign (resid 144 and name O )(resid 33 and name N ) 2.70 0.00 0.60 assign (resid 144 and name O )(resid 33 and name HN ) 1.70 0.00 0.60 ! PHI for VAL 14 assign (resid 13 and name C ) (resid 14 and name N ) (resid 14 and name CA ) (resid 14 and name C ) 1.0 -86.67 30 2 ! PSI for VAL 14 assign (resid 14 and name N ) (resid 14 and name CA ) (resid 14 and name C ) (resid 15 and name N ) 1.0 124.55 40 2 ! PHI for TYR 21 assign (resid 20 and name C ) (resid 21 and name N ) (resid 21 and name CA ) (resid 21 and name C ) 1.0 -141.69 30 2 ! PSI for TYR 21 assign (resid 21 and name N ) (resid 21 and name CA ) (resid 21 and name C ) (resid 22 and name N ) 1.0 155.87 40 2 ! PHI for ILE 22 assign (resid 21 and name C ) (resid 22 and name N ) (resid 22 and name CA ) (resid 22 and name C ) 1.0 -126.97 30 2 ! PSI for ILE 22 assign (resid 22 and name N ) (resid 22 and name CA ) (resid 22 and name C ) (resid 23 and name N ) 1.0 134.31 40 2 ! PHI for GLU 23 assign (resid 22 and name C ) (resid 23 and name N ) (resid 23 and name CA ) (resid 23 and name C ) 1.0 -119.46 30 2 ! PSI for GLU 23 assign (resid 23 and name N ) (resid 23 and name CA ) (resid 23 and name C ) (resid 24 and name N ) 1.0 132.83 40 2 ! PHI for VAL 24 assign (resid 23 and name C ) (resid 24 and name N ) (resid 24 and name CA ) (resid 24 and name C ) 1.0 -117.02 30 2 ! PSI for VAL 24 assign (resid 24 and name N ) (resid 24 and name CA ) (resid 24 and name C ) (resid 25 and name N ) 1.0 136.05 40 2 ! PHI for PHE 29 assign (resid 28 and name C ) (resid 29 and name N ) (resid 29 and name CA ) (resid 29 and name C ) 1.0 -91.22 30 2 ! PSI for PHE 29 assign (resid 29 and name N ) (resid 29 and name CA ) (resid 29 and name C ) (resid 30 and name N ) 1.0 129.32 40 2 ! PHI for HIS 31 assign (resid 30 and name C ) (resid 31 and name N ) (resid 31 and name CA ) (resid 31 and name C ) 1.0 -146.17 30 2 ! PSI for HIS 31 assign (resid 31 and name N ) (resid 31 and name CA ) (resid 31 and name C ) (resid 32 and name N ) 1.0 161.94 40 2 ! PHI for ILE 33 assign (resid 32 and name C ) (resid 33 and name N ) (resid 33 and name CA ) (resid 33 and name C ) 1.0 -141.25 30 2 ! PSI for ILE 33 assign (resid 33 and name N ) (resid 33 and name CA ) (resid 33 and name C ) (resid 34 and name N ) 1.0 158.03 40 2 ! PHI for ALA 34 assign (resid 33 and name C ) (resid 34 and name N ) (resid 34 and name CA ) (resid 34 and name C ) 1.0 -132.48 30 2 ! PSI for ALA 34 assign (resid 34 and name N ) (resid 34 and name CA ) (resid 34 and name C ) (resid 35 and name N ) 1.0 149.66 40 2 ! PHI for PHE 35 assign (resid 34 and name C ) (resid 35 and name N ) (resid 35 and name CA ) (resid 35 and name C ) 1.0 -154.85 30 2 ! PSI for PHE 35 assign (resid 35 and name N ) (resid 35 and name CA ) (resid 35 and name C ) (resid 36 and name N ) 1.0 158.55 40 2 ! PHI for ALA 36 assign (resid 35 and name C ) (resid 36 and name N ) (resid 36 and name CA ) (resid 36 and name C ) 1.0 -109.4 30 2 ! PSI for ALA 36 assign (resid 36 and name N ) (resid 36 and name CA ) (resid 36 and name C ) (resid 37 and name N ) 1.0 130.17 40 2 ! PHI for VAL 41 assign (resid 40 and name C ) (resid 41 and name N ) (resid 41 and name CA ) (resid 41 and name C ) 1.0 -84.29 30 2 ! PSI for VAL 41 assign (resid 41 and name N ) (resid 41 and name CA ) (resid 41 and name C ) (resid 42 and name N ) 1.0 124.79 40 2 ! PHI for SER 43 assign (resid 42 and name C ) (resid 43 and name N ) (resid 43 and name CA ) (resid 43 and name C ) 1.0 -97.04 30 2 ! PSI for SER 43 assign (resid 43 and name N ) (resid 43 and name CA ) (resid 43 and name C ) (resid 44 and name N ) 1.0 137.82 40 2 ! PHI for TRP 44 assign (resid 43 and name C ) (resid 44 and name N ) (resid 44 and name CA ) (resid 44 and name C ) 1.0 -128.18 30 2 ! PSI for TRP 44 assign (resid 44 and name N ) (resid 44 and name CA ) (resid 44 and name C ) (resid 45 and name N ) 1.0 148.26 40 2 ! PHI for VAL 46 assign (resid 45 and name C ) (resid 46 and name N ) (resid 46 and name CA ) (resid 46 and name C ) 1.0 -116.06 30 2 ! PSI for VAL 46 assign (resid 46 and name N ) (resid 46 and name CA ) (resid 46 and name C ) (resid 47 and name N ) 1.0 136.48 40 2 ! PHI for ALA 50 assign (resid 49 and name C ) (resid 50 and name N ) (resid 50 and name CA ) (resid 50 and name C ) 1.0 -65.49 30 2 ! PSI for ALA 50 assign (resid 50 and name N ) (resid 50 and name CA ) (resid 50 and name C ) (resid 51 and name N ) 1.0 -29.98 40 2 ! PHI for SER 55 assign (resid 54 and name C ) (resid 55 and name N ) (resid 55 and name CA ) (resid 55 and name C ) 1.0 -64.12 30 2 ! PSI for SER 55 assign (resid 55 and name N ) (resid 55 and name CA ) (resid 55 and name C ) (resid 56 and name N ) 1.0 -41.08 40 2 ! PHI for LEU 56 assign (resid 55 and name C ) (resid 56 and name N ) (resid 56 and name CA ) (resid 56 and name C ) 1.0 -65.95 30 2 ! PSI for LEU 56 assign (resid 56 and name N ) (resid 56 and name CA ) (resid 56 and name C ) (resid 57 and name N ) 1.0 -37.88 40 2 ! PHI for LEU 57 assign (resid 56 and name C ) (resid 57 and name N ) (resid 57 and name CA ) (resid 57 and name C ) 1.0 -62.26 30 2 ! PSI for LEU 57 assign (resid 57 and name N ) (resid 57 and name CA ) (resid 57 and name C ) (resid 58 and name N ) 1.0 -45.16 40 2 ! PHI for GLN 58 assign (resid 57 and name C ) (resid 58 and name N ) (resid 58 and name CA ) (resid 58 and name C ) 1.0 -64.57 30 2 ! PSI for GLN 58 assign (resid 58 and name N ) (resid 58 and name CA ) (resid 58 and name C ) (resid 59 and name N ) 1.0 -42.93 40 2 ! PHI for GLN 59 assign (resid 58 and name C ) (resid 59 and name N ) (resid 59 and name CA ) (resid 59 and name C ) 1.0 -63.96 30 2 ! PSI for GLN 59 assign (resid 59 and name N ) (resid 59 and name CA ) (resid 59 and name C ) (resid 60 and name N ) 1.0 -39.68 40 2 ! PHI for ALA 60 assign (resid 59 and name C ) (resid 60 and name N ) (resid 60 and name CA ) (resid 60 and name C ) 1.0 -65.92 30 2 ! PSI for ALA 60 assign (resid 60 and name N ) (resid 60 and name CA ) (resid 60 and name C ) (resid 61 and name N ) 1.0 -28.85 40 2 ! PHI for LEU 71 assign (resid 70 and name C ) (resid 71 and name N ) (resid 71 and name CA ) (resid 71 and name C ) 1.0 -84.16 30 2 ! PSI for LEU 71 assign (resid 71 and name N ) (resid 71 and name CA ) (resid 71 and name C ) (resid 72 and name N ) 1.0 -2.5 40 2 ! PHI for ARG 84 assign (resid 83 and name C ) (resid 84 and name N ) (resid 84 and name CA ) (resid 84 and name C ) 1.0 -100.17 30 2 ! PSI for ARG 84 assign (resid 84 and name N ) (resid 84 and name CA ) (resid 84 and name C ) (resid 85 and name N ) 1.0 147.4 40 2 ! PHI for VAL 91 assign (resid 90 and name C ) (resid 91 and name N ) (resid 91 and name CA ) (resid 91 and name C ) 1.0 -133.29 30 2 ! PSI for VAL 91 assign (resid 91 and name N ) (resid 91 and name CA ) (resid 91 and name C ) (resid 92 and name N ) 1.0 143.09 40 2 ! PHI for LEU 92 assign (resid 91 and name C ) (resid 92 and name N ) (resid 92 and name CA ) (resid 92 and name C ) 1.0 -115.42 30 2 ! PSI for LEU 92 assign (resid 92 and name N ) (resid 92 and name CA ) (resid 92 and name C ) (resid 93 and name N ) 1.0 127.9 40 2 ! PHI for LEU 93 assign (resid 92 and name C ) (resid 93 and name N ) (resid 93 and name CA ) (resid 93 and name C ) 1.0 -111.38 30 2 ! PSI for LEU 93 assign (resid 93 and name N ) (resid 93 and name CA ) (resid 93 and name C ) (resid 94 and name N ) 1.0 131.3 40 2 ! PHI for VAL 94 assign (resid 93 and name C ) (resid 94 and name N ) (resid 94 and name CA ) (resid 94 and name C ) 1.0 -120.57 30 2 ! PSI for VAL 94 assign (resid 94 and name N ) (resid 94 and name CA ) (resid 94 and name C ) (resid 95 and name N ) 1.0 137.3 40 2 ! PHI for GLY 104 assign (resid 103 and name C ) (resid 104 and name N ) (resid 104 and name CA ) (resid 104 and name C ) 1.0 -136.22 30 2 ! PSI for GLY 104 assign (resid 104 and name N ) (resid 104 and name CA ) (resid 104 and name C ) (resid 105 and name N ) 1.0 -178.28 40 2 ! PSI for PRO 105 assign (resid 105 and name N ) (resid 105 and name CA ) (resid 105 and name C ) (resid 106 and name N ) 1.0 -33.22 40 2 ! PHI for GLU 106 assign (resid 105 and name C ) (resid 106 and name N ) (resid 106 and name CA ) (resid 106 and name C ) 1.0 -66.83 30 2 ! PSI for GLU 106 assign (resid 106 and name N ) (resid 106 and name CA ) (resid 106 and name C ) (resid 107 and name N ) 1.0 -33.37 40 2 ! PHI for GLN 107 assign (resid 106 and name C ) (resid 107 and name N ) (resid 107 and name CA ) (resid 107 and name C ) 1.0 -66.18 30 2 ! PSI for GLN 107 assign (resid 107 and name N ) (resid 107 and name CA ) (resid 107 and name C ) (resid 108 and name N ) 1.0 -33.49 40 2 ! PHI for MET 114 assign (resid 113 and name C ) (resid 114 and name N ) (resid 114 and name CA ) (resid 114 and name C ) 1.0 -90.05 30 2 ! PSI for MET 114 assign (resid 114 and name N ) (resid 114 and name CA ) (resid 114 and name C ) (resid 115 and name N ) 1.0 -3.86 40 2 ! PHI for VAL 118 assign (resid 117 and name C ) (resid 118 and name N ) (resid 118 and name CA ) (resid 118 and name C ) 1.0 -111.96 30 2 ! PSI for VAL 118 assign (resid 118 and name N ) (resid 118 and name CA ) (resid 118 and name C ) (resid 119 and name N ) 1.0 136.7 40 2 ! PHI for GLU 119 assign (resid 118 and name C ) (resid 119 and name N ) (resid 119 and name CA ) (resid 119 and name C ) 1.0 -126.55 30 2 ! PSI for GLU 119 assign (resid 119 and name N ) (resid 119 and name CA ) (resid 119 and name C ) (resid 120 and name N ) 1.0 137.21 40 2 ! PHI for ALA 120 assign (resid 119 and name C ) (resid 120 and name N ) (resid 120 and name CA ) (resid 120 and name C ) 1.0 -108.42 30 2 ! PSI for ALA 120 assign (resid 120 and name N ) (resid 120 and name CA ) (resid 120 and name C ) (resid 121 and name N ) 1.0 135.81 40 2 ! PHI for MET 121 assign (resid 120 and name C ) (resid 121 and name N ) (resid 121 and name CA ) (resid 121 and name C ) 1.0 -143.97 30 2 ! PSI for MET 121 assign (resid 121 and name N ) (resid 121 and name CA ) (resid 121 and name C ) (resid 122 and name N ) 1.0 148.15 40 2 ! PHI for THR 123 assign (resid 122 and name C ) (resid 123 and name N ) (resid 123 and name CA ) (resid 123 and name C ) 1.0 -61.42 30 2 ! PSI for THR 123 assign (resid 123 and name N ) (resid 123 and name CA ) (resid 123 and name C ) (resid 124 and name N ) 1.0 -43.43 40 2 ! PHI for GLN 124 assign (resid 123 and name C ) (resid 124 and name N ) (resid 124 and name CA ) (resid 124 and name C ) 1.0 -60.9 30 2 ! PSI for GLN 124 assign (resid 124 and name N ) (resid 124 and name CA ) (resid 124 and name C ) (resid 125 and name N ) 1.0 -42.6 40 2 ! PHI for ALA 125 assign (resid 124 and name C ) (resid 125 and name N ) (resid 125 and name CA ) (resid 125 and name C ) 1.0 -65.28 30 2 ! PSI for ALA 125 assign (resid 125 and name N ) (resid 125 and name CA ) (resid 125 and name C ) (resid 126 and name N ) 1.0 -40.24 40 2 ! PHI for ALA 126 assign (resid 125 and name C ) (resid 126 and name N ) (resid 126 and name CA ) (resid 126 and name C ) 1.0 -65.9 30 2 ! PSI for ALA 126 assign (resid 126 and name N ) (resid 126 and name CA ) (resid 126 and name C ) (resid 127 and name N ) 1.0 -45.63 40 2 ! PHI for ALA 127 assign (resid 126 and name C ) (resid 127 and name N ) (resid 127 and name CA ) (resid 127 and name C ) 1.0 -60.33 30 2 ! PSI for ALA 127 assign (resid 127 and name N ) (resid 127 and name CA ) (resid 127 and name C ) (resid 128 and name N ) 1.0 -43.14 40 2 ! PHI for ARG 128 assign (resid 127 and name C ) (resid 128 and name N ) (resid 128 and name CA ) (resid 128 and name C ) 1.0 -64.12 30 2 ! PSI for ARG 128 assign (resid 128 and name N ) (resid 128 and name CA ) (resid 128 and name C ) (resid 129 and name N ) 1.0 -36.89 40 2 ! PHI for THR 129 assign (resid 128 and name C ) (resid 129 and name N ) (resid 129 and name CA ) (resid 129 and name C ) 1.0 -68.47 30 2 ! PSI for THR 129 assign (resid 129 and name N ) (resid 129 and name CA ) (resid 129 and name C ) (resid 130 and name N ) 1.0 -39.09 40 2 ! PHI for TYR 130 assign (resid 129 and name C ) (resid 130 and name N ) (resid 130 and name CA ) (resid 130 and name C ) 1.0 -64.09 30 2 ! PSI for TYR 130 assign (resid 130 and name N ) (resid 130 and name CA ) (resid 130 and name C ) (resid 131 and name N ) 1.0 -46.65 40 2 ! PHI for ASN 131 assign (resid 130 and name C ) (resid 131 and name N ) (resid 131 and name CA ) (resid 131 and name C ) 1.0 -63.09 30 2 ! PSI for ASN 131 assign (resid 131 and name N ) (resid 131 and name CA ) (resid 131 and name C ) (resid 132 and name N ) 1.0 -36.24 40 2 ! PHI for ILE 132 assign (resid 131 and name C ) (resid 132 and name N ) (resid 132 and name CA ) (resid 132 and name C ) 1.0 -66.5 30 2 ! PSI for ILE 132 assign (resid 132 and name N ) (resid 132 and name CA ) (resid 132 and name C ) (resid 133 and name N ) 1.0 -44.58 40 2 ! PHI for LEU 133 assign (resid 132 and name C ) (resid 133 and name N ) (resid 133 and name CA ) (resid 133 and name C ) 1.0 -65.06 30 2 ! PSI for LEU 133 assign (resid 133 and name N ) (resid 133 and name CA ) (resid 133 and name C ) (resid 134 and name N ) 1.0 -34.24 40 2 ! PHI for GLU 136 assign (resid 135 and name C ) (resid 136 and name N ) (resid 136 and name CA ) (resid 136 and name C ) 1.0 -83.99 30 2 ! PSI for GLU 136 assign (resid 136 and name N ) (resid 136 and name CA ) (resid 136 and name C ) (resid 137 and name N ) 1.0 -5.7 40 2 ! PHI for VAL 140 assign (resid 139 and name C ) (resid 140 and name N ) (resid 140 and name CA ) (resid 140 and name C ) 1.0 -133.38 30 2 ! PSI for VAL 140 assign (resid 140 and name N ) (resid 140 and name CA ) (resid 140 and name C ) (resid 141 and name N ) 1.0 147.66 40 2 ! PHI for VAL 141 assign (resid 140 and name C ) (resid 141 and name N ) (resid 141 and name CA ) (resid 141 and name C ) 1.0 -128.02 30 2 ! PSI for VAL 141 assign (resid 141 and name N ) (resid 141 and name CA ) (resid 141 and name C ) (resid 142 and name N ) 1.0 134.43 40 2 ! PHI for VAL 142 assign (resid 141 and name C ) (resid 142 and name N ) (resid 142 and name CA ) (resid 142 and name C ) 1.0 -115.74 30 2 ! PSI for VAL 142 assign (resid 142 and name N ) (resid 142 and name CA ) (resid 142 and name C ) (resid 143 and name N ) 1.0 132.69 40 2 ! PHI for ALA 143 assign (resid 142 and name C ) (resid 143 and name N ) (resid 143 and name CA ) (resid 143 and name C ) 1.0 -115.09 30 2 ! PSI for ALA 143 assign (resid 143 and name N ) (resid 143 and name CA ) (resid 143 and name C ) (resid 144 and name N ) 1.0 138.06 40 2 ! PHI for LEU 144 assign (resid 143 and name C ) (resid 144 and name N ) (resid 144 and name CA ) (resid 144 and name C ) 1.0 -130.61 30 2 ! PSI for LEU 144 assign (resid 144 and name N ) (resid 144 and name CA ) (resid 144 and name C ) (resid 145 and name N ) 1.0 150.97 40 2 ! PHI for LEU 145 assign (resid 144 and name C ) (resid 145 and name N ) (resid 145 and name CA ) (resid 145 and name C ) 1.0 -110.2 30 2 ! PSI for LEU 145 assign (resid 145 and name N ) (resid 145 and name CA ) (resid 145 and name C ) (resid 146 and name N ) 1.0 119.23 40 2 ! PHI for GLY 148 assign (resid 147 and name C ) (resid 148 and name N ) (resid 148 and name CA ) (resid 148 and name C ) 1.0 -170.29 30 2 ! PSI for GLY 148 assign (resid 148 and name N ) (resid 148 and name CA ) (resid 148 and name C ) (resid 149 and name N ) 1.0 -44.81 40 2 Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 1 HA MET 1 22.052 13.219 -28.531 2 H1 MET 1 1H MET 1 21.653 11.976 -31.193 3 H2 MET 1 2H MET 1 22.642 11.365 -29.958 4 H3 MET 1 3H MET 1 23.016 12.851 -30.680 5 HB2 MET 1 1HB MET 1 20.338 13.945 -30.902 6 HB3 MET 1 2HB MET 1 19.999 14.541 -29.284 7 HG2 MET 1 1HG MET 1 22.544 14.990 -30.822 8 HG3 MET 1 2HG MET 1 21.239 16.157 -30.619 9 HE1 MET 1 3HE MET 1 20.612 17.302 -28.307 10 HE2 MET 1 1HE MET 1 21.369 16.873 -26.773 11 HE3 MET 1 2HE MET 1 20.362 15.698 -27.619 12 H LYS 2 H LYS 2 21.410 10.395 -29.175 13 HA LYS 2 HA LYS 2 18.604 10.216 -28.388 14 HB2 LYS 2 1HB LYS 2 20.605 8.044 -29.057 15 HB3 LYS 2 2HB LYS 2 18.898 7.785 -28.717 16 HG2 LYS 2 1HG LYS 2 18.302 9.115 -30.677 17 HG3 LYS 2 2HG LYS 2 20.012 9.386 -31.013 18 HD2 LYS 2 1HD LYS 2 20.318 6.953 -31.270 19 HD3 LYS 2 2HD LYS 2 18.588 6.725 -31.003 20 HE2 LYS 2 1HE LYS 2 18.113 8.103 -32.975 21 HE3 LYS 2 2HE LYS 2 19.842 8.313 -33.244 22 HZ1 LYS 2 3HZ LYS 2 18.929 6.593 -34.664 23 HZ2 LYS 2 1HZ LYS 2 18.372 5.731 -33.313 24 HZ3 LYS 2 2HZ LYS 2 20.037 5.924 -33.569 25 H LEU 3 H LEU 3 18.084 10.202 -26.327 26 HA LEU 3 HA LEU 3 20.104 10.144 -24.308 27 HG LEU 3 HG LEU 3 17.915 12.206 -25.181 28 HB2 LEU 3 1HB LEU 3 17.097 10.173 -24.058 29 HB3 LEU 3 2HB LEU 3 18.225 10.448 -22.744 30 HD11 LEU 3 1HD1 LEU 3 16.980 13.824 -23.594 31 HD12 LEU 3 2HD1 LEU 3 17.066 12.610 -22.317 32 HD13 LEU 3 3HD1 LEU 3 16.001 12.362 -23.701 33 HD21 LEU 3 3HD2 LEU 3 20.203 12.182 -24.306 34 HD22 LEU 3 1HD2 LEU 3 19.591 12.571 -22.698 35 HD23 LEU 3 2HD2 LEU 3 19.414 13.732 -24.014 36 H HIS 4 H HIS 4 20.954 8.395 -23.443 37 HA HIS 4 HA HIS 4 19.745 5.807 -23.784 38 HD1 HIS 4 HD1 HIS 4 21.721 4.938 -25.496 39 HD2 HIS 4 HD2 HIS 4 24.061 7.694 -23.436 40 HE1 HIS 4 HE1 HIS 4 23.460 5.715 -27.135 41 HE2 HIS 4 HE2 HIS 4 24.978 7.223 -25.809 42 HB2 HIS 4 1HB HIS 4 22.110 6.505 -22.028 43 HB3 HIS 4 2HB HIS 4 21.691 4.922 -22.667 44 H THR 5 H THR 5 18.308 4.894 -22.446 45 HA THR 5 HA THR 5 17.814 6.148 -19.858 46 HB THR 5 HB THR 5 16.319 3.862 -21.166 47 HG1 THR 5 HG1 THR 5 16.429 6.299 -22.011 48 HG21 THR 5 3HG2 THR 5 14.526 4.461 -19.612 49 HG22 THR 5 1HG2 THR 5 15.536 5.730 -18.920 50 HG23 THR 5 2HG2 THR 5 15.996 4.037 -18.734 51 H ASP 6 H ASP 6 19.231 5.506 -18.348 52 HA ASP 6 HA ASP 6 20.195 2.762 -18.288 53 HB2 ASP 6 1HB ASP 6 20.836 5.094 -16.461 54 HB3 ASP 6 2HB ASP 6 21.654 3.535 -16.464 55 HA PRO 7 HA PRO 7 16.768 2.012 -15.505 56 HB2 PRO 7 1HB PRO 7 17.087 -0.792 -15.937 57 HB3 PRO 7 2HB PRO 7 15.894 0.284 -16.662 58 HG2 PRO 7 1HG PRO 7 17.942 -0.978 -18.035 59 HG3 PRO 7 2HG PRO 7 17.064 0.452 -18.602 60 HD2 PRO 7 1HD PRO 7 19.743 0.263 -17.293 61 HD3 PRO 7 2HD PRO 7 19.190 1.347 -18.590 62 H ALA 8 H ALA 8 17.096 2.115 -13.382 63 HA ALA 8 HA ALA 8 19.149 0.448 -12.139 64 HB1 ALA 8 3HB ALA 8 17.412 2.599 -10.921 65 HB2 ALA 8 1HB ALA 8 19.060 2.821 -11.509 66 HB3 ALA 8 2HB ALA 8 18.751 1.768 -10.129 67 H THR 9 H THR 9 18.642 -1.421 -11.191 68 HA THR 9 HA THR 9 15.987 -2.410 -11.382 69 HB THR 9 HB THR 9 17.258 -4.291 -9.900 70 HG1 THR 9 HG1 THR 9 19.282 -3.645 -9.742 71 HG21 THR 9 3HG2 THR 9 17.561 -3.832 -12.872 72 HG22 THR 9 1HG2 THR 9 16.199 -4.628 -12.083 73 HG23 THR 9 2HG2 THR 9 17.800 -5.367 -12.037 74 H ALA 10 H ALA 10 17.314 -0.450 -9.069 75 HA ALA 10 HA ALA 10 16.002 -1.588 -6.766 76 HB1 ALA 10 3HB ALA 10 17.219 1.148 -7.152 77 HB2 ALA 10 1HB ALA 10 18.048 -0.268 -6.505 78 HB3 ALA 10 2HB ALA 10 16.705 0.450 -5.616 79 H LEU 11 H LEU 11 15.081 0.271 -9.429 80 HA LEU 11 HA LEU 11 12.880 1.612 -8.085 81 HG LEU 11 HG LEU 11 14.112 4.029 -10.673 82 HB2 LEU 11 1HB LEU 11 13.915 1.627 -10.910 83 HB3 LEU 11 2HB LEU 11 12.361 2.326 -10.511 84 HD11 LEU 11 1HD1 LEU 11 12.236 4.423 -9.186 85 HD12 LEU 11 2HD1 LEU 11 13.710 5.148 -8.544 86 HD13 LEU 11 3HD1 LEU 11 13.101 3.639 -7.865 87 HD21 LEU 11 3HD2 LEU 11 15.890 4.158 -8.995 88 HD22 LEU 11 1HD2 LEU 11 16.038 2.712 -9.995 89 HD23 LEU 11 2HD2 LEU 11 15.396 2.589 -8.357 90 H ASN 12 H ASN 12 11.719 -0.231 -7.401 91 HA ASN 12 HA ASN 12 10.780 -2.214 -9.215 92 HB2 ASN 12 1HB ASN 12 9.988 -1.449 -6.408 93 HB3 ASN 12 2HB ASN 12 9.131 -2.700 -7.302 94 HD21 ASN 12 2HD2 ASN 12 10.755 -2.883 -4.858 95 HD22 ASN 12 1HD2 ASN 12 11.986 -4.046 -5.213 96 H THR 13 H THR 13 9.531 -1.672 -10.871 97 HA THR 13 HA THR 13 7.333 0.230 -10.387 98 HB THR 13 HB THR 13 8.925 0.083 -12.952 99 HG1 THR 13 HG1 THR 13 10.269 0.789 -11.219 100 HG21 THR 13 3HG2 THR 13 7.051 2.181 -11.840 101 HG22 THR 13 1HG2 THR 13 6.684 1.058 -13.150 102 HG23 THR 13 2HG2 THR 13 7.929 2.290 -13.367 103 H VAL 14 H VAL 14 5.458 -0.061 -11.634 104 HA VAL 14 HA VAL 14 4.792 -2.731 -12.338 105 HB VAL 14 HB VAL 14 3.310 -0.160 -12.942 106 HG11 VAL 14 1HG1 VAL 14 1.323 -1.583 -13.114 107 HG12 VAL 14 2HG1 VAL 14 2.334 -3.013 -12.902 108 HG13 VAL 14 3HG1 VAL 14 2.533 -1.995 -14.329 109 HG21 VAL 14 3HG2 VAL 14 1.993 -0.677 -10.938 110 HG22 VAL 14 1HG2 VAL 14 3.696 -0.425 -10.556 111 HG23 VAL 14 2HG2 VAL 14 3.039 -2.060 -10.614 112 H THR 15 H THR 15 5.160 -3.747 -14.213 113 HA THR 15 HA THR 15 6.272 -2.219 -16.425 114 HB THR 15 HB THR 15 6.650 -4.564 -17.390 115 HG1 THR 15 HG1 THR 15 5.510 -5.987 -16.261 116 HG21 THR 15 3HG2 THR 15 8.435 -3.240 -16.378 117 HG22 THR 15 1HG2 THR 15 8.612 -4.944 -15.961 118 HG23 THR 15 2HG2 THR 15 7.965 -3.809 -14.777 119 H ALA 16 H ALA 16 3.339 -3.766 -15.537 120 HA ALA 16 HA ALA 16 2.021 -2.714 -17.859 121 HB1 ALA 16 3HB ALA 16 2.081 -5.710 -17.474 122 HB2 ALA 16 1HB ALA 16 2.816 -4.819 -18.806 123 HB3 ALA 16 2HB ALA 16 1.062 -4.844 -18.623 124 H TYR 17 H TYR 17 -0.146 -2.376 -17.452 125 HA TYR 17 HA TYR 17 -0.928 -2.625 -14.689 126 HD1 TYR 17 HD1 TYR 17 -1.123 -0.100 -13.958 127 HD2 TYR 17 HD2 TYR 17 -4.789 -1.488 -15.612 128 HE1 TYR 17 HE1 TYR 17 -2.348 0.954 -12.107 129 HE2 TYR 17 HE2 TYR 17 -6.027 -0.438 -13.762 130 HH TYR 17 HH TYR 17 -5.660 0.342 -11.495 131 HB2 TYR 17 1HB TYR 17 -1.446 -0.739 -16.468 132 HB3 TYR 17 2HB TYR 17 -2.826 -1.766 -16.828 133 H GLY 18 H GLY 18 -2.985 -3.331 -17.494 134 HA2 GLY 18 1HA GLY 18 -3.950 -5.370 -18.111 135 HA3 GLY 18 2HA GLY 18 -3.269 -6.108 -16.670 136 H ASP 19 H ASP 19 -5.885 -6.576 -17.516 137 HA ASP 19 HA ASP 19 -7.484 -5.128 -15.535 138 HB2 ASP 19 1HB ASP 19 -8.210 -6.637 -18.037 139 HB3 ASP 19 2HB ASP 19 -9.403 -6.201 -16.830 140 H GLY 20 H GLY 20 -7.602 -6.161 -13.659 141 HA2 GLY 20 1HA GLY 20 -8.482 -7.923 -12.337 142 HA3 GLY 20 2HA GLY 20 -8.230 -9.024 -13.684 143 H TYR 21 H TYR 21 -5.562 -7.108 -13.404 144 HA TYR 21 HA TYR 21 -4.203 -8.438 -11.271 145 HD1 TYR 21 HD1 TYR 21 -5.292 -9.864 -15.039 146 HD2 TYR 21 HD2 TYR 21 -1.359 -8.357 -14.435 147 HE1 TYR 21 HE1 TYR 21 -5.068 -9.493 -17.457 148 HE2 TYR 21 HE2 TYR 21 -1.127 -7.980 -16.853 149 HH TYR 21 HH TYR 21 -3.807 -8.166 -18.995 150 HB2 TYR 21 1HB TYR 21 -2.504 -9.557 -12.673 151 HB3 TYR 21 2HB TYR 21 -4.105 -10.240 -12.931 152 H ILE 22 H ILE 22 -1.817 -7.813 -11.351 153 HA ILE 22 HA ILE 22 -1.301 -5.351 -12.875 154 HB ILE 22 HB ILE 22 -0.761 -5.686 -9.906 155 HG12 ILE 22 1HG1 ILE 22 -2.585 -3.725 -11.317 156 HG13 ILE 22 2HG1 ILE 22 -3.137 -5.190 -10.514 157 HG21 ILE 22 1HG2 ILE 22 1.027 -4.470 -11.027 158 HG22 ILE 22 2HG2 ILE 22 0.087 -3.390 -9.997 159 HG23 ILE 22 3HG2 ILE 22 -0.153 -3.373 -11.745 160 HD11 ILE 22 3HD1 ILE 22 -2.277 -4.333 -8.390 161 HD12 ILE 22 1HD1 ILE 22 -3.477 -3.258 -9.108 162 HD13 ILE 22 2HD1 ILE 22 -1.763 -2.857 -9.208 163 H GLU 23 H GLU 23 0.636 -5.512 -13.875 164 HA GLU 23 HA GLU 23 2.300 -7.818 -13.197 165 HB2 GLU 23 1HB GLU 23 1.541 -7.483 -15.542 166 HB3 GLU 23 2HB GLU 23 2.459 -5.984 -15.595 167 HG2 GLU 23 1HG GLU 23 4.504 -7.337 -15.072 168 HG3 GLU 23 2HG GLU 23 3.520 -8.778 -15.317 169 H VAL 24 H VAL 24 3.810 -7.424 -11.722 170 HA VAL 24 HA VAL 24 5.452 -4.987 -12.025 171 HB VAL 24 HB VAL 24 5.008 -6.596 -9.498 172 HG11 VAL 24 1HG1 VAL 24 6.504 -4.019 -9.972 173 HG12 VAL 24 2HG1 VAL 24 7.207 -5.580 -9.549 174 HG13 VAL 24 3HG1 VAL 24 6.181 -4.731 -8.391 175 HG21 VAL 24 3HG2 VAL 24 3.752 -4.650 -8.694 176 HG22 VAL 24 1HG2 VAL 24 2.998 -5.367 -10.119 177 HG23 VAL 24 2HG2 VAL 24 3.938 -3.883 -10.271 178 H ASN 25 H ASN 25 7.512 -5.344 -12.625 179 HA ASN 25 HA ASN 25 9.451 -6.417 -13.185 180 HB2 ASN 25 1HB ASN 25 9.470 -6.832 -10.686 181 HB3 ASN 25 2HB ASN 25 8.744 -8.400 -11.004 182 HD21 ASN 25 2HD2 ASN 25 11.190 -6.898 -13.028 183 HD22 ASN 25 1HD2 ASN 25 12.449 -8.029 -12.671 184 H GLN 26 H GLN 26 6.946 -7.046 -14.431 185 HA GLN 26 HA GLN 26 5.985 -8.413 -15.928 186 HB2 GLN 26 1HB GLN 26 8.656 -9.807 -15.866 187 HB3 GLN 26 2HB GLN 26 7.354 -10.241 -16.966 188 HG2 GLN 26 1HG GLN 26 7.434 -7.700 -17.578 189 HG3 GLN 26 2HG GLN 26 9.065 -7.807 -16.917 190 HE21 GLN 26 2HE2 GLN 26 8.202 -7.297 -19.641 191 HE22 GLN 26 1HE2 GLN 26 8.910 -8.534 -20.620 192 H VAL 27 H VAL 27 6.281 -9.123 -12.899 193 HA VAL 27 HA VAL 27 5.129 -11.810 -13.103 194 HB VAL 27 HB VAL 27 5.720 -10.210 -10.601 195 HG11 VAL 27 1HG1 VAL 27 5.075 -13.134 -10.982 196 HG12 VAL 27 2HG1 VAL 27 3.996 -11.912 -10.309 197 HG13 VAL 27 3HG1 VAL 27 5.472 -12.354 -9.451 198 HG21 VAL 27 3HG2 VAL 27 7.787 -10.691 -11.799 199 HG22 VAL 27 1HG2 VAL 27 7.347 -12.396 -11.901 200 HG23 VAL 27 2HG2 VAL 27 7.679 -11.663 -10.332 201 H ARG 28 H ARG 28 3.038 -11.847 -13.525 202 HA ARG 28 HA ARG 28 1.428 -9.486 -13.034 203 HE ARG 28 HE ARG 28 2.160 -9.684 -17.944 204 HB2 ARG 28 1HB ARG 28 0.736 -12.082 -14.423 205 HB3 ARG 28 2HB ARG 28 -0.264 -10.633 -14.398 206 HG2 ARG 28 1HG ARG 28 1.397 -9.400 -15.618 207 HG3 ARG 28 2HG ARG 28 2.518 -10.757 -15.535 208 HD2 ARG 28 1HD ARG 28 0.949 -12.101 -16.872 209 HD3 ARG 28 2HD ARG 28 -0.120 -10.702 -16.991 210 HH11 ARG 28 1HH1 ARG 28 0.526 -12.713 -18.678 211 HH12 ARG 28 2HH1 ARG 28 1.160 -12.788 -20.297 212 HH21 ARG 28 1HH2 ARG 28 2.957 -9.801 -20.074 213 HH22 ARG 28 2HH2 ARG 28 2.516 -11.144 -21.090 214 H PHE 29 H PHE 29 0.975 -9.359 -10.912 215 HA PHE 29 HA PHE 29 -0.043 -11.644 -9.453 216 HD1 PHE 29 HD1 PHE 29 1.310 -11.730 -6.813 217 HD2 PHE 29 HD2 PHE 29 2.558 -8.471 -9.249 218 HE1 PHE 29 HE1 PHE 29 3.652 -12.161 -6.184 219 HE2 PHE 29 HE2 PHE 29 4.901 -8.900 -8.628 220 HZ PHE 29 HZ PHE 29 5.449 -10.747 -7.095 221 HB2 PHE 29 1HB PHE 29 0.256 -8.740 -8.655 222 HB3 PHE 29 2HB PHE 29 -0.271 -10.025 -7.577 223 H SER 30 H SER 30 -2.089 -12.248 -9.674 224 HA SER 30 HA SER 30 -4.097 -10.351 -10.578 225 HG SER 30 HG SER 30 -3.803 -14.304 -10.908 226 HB2 SER 30 1HB SER 30 -5.495 -12.569 -10.473 227 HB3 SER 30 2HB SER 30 -4.284 -12.356 -11.741 228 H HIS 31 H HIS 31 -2.969 -10.135 -7.888 229 HA HIS 31 HA HIS 31 -5.446 -9.930 -6.437 230 HD1 HIS 31 HD1 HIS 31 -2.493 -13.071 -6.883 231 HD2 HIS 31 HD2 HIS 31 -2.252 -10.997 -3.289 232 HE1 HIS 31 HE1 HIS 31 -0.201 -13.548 -5.980 233 HE2 HIS 31 HE2 HIS 31 -0.180 -12.486 -3.697 234 HB2 HIS 31 1HB HIS 31 -4.730 -11.220 -4.486 235 HB3 HIS 31 2HB HIS 31 -4.799 -12.248 -5.910 236 H ALA 32 H ALA 32 -4.925 -8.988 -4.155 237 HA ALA 32 HA ALA 32 -3.574 -6.557 -4.609 238 HB1 ALA 32 3HB ALA 32 -5.458 -6.779 -3.060 239 HB2 ALA 32 1HB ALA 32 -4.050 -6.063 -2.275 240 HB3 ALA 32 2HB ALA 32 -4.455 -7.756 -1.985 241 H ILE 33 H ILE 33 -1.597 -5.819 -4.023 242 HA ILE 33 HA ILE 33 0.222 -7.594 -2.565 243 HB ILE 33 HB ILE 33 2.021 -7.124 -4.261 244 HG12 ILE 33 1HG1 ILE 33 -0.324 -6.398 -6.031 245 HG13 ILE 33 2HG1 ILE 33 0.831 -5.242 -5.376 246 HG21 ILE 33 1HG2 ILE 33 0.961 -9.303 -4.090 247 HG22 ILE 33 2HG2 ILE 33 1.337 -8.921 -5.770 248 HG23 ILE 33 3HG2 ILE 33 -0.321 -8.780 -5.183 249 HD11 ILE 33 3HD1 ILE 33 2.622 -6.332 -6.619 250 HD12 ILE 33 1HD1 ILE 33 1.330 -5.784 -7.686 251 HD13 ILE 33 2HD1 ILE 33 1.465 -7.492 -7.270 252 H ALA 34 H ALA 34 1.894 -6.549 -1.526 253 HA ALA 34 HA ALA 34 1.966 -3.611 -1.781 254 HB1 ALA 34 3HB ALA 34 0.946 -4.288 0.350 255 HB2 ALA 34 1HB ALA 34 2.484 -3.462 0.593 256 HB3 ALA 34 2HB ALA 34 2.394 -5.216 0.740 257 H PHE 35 H PHE 35 3.842 -2.957 -2.603 258 HA PHE 35 HA PHE 35 6.269 -4.429 -1.887 259 HD1 PHE 35 HD2 PHE 35 3.425 -4.417 -4.829 260 HD2 PHE 35 HD1 PHE 35 7.126 -2.475 -5.631 261 HE1 PHE 35 HE2 PHE 35 2.353 -3.124 -6.627 262 HE2 PHE 35 HE1 PHE 35 6.061 -1.182 -7.433 263 HZ PHE 35 HZ PHE 35 3.673 -1.505 -7.932 264 HB2 PHE 35 1HB PHE 35 7.064 -4.364 -4.220 265 HB3 PHE 35 2HB PHE 35 5.609 -5.334 -4.045 266 H ALA 36 H ALA 36 8.238 -3.249 -2.290 267 HA ALA 36 HA ALA 36 7.932 -0.342 -2.506 268 HB1 ALA 36 3HB ALA 36 9.299 0.009 -0.520 269 HB2 ALA 36 1HB ALA 36 9.400 -1.734 -0.264 270 HB3 ALA 36 2HB ALA 36 7.849 -0.910 -0.119 271 HA PRO 37 HA PRO 37 11.811 -0.473 -4.789 272 HB2 PRO 37 1HB PRO 37 13.165 1.585 -3.485 273 HB3 PRO 37 2HB PRO 37 12.078 1.790 -4.862 274 HG2 PRO 37 1HG PRO 37 11.549 2.178 -1.952 275 HG3 PRO 37 2HG PRO 37 10.944 3.102 -3.339 276 HD2 PRO 37 1HD PRO 37 9.398 1.330 -2.050 277 HD3 PRO 37 2HD PRO 37 9.288 1.550 -3.810 278 H GLU 38 H GLU 38 12.455 0.443 -1.407 279 HA GLU 38 HA GLU 38 14.189 -1.915 -1.163 280 HB2 GLU 38 1HB GLU 38 14.047 0.585 0.537 281 HB3 GLU 38 2HB GLU 38 15.053 -0.808 0.902 282 HG2 GLU 38 1HG GLU 38 16.159 -0.444 -1.333 283 HG3 GLU 38 2HG GLU 38 15.299 1.094 -1.407 284 H GLY 39 H GLY 39 12.912 -3.558 -0.553 285 HA2 GLY 39 1HA GLY 39 11.947 -3.995 1.929 286 HA3 GLY 39 2HA GLY 39 10.630 -3.110 1.172 287 HA PRO 40 HA PRO 40 10.359 -7.604 -0.016 288 HB2 PRO 40 1HB PRO 40 8.495 -8.515 1.654 289 HB3 PRO 40 2HB PRO 40 10.170 -8.318 2.182 290 HG2 PRO 40 1HG PRO 40 7.792 -6.609 2.740 291 HG3 PRO 40 2HG PRO 40 9.164 -7.005 3.789 292 HD2 PRO 40 1HD PRO 40 8.847 -4.653 2.287 293 HD3 PRO 40 2HD PRO 40 10.345 -5.212 3.055 294 H VAL 41 H VAL 41 8.403 -8.855 -0.766 295 HA VAL 41 HA VAL 41 6.289 -7.029 -1.707 296 HB VAL 41 HB VAL 41 7.018 -9.729 -2.871 297 HG11 VAL 41 1HG1 VAL 41 5.188 -7.551 -3.877 298 HG12 VAL 41 2HG1 VAL 41 4.692 -9.115 -3.231 299 HG13 VAL 41 3HG1 VAL 41 5.594 -9.031 -4.744 300 HG21 VAL 41 3HG2 VAL 41 8.830 -8.126 -3.221 301 HG22 VAL 41 1HG2 VAL 41 7.683 -6.971 -3.901 302 HG23 VAL 41 2HG2 VAL 41 8.003 -8.491 -4.735 303 H ALA 42 H ALA 42 4.663 -7.133 -0.294 304 HA ALA 42 HA ALA 42 4.096 -9.603 1.127 305 HB1 ALA 42 3HB ALA 42 2.501 -8.276 2.401 306 HB2 ALA 42 1HB ALA 42 2.743 -6.913 1.310 307 HB3 ALA 42 2HB ALA 42 4.067 -7.467 2.334 308 H SER 43 H SER 43 2.602 -11.024 0.552 309 HA SER 43 HA SER 43 0.879 -10.412 -1.712 310 HG SER 43 HG SER 43 -0.422 -13.439 -1.435 311 HB2 SER 43 1HB SER 43 2.199 -12.525 -1.667 312 HB3 SER 43 2HB SER 43 1.295 -13.031 -0.242 313 H TRP 44 H TRP 44 -1.107 -9.693 -1.389 314 HA TRP 44 HA TRP 44 -2.351 -10.054 1.235 315 HD1 TRP 44 HD1 TRP 44 -1.256 -8.641 2.322 316 HE1 TRP 44 HE1 TRP 44 -1.326 -6.573 3.862 317 HE3 TRP 44 HE3 TRP 44 -4.579 -5.785 -0.306 318 HZ2 TRP 44 HZ2 TRP 44 -2.626 -4.059 3.942 319 HZ3 TRP 44 HZ3 TRP 44 -5.187 -3.567 0.562 320 HH2 TRP 44 HH2 TRP 44 -4.228 -2.721 2.646 321 HB2 TRP 44 1HB TRP 44 -2.483 -8.026 -0.889 322 HB3 TRP 44 2HB TRP 44 -4.038 -8.428 -0.174 323 HA PRO 45 HA PRO 45 -5.301 -12.870 -0.658 324 HB2 PRO 45 1HB PRO 45 -6.582 -13.535 1.608 325 HB3 PRO 45 2HB PRO 45 -4.967 -14.154 1.245 326 HG2 PRO 45 1HG PRO 45 -5.788 -11.959 3.091 327 HG3 PRO 45 2HG PRO 45 -4.516 -13.177 3.288 328 HD2 PRO 45 1HD PRO 45 -4.109 -10.555 2.476 329 HD3 PRO 45 2HD PRO 45 -2.980 -11.896 2.202 330 H VAL 46 H VAL 46 -5.581 -9.881 -0.285 331 HA VAL 46 HA VAL 46 -8.349 -9.483 0.450 332 HB VAL 46 HB VAL 46 -6.197 -7.586 -0.502 333 HG11 VAL 46 1HG1 VAL 46 -7.754 -5.783 0.211 334 HG12 VAL 46 2HG1 VAL 46 -9.025 -6.998 0.351 335 HG13 VAL 46 3HG1 VAL 46 -8.288 -6.670 -1.215 336 HG21 VAL 46 3HG2 VAL 46 -6.258 -6.774 1.810 337 HG22 VAL 46 1HG2 VAL 46 -5.823 -8.480 1.722 338 HG23 VAL 46 2HG2 VAL 46 -7.453 -8.010 2.205 339 H GLN 47 H GLN 47 -10.005 -9.119 -0.910 340 HA GLN 47 HA GLN 47 -9.429 -9.234 -3.808 341 HB2 GLN 47 1HB GLN 47 -11.872 -10.268 -2.350 342 HB3 GLN 47 2HB GLN 47 -11.579 -10.377 -4.080 343 HG2 GLN 47 1HG GLN 47 -9.818 -11.657 -2.006 344 HG3 GLN 47 2HG GLN 47 -11.166 -12.475 -2.791 345 HE21 GLN 47 2HE2 GLN 47 -7.994 -11.092 -3.242 346 HE22 GLN 47 1HE2 GLN 47 -7.662 -11.873 -4.748 347 H ARG 48 H ARG 48 -10.995 -7.634 -1.208 348 HA ARG 48 HA ARG 48 -12.089 -5.613 -3.037 349 HE ARG 48 HE ARG 48 -14.394 -8.819 1.507 350 HB2 ARG 48 1HB ARG 48 -14.166 -5.550 -1.642 351 HB3 ARG 48 2HB ARG 48 -13.966 -7.058 -2.529 352 HG2 ARG 48 1HG ARG 48 -12.856 -7.919 -0.375 353 HG3 ARG 48 2HG ARG 48 -13.632 -6.535 0.392 354 HD2 ARG 48 1HD ARG 48 -15.779 -7.329 -0.094 355 HD3 ARG 48 2HD ARG 48 -15.175 -8.473 -1.297 356 HH11 ARG 48 1HH1 ARG 48 -16.189 -9.936 -1.289 357 HH12 ARG 48 2HH1 ARG 48 -16.417 -11.537 -0.648 358 HH21 ARG 48 1HH2 ARG 48 -14.720 -10.901 2.353 359 HH22 ARG 48 2HH2 ARG 48 -15.601 -12.082 1.436 360 HA PRO 49 HA PRO 49 -10.311 -2.755 -0.183 361 HB2 PRO 49 1HB PRO 49 -12.117 -0.710 -0.195 362 HB3 PRO 49 2HB PRO 49 -10.993 -1.027 -1.520 363 HG2 PRO 49 1HG PRO 49 -13.878 -1.779 -1.264 364 HG3 PRO 49 2HG PRO 49 -13.010 -1.133 -2.669 365 HD2 PRO 49 1HD PRO 49 -13.588 -3.754 -2.425 366 HD3 PRO 49 2HD PRO 49 -12.100 -3.187 -3.211 367 H ALA 50 H ALA 50 -13.016 -4.469 0.584 368 HA ALA 50 HA ALA 50 -13.570 -3.112 3.108 369 HB1 ALA 50 3HB ALA 50 -15.469 -3.851 1.750 370 HB2 ALA 50 1HB ALA 50 -15.438 -4.662 3.316 371 HB3 ALA 50 2HB ALA 50 -14.904 -5.517 1.869 372 H ASP 51 H ASP 51 -11.625 -5.633 1.905 373 HA ASP 51 HA ASP 51 -11.706 -7.321 4.237 374 HB2 ASP 51 1HB ASP 51 -9.648 -7.241 2.021 375 HB3 ASP 51 2HB ASP 51 -9.812 -8.509 3.225 376 H ILE 52 H ILE 52 -10.161 -4.430 3.419 377 HA ILE 52 HA ILE 52 -7.623 -4.773 4.572 378 HB ILE 52 HB ILE 52 -9.150 -2.195 4.180 379 HG12 ILE 52 1HG1 ILE 52 -7.176 -3.600 2.364 380 HG13 ILE 52 2HG1 ILE 52 -8.916 -3.528 2.109 381 HG21 ILE 52 1HG2 ILE 52 -7.261 -1.934 5.696 382 HG22 ILE 52 2HG2 ILE 52 -6.934 -1.143 4.154 383 HG23 ILE 52 3HG2 ILE 52 -6.194 -2.701 4.520 384 HD11 ILE 52 3HD1 ILE 52 -7.758 -1.933 0.702 385 HD12 ILE 52 1HD1 ILE 52 -7.030 -1.185 2.123 386 HD13 ILE 52 2HD1 ILE 52 -8.775 -1.100 1.880 387 H THR 53 H THR 53 -7.157 -5.117 6.606 388 HA THR 53 HA THR 53 -8.631 -3.658 8.697 389 HB THR 53 HB THR 53 -7.905 -5.522 10.233 390 HG1 THR 53 HG1 THR 53 -7.583 -7.551 8.771 391 HG21 THR 53 3HG2 THR 53 -10.193 -5.400 9.371 392 HG22 THR 53 1HG2 THR 53 -9.660 -7.074 9.535 393 HG23 THR 53 2HG2 THR 53 -9.707 -6.315 7.943 394 H ALA 54 H ALA 54 -7.158 -3.591 10.772 395 HA ALA 54 HA ALA 54 -4.822 -2.118 10.119 396 HB1 ALA 54 3HB ALA 54 -4.429 -2.034 12.526 397 HB2 ALA 54 1HB ALA 54 -5.654 -3.277 12.781 398 HB3 ALA 54 2HB ALA 54 -6.120 -1.694 12.158 399 H SER 55 H SER 55 -5.468 -5.441 10.960 400 HA SER 55 HA SER 55 -2.851 -6.312 11.501 401 HG SER 55 HG SER 55 -5.019 -6.772 12.608 402 HB2 SER 55 1HB SER 55 -4.994 -7.949 10.131 403 HB3 SER 55 2HB SER 55 -3.702 -8.526 11.186 404 H LEU 56 H LEU 56 -4.707 -6.133 8.492 405 HA LEU 56 HA LEU 56 -2.678 -7.266 6.863 406 HG LEU 56 HG LEU 56 -5.728 -7.728 7.090 407 HB2 LEU 56 1HB LEU 56 -5.063 -5.565 6.140 408 HB3 LEU 56 2HB LEU 56 -4.037 -6.386 4.977 409 HD11 LEU 56 1HD1 LEU 56 -7.031 -8.541 5.189 410 HD12 LEU 56 2HD1 LEU 56 -6.033 -7.580 4.096 411 HD13 LEU 56 3HD1 LEU 56 -7.055 -6.780 5.291 412 HD21 LEU 56 3HD2 LEU 56 -3.675 -8.972 6.640 413 HD22 LEU 56 1HD2 LEU 56 -4.013 -8.916 4.910 414 HD23 LEU 56 2HD2 LEU 56 -5.082 -9.812 5.988 415 H LEU 57 H LEU 57 -3.433 -4.001 7.880 416 HA LEU 57 HA LEU 57 -1.758 -2.623 6.086 417 HG LEU 57 HG LEU 57 -4.481 -1.958 7.358 418 HB2 LEU 57 1HB LEU 57 -2.576 -1.950 8.913 419 HB3 LEU 57 2HB LEU 57 -1.715 -0.849 7.855 420 HD11 LEU 57 1HD1 LEU 57 -3.569 0.799 8.169 421 HD12 LEU 57 2HD1 LEU 57 -4.445 -0.349 9.182 422 HD13 LEU 57 3HD1 LEU 57 -5.221 0.341 7.756 423 HD21 LEU 57 3HD2 LEU 57 -3.261 -1.559 5.282 424 HD22 LEU 57 1HD2 LEU 57 -2.873 0.077 5.816 425 HD23 LEU 57 2HD2 LEU 57 -4.549 -0.373 5.497 426 H GLN 58 H GLN 58 -1.145 -4.187 9.180 427 HA GLN 58 HA GLN 58 1.544 -3.383 9.471 428 HB2 GLN 58 1HB GLN 58 0.076 -5.812 10.504 429 HB3 GLN 58 2HB GLN 58 1.712 -5.381 10.983 430 HG2 GLN 58 1HG GLN 58 0.936 -3.329 11.966 431 HG3 GLN 58 2HG GLN 58 -0.698 -3.622 11.370 432 HE21 GLN 58 2HE2 GLN 58 0.340 -3.251 14.103 433 HE22 GLN 58 1HE2 GLN 58 -0.183 -4.653 14.982 434 H GLN 59 H GLN 59 0.032 -6.137 7.854 435 HA GLN 59 HA GLN 59 2.456 -7.422 7.122 436 HB2 GLN 59 1HB GLN 59 -0.222 -7.556 5.720 437 HB3 GLN 59 2HB GLN 59 1.110 -8.684 5.518 438 HG2 GLN 59 1HG GLN 59 0.877 -9.213 7.972 439 HG3 GLN 59 2HG GLN 59 -0.622 -8.284 7.938 440 HE21 GLN 59 2HE2 GLN 59 -0.240 -11.101 8.507 441 HE22 GLN 59 1HE2 GLN 59 -1.180 -11.971 7.333 442 H ALA 60 H ALA 60 0.375 -5.059 5.526 443 HA ALA 60 HA ALA 60 1.699 -5.035 3.034 444 HB1 ALA 60 3HB ALA 60 0.066 -2.855 4.326 445 HB2 ALA 60 1HB ALA 60 -0.569 -4.178 3.347 446 HB3 ALA 60 2HB ALA 60 0.484 -2.965 2.616 447 H ALA 61 H ALA 61 2.377 -3.472 6.058 448 HA ALA 61 HA ALA 61 4.140 -1.490 5.008 449 HB1 ALA 61 3HB ALA 61 4.775 -1.108 7.325 450 HB2 ALA 61 1HB ALA 61 3.952 -2.591 7.809 451 HB3 ALA 61 2HB ALA 61 3.022 -1.233 7.174 452 H GLY 62 H GLY 62 4.403 -4.826 5.425 453 HA2 GLY 62 1HA GLY 62 6.136 -6.290 5.097 454 HA3 GLY 62 2HA GLY 62 7.035 -4.937 4.427 455 H LEU 63 H LEU 63 5.790 -4.922 7.681 456 HA LEU 63 HA LEU 63 8.346 -4.258 8.728 457 HG LEU 63 HG LEU 63 5.477 -2.979 8.823 458 HB2 LEU 63 1HB LEU 63 5.806 -5.007 10.177 459 HB3 LEU 63 2HB LEU 63 7.220 -4.281 10.916 460 HD11 LEU 63 1HD1 LEU 63 5.733 -2.468 11.783 461 HD12 LEU 63 2HD1 LEU 63 4.343 -3.177 10.962 462 HD13 LEU 63 3HD1 LEU 63 4.790 -1.500 10.649 463 HD21 LEU 63 3HD2 LEU 63 6.780 -0.961 9.333 464 HD22 LEU 63 1HD2 LEU 63 7.785 -2.241 8.653 465 HD23 LEU 63 2HD2 LEU 63 7.827 -1.914 10.385 466 H ALA 64 H ALA 64 6.229 -6.845 9.905 467 HA ALA 64 HA ALA 64 6.675 -8.819 10.926 468 HB1 ALA 64 3HB ALA 64 8.815 -9.010 8.808 469 HB2 ALA 64 1HB ALA 64 7.124 -9.471 8.611 470 HB3 ALA 64 2HB ALA 64 8.151 -10.351 9.742 471 H GLU 65 H GLU 65 7.427 -7.359 12.721 472 HA GLU 65 HA GLU 65 10.229 -7.121 13.204 473 HB2 GLU 65 1HB GLU 65 8.633 -5.525 14.149 474 HB3 GLU 65 2HB GLU 65 7.879 -6.811 15.081 475 HG2 GLU 65 1HG GLU 65 9.774 -7.050 16.465 476 HG3 GLU 65 2HG GLU 65 10.764 -6.053 15.398 477 H VAL 66 H VAL 66 7.660 -9.226 14.430 478 HA VAL 66 HA VAL 66 9.641 -10.978 15.630 479 HB VAL 66 HB VAL 66 7.628 -10.686 16.926 480 HG11 VAL 66 1HG1 VAL 66 5.424 -11.392 16.128 481 HG12 VAL 66 2HG1 VAL 66 6.109 -11.723 14.537 482 HG13 VAL 66 3HG1 VAL 66 6.079 -10.072 15.158 483 HG21 VAL 66 3HG2 VAL 66 8.668 -12.884 17.022 484 HG22 VAL 66 1HG2 VAL 66 7.675 -13.427 15.670 485 HG23 VAL 66 2HG2 VAL 66 6.919 -13.012 17.208 486 H VAL 67 H VAL 67 10.653 -12.401 14.430 487 HA VAL 67 HA VAL 67 9.560 -13.167 11.842 488 HB VAL 67 HB VAL 67 12.211 -13.980 13.046 489 HG11 VAL 67 1HG1 VAL 67 12.865 -14.345 10.715 490 HG12 VAL 67 2HG1 VAL 67 11.242 -13.896 10.191 491 HG13 VAL 67 3HG1 VAL 67 11.485 -15.346 11.166 492 HG21 VAL 67 3HG2 VAL 67 13.207 -12.142 11.766 493 HG22 VAL 67 1HG2 VAL 67 12.077 -11.549 12.984 494 HG23 VAL 67 2HG2 VAL 67 11.596 -11.607 11.289 495 H ARG 68 H ARG 68 8.546 -15.038 11.497 496 HA ARG 68 HA ARG 68 7.887 -16.753 13.644 497 HE ARG 68 HE ARG 68 4.789 -14.860 9.305 498 HB2 ARG 68 1HB ARG 68 7.626 -17.450 10.721 499 HB3 ARG 68 2HB ARG 68 6.649 -18.036 12.060 500 HG2 ARG 68 1HG ARG 68 5.790 -15.730 12.370 501 HG3 ARG 68 2HG ARG 68 6.678 -15.250 10.924 502 HD2 ARG 68 1HD ARG 68 5.407 -17.164 9.768 503 HD3 ARG 68 2HD ARG 68 4.339 -17.108 11.170 504 HH11 ARG 68 1HH1 ARG 68 2.782 -16.584 11.609 505 HH12 ARG 68 2HH1 ARG 68 1.394 -15.568 11.342 506 HH21 ARG 68 1HH2 ARG 68 2.938 -13.578 8.909 507 HH22 ARG 68 2HH2 ARG 68 1.466 -13.895 9.776 508 H ASP 69 H ASP 69 10.139 -17.022 10.943 509 HA ASP 69 HA ASP 69 11.447 -19.236 12.386 510 HB2 ASP 69 1HB ASP 69 11.290 -18.802 9.392 511 HB3 ASP 69 2HB ASP 69 12.271 -20.036 10.176 512 HA PRO 70 HA PRO 70 14.360 -15.731 12.540 513 HB2 PRO 70 1HB PRO 70 15.922 -16.915 14.474 514 HB3 PRO 70 2HB PRO 70 14.512 -15.904 14.808 515 HG2 PRO 70 1HG PRO 70 14.738 -18.884 14.746 516 HG3 PRO 70 2HG PRO 70 13.842 -17.849 15.874 517 HD2 PRO 70 1HD PRO 70 12.611 -19.166 13.880 518 HD3 PRO 70 2HD PRO 70 12.082 -17.553 14.400 519 H LEU 71 H LEU 71 15.837 -15.586 11.012 520 HA LEU 71 HA LEU 71 17.247 -17.914 10.036 521 HG LEU 71 HG LEU 71 15.269 -15.791 8.703 522 HB2 LEU 71 1HB LEU 71 17.514 -15.000 9.275 523 HB3 LEU 71 2HB LEU 71 18.222 -16.351 8.411 524 HD11 LEU 71 1HD1 LEU 71 16.385 -14.245 7.189 525 HD12 LEU 71 2HD1 LEU 71 15.351 -15.364 6.300 526 HD13 LEU 71 3HD1 LEU 71 17.098 -15.602 6.317 527 HD21 LEU 71 3HD2 LEU 71 16.692 -17.970 7.180 528 HD22 LEU 71 1HD2 LEU 71 14.958 -17.650 7.153 529 HD23 LEU 71 2HD2 LEU 71 15.733 -18.188 8.644 530 H ALA 72 H ALA 72 18.003 -14.898 11.708 531 HA ALA 72 HA ALA 72 20.547 -16.100 12.578 532 HB1 ALA 72 3HB ALA 72 21.345 -13.834 13.017 533 HB2 ALA 72 1HB ALA 72 19.799 -13.175 12.481 534 HB3 ALA 72 2HB ALA 72 20.849 -14.006 11.333 535 H PHE 73 H PHE 73 19.931 -17.183 14.378 536 HA PHE 73 HA PHE 73 17.955 -16.103 16.163 537 HD1 PHE 73 HD2 PHE 73 16.183 -17.828 17.284 538 HD2 PHE 73 HD1 PHE 73 20.062 -18.769 18.761 539 HE1 PHE 73 HE2 PHE 73 15.241 -18.169 19.534 540 HE2 PHE 73 HE1 PHE 73 19.128 -19.110 21.009 541 HZ PHE 73 HZ PHE 73 16.717 -18.809 21.399 542 HB2 PHE 73 1HB PHE 73 18.097 -18.521 15.780 543 HB3 PHE 73 2HB PHE 73 19.724 -18.542 16.455 544 H LEU 74 H LEU 74 18.363 -14.621 17.615 545 HA LEU 74 HA LEU 74 21.040 -14.289 18.696 546 HG LEU 74 HG LEU 74 19.310 -12.354 16.909 547 HB2 LEU 74 1HB LEU 74 18.500 -12.728 19.195 548 HB3 LEU 74 2HB LEU 74 20.081 -12.313 19.829 549 HD11 LEU 74 1HD1 LEU 74 19.560 -9.932 17.044 550 HD12 LEU 74 2HD1 LEU 74 19.887 -10.056 18.772 551 HD13 LEU 74 3HD1 LEU 74 18.302 -10.503 18.141 552 HD21 LEU 74 3HD2 LEU 74 21.647 -12.967 17.226 553 HD22 LEU 74 1HD2 LEU 74 21.891 -11.548 18.243 554 HD23 LEU 74 2HD2 LEU 74 21.512 -11.350 16.533 555 H ASP 75 H ASP 75 21.657 -15.037 20.613 556 HA ASP 75 HA ASP 75 19.828 -16.700 22.114 557 HB2 ASP 75 1HB ASP 75 21.764 -17.411 23.360 558 HB3 ASP 75 2HB ASP 75 22.199 -17.362 21.655 559 H GLU 76 H GLU 76 20.402 -13.518 22.038 560 HA GLU 76 HA GLU 76 19.876 -11.754 23.344 561 HB2 GLU 76 1HB GLU 76 18.586 -13.816 25.135 562 HB3 GLU 76 2HB GLU 76 18.351 -12.078 25.244 563 HG2 GLU 76 1HG GLU 76 17.299 -12.046 23.070 564 HG3 GLU 76 2HG GLU 76 17.619 -13.768 22.864 565 HA PRO 77 HA PRO 77 23.310 -12.337 26.301 566 HB2 PRO 77 1HB PRO 77 25.079 -10.694 25.157 567 HB3 PRO 77 2HB PRO 77 24.826 -12.330 24.539 568 HG2 PRO 77 1HG PRO 77 23.870 -9.725 23.455 569 HG3 PRO 77 2HG PRO 77 24.392 -11.180 22.589 570 HD2 PRO 77 1HD PRO 77 21.740 -10.420 23.105 571 HD3 PRO 77 2HD PRO 77 22.286 -12.017 22.560 572 H GLU 78 H GLU 78 21.092 -10.100 25.514 573 HA GLU 78 HA GLU 78 21.908 -8.232 27.608 574 HB2 GLU 78 1HB GLU 78 22.643 -7.338 25.375 575 HB3 GLU 78 2HB GLU 78 20.961 -7.350 24.871 576 HG2 GLU 78 1HG GLU 78 20.538 -5.840 26.890 577 HG3 GLU 78 2HG GLU 78 22.288 -5.627 26.927 578 H ALA 79 H ALA 79 20.098 -7.013 28.454 579 HA ALA 79 HA ALA 79 17.442 -7.879 27.541 580 HB1 ALA 79 3HB ALA 79 18.299 -7.759 30.432 581 HB2 ALA 79 1HB ALA 79 18.028 -9.232 29.502 582 HB3 ALA 79 2HB ALA 79 16.683 -8.143 29.840 583 H GLY 80 H GLY 80 19.219 -5.442 27.367 584 HA2 GLY 80 1HA GLY 80 17.920 -3.459 29.011 585 HA3 GLY 80 2HA GLY 80 19.179 -3.171 27.820 586 H ALA 81 H ALA 81 18.499 -3.336 25.509 587 HA ALA 81 HA ALA 81 15.688 -2.850 24.996 588 HB1 ALA 81 3HB ALA 81 15.998 -0.637 24.040 589 HB2 ALA 81 1HB ALA 81 17.704 -0.666 24.485 590 HB3 ALA 81 2HB ALA 81 16.465 -0.648 25.740 591 H GLY 82 H GLY 82 15.272 -2.492 22.672 592 HA2 GLY 82 1HA GLY 82 17.363 -3.767 21.018 593 HA3 GLY 82 2HA GLY 82 15.643 -4.072 20.805 594 H ALA 83 H ALA 83 17.511 -3.094 18.840 595 HA ALA 83 HA ALA 83 16.594 -0.334 18.436 596 HB1 ALA 83 3HB ALA 83 18.339 -0.195 16.728 597 HB2 ALA 83 1HB ALA 83 18.751 -1.887 17.006 598 HB3 ALA 83 2HB ALA 83 19.006 -0.696 18.281 599 H ARG 84 H ARG 84 14.926 -0.001 17.114 600 HA ARG 84 HA ARG 84 13.919 -2.198 15.546 601 HE ARG 84 HE ARG 84 9.776 -2.530 17.089 602 HB2 ARG 84 1HB ARG 84 12.905 0.589 16.082 603 HB3 ARG 84 2HB ARG 84 12.099 -0.509 14.963 604 HG2 ARG 84 1HG ARG 84 11.966 -2.170 16.830 605 HG3 ARG 84 2HG ARG 84 12.559 -0.910 17.909 606 HD2 ARG 84 1HD ARG 84 10.585 0.184 17.928 607 HD3 ARG 84 2HD ARG 84 10.245 -0.186 16.234 608 HH11 ARG 84 1HH1 ARG 84 9.256 0.317 19.092 609 HH12 ARG 84 2HH1 ARG 84 7.965 -0.424 19.996 610 HH21 ARG 84 1HH2 ARG 84 8.148 -3.497 18.310 611 HH22 ARG 84 2HH2 ARG 84 7.360 -2.596 19.577 612 HA PRO 85 HA PRO 85 15.563 -1.776 11.612 613 HB2 PRO 85 1HB PRO 85 12.838 -1.112 10.580 614 HB3 PRO 85 2HB PRO 85 13.998 -2.314 10.002 615 HG2 PRO 85 1HG PRO 85 11.905 -3.055 11.460 616 HG3 PRO 85 2HG PRO 85 13.491 -3.811 11.704 617 HD2 PRO 85 1HD PRO 85 12.062 -1.813 13.382 618 HD3 PRO 85 2HD PRO 85 13.169 -3.112 13.867 619 H ALA 86 H ALA 86 13.058 0.749 12.000 620 HA ALA 86 HA ALA 86 12.980 2.946 11.443 621 HB1 ALA 86 3HB ALA 86 15.988 2.791 11.251 622 HB2 ALA 86 1HB ALA 86 15.070 3.138 12.716 623 HB3 ALA 86 2HB ALA 86 15.018 4.261 11.357 624 H ASN 87 H ASN 87 13.823 0.563 9.440 625 HA ASN 87 HA ASN 87 14.024 2.217 7.032 626 HB2 ASN 87 1HB ASN 87 14.445 -0.732 7.544 627 HB3 ASN 87 2HB ASN 87 14.368 -0.057 5.921 628 HD21 ASN 87 2HD2 ASN 87 16.539 -1.390 7.451 629 HD22 ASN 87 1HD2 ASN 87 17.877 -0.290 7.364 630 H ALA 88 H ALA 88 11.670 1.503 8.892 631 HA ALA 88 HA ALA 88 9.820 0.021 7.323 632 HB1 ALA 88 3HB ALA 88 9.343 1.944 9.602 633 HB2 ALA 88 1HB ALA 88 9.619 0.209 9.755 634 HB3 ALA 88 2HB ALA 88 8.167 0.803 8.951 635 HA PRO 89 HA PRO 89 8.174 2.934 4.428 636 HB2 PRO 89 1HB PRO 89 5.470 2.881 5.183 637 HB3 PRO 89 2HB PRO 89 6.239 1.840 3.984 638 HG2 PRO 89 1HG PRO 89 5.607 1.295 6.843 639 HG3 PRO 89 2HG PRO 89 5.576 0.195 5.452 640 HD2 PRO 89 1HD PRO 89 7.560 0.106 7.241 641 HD3 PRO 89 2HD PRO 89 7.876 -0.140 5.509 642 H GLU 90 H GLU 90 8.806 4.964 4.866 643 HA GLU 90 HA GLU 90 7.997 6.451 7.153 644 HB2 GLU 90 1HB GLU 90 9.891 6.751 5.162 645 HB3 GLU 90 2HB GLU 90 8.722 8.003 4.769 646 HG2 GLU 90 1HG GLU 90 8.930 8.904 7.029 647 HG3 GLU 90 2HG GLU 90 10.114 7.654 7.413 648 H VAL 91 H VAL 91 6.881 5.998 3.905 649 HA VAL 91 HA VAL 91 4.286 7.110 4.669 650 HB VAL 91 HB VAL 91 5.243 8.835 3.301 651 HG11 VAL 91 1HG1 VAL 91 7.022 7.579 2.244 652 HG12 VAL 91 2HG1 VAL 91 6.065 8.425 1.028 653 HG13 VAL 91 3HG1 VAL 91 5.849 6.691 1.272 654 HG21 VAL 91 3HG2 VAL 91 2.896 8.366 2.887 655 HG22 VAL 91 1HG2 VAL 91 3.333 7.181 1.656 656 HG23 VAL 91 2HG2 VAL 91 3.693 8.889 1.404 657 H LEU 92 H LEU 92 2.636 5.798 4.195 658 HA LEU 92 HA LEU 92 3.224 3.401 2.581 659 HG LEU 92 HG LEU 92 0.549 1.995 3.197 660 HB2 LEU 92 1HB LEU 92 2.802 2.945 4.969 661 HB3 LEU 92 2HB LEU 92 1.245 3.739 4.841 662 HD11 LEU 92 1HD1 LEU 92 2.753 1.317 2.421 663 HD12 LEU 92 2HD1 LEU 92 1.860 -0.063 3.060 664 HD13 LEU 92 3HD1 LEU 92 3.135 0.684 4.022 665 HD21 LEU 92 3HD2 LEU 92 0.227 0.235 4.869 666 HD22 LEU 92 1HD2 LEU 92 -0.089 1.837 5.536 667 HD23 LEU 92 2HD2 LEU 92 1.423 1.009 5.909 668 H LEU 93 H LEU 93 2.166 3.273 0.723 669 HA LEU 93 HA LEU 93 -0.163 5.015 0.334 670 HG LEU 93 HG LEU 93 2.828 5.430 -0.689 671 HB2 LEU 93 1HB LEU 93 1.550 3.607 -1.715 672 HB3 LEU 93 2HB LEU 93 0.236 4.714 -2.064 673 HD11 LEU 93 1HD1 LEU 93 1.781 6.096 -3.433 674 HD12 LEU 93 2HD1 LEU 93 3.100 4.985 -3.063 675 HD13 LEU 93 3HD1 LEU 93 3.274 6.706 -2.720 676 HD21 LEU 93 3HD2 LEU 93 2.048 7.734 -0.842 677 HD22 LEU 93 1HD2 LEU 93 0.952 6.762 0.141 678 HD23 LEU 93 2HD2 LEU 93 0.515 7.179 -1.515 679 H VAL 94 H VAL 94 -1.955 3.956 0.890 680 HA VAL 94 HA VAL 94 -2.254 1.147 0.131 681 HB VAL 94 HB VAL 94 -4.069 2.881 1.824 682 HG11 VAL 94 1HG1 VAL 94 -5.279 1.065 0.752 683 HG12 VAL 94 2HG1 VAL 94 -5.116 0.758 2.481 684 HG13 VAL 94 3HG1 VAL 94 -4.087 -0.096 1.332 685 HG21 VAL 94 3HG2 VAL 94 -1.916 2.529 2.903 686 HG22 VAL 94 1HG2 VAL 94 -2.055 0.789 2.645 687 HG23 VAL 94 2HG2 VAL 94 -3.179 1.613 3.726 688 H GLY 95 H GLY 95 -3.117 0.734 -1.773 689 HA2 GLY 95 1HA GLY 95 -5.002 2.674 -2.935 690 HA3 GLY 95 2HA GLY 95 -4.057 1.500 -3.844 691 H THR 96 H THR 96 -7.062 2.191 -2.642 692 HA THR 96 HA THR 96 -7.922 -0.449 -1.957 693 HB THR 96 HB THR 96 -10.241 0.751 -2.277 694 HG1 THR 96 HG1 THR 96 -9.515 2.625 -3.308 695 HG21 THR 96 3HG2 THR 96 -9.205 0.063 -0.139 696 HG22 THR 96 1HG2 THR 96 -10.060 1.598 -0.009 697 HG23 THR 96 2HG2 THR 96 -8.301 1.577 -0.112 698 H GLY 97 H GLY 97 -7.686 1.338 -4.898 699 HA2 GLY 97 1HA GLY 97 -7.652 0.421 -7.029 700 HA3 GLY 97 2HA GLY 97 -8.249 -1.087 -6.358 701 H ARG 98 H ARG 98 -10.605 -0.629 -5.341 702 HA ARG 98 HA ARG 98 -12.185 -0.094 -7.698 703 HE ARG 98 HE ARG 98 -12.126 -5.045 -5.483 704 HB2 ARG 98 1HB ARG 98 -13.104 -0.892 -4.929 705 HB3 ARG 98 2HB ARG 98 -14.056 -0.962 -6.406 706 HG2 ARG 98 1HG ARG 98 -12.450 -2.623 -7.307 707 HG3 ARG 98 2HG ARG 98 -11.617 -2.606 -5.751 708 HD2 ARG 98 1HD ARG 98 -13.744 -3.296 -4.672 709 HD3 ARG 98 2HD ARG 98 -14.468 -3.434 -6.272 710 HH11 ARG 98 1HH1 ARG 98 -15.329 -4.756 -6.873 711 HH12 ARG 98 2HH1 ARG 98 -15.459 -6.459 -7.232 712 HH21 ARG 98 1HH2 ARG 98 -12.313 -7.289 -5.928 713 HH22 ARG 98 2HH2 ARG 98 -13.747 -7.883 -6.709 714 H ARG 99 H ARG 99 -12.242 1.108 -4.343 715 HA ARG 99 HA ARG 99 -12.541 3.805 -5.233 716 HE ARG 99 HE ARG 99 -16.904 5.648 -1.982 717 HB2 ARG 99 1HB ARG 99 -14.871 3.252 -5.413 718 HB3 ARG 99 2HB ARG 99 -14.860 2.449 -3.846 719 HG2 ARG 99 1HG ARG 99 -14.572 4.529 -2.706 720 HG3 ARG 99 2HG ARG 99 -14.328 5.386 -4.226 721 HD2 ARG 99 1HD ARG 99 -16.590 5.120 -4.846 722 HD3 ARG 99 2HD ARG 99 -16.873 3.926 -3.578 723 HH11 ARG 99 1HH1 ARG 99 -16.397 6.902 -5.218 724 HH12 ARG 99 2HH1 ARG 99 -16.878 8.518 -4.797 725 HH21 ARG 99 1HH2 ARG 99 -17.481 7.768 -1.423 726 HH22 ARG 99 2HH2 ARG 99 -17.455 9.026 -2.625 727 H GLN 100 H GLN 100 -12.001 5.272 -3.671 728 HA GLN 100 HA GLN 100 -10.215 4.540 -1.724 729 HB2 GLN 100 1HB GLN 100 -11.922 7.029 -1.760 730 HB3 GLN 100 2HB GLN 100 -10.420 6.817 -0.882 731 HG2 GLN 100 1HG GLN 100 -9.231 6.540 -3.013 732 HG3 GLN 100 2HG GLN 100 -10.746 6.830 -3.868 733 HE21 GLN 100 2HE2 GLN 100 -8.284 8.340 -3.984 734 HE22 GLN 100 1HE2 GLN 100 -8.668 9.950 -3.494 735 H HIS 101 H HIS 101 -10.561 3.332 -0.009 736 HA HIS 101 HA HIS 101 -12.981 3.705 1.597 737 HD1 HIS 101 HD1 HIS 101 -11.997 -0.616 3.038 738 HD2 HIS 101 HD2 HIS 101 -12.989 3.217 4.303 739 HE1 HIS 101 HE1 HIS 101 -12.890 -0.882 5.370 740 HE2 HIS 101 HE2 HIS 101 -13.201 1.473 6.200 741 HB2 HIS 101 1HB HIS 101 -12.329 1.385 1.103 742 HB3 HIS 101 2HB HIS 101 -10.745 1.663 1.809 743 H LEU 102 H LEU 102 -12.880 5.277 3.049 744 HA LEU 102 HA LEU 102 -10.417 6.474 3.822 745 HG LEU 102 HG LEU 102 -13.240 7.471 2.658 746 HB2 LEU 102 1HB LEU 102 -13.167 6.841 5.012 747 HB3 LEU 102 2HB LEU 102 -11.787 7.891 5.273 748 HD11 LEU 102 1HD1 LEU 102 -13.865 9.822 2.927 749 HD12 LEU 102 2HD1 LEU 102 -13.072 9.849 4.502 750 HD13 LEU 102 3HD1 LEU 102 -14.485 8.826 4.243 751 HD21 LEU 102 3HD2 LEU 102 -10.842 7.805 2.306 752 HD22 LEU 102 1HD2 LEU 102 -10.897 9.261 3.298 753 HD23 LEU 102 2HD2 LEU 102 -11.772 9.203 1.767 754 H LEU 103 H LEU 103 -9.098 5.117 4.906 755 HA LEU 103 HA LEU 103 -9.959 3.550 7.146 756 HG LEU 103 HG LEU 103 -8.113 3.252 4.444 757 HB2 LEU 103 1HB LEU 103 -7.139 4.343 6.411 758 HB3 LEU 103 2HB LEU 103 -7.629 2.992 7.414 759 HD11 LEU 103 1HD1 LEU 103 -5.783 2.831 4.993 760 HD12 LEU 103 2HD1 LEU 103 -6.524 1.406 4.264 761 HD13 LEU 103 3HD1 LEU 103 -6.256 1.467 6.006 762 HD21 LEU 103 3HD2 LEU 103 -8.932 0.958 4.567 763 HD22 LEU 103 1HD2 LEU 103 -9.921 2.037 5.553 764 HD23 LEU 103 2HD2 LEU 103 -8.739 0.975 6.320 765 H GLY 104 H GLY 104 -9.873 4.083 9.300 766 HA2 GLY 104 1HA GLY 104 -9.298 6.926 9.814 767 HA3 GLY 104 2HA GLY 104 -10.450 5.952 10.714 768 HA PRO 105 HA PRO 105 -6.253 6.509 12.965 769 HB2 PRO 105 1HB PRO 105 -8.321 7.029 15.056 770 HB3 PRO 105 2HB PRO 105 -6.742 7.787 14.824 771 HG2 PRO 105 1HG PRO 105 -8.959 9.060 14.108 772 HG3 PRO 105 2HG PRO 105 -7.500 9.149 13.102 773 HD2 PRO 105 1HD PRO 105 -10.012 7.601 12.672 774 HD3 PRO 105 2HD PRO 105 -8.939 8.369 11.485 775 H GLU 106 H GLU 106 -9.331 4.953 13.754 776 HA GLU 106 HA GLU 106 -8.585 3.139 15.676 777 HB2 GLU 106 1HB GLU 106 -10.878 3.338 14.959 778 HB3 GLU 106 2HB GLU 106 -10.471 2.782 13.342 779 HG2 GLU 106 1HG GLU 106 -9.826 0.591 14.334 780 HG3 GLU 106 2HG GLU 106 -10.439 1.172 15.882 781 H GLN 107 H GLN 107 -8.110 2.896 12.181 782 HA GLN 107 HA GLN 107 -6.933 0.243 12.502 783 HB2 GLN 107 1HB GLN 107 -7.679 1.780 10.011 784 HB3 GLN 107 2HB GLN 107 -7.077 0.127 10.045 785 HG2 GLN 107 1HG GLN 107 -9.028 -0.619 11.227 786 HG3 GLN 107 2HG GLN 107 -9.607 1.037 11.395 787 HE21 GLN 107 2HE2 GLN 107 -10.878 -1.283 10.171 788 HE22 GLN 107 1HE2 GLN 107 -11.218 -0.844 8.529 789 H VAL 108 H VAL 108 -6.044 3.510 11.485 790 HA VAL 108 HA VAL 108 -3.500 2.527 10.469 791 HB VAL 108 HB VAL 108 -3.114 4.808 9.659 792 HG11 VAL 108 1HG1 VAL 108 -4.900 4.844 7.987 793 HG12 VAL 108 2HG1 VAL 108 -5.829 3.699 8.955 794 HG13 VAL 108 3HG1 VAL 108 -4.289 3.211 8.248 795 HG21 VAL 108 3HG2 VAL 108 -5.811 5.413 10.869 796 HG22 VAL 108 1HG2 VAL 108 -4.886 6.492 9.823 797 HG23 VAL 108 2HG2 VAL 108 -4.259 6.051 11.412 798 H ARG 109 H ARG 109 -4.612 3.808 13.424 799 HA ARG 109 HA ARG 109 -2.494 5.460 14.189 800 HE ARG 109 HE ARG 109 -1.046 6.100 18.395 801 HB2 ARG 109 1HB ARG 109 -4.677 5.190 15.401 802 HB3 ARG 109 2HB ARG 109 -4.057 3.689 16.067 803 HG2 ARG 109 1HG ARG 109 -2.495 6.203 16.431 804 HG3 ARG 109 2HG ARG 109 -3.916 5.906 17.431 805 HD2 ARG 109 1HD ARG 109 -2.968 3.873 18.275 806 HD3 ARG 109 2HD ARG 109 -1.621 3.973 17.141 807 HH11 ARG 109 1HH1 ARG 109 -2.708 3.420 19.922 808 HH12 ARG 109 2HH1 ARG 109 -2.092 3.780 21.503 809 HH21 ARG 109 1HH2 ARG 109 -0.201 6.542 20.468 810 HH22 ARG 109 2HH2 ARG 109 -0.646 5.518 21.808 811 HA PRO 110 HA PRO 110 -0.443 1.277 16.067 812 HB2 PRO 110 1HB PRO 110 -1.159 -0.218 13.574 813 HB3 PRO 110 2HB PRO 110 -0.855 -0.833 15.204 814 HG2 PRO 110 1HG PRO 110 -3.339 -0.591 14.307 815 HG3 PRO 110 2HG PRO 110 -2.939 -0.172 15.983 816 HD2 PRO 110 1HD PRO 110 -3.534 1.607 13.674 817 HD3 PRO 110 2HD PRO 110 -3.853 1.851 15.402 818 H LEU 111 H LEU 111 -0.669 2.315 12.692 819 HA LEU 111 HA LEU 111 2.192 1.900 12.310 820 HG LEU 111 HG LEU 111 -0.167 0.467 10.869 821 HB2 LEU 111 1HB LEU 111 0.054 2.870 10.414 822 HB3 LEU 111 2HB LEU 111 1.738 2.638 9.983 823 HD11 LEU 111 1HD1 LEU 111 1.030 1.078 8.172 824 HD12 LEU 111 2HD1 LEU 111 -0.658 1.297 8.635 825 HD13 LEU 111 3HD1 LEU 111 0.035 -0.323 8.567 826 HD21 LEU 111 3HD2 LEU 111 2.123 0.011 11.579 827 HD22 LEU 111 1HD2 LEU 111 2.699 0.303 9.938 828 HD23 LEU 111 2HD2 LEU 111 1.641 -1.069 10.270 829 H LEU 112 H LEU 112 -0.169 4.505 12.563 830 HA LEU 112 HA LEU 112 1.471 6.677 11.936 831 HG LEU 112 HG LEU 112 -1.583 6.053 11.657 832 HB2 LEU 112 1HB LEU 112 -0.793 6.518 13.924 833 HB3 LEU 112 2HB LEU 112 -0.061 8.012 13.377 834 HD11 LEU 112 1HD1 LEU 112 -3.233 7.850 11.507 835 HD12 LEU 112 2HD1 LEU 112 -2.275 8.823 12.623 836 HD13 LEU 112 3HD1 LEU 112 -3.008 7.316 13.174 837 HD21 LEU 112 3HD2 LEU 112 -0.357 8.718 10.951 838 HD22 LEU 112 1HD2 LEU 112 -1.360 7.725 9.893 839 HD23 LEU 112 2HD2 LEU 112 0.222 7.141 10.414 840 H ALA 113 H ALA 113 1.089 4.876 14.928 841 HA ALA 113 HA ALA 113 2.557 6.563 16.630 842 HB1 ALA 113 3HB ALA 113 2.269 3.563 16.777 843 HB2 ALA 113 1HB ALA 113 1.124 4.736 17.428 844 HB3 ALA 113 2HB ALA 113 2.753 4.631 18.094 845 H MET 114 H MET 114 3.561 4.323 14.186 846 HA MET 114 HA MET 114 6.306 4.218 15.137 847 HB2 MET 114 1HB MET 114 5.023 3.079 12.646 848 HB3 MET 114 2HB MET 114 6.689 2.807 13.136 849 HG2 MET 114 1HG MET 114 5.932 1.673 15.145 850 HG3 MET 114 2HG MET 114 4.254 1.981 14.700 851 HE1 MET 114 3HE MET 114 4.632 -1.889 14.172 852 HE2 MET 114 1HE MET 114 3.746 -0.613 15.005 853 HE3 MET 114 2HE MET 114 5.435 -0.922 15.409 854 H GLY 115 H GLY 115 4.411 6.268 13.276 855 HA2 GLY 115 1HA GLY 115 5.217 8.315 12.394 856 HA3 GLY 115 2HA GLY 115 6.799 7.575 12.189 857 H VAL 116 H VAL 116 4.198 5.633 11.191 858 HA VAL 116 HA VAL 116 5.035 5.892 8.425 859 HB VAL 116 HB VAL 116 2.982 4.034 9.647 860 HG11 VAL 116 1HG1 VAL 116 3.274 2.721 7.594 861 HG12 VAL 116 2HG1 VAL 116 4.343 3.970 6.957 862 HG13 VAL 116 3HG1 VAL 116 2.646 4.335 7.263 863 HG21 VAL 116 3HG2 VAL 116 5.174 3.628 10.612 864 HG22 VAL 116 1HG2 VAL 116 5.893 3.551 9.003 865 HG23 VAL 116 2HG2 VAL 116 4.742 2.316 9.515 866 H GLY 117 H GLY 117 4.163 7.558 7.339 867 HA2 GLY 117 1HA GLY 117 1.503 8.532 7.891 868 HA3 GLY 117 2HA GLY 117 2.585 9.104 6.627 869 H VAL 118 H VAL 118 -0.246 7.454 7.226 870 HA VAL 118 HA VAL 118 -0.027 5.708 4.890 871 HB VAL 118 HB VAL 118 -2.253 5.899 6.927 872 HG11 VAL 118 1HG1 VAL 118 -2.958 3.728 6.025 873 HG12 VAL 118 2HG1 VAL 118 -1.695 3.837 4.798 874 HG13 VAL 118 3HG1 VAL 118 -3.020 5.000 4.806 875 HG21 VAL 118 3HG2 VAL 118 0.011 3.916 6.718 876 HG22 VAL 118 1HG2 VAL 118 -1.328 3.836 7.863 877 HG23 VAL 118 2HG2 VAL 118 -0.167 5.161 7.955 878 H GLU 119 H GLU 119 -0.794 6.295 2.992 879 HA GLU 119 HA GLU 119 -2.814 8.425 2.825 880 HB2 GLU 119 1HB GLU 119 -0.924 7.268 0.773 881 HB3 GLU 119 2HB GLU 119 -2.203 8.404 0.371 882 HG2 GLU 119 1HG GLU 119 0.038 8.963 2.299 883 HG3 GLU 119 2HG GLU 119 0.026 9.439 0.602 884 H ALA 120 H ALA 120 -4.845 7.946 2.257 885 HA ALA 120 HA ALA 120 -5.438 5.216 1.369 886 HB1 ALA 120 3HB ALA 120 -6.629 6.012 3.357 887 HB2 ALA 120 1HB ALA 120 -7.740 5.679 2.028 888 HB3 ALA 120 2HB ALA 120 -7.305 7.343 2.418 889 H MET 121 H MET 121 -5.274 5.097 -0.786 890 HA MET 121 HA MET 121 -6.920 6.906 -2.402 891 HB2 MET 121 1HB MET 121 -3.997 6.311 -2.932 892 HB3 MET 121 2HB MET 121 -5.076 7.083 -4.084 893 HG2 MET 121 1HG MET 121 -5.391 8.952 -2.553 894 HG3 MET 121 2HG MET 121 -4.330 8.175 -1.380 895 HE1 MET 121 3HE MET 121 -2.079 6.939 -3.275 896 HE2 MET 121 1HE MET 121 -1.724 7.789 -1.770 897 HE3 MET 121 2HE MET 121 -0.884 8.235 -3.256 898 H ASP 122 H ASP 122 -6.452 5.954 -4.881 899 HA ASP 122 HA ASP 122 -7.007 3.082 -4.629 900 HB2 ASP 122 1HB ASP 122 -7.758 5.066 -6.774 901 HB3 ASP 122 2HB ASP 122 -7.896 3.324 -7.003 902 H THR 123 H THR 123 -6.347 1.878 -6.748 903 HA THR 123 HA THR 123 -3.619 1.545 -6.608 904 HB THR 123 HB THR 123 -5.455 0.814 -8.895 905 HG1 THR 123 HG1 THR 123 -5.714 -1.112 -7.749 906 HG21 THR 123 3HG2 THR 123 -3.033 0.680 -9.466 907 HG22 THR 123 1HG2 THR 123 -3.844 -0.887 -9.472 908 HG23 THR 123 2HG2 THR 123 -2.817 -0.433 -8.115 909 H GLN 124 H GLN 124 -5.431 3.304 -9.129 910 HA GLN 124 HA GLN 124 -3.212 3.901 -10.743 911 HB2 GLN 124 1HB GLN 124 -5.575 4.061 -11.472 912 HB3 GLN 124 2HB GLN 124 -5.771 5.481 -10.455 913 HG2 GLN 124 1HG GLN 124 -4.095 6.662 -11.776 914 HG3 GLN 124 2HG GLN 124 -3.892 5.235 -12.792 915 HE21 GLN 124 2HE2 GLN 124 -5.540 4.658 -14.219 916 HE22 GLN 124 1HE2 GLN 124 -6.783 5.770 -14.685 917 H ALA 125 H ALA 125 -4.829 5.875 -8.267 918 HA ALA 125 HA ALA 125 -3.128 8.116 -8.535 919 HB1 ALA 125 3HB ALA 125 -5.354 8.268 -7.539 920 HB2 ALA 125 1HB ALA 125 -4.119 8.883 -6.440 921 HB3 ALA 125 2HB ALA 125 -4.816 7.284 -6.177 922 H ALA 126 H ALA 126 -3.032 5.253 -6.492 923 HA ALA 126 HA ALA 126 -0.905 6.105 -4.829 924 HB1 ALA 126 3HB ALA 126 -1.741 3.291 -5.528 925 HB2 ALA 126 1HB ALA 126 -2.413 4.267 -4.222 926 HB3 ALA 126 2HB ALA 126 -0.722 3.770 -4.170 927 H ALA 127 H ALA 127 -1.041 4.362 -7.893 928 HA ALA 127 HA ALA 127 1.632 3.558 -8.049 929 HB1 ALA 127 3HB ALA 127 -0.141 2.722 -9.527 930 HB2 ALA 127 1HB ALA 127 1.257 3.303 -10.433 931 HB3 ALA 127 2HB ALA 127 -0.200 4.292 -10.329 932 H ARG 128 H ARG 128 0.081 6.504 -9.336 933 HA ARG 128 HA ARG 128 2.386 7.613 -10.484 934 HE ARG 128 HE ARG 128 -1.810 8.659 -13.460 935 HB2 ARG 128 1HB ARG 128 -0.101 8.922 -9.394 936 HB3 ARG 128 2HB ARG 128 1.175 9.824 -10.199 937 HG2 ARG 128 1HG ARG 128 0.843 8.312 -12.179 938 HG3 ARG 128 2HG ARG 128 -0.597 7.698 -11.363 939 HD2 ARG 128 1HD ARG 128 -1.565 9.914 -11.326 940 HD3 ARG 128 2HD ARG 128 -0.098 10.596 -12.029 941 HH11 ARG 128 1HH1 ARG 128 0.081 11.618 -13.382 942 HH12 ARG 128 2HH1 ARG 128 -0.154 11.954 -15.071 943 HH21 ARG 128 1HH2 ARG 128 -2.111 9.110 -15.657 944 HH22 ARG 128 2HH2 ARG 128 -1.414 10.536 -16.363 945 H THR 129 H THR 129 0.977 8.105 -7.273 946 HA THR 129 HA THR 129 2.904 9.968 -6.383 947 HB THR 129 HB THR 129 1.265 8.113 -4.648 948 HG1 THR 129 HG1 THR 129 -0.313 9.068 -5.774 949 HG21 THR 129 3HG2 THR 129 2.332 10.906 -4.187 950 HG22 THR 129 1HG2 THR 129 2.967 9.427 -3.465 951 HG23 THR 129 2HG2 THR 129 1.343 9.981 -3.056 952 H TYR 130 H TYR 130 2.679 6.457 -6.208 953 HA TYR 130 HA TYR 130 4.857 5.956 -4.522 954 HD1 TYR 130 HD1 TYR 130 5.620 3.664 -3.657 955 HD2 TYR 130 HD2 TYR 130 4.926 2.768 -7.757 956 HE1 TYR 130 HE1 TYR 130 7.345 1.911 -3.561 957 HE2 TYR 130 HE2 TYR 130 6.646 1.020 -7.674 958 HH TYR 130 HH TYR 130 8.526 0.356 -6.416 959 HB2 TYR 130 1HB TYR 130 3.347 4.177 -5.023 960 HB3 TYR 130 2HB TYR 130 3.615 4.345 -6.753 961 H ASN 131 H ASN 131 4.692 6.274 -8.054 962 HA ASN 131 HA ASN 131 7.386 5.771 -8.597 963 HB2 ASN 131 1HB ASN 131 5.400 7.525 -10.048 964 HB3 ASN 131 2HB ASN 131 7.008 7.165 -10.665 965 HD21 ASN 131 2HD2 ASN 131 6.959 4.431 -9.610 966 HD22 ASN 131 1HD2 ASN 131 5.919 3.544 -10.663 967 H ILE 132 H ILE 132 5.750 8.768 -7.689 968 HA ILE 132 HA ILE 132 7.929 10.518 -8.029 969 HB ILE 132 HB ILE 132 5.681 10.726 -6.015 970 HG12 ILE 132 1HG1 ILE 132 5.904 11.904 -8.794 971 HG13 ILE 132 2HG1 ILE 132 4.909 10.517 -8.364 972 HG21 ILE 132 1HG2 ILE 132 7.544 12.832 -7.109 973 HG22 ILE 132 2HG2 ILE 132 7.531 12.199 -5.463 974 HG23 ILE 132 3HG2 ILE 132 6.161 13.136 -6.057 975 HD11 ILE 132 3HD1 ILE 132 3.589 11.925 -6.875 976 HD12 ILE 132 1HD1 ILE 132 3.585 12.545 -8.525 977 HD13 ILE 132 2HD1 ILE 132 4.592 13.313 -7.297 978 H LEU 133 H LEU 133 6.730 8.895 -5.099 979 HA LEU 133 HA LEU 133 8.781 9.878 -3.418 980 HG LEU 133 HG LEU 133 5.730 9.628 -3.324 981 HB2 LEU 133 1HB LEU 133 6.984 7.480 -3.066 982 HB3 LEU 133 2HB LEU 133 7.933 8.236 -1.798 983 HD11 LEU 133 1HD1 LEU 133 5.683 8.405 -0.571 984 HD12 LEU 133 2HD1 LEU 133 4.827 7.802 -1.990 985 HD13 LEU 133 3HD1 LEU 133 4.395 9.366 -1.299 986 HD21 LEU 133 3HD2 LEU 133 7.423 11.138 -2.432 987 HD22 LEU 133 1HD2 LEU 133 7.251 10.403 -0.838 988 HD23 LEU 133 2HD2 LEU 133 5.906 11.298 -1.545 989 H MET 134 H MET 134 8.475 6.983 -5.373 990 HA MET 134 HA MET 134 10.769 5.675 -4.295 991 HB2 MET 134 1HB MET 134 8.972 4.464 -5.481 992 HB3 MET 134 2HB MET 134 9.418 5.282 -6.972 993 HG2 MET 134 1HG MET 134 11.606 4.224 -6.914 994 HG3 MET 134 2HG MET 134 11.186 3.421 -5.403 995 HE1 MET 134 3HE MET 134 9.068 2.562 -9.415 996 HE2 MET 134 1HE MET 134 10.373 3.736 -9.235 997 HE3 MET 134 2HE MET 134 8.806 4.033 -8.481 998 H ALA 135 H ALA 135 10.194 7.846 -7.027 999 HA ALA 135 HA ALA 135 12.851 7.778 -8.035 1000 HB1 ALA 135 3HB ALA 135 12.245 9.798 -9.260 1001 HB2 ALA 135 1HB ALA 135 10.789 9.972 -8.278 1002 HB3 ALA 135 2HB ALA 135 10.959 8.596 -9.368 1003 H GLU 136 H GLU 136 11.159 9.837 -5.724 1004 HA GLU 136 HA GLU 136 13.221 11.591 -5.058 1005 HB2 GLU 136 1HB GLU 136 11.016 12.015 -4.266 1006 HB3 GLU 136 2HB GLU 136 10.919 10.450 -3.479 1007 HG2 GLU 136 1HG GLU 136 11.157 12.256 -1.873 1008 HG3 GLU 136 2HG GLU 136 12.531 11.157 -1.816 1009 H GLY 137 H GLY 137 12.556 8.311 -3.998 1010 HA2 GLY 137 1HA GLY 137 14.164 6.763 -3.275 1011 HA3 GLY 137 2HA GLY 137 15.299 8.087 -3.040 1012 H ARG 138 H ARG 138 12.012 7.734 -1.836 1013 HA ARG 138 HA ARG 138 13.065 7.965 0.906 1014 HE ARG 138 HE ARG 138 10.122 10.367 4.061 1015 HB2 ARG 138 1HB ARG 138 11.624 9.841 -0.038 1016 HB3 ARG 138 2HB ARG 138 10.292 8.696 -0.057 1017 HG2 ARG 138 1HG ARG 138 10.411 8.466 2.345 1018 HG3 ARG 138 2HG ARG 138 11.826 9.521 2.399 1019 HD2 ARG 138 1HD ARG 138 10.429 11.326 1.394 1020 HD3 ARG 138 2HD ARG 138 9.029 10.265 1.552 1021 HH11 ARG 138 1HH1 ARG 138 8.876 12.738 1.802 1022 HH12 ARG 138 2HH1 ARG 138 8.397 13.850 3.046 1023 HH21 ARG 138 1HH2 ARG 138 9.500 11.804 5.680 1024 HH22 ARG 138 2HH2 ARG 138 8.734 13.310 5.261 1025 H ARG 139 H ARG 139 12.006 6.682 2.549 1026 HA ARG 139 HA ARG 139 11.383 4.057 1.742 1027 HE ARG 139 HE ARG 139 14.868 2.894 3.567 1028 HB2 ARG 139 1HB ARG 139 11.122 5.521 4.350 1029 HB3 ARG 139 2HB ARG 139 10.510 3.881 4.178 1030 HG2 ARG 139 1HG ARG 139 13.348 4.708 3.613 1031 HG3 ARG 139 2HG ARG 139 12.786 3.997 5.129 1032 HD2 ARG 139 1HD ARG 139 12.169 1.968 4.031 1033 HD3 ARG 139 2HD ARG 139 12.448 2.680 2.443 1034 HH11 ARG 139 1HH1 ARG 139 12.644 0.199 3.478 1035 HH12 ARG 139 2HH1 ARG 139 13.892 -0.995 3.354 1036 HH21 ARG 139 1HH2 ARG 139 16.523 1.331 3.406 1037 HH22 ARG 139 2HH2 ARG 139 16.106 -0.357 3.291 1038 H VAL 140 H VAL 140 9.709 3.840 0.385 1039 HA VAL 140 HA VAL 140 7.056 4.503 1.448 1040 HB VAL 140 HB VAL 140 7.551 6.162 -0.264 1041 HG11 VAL 140 1HG1 VAL 140 9.239 4.970 -1.532 1042 HG12 VAL 140 2HG1 VAL 140 7.948 5.518 -2.600 1043 HG13 VAL 140 3HG1 VAL 140 8.029 3.825 -2.110 1044 HG21 VAL 140 3HG2 VAL 140 5.658 5.778 -1.765 1045 HG22 VAL 140 1HG2 VAL 140 5.255 5.363 -0.100 1046 HG23 VAL 140 2HG2 VAL 140 5.604 4.087 -1.266 1047 H VAL 141 H VAL 141 5.595 2.907 1.307 1048 HA VAL 141 HA VAL 141 6.216 0.595 -0.417 1049 HB VAL 141 HB VAL 141 4.750 0.455 2.229 1050 HG11 VAL 141 1HG1 VAL 141 5.766 -1.705 0.387 1051 HG12 VAL 141 2HG1 VAL 141 4.081 -1.256 0.644 1052 HG13 VAL 141 3HG1 VAL 141 5.013 -1.969 1.960 1053 HG21 VAL 141 3HG2 VAL 141 6.728 -0.631 3.145 1054 HG22 VAL 141 1HG2 VAL 141 7.111 1.000 2.596 1055 HG23 VAL 141 2HG2 VAL 141 7.583 -0.391 1.623 1056 H VAL 142 H VAL 142 4.571 -0.027 -1.760 1057 HA VAL 142 HA VAL 142 2.041 1.449 -1.436 1058 HB VAL 142 HB VAL 142 3.354 2.198 -3.392 1059 HG11 VAL 142 1HG1 VAL 142 3.576 0.743 -5.350 1060 HG12 VAL 142 2HG1 VAL 142 2.943 -0.609 -4.410 1061 HG13 VAL 142 3HG1 VAL 142 4.480 0.131 -3.965 1062 HG21 VAL 142 3HG2 VAL 142 1.540 2.067 -5.026 1063 HG22 VAL 142 1HG2 VAL 142 0.935 2.405 -3.404 1064 HG23 VAL 142 2HG2 VAL 142 0.785 0.784 -4.080 1065 H ALA 143 H ALA 143 0.236 0.330 -1.287 1066 HA ALA 143 HA ALA 143 0.308 -2.556 -1.889 1067 HB1 ALA 143 3HB ALA 143 -1.510 -2.798 -0.271 1068 HB2 ALA 143 1HB ALA 143 -1.485 -1.060 0.026 1069 HB3 ALA 143 2HB ALA 143 -0.096 -2.051 0.473 1070 H LEU 144 H LEU 144 -0.658 -3.013 -3.750 1071 HA LEU 144 HA LEU 144 -2.763 -1.204 -4.722 1072 HG LEU 144 HG LEU 144 0.318 -1.354 -5.590 1073 HB2 LEU 144 1HB LEU 144 -1.114 -3.218 -6.253 1074 HB3 LEU 144 2HB LEU 144 -2.276 -2.100 -6.944 1075 HD11 LEU 144 1HD1 LEU 144 -0.531 -1.204 -8.478 1076 HD12 LEU 144 2HD1 LEU 144 0.641 -2.330 -7.793 1077 HD13 LEU 144 3HD1 LEU 144 0.988 -0.601 -7.816 1078 HD21 LEU 144 3HD2 LEU 144 -1.758 0.402 -6.897 1079 HD22 LEU 144 1HD2 LEU 144 -0.190 0.931 -6.290 1080 HD23 LEU 144 2HD2 LEU 144 -1.407 0.317 -5.172 1081 H LEU 145 H LEU 145 -4.750 -1.968 -5.330 1082 HA LEU 145 HA LEU 145 -5.350 -4.751 -4.552 1083 HG LEU 145 HG LEU 145 -6.789 -5.045 -2.629 1084 HB2 LEU 145 1HB LEU 145 -6.051 -2.645 -3.084 1085 HB3 LEU 145 2HB LEU 145 -7.357 -2.563 -4.244 1086 HD11 LEU 145 1HD1 LEU 145 -8.555 -4.303 -1.113 1087 HD12 LEU 145 2HD1 LEU 145 -8.663 -2.772 -1.980 1088 HD13 LEU 145 3HD1 LEU 145 -7.191 -3.186 -1.101 1089 HD21 LEU 145 3HD2 LEU 145 -8.178 -5.358 -4.613 1090 HD22 LEU 145 1HD2 LEU 145 -9.250 -4.065 -4.074 1091 HD23 LEU 145 2HD2 LEU 145 -9.125 -5.555 -3.138 1092 HA PRO 146 HA PRO 146 -7.007 -5.202 -8.700 1093 HB2 PRO 146 1HB PRO 146 -8.774 -7.128 -7.267 1094 HB3 PRO 146 2HB PRO 146 -7.816 -7.356 -8.735 1095 HG2 PRO 146 1HG PRO 146 -7.004 -8.384 -6.427 1096 HG3 PRO 146 2HG PRO 146 -5.841 -7.663 -7.557 1097 HD2 PRO 146 1HD PRO 146 -6.951 -6.560 -5.014 1098 HD3 PRO 146 2HD PRO 146 -5.321 -6.401 -5.698 1099 H ASP 147 H ASP 147 -8.655 -4.240 -9.757 1100 HA ASP 147 HA ASP 147 -10.506 -2.769 -8.067 1101 HB2 ASP 147 1HB ASP 147 -10.803 -1.281 -9.973 1102 HB3 ASP 147 2HB ASP 147 -9.091 -1.510 -9.637 1103 H GLY 148 H GLY 148 -10.820 -5.659 -9.204 1104 HA2 GLY 148 1HA GLY 148 -13.572 -5.732 -9.144 1105 HA3 GLY 148 2HA GLY 148 -13.161 -5.476 -10.831 1106 H ASP 149 H ASP 149 -10.757 -7.051 -10.807 1107 HA ASP 149 HA ASP 149 -12.074 -9.698 -10.721 1108 HB2 ASP 149 1HB ASP 149 -9.979 -8.620 -12.595 1109 HB3 ASP 149 2HB ASP 149 -10.322 -10.340 -12.458 1110 H SER 150 H SER 150 -10.332 -11.514 -10.776 1111 HA SER 150 HA SER 150 -7.869 -11.162 -9.472 1112 HG SER 150 HG SER 150 -10.557 -12.448 -6.685 1113 HB2 SER 150 1HB SER 150 -8.426 -12.214 -7.293 1114 HB3 SER 150 2HB SER 150 -9.228 -10.658 -7.503 1115 H LEU 151 H LEU 151 -7.432 -13.568 -8.306 1116 HA LEU 151 HA LEU 151 -7.248 -15.366 -10.448 1117 HG LEU 151 HG LEU 151 -5.097 -14.834 -9.209 1118 HB2 LEU 151 1HB LEU 151 -7.193 -16.066 -7.511 1119 HB3 LEU 151 2HB LEU 151 -6.561 -17.040 -8.822 1120 HD11 LEU 151 1HD1 LEU 151 -6.109 -13.611 -7.364 1121 HD12 LEU 151 2HD1 LEU 151 -4.398 -13.915 -7.061 1122 HD13 LEU 151 3HD1 LEU 151 -5.624 -14.883 -6.242 1123 HD21 LEU 151 3HD2 LEU 151 -4.517 -16.997 -7.190 1124 HD22 LEU 151 1HD2 LEU 151 -3.318 -15.944 -7.942 1125 HD23 LEU 151 2HD2 LEU 151 -4.232 -17.086 -8.928 1126 H GLU 152 H GLU 152 -9.688 -14.918 -8.002 1127 HA GLU 152 HA GLU 152 -11.025 -17.368 -8.187 1128 HB2 GLU 152 1HB GLU 152 -11.449 -15.812 -6.378 1129 HB3 GLU 152 2HB GLU 152 -12.065 -14.613 -7.504 1130 HG2 GLU 152 1HG GLU 152 -13.963 -16.019 -8.016 1131 HG3 GLU 152 2HG GLU 152 -13.328 -17.293 -6.976 1132 H HIS 153 H HIS 153 -11.223 -14.467 -10.149 1133 HA HIS 153 HA HIS 153 -13.656 -15.218 -11.453 1134 HD1 HIS 153 HD1 HIS 153 -15.130 -12.277 -11.509 1135 HD2 HIS 153 HD2 HIS 153 -13.146 -13.447 -14.973 1136 HE1 HIS 153 HE1 HIS 153 -16.701 -11.756 -13.402 1137 HE2 HIS 153 HE2 HIS 153 -15.434 -12.350 -15.494 1138 HB2 HIS 153 1HB HIS 153 -12.700 -12.846 -11.116 1139 HB3 HIS 153 2HB HIS 153 -11.696 -13.198 -12.518 1140 H HIS 154 H HIS 154 -10.464 -16.244 -11.796 1141 HA HIS 154 HA HIS 154 -10.526 -16.746 -14.627 1142 HD1 HIS 154 HD1 HIS 154 -6.580 -16.427 -12.243 1143 HD2 HIS 154 HD2 HIS 154 -8.848 -15.341 -15.558 1144 HE1 HIS 154 HE1 HIS 154 -5.457 -14.385 -13.197 1145 HE2 HIS 154 HE2 HIS 154 -6.693 -13.918 -15.343 1146 HB2 HIS 154 1HB HIS 154 -8.717 -17.717 -12.417 1147 HB3 HIS 154 2HB HIS 154 -8.560 -18.285 -14.075 1148 H HIS 155 H HIS 155 -11.741 -18.292 -11.821 1149 HA HIS 155 HA HIS 155 -12.120 -20.826 -13.259 1150 HD1 HIS 155 HD1 HIS 155 -10.910 -23.325 -11.475 1151 HD2 HIS 155 HD2 HIS 155 -9.672 -19.588 -10.134 1152 HE1 HIS 155 HE1 HIS 155 -8.486 -23.587 -10.889 1153 HE2 HIS 155 HE2 HIS 155 -7.872 -21.413 -9.780 1154 HB2 HIS 155 1HB HIS 155 -12.436 -20.146 -10.327 1155 HB3 HIS 155 2HB HIS 155 -12.835 -21.709 -11.023 1156 H HIS 156 H HIS 156 -14.272 -21.913 -12.692 1157 HA HIS 156 HA HIS 156 -16.431 -19.916 -12.537 1158 HD1 HIS 156 HD1 HIS 156 -14.588 -22.339 -15.578 1159 HD2 HIS 156 HD2 HIS 156 -17.698 -24.252 -13.583 1160 HE1 HIS 156 HE1 HIS 156 -14.289 -24.792 -16.043 1161 HE2 HIS 156 HE2 HIS 156 -16.251 -25.918 -14.939 1162 HB2 HIS 156 1HB HIS 156 -17.821 -21.468 -13.928 1163 HB3 HIS 156 2HB HIS 156 -16.463 -20.755 -14.785 1164 H HIS 157 H HIS 157 -14.868 -22.249 -10.964 1165 HA HIS 157 HA HIS 157 -17.149 -22.714 -9.185 1166 HD1 HIS 157 HD1 HIS 157 -17.997 -26.036 -8.240 1167 HD2 HIS 157 HD2 HIS 157 -17.802 -24.637 -12.151 1168 HE1 HIS 157 HE1 HIS 157 -20.100 -26.847 -9.357 1169 HE2 HIS 157 HE2 HIS 157 -19.880 -26.128 -11.764 1170 HB2 HIS 157 1HB HIS 157 -15.416 -24.764 -10.467 1171 HB3 HIS 157 2HB HIS 157 -15.795 -25.001 -8.766 1172 H HIS 158 H HIS 158 -15.941 -23.976 -7.130 1173 HA HIS 158 HA HIS 158 -13.576 -22.335 -6.510 1174 HD1 HIS 158 HD1 HIS 158 -17.239 -20.958 -6.105 1175 HD2 HIS 158 HD2 HIS 158 -13.605 -19.800 -4.440 1176 HE1 HIS 158 HE1 HIS 158 -17.183 -18.447 -6.268 1177 HE2 HIS 158 HE2 HIS 158 -15.015 -17.757 -5.172 1178 HB2 HIS 158 1HB HIS 158 -16.014 -22.834 -4.822 1179 HB3 HIS 158 2HB HIS 158 -14.466 -22.440 -4.081 Start of MODEL 2 1 HA MET 1 HA MET 1 35.542 -4.196 -11.066 2 H1 MET 1 1H MET 1 36.941 -5.022 -9.295 3 H2 MET 1 2H MET 1 35.574 -5.415 -8.370 4 H3 MET 1 3H MET 1 35.908 -3.796 -8.740 5 HB2 MET 1 1HB MET 1 34.900 -7.000 -10.134 6 HB3 MET 1 2HB MET 1 34.530 -6.380 -11.738 7 HG2 MET 1 1HG MET 1 37.272 -6.683 -10.530 8 HG3 MET 1 2HG MET 1 36.552 -7.703 -11.775 9 HE1 MET 1 3HE MET 1 35.096 -5.670 -13.684 10 HE2 MET 1 1HE MET 1 36.144 -6.966 -14.260 11 HE3 MET 1 2HE MET 1 36.372 -5.321 -14.850 12 H LYS 2 H LYS 2 33.185 -4.808 -11.964 13 HA LYS 2 HA LYS 2 31.452 -3.387 -10.065 14 HB2 LYS 2 1HB LYS 2 31.342 -3.637 -13.073 15 HB3 LYS 2 2HB LYS 2 30.118 -2.822 -12.110 16 HG2 LYS 2 1HG LYS 2 31.787 -1.230 -11.319 17 HG3 LYS 2 2HG LYS 2 33.024 -2.055 -12.268 18 HD2 LYS 2 1HD LYS 2 32.204 -0.048 -13.407 19 HD3 LYS 2 2HD LYS 2 31.837 -1.508 -14.322 20 HE2 LYS 2 1HE LYS 2 29.958 0.102 -14.261 21 HE3 LYS 2 2HE LYS 2 29.551 -1.470 -13.570 22 HZ1 LYS 2 3HZ LYS 2 29.589 -0.617 -11.421 23 HZ2 LYS 2 1HZ LYS 2 28.818 0.598 -12.314 24 HZ3 LYS 2 2HZ LYS 2 30.444 0.781 -11.868 25 H LEU 3 H LEU 3 31.195 -5.926 -12.566 26 HA LEU 3 HA LEU 3 28.577 -6.641 -11.585 27 HG LEU 3 HG LEU 3 29.464 -5.594 -14.359 28 HB2 LEU 3 1HB LEU 3 30.262 -7.837 -13.779 29 HB3 LEU 3 2HB LEU 3 28.621 -8.329 -13.402 30 HD11 LEU 3 1HD1 LEU 3 27.940 -7.796 -15.739 31 HD12 LEU 3 2HD1 LEU 3 29.585 -7.274 -16.110 32 HD13 LEU 3 3HD1 LEU 3 28.227 -6.180 -16.386 33 HD21 LEU 3 3HD2 LEU 3 27.068 -5.126 -14.492 34 HD22 LEU 3 1HD2 LEU 3 27.565 -5.468 -12.835 35 HD23 LEU 3 2HD2 LEU 3 26.720 -6.698 -13.774 36 H HIS 4 H HIS 4 29.660 -7.074 -9.455 37 HA HIS 4 HA HIS 4 29.794 -9.984 -9.207 38 HD1 HIS 4 HD1 HIS 4 32.629 -11.461 -9.297 39 HD2 HIS 4 HD2 HIS 4 31.609 -10.042 -5.522 40 HE1 HIS 4 HE1 HIS 4 33.229 -13.306 -7.691 41 HE2 HIS 4 HE2 HIS 4 32.758 -12.357 -5.400 42 HB2 HIS 4 1HB HIS 4 32.156 -8.941 -9.224 43 HB3 HIS 4 2HB HIS 4 31.721 -8.230 -7.675 44 H THR 5 H THR 5 28.126 -7.439 -8.648 45 HA THR 5 HA THR 5 27.221 -8.229 -6.003 46 HB THR 5 HB THR 5 28.927 -6.489 -5.585 47 HG1 THR 5 HG1 THR 5 26.924 -4.905 -4.836 48 HG21 THR 5 3HG2 THR 5 27.130 -4.705 -7.230 49 HG22 THR 5 1HG2 THR 5 28.746 -5.252 -7.677 50 HG23 THR 5 2HG2 THR 5 28.531 -4.176 -6.297 51 H ASP 6 H ASP 6 25.299 -6.497 -5.479 52 HA ASP 6 HA ASP 6 23.669 -6.250 -7.918 53 HB2 ASP 6 1HB ASP 6 23.164 -8.366 -6.599 54 HB3 ASP 6 2HB ASP 6 22.616 -7.325 -5.291 55 HA PRO 7 HA PRO 7 22.685 -2.158 -6.383 56 HB2 PRO 7 1HB PRO 7 19.975 -2.810 -7.439 57 HB3 PRO 7 2HB PRO 7 20.985 -1.389 -7.733 58 HG2 PRO 7 1HG PRO 7 20.746 -3.265 -9.593 59 HG3 PRO 7 2HG PRO 7 22.312 -2.487 -9.291 60 HD2 PRO 7 1HD PRO 7 21.353 -5.200 -8.483 61 HD3 PRO 7 2HD PRO 7 22.968 -4.682 -9.009 62 H ALA 8 H ALA 8 20.814 -5.002 -5.652 63 HA ALA 8 HA ALA 8 19.927 -5.758 -3.712 64 HB1 ALA 8 3HB ALA 8 21.766 -4.624 -2.546 65 HB2 ALA 8 1HB ALA 8 20.271 -4.619 -1.609 66 HB3 ALA 8 2HB ALA 8 20.790 -3.158 -2.453 67 H THR 9 H THR 9 19.237 -2.257 -3.806 68 HA THR 9 HA THR 9 16.550 -2.654 -2.912 69 HB THR 9 HB THR 9 16.300 -0.215 -3.440 70 HG1 THR 9 HG1 THR 9 17.913 -0.268 -5.165 71 HG21 THR 9 3HG2 THR 9 17.866 0.559 -1.710 72 HG22 THR 9 1HG2 THR 9 18.725 -0.980 -1.805 73 HG23 THR 9 2HG2 THR 9 17.057 -0.933 -1.231 74 H ALA 10 H ALA 10 15.237 -3.763 -4.248 75 HA ALA 10 HA ALA 10 15.243 -3.394 -7.095 76 HB1 ALA 10 3HB ALA 10 13.329 -4.912 -7.089 77 HB2 ALA 10 1HB ALA 10 13.247 -4.813 -5.329 78 HB3 ALA 10 2HB ALA 10 14.646 -5.554 -6.107 79 H LEU 11 H LEU 11 14.002 -2.021 -8.269 80 HA LEU 11 HA LEU 11 12.740 0.124 -6.857 81 HG LEU 11 HG LEU 11 15.099 0.006 -8.904 82 HB2 LEU 11 1HB LEU 11 12.873 -0.477 -9.810 83 HB3 LEU 11 2HB LEU 11 12.261 1.014 -9.120 84 HD11 LEU 11 1HD1 LEU 11 14.562 0.765 -11.143 85 HD12 LEU 11 2HD1 LEU 11 15.631 1.916 -10.342 86 HD13 LEU 11 3HD1 LEU 11 13.910 2.270 -10.498 87 HD21 LEU 11 3HD2 LEU 11 15.565 2.204 -7.913 88 HD22 LEU 11 1HD2 LEU 11 14.456 1.257 -6.923 89 HD23 LEU 11 2HD2 LEU 11 13.840 2.568 -7.928 90 H ASN 12 H ASN 12 11.657 -2.540 -8.874 91 HA ASN 12 HA ASN 12 9.633 -3.496 -9.240 92 HB2 ASN 12 1HB ASN 12 8.921 -2.144 -6.629 93 HB3 ASN 12 2HB ASN 12 7.931 -3.356 -7.433 94 HD21 ASN 12 2HD2 ASN 12 9.302 -3.304 -4.802 95 HD22 ASN 12 1HD2 ASN 12 10.265 -4.736 -4.771 96 H THR 13 H THR 13 9.176 -2.380 -11.102 97 HA THR 13 HA THR 13 7.659 0.126 -10.832 98 HB THR 13 HB THR 13 9.159 -0.923 -13.243 99 HG1 THR 13 HG1 THR 13 9.898 1.334 -11.692 100 HG21 THR 13 3HG2 THR 13 7.883 1.767 -12.718 101 HG22 THR 13 1HG2 THR 13 7.289 0.542 -13.839 102 HG23 THR 13 2HG2 THR 13 8.833 1.337 -14.141 103 H VAL 14 H VAL 14 5.550 -0.070 -11.101 104 HA VAL 14 HA VAL 14 4.282 -2.283 -12.348 105 HB VAL 14 HB VAL 14 3.115 0.451 -11.785 106 HG11 VAL 14 1HG1 VAL 14 1.778 -2.227 -12.166 107 HG12 VAL 14 2HG1 VAL 14 1.752 -0.880 -13.304 108 HG13 VAL 14 3HG1 VAL 14 0.967 -0.722 -11.733 109 HG21 VAL 14 3HG2 VAL 14 4.066 -0.494 -9.757 110 HG22 VAL 14 1HG2 VAL 14 3.192 -2.001 -10.030 111 HG23 VAL 14 2HG2 VAL 14 2.305 -0.517 -9.683 112 H THR 15 H THR 15 4.767 -2.614 -14.450 113 HA THR 15 HA THR 15 5.138 -0.432 -16.276 114 HB THR 15 HB THR 15 5.171 -2.540 -17.910 115 HG1 THR 15 HG1 THR 15 4.755 -4.254 -16.679 116 HG21 THR 15 3HG2 THR 15 7.361 -1.900 -15.927 117 HG22 THR 15 1HG2 THR 15 7.067 -1.055 -17.446 118 HG23 THR 15 2HG2 THR 15 7.572 -2.745 -17.462 119 H ALA 16 H ALA 16 2.546 -2.582 -15.417 120 HA ALA 16 HA ALA 16 0.725 -0.967 -16.975 121 HB1 ALA 16 3HB ALA 16 0.802 -3.938 -17.489 122 HB2 ALA 16 1HB ALA 16 1.467 -2.720 -18.578 123 HB3 ALA 16 2HB ALA 16 -0.263 -2.750 -18.239 124 H TYR 17 H TYR 17 -1.425 -1.130 -16.278 125 HA TYR 17 HA TYR 17 -1.738 -2.287 -13.626 126 HD1 TYR 17 HD2 TYR 17 -2.402 -0.432 -11.783 127 HD2 TYR 17 HD1 TYR 17 -2.407 1.408 -15.621 128 HE1 TYR 17 HE2 TYR 17 -1.285 1.542 -10.832 129 HE2 TYR 17 HE1 TYR 17 -1.289 3.387 -14.681 130 HH TYR 17 HH TYR 17 -1.049 4.488 -12.462 131 HB2 TYR 17 1HB TYR 17 -3.595 -0.585 -15.303 132 HB3 TYR 17 2HB TYR 17 -3.966 -1.155 -13.681 133 H GLY 18 H GLY 18 -2.367 -3.037 -16.865 134 HA2 GLY 18 1HA GLY 18 -3.078 -4.998 -17.807 135 HA3 GLY 18 2HA GLY 18 -3.139 -5.675 -16.188 136 H ASP 19 H ASP 19 -5.000 -6.801 -17.037 137 HA ASP 19 HA ASP 19 -7.432 -5.251 -16.549 138 HB2 ASP 19 1HB ASP 19 -7.162 -5.473 -19.012 139 HB3 ASP 19 2HB ASP 19 -7.123 -7.223 -18.831 140 H GLY 20 H GLY 20 -7.472 -6.183 -14.503 141 HA2 GLY 20 1HA GLY 20 -8.598 -7.820 -13.187 142 HA3 GLY 20 2HA GLY 20 -8.326 -8.996 -14.466 143 H TYR 21 H TYR 21 -5.527 -7.420 -14.258 144 HA TYR 21 HA TYR 21 -4.360 -8.610 -11.927 145 HD1 TYR 21 HD1 TYR 21 -1.721 -8.889 -15.206 146 HD2 TYR 21 HD2 TYR 21 -5.543 -10.751 -15.355 147 HE1 TYR 21 HE1 TYR 21 -1.613 -8.903 -17.662 148 HE2 TYR 21 HE2 TYR 21 -5.444 -10.771 -17.810 149 HH TYR 21 HH TYR 21 -4.323 -9.557 -19.620 150 HB2 TYR 21 1HB TYR 21 -2.717 -10.002 -13.214 151 HB3 TYR 21 2HB TYR 21 -4.367 -10.610 -13.283 152 H ILE 22 H ILE 22 -2.235 -7.822 -11.555 153 HA ILE 22 HA ILE 22 -1.724 -5.353 -13.052 154 HB ILE 22 HB ILE 22 -0.557 -6.235 -10.403 155 HG12 ILE 22 1HG1 ILE 22 -2.812 -4.299 -10.985 156 HG13 ILE 22 2HG1 ILE 22 -3.001 -5.905 -10.292 157 HG21 ILE 22 1HG2 ILE 22 -0.520 -3.557 -11.794 158 HG22 ILE 22 2HG2 ILE 22 0.857 -4.638 -11.579 159 HG23 ILE 22 3HG2 ILE 22 0.104 -3.878 -10.176 160 HD11 ILE 22 3HD1 ILE 22 -1.700 -5.202 -8.343 161 HD12 ILE 22 1HD1 ILE 22 -3.138 -4.210 -8.578 162 HD13 ILE 22 2HD1 ILE 22 -1.554 -3.587 -9.037 163 H GLU 23 H GLU 23 0.218 -4.942 -14.062 164 HA GLU 23 HA GLU 23 1.937 -7.306 -14.410 165 HB2 GLU 23 1HB GLU 23 0.506 -6.279 -16.335 166 HB3 GLU 23 2HB GLU 23 1.747 -5.037 -16.363 167 HG2 GLU 23 1HG GLU 23 2.436 -7.938 -16.589 168 HG3 GLU 23 2HG GLU 23 1.942 -6.992 -17.987 169 H VAL 24 H VAL 24 3.774 -7.104 -13.308 170 HA VAL 24 HA VAL 24 5.073 -4.458 -13.166 171 HB VAL 24 HB VAL 24 4.878 -6.439 -10.886 172 HG11 VAL 24 1HG1 VAL 24 5.972 -4.716 -9.547 173 HG12 VAL 24 2HG1 VAL 24 6.116 -3.691 -10.974 174 HG13 VAL 24 3HG1 VAL 24 6.992 -5.219 -10.895 175 HG21 VAL 24 3HG2 VAL 24 2.756 -5.296 -11.257 176 HG22 VAL 24 1HG2 VAL 24 3.577 -3.735 -11.215 177 HG23 VAL 24 2HG2 VAL 24 3.515 -4.741 -9.766 178 H ASN 25 H ASN 25 6.875 -4.653 -14.307 179 HA ASN 25 HA ASN 25 8.871 -5.382 -15.108 180 HB2 ASN 25 1HB ASN 25 9.004 -6.588 -12.341 181 HB3 ASN 25 2HB ASN 25 10.366 -6.531 -13.452 182 HD21 ASN 25 2HD2 ASN 25 11.276 -4.498 -13.975 183 HD22 ASN 25 1HD2 ASN 25 11.051 -3.131 -12.935 184 H GLN 26 H GLN 26 6.960 -6.829 -16.189 185 HA GLN 26 HA GLN 26 6.741 -8.626 -17.541 186 HB2 GLN 26 1HB GLN 26 9.357 -9.516 -16.326 187 HB3 GLN 26 2HB GLN 26 8.538 -10.360 -17.633 188 HG2 GLN 26 1HG GLN 26 8.774 -8.447 -19.078 189 HG3 GLN 26 2HG GLN 26 9.471 -7.503 -17.762 190 HE21 GLN 26 2HE2 GLN 26 10.570 -8.194 -20.387 191 HE22 GLN 26 1HE2 GLN 26 12.075 -8.991 -20.071 192 H VAL 27 H VAL 27 6.466 -8.677 -14.287 193 HA VAL 27 HA VAL 27 5.494 -11.460 -14.260 194 HB VAL 27 HB VAL 27 6.042 -9.693 -11.866 195 HG11 VAL 27 1HG1 VAL 27 5.893 -11.803 -10.605 196 HG12 VAL 27 2HG1 VAL 27 5.452 -12.642 -12.091 197 HG13 VAL 27 3HG1 VAL 27 4.385 -11.406 -11.427 198 HG21 VAL 27 3HG2 VAL 27 7.744 -11.882 -13.052 199 HG22 VAL 27 1HG2 VAL 27 8.043 -11.077 -11.511 200 HG23 VAL 27 2HG2 VAL 27 8.128 -10.161 -13.016 201 H ARG 28 H ARG 28 3.365 -11.733 -14.350 202 HA ARG 28 HA ARG 28 1.634 -9.426 -13.850 203 HE ARG 28 HE ARG 28 1.610 -12.927 -17.376 204 HB2 ARG 28 1HB ARG 28 1.005 -12.099 -15.119 205 HB3 ARG 28 2HB ARG 28 -0.109 -10.744 -14.985 206 HG2 ARG 28 1HG ARG 28 1.323 -9.404 -16.419 207 HG3 ARG 28 2HG ARG 28 2.480 -10.731 -16.520 208 HD2 ARG 28 1HD ARG 28 -0.370 -10.769 -17.500 209 HD3 ARG 28 2HD ARG 28 1.074 -10.658 -18.504 210 HH11 ARG 28 1HH1 ARG 28 -1.551 -11.798 -18.342 211 HH12 ARG 28 2HH1 ARG 28 -2.191 -13.389 -18.589 212 HH21 ARG 28 1HH2 ARG 28 0.793 -15.021 -17.702 213 HH22 ARG 28 2HH2 ARG 28 -0.843 -15.236 -18.259 214 H PHE 29 H PHE 29 0.911 -9.229 -11.858 215 HA PHE 29 HA PHE 29 0.531 -11.589 -10.180 216 HD1 PHE 29 HD1 PHE 29 2.148 -11.268 -7.671 217 HD2 PHE 29 HD2 PHE 29 2.547 -8.047 -10.424 218 HE1 PHE 29 HE1 PHE 29 4.583 -11.261 -7.306 219 HE2 PHE 29 HE2 PHE 29 4.981 -8.039 -10.067 220 HZ PHE 29 HZ PHE 29 6.002 -9.646 -8.507 221 HB2 PHE 29 1HB PHE 29 0.396 -8.639 -9.514 222 HB3 PHE 29 2HB PHE 29 0.224 -9.947 -8.349 223 H SER 30 H SER 30 -1.390 -12.513 -10.127 224 HA SER 30 HA SER 30 -3.757 -11.057 -10.975 225 HG SER 30 HG SER 30 -2.501 -14.323 -11.753 226 HB2 SER 30 1HB SER 30 -3.593 -13.923 -10.020 227 HB3 SER 30 2HB SER 30 -4.843 -13.192 -11.024 228 H HIS 31 H HIS 31 -2.081 -11.520 -8.162 229 HA HIS 31 HA HIS 31 -4.494 -11.218 -6.505 230 HD1 HIS 31 HD1 HIS 31 -1.016 -13.936 -7.060 231 HD2 HIS 31 HD2 HIS 31 -0.739 -11.136 -3.995 232 HE1 HIS 31 HE1 HIS 31 1.426 -13.792 -6.487 233 HE2 HIS 31 HE2 HIS 31 1.522 -12.295 -4.463 234 HB2 HIS 31 1HB HIS 31 -3.271 -12.225 -4.648 235 HB3 HIS 31 2HB HIS 31 -3.280 -13.313 -6.027 236 H ALA 32 H ALA 32 -4.161 -9.890 -4.524 237 HA ALA 32 HA ALA 32 -3.088 -7.363 -5.230 238 HB1 ALA 32 3HB ALA 32 -3.735 -6.684 -2.973 239 HB2 ALA 32 1HB ALA 32 -4.011 -8.369 -2.539 240 HB3 ALA 32 2HB ALA 32 -5.023 -7.597 -3.758 241 H ILE 33 H ILE 33 -1.314 -6.246 -4.370 242 HA ILE 33 HA ILE 33 0.669 -7.860 -2.936 243 HB ILE 33 HB ILE 33 2.439 -6.973 -4.525 244 HG12 ILE 33 1HG1 ILE 33 0.014 -6.529 -6.283 245 HG13 ILE 33 2HG1 ILE 33 1.043 -5.264 -5.619 246 HG21 ILE 33 1HG2 ILE 33 1.769 -9.308 -4.483 247 HG22 ILE 33 2HG2 ILE 33 2.102 -8.787 -6.135 248 HG23 ILE 33 3HG2 ILE 33 0.435 -8.960 -5.583 249 HD11 ILE 33 3HD1 ILE 33 1.543 -5.704 -7.958 250 HD12 ILE 33 1HD1 ILE 33 1.907 -7.385 -7.572 251 HD13 ILE 33 2HD1 ILE 33 2.919 -6.093 -6.926 252 H ALA 34 H ALA 34 2.164 -6.717 -1.758 253 HA ALA 34 HA ALA 34 1.934 -3.780 -1.750 254 HB1 ALA 34 3HB ALA 34 2.196 -5.545 0.690 255 HB2 ALA 34 1HB ALA 34 0.737 -4.683 0.195 256 HB3 ALA 34 2HB ALA 34 2.173 -3.781 0.682 257 H PHE 35 H PHE 35 3.851 -2.967 -2.368 258 HA PHE 35 HA PHE 35 6.293 -4.321 -1.497 259 HD1 PHE 35 HD1 PHE 35 3.633 -4.778 -4.493 260 HD2 PHE 35 HD2 PHE 35 7.037 -2.357 -5.300 261 HE1 PHE 35 HE1 PHE 35 2.437 -3.727 -6.365 262 HE2 PHE 35 HE2 PHE 35 5.844 -1.299 -7.173 263 HZ PHE 35 HZ PHE 35 3.540 -1.985 -7.707 264 HB2 PHE 35 1HB PHE 35 7.210 -4.194 -3.822 265 HB3 PHE 35 2HB PHE 35 5.890 -5.339 -3.624 266 H ALA 36 H ALA 36 8.252 -3.076 -1.937 267 HA ALA 36 HA ALA 36 7.846 -0.190 -2.234 268 HB1 ALA 36 3HB ALA 36 9.220 0.264 -0.267 269 HB2 ALA 36 1HB ALA 36 9.375 -1.466 0.038 270 HB3 ALA 36 2HB ALA 36 7.800 -0.685 0.173 271 HA PRO 37 HA PRO 37 11.583 -0.532 -4.591 272 HB2 PRO 37 1HB PRO 37 12.410 2.166 -3.996 273 HB3 PRO 37 2HB PRO 37 11.633 1.554 -5.457 274 HG2 PRO 37 1HG PRO 37 10.436 3.268 -3.681 275 HG3 PRO 37 2HG PRO 37 9.552 2.168 -4.754 276 HD2 PRO 37 1HD PRO 37 10.208 1.872 -1.849 277 HD3 PRO 37 2HD PRO 37 8.718 1.446 -2.720 278 H GLU 38 H GLU 38 11.645 -0.522 -1.390 279 HA GLU 38 HA GLU 38 14.490 -1.032 -1.266 280 HB2 GLU 38 1HB GLU 38 14.150 1.443 -0.809 281 HB3 GLU 38 2HB GLU 38 13.250 0.979 0.627 282 HG2 GLU 38 1HG GLU 38 15.154 0.099 1.671 283 HG3 GLU 38 2HG GLU 38 16.067 0.064 0.162 284 H GLY 39 H GLY 39 11.818 -2.343 -1.014 285 HA2 GLY 39 1HA GLY 39 12.316 -3.691 1.535 286 HA3 GLY 39 2HA GLY 39 10.719 -3.008 1.264 287 HA PRO 40 HA PRO 40 10.745 -7.237 -0.600 288 HB2 PRO 40 1HB PRO 40 9.073 -8.491 1.058 289 HB3 PRO 40 2HB PRO 40 10.766 -8.235 1.494 290 HG2 PRO 40 1HG PRO 40 8.332 -6.783 2.417 291 HG3 PRO 40 2HG PRO 40 9.792 -7.216 3.324 292 HD2 PRO 40 1HD PRO 40 9.241 -4.716 2.187 293 HD3 PRO 40 2HD PRO 40 10.829 -5.280 2.743 294 H VAL 41 H VAL 41 8.791 -8.545 -1.350 295 HA VAL 41 HA VAL 41 6.540 -6.752 -1.976 296 HB VAL 41 HB VAL 41 7.379 -9.211 -3.531 297 HG11 VAL 41 1HG1 VAL 41 5.868 -8.325 -5.252 298 HG12 VAL 41 2HG1 VAL 41 5.417 -7.010 -4.168 299 HG13 VAL 41 3HG1 VAL 41 5.020 -8.676 -3.746 300 HG21 VAL 41 3HG2 VAL 41 8.233 -7.651 -5.233 301 HG22 VAL 41 1HG2 VAL 41 9.116 -7.523 -3.711 302 HG23 VAL 41 2HG2 VAL 41 7.916 -6.303 -4.139 303 H ALA 42 H ALA 42 4.999 -7.171 -0.522 304 HA ALA 42 HA ALA 42 4.592 -9.878 0.470 305 HB1 ALA 42 3HB ALA 42 3.022 -8.847 2.029 306 HB2 ALA 42 1HB ALA 42 3.208 -7.298 1.204 307 HB3 ALA 42 2HB ALA 42 4.577 -8.016 2.055 308 H SER 43 H SER 43 2.569 -10.943 0.378 309 HA SER 43 HA SER 43 0.948 -10.140 -1.940 310 HG SER 43 HG SER 43 3.106 -12.198 -2.011 311 HB2 SER 43 1HB SER 43 1.375 -12.877 -0.720 312 HB3 SER 43 2HB SER 43 0.285 -12.534 -2.064 313 H TRP 44 H TRP 44 -1.150 -9.737 -1.699 314 HA TRP 44 HA TRP 44 -2.314 -10.093 0.984 315 HD1 TRP 44 HD1 TRP 44 -1.128 -8.780 2.209 316 HE1 TRP 44 HE1 TRP 44 -1.380 -7.022 4.076 317 HE3 TRP 44 HE3 TRP 44 -4.658 -5.788 0.038 318 HZ2 TRP 44 HZ2 TRP 44 -2.873 -4.675 4.555 319 HZ3 TRP 44 HZ3 TRP 44 -5.443 -3.806 1.265 320 HH2 TRP 44 HH2 TRP 44 -4.568 -3.264 3.478 321 HB2 TRP 44 1HB TRP 44 -2.216 -7.829 -0.845 322 HB3 TRP 44 2HB TRP 44 -3.865 -8.219 -0.375 323 HA PRO 45 HA PRO 45 -5.339 -12.595 -1.216 324 HB2 PRO 45 1HB PRO 45 -6.520 -13.238 1.312 325 HB3 PRO 45 2HB PRO 45 -5.469 -14.251 0.324 326 HG2 PRO 45 1HG PRO 45 -4.792 -13.217 2.793 327 HG3 PRO 45 2HG PRO 45 -3.631 -13.756 1.569 328 HD2 PRO 45 1HD PRO 45 -4.537 -10.985 2.233 329 HD3 PRO 45 2HD PRO 45 -2.918 -11.567 1.781 330 H VAL 46 H VAL 46 -5.586 -9.688 0.043 331 HA VAL 46 HA VAL 46 -8.433 -9.531 0.573 332 HB VAL 46 HB VAL 46 -6.377 -7.316 0.439 333 HG11 VAL 46 1HG1 VAL 46 -7.994 -6.065 1.813 334 HG12 VAL 46 2HG1 VAL 46 -9.134 -7.400 1.648 335 HG13 VAL 46 3HG1 VAL 46 -8.641 -6.483 0.226 336 HG21 VAL 46 3HG2 VAL 46 -5.773 -8.987 2.116 337 HG22 VAL 46 1HG2 VAL 46 -7.373 -8.841 2.842 338 HG23 VAL 46 2HG2 VAL 46 -6.265 -7.468 2.865 339 H GLN 47 H GLN 47 -9.938 -8.623 -0.780 340 HA GLN 47 HA GLN 47 -8.965 -7.670 -3.392 341 HB2 GLN 47 1HB GLN 47 -11.454 -9.257 -2.767 342 HB3 GLN 47 2HB GLN 47 -11.152 -8.486 -4.317 343 HG2 GLN 47 1HG GLN 47 -9.100 -9.851 -4.543 344 HG3 GLN 47 2HG GLN 47 -9.534 -10.681 -3.049 345 HE21 GLN 47 2HE2 GLN 47 -9.231 -11.675 -5.802 346 HE22 GLN 47 1HE2 GLN 47 -10.730 -12.442 -6.194 347 H ARG 48 H ARG 48 -11.223 -7.213 -0.758 348 HA ARG 48 HA ARG 48 -12.320 -4.856 -2.126 349 HE ARG 48 HE ARG 48 -16.748 -6.083 -0.235 350 HB2 ARG 48 1HB ARG 48 -13.481 -6.439 0.176 351 HB3 ARG 48 2HB ARG 48 -14.253 -5.086 -0.644 352 HG2 ARG 48 1HG ARG 48 -14.332 -6.361 -2.712 353 HG3 ARG 48 2HG ARG 48 -13.517 -7.710 -1.924 354 HD2 ARG 48 1HD ARG 48 -15.895 -8.127 -2.053 355 HD3 ARG 48 2HD ARG 48 -15.404 -7.925 -0.373 356 HH11 ARG 48 1HH1 ARG 48 -16.166 -6.755 -3.642 357 HH12 ARG 48 2HH1 ARG 48 -17.433 -5.688 -4.178 358 HH21 ARG 48 1HH2 ARG 48 -18.394 -4.679 -0.956 359 HH22 ARG 48 2HH2 ARG 48 -18.678 -4.499 -2.665 360 HA PRO 49 HA PRO 49 -10.337 -2.202 0.762 361 HB2 PRO 49 1HB PRO 49 -12.597 -0.351 0.563 362 HB3 PRO 49 2HB PRO 49 -10.943 -0.159 -0.020 363 HG2 PRO 49 1HG PRO 49 -13.031 -0.492 -1.694 364 HG3 PRO 49 2HG PRO 49 -11.407 -1.104 -2.062 365 HD2 PRO 49 1HD PRO 49 -13.802 -2.575 -1.024 366 HD3 PRO 49 2HD PRO 49 -12.618 -3.073 -2.252 367 H ALA 50 H ALA 50 -13.271 -3.675 1.383 368 HA ALA 50 HA ALA 50 -13.777 -2.373 3.928 369 HB1 ALA 50 3HB ALA 50 -15.660 -2.951 2.483 370 HB2 ALA 50 1HB ALA 50 -15.751 -3.804 4.022 371 HB3 ALA 50 2HB ALA 50 -15.213 -4.654 2.575 372 H ASP 51 H ASP 51 -12.091 -5.109 2.722 373 HA ASP 51 HA ASP 51 -12.338 -6.684 5.138 374 HB2 ASP 51 1HB ASP 51 -10.458 -7.086 2.807 375 HB3 ASP 51 2HB ASP 51 -10.839 -8.263 4.054 376 H ILE 52 H ILE 52 -10.346 -4.186 3.998 377 HA ILE 52 HA ILE 52 -7.842 -4.886 5.062 378 HB ILE 52 HB ILE 52 -8.945 -2.113 4.591 379 HG12 ILE 52 1HG1 ILE 52 -7.319 -3.898 2.763 380 HG13 ILE 52 2HG1 ILE 52 -9.043 -3.581 2.592 381 HG21 ILE 52 1HG2 ILE 52 -6.965 -2.085 5.996 382 HG22 ILE 52 2HG2 ILE 52 -6.583 -1.457 4.393 383 HG23 ILE 52 3HG2 ILE 52 -6.103 -3.095 4.836 384 HD11 ILE 52 3HD1 ILE 52 -7.747 -2.246 1.039 385 HD12 ILE 52 1HD1 ILE 52 -6.838 -1.544 2.376 386 HD13 ILE 52 2HD1 ILE 52 -8.562 -1.216 2.215 387 H THR 53 H THR 53 -7.346 -5.203 7.118 388 HA THR 53 HA THR 53 -8.567 -3.489 9.174 389 HB THR 53 HB THR 53 -7.816 -5.274 10.787 390 HG1 THR 53 HG1 THR 53 -7.697 -7.390 9.334 391 HG21 THR 53 3HG2 THR 53 -9.763 -6.161 8.660 392 HG22 THR 53 1HG2 THR 53 -10.143 -5.139 10.048 393 HG23 THR 53 2HG2 THR 53 -9.640 -6.812 10.297 394 H ALA 54 H ALA 54 -7.092 -3.116 11.085 395 HA ALA 54 HA ALA 54 -4.644 -1.949 10.357 396 HB1 ALA 54 3HB ALA 54 -4.196 -1.805 12.757 397 HB2 ALA 54 1HB ALA 54 -5.505 -2.943 13.075 398 HB3 ALA 54 2HB ALA 54 -5.865 -1.353 12.399 399 H SER 55 H SER 55 -5.479 -5.150 11.487 400 HA SER 55 HA SER 55 -2.953 -6.211 11.992 401 HG SER 55 HG SER 55 -5.221 -7.661 13.451 402 HB2 SER 55 1HB SER 55 -5.224 -7.750 10.731 403 HB3 SER 55 2HB SER 55 -4.014 -8.331 11.877 404 H LEU 56 H LEU 56 -4.851 -6.123 8.997 405 HA LEU 56 HA LEU 56 -2.944 -7.476 7.402 406 HG LEU 56 HG LEU 56 -6.004 -7.637 7.717 407 HB2 LEU 56 1HB LEU 56 -5.164 -5.586 6.616 408 HB3 LEU 56 2HB LEU 56 -4.253 -6.578 5.494 409 HD11 LEU 56 1HD1 LEU 56 -7.500 -8.340 5.916 410 HD12 LEU 56 2HD1 LEU 56 -6.467 -7.525 4.742 411 HD13 LEU 56 3HD1 LEU 56 -7.323 -6.587 5.964 412 HD21 LEU 56 3HD2 LEU 56 -4.552 -9.051 5.484 413 HD22 LEU 56 1HD2 LEU 56 -5.668 -9.804 6.625 414 HD23 LEU 56 2HD2 LEU 56 -4.146 -9.122 7.198 415 H LEU 57 H LEU 57 -3.461 -4.098 8.208 416 HA LEU 57 HA LEU 57 -1.653 -2.975 6.361 417 HG LEU 57 HG LEU 57 -4.375 -2.104 7.521 418 HB2 LEU 57 1HB LEU 57 -2.477 -2.012 9.102 419 HB3 LEU 57 2HB LEU 57 -1.575 -1.055 7.942 420 HD11 LEU 57 1HD1 LEU 57 -5.031 0.253 7.736 421 HD12 LEU 57 2HD1 LEU 57 -3.373 0.665 8.171 422 HD13 LEU 57 3HD1 LEU 57 -4.329 -0.380 9.223 423 HD21 LEU 57 3HD2 LEU 57 -2.694 -0.225 5.864 424 HD22 LEU 57 1HD2 LEU 57 -4.375 -0.660 5.551 425 HD23 LEU 57 2HD2 LEU 57 -3.110 -1.885 5.440 426 H GLN 58 H GLN 58 -1.232 -4.225 9.641 427 HA GLN 58 HA GLN 58 1.467 -3.501 9.970 428 HB2 GLN 58 1HB GLN 58 -0.097 -5.790 11.178 429 HB3 GLN 58 2HB GLN 58 1.501 -5.287 11.714 430 HG2 GLN 58 1HG GLN 58 0.627 -3.105 12.330 431 HG3 GLN 58 2HG GLN 58 -0.971 -3.567 11.750 432 HE21 GLN 58 2HE2 GLN 58 -0.102 -2.721 14.402 433 HE22 GLN 58 1HE2 GLN 58 -0.546 -3.993 15.487 434 H GLN 59 H GLN 59 -0.055 -6.281 8.455 435 HA GLN 59 HA GLN 59 2.393 -7.675 7.956 436 HB2 GLN 59 1HB GLN 59 -0.382 -7.928 6.814 437 HB3 GLN 59 2HB GLN 59 0.957 -8.916 6.247 438 HG2 GLN 59 1HG GLN 59 1.258 -9.827 8.473 439 HG3 GLN 59 2HG GLN 59 -0.038 -8.800 9.083 440 HE21 GLN 59 2HE2 GLN 59 0.271 -11.741 9.003 441 HE22 GLN 59 1HE2 GLN 59 -1.156 -12.322 8.203 442 H ALA 60 H ALA 60 0.345 -5.489 6.074 443 HA ALA 60 HA ALA 60 1.745 -5.731 3.631 444 HB1 ALA 60 3HB ALA 60 0.069 -3.424 4.609 445 HB2 ALA 60 1HB ALA 60 -0.543 -4.866 3.798 446 HB3 ALA 60 2HB ALA 60 0.521 -3.755 2.937 447 H ALA 61 H ALA 61 2.361 -3.883 6.492 448 HA ALA 61 HA ALA 61 4.026 -1.893 5.377 449 HB1 ALA 61 3HB ALA 61 4.782 -1.504 7.652 450 HB2 ALA 61 1HB ALA 61 4.074 -3.036 8.168 451 HB3 ALA 61 2HB ALA 61 3.032 -1.725 7.614 452 H GLY 62 H GLY 62 4.527 -5.236 6.029 453 HA2 GLY 62 1HA GLY 62 6.327 -6.606 5.630 454 HA3 GLY 62 2HA GLY 62 7.041 -5.271 4.737 455 H LEU 63 H LEU 63 6.155 -5.496 8.156 456 HA LEU 63 HA LEU 63 8.697 -4.349 8.912 457 HG LEU 63 HG LEU 63 5.799 -3.311 9.149 458 HB2 LEU 63 1HB LEU 63 6.350 -5.261 10.580 459 HB3 LEU 63 2HB LEU 63 7.742 -4.388 11.193 460 HD11 LEU 63 1HD1 LEU 63 4.980 -1.894 10.949 461 HD12 LEU 63 2HD1 LEU 63 6.076 -2.684 12.083 462 HD13 LEU 63 3HD1 LEU 63 4.764 -3.600 11.343 463 HD21 LEU 63 3HD2 LEU 63 8.073 -1.999 10.636 464 HD22 LEU 63 1HD2 LEU 63 6.913 -1.167 9.599 465 HD23 LEU 63 2HD2 LEU 63 8.019 -2.355 8.909 466 H ALA 64 H ALA 64 8.580 -7.106 7.799 467 HA ALA 64 HA ALA 64 10.086 -8.432 9.919 468 HB1 ALA 64 3HB ALA 64 7.803 -9.273 10.156 469 HB2 ALA 64 1HB ALA 64 8.893 -10.540 9.594 470 HB3 ALA 64 2HB ALA 64 7.800 -9.750 8.459 471 H GLU 65 H GLU 65 11.957 -9.078 9.090 472 HA GLU 65 HA GLU 65 12.257 -9.425 6.231 473 HB2 GLU 65 1HB GLU 65 14.238 -9.599 8.503 474 HB3 GLU 65 2HB GLU 65 14.661 -9.880 6.821 475 HG2 GLU 65 1HG GLU 65 13.916 -7.572 6.304 476 HG3 GLU 65 2HG GLU 65 13.657 -7.314 8.031 477 H VAL 66 H VAL 66 11.441 -11.297 5.491 478 HA VAL 66 HA VAL 66 11.828 -13.770 6.943 479 HB VAL 66 HB VAL 66 10.785 -13.362 4.131 480 HG11 VAL 66 1HG1 VAL 66 9.835 -15.606 4.398 481 HG12 VAL 66 2HG1 VAL 66 10.602 -15.739 5.981 482 HG13 VAL 66 3HG1 VAL 66 11.593 -15.624 4.527 483 HG21 VAL 66 3HG2 VAL 66 8.551 -13.640 5.123 484 HG22 VAL 66 1HG2 VAL 66 9.375 -12.205 5.735 485 HG23 VAL 66 2HG2 VAL 66 9.279 -13.660 6.730 486 H VAL 67 H VAL 67 13.893 -14.382 7.049 487 HA VAL 67 HA VAL 67 15.478 -14.316 4.565 488 HB VAL 67 HB VAL 67 16.183 -12.624 6.255 489 HG11 VAL 67 1HG1 VAL 67 17.311 -13.348 8.291 490 HG12 VAL 67 2HG1 VAL 67 16.889 -15.022 7.933 491 HG13 VAL 67 3HG1 VAL 67 15.620 -13.847 8.277 492 HG21 VAL 67 3HG2 VAL 67 17.794 -13.452 4.645 493 HG22 VAL 67 1HG2 VAL 67 18.188 -14.807 5.703 494 HG23 VAL 67 2HG2 VAL 67 18.579 -13.159 6.197 495 H ARG 68 H ARG 68 17.212 -15.954 4.486 496 HA ARG 68 HA ARG 68 16.176 -18.501 5.439 497 HE ARG 68 HE ARG 68 19.320 -18.233 1.406 498 HB2 ARG 68 1HB ARG 68 18.501 -17.922 3.593 499 HB3 ARG 68 2HB ARG 68 17.784 -19.499 3.894 500 HG2 ARG 68 1HG ARG 68 15.752 -18.864 2.821 501 HG3 ARG 68 2HG ARG 68 16.279 -17.185 2.701 502 HD2 ARG 68 1HD ARG 68 17.445 -19.570 1.273 503 HD3 ARG 68 2HD ARG 68 16.543 -18.235 0.556 504 HH11 ARG 68 1HH1 ARG 68 16.560 -16.327 0.388 505 HH12 ARG 68 2HH1 ARG 68 17.511 -14.940 -0.037 506 HH21 ARG 68 1HH2 ARG 68 20.579 -16.410 0.834 507 HH22 ARG 68 2HH2 ARG 68 19.797 -14.998 0.184 508 H ASP 69 H ASP 69 18.321 -16.217 6.542 509 HA ASP 69 HA ASP 69 19.802 -18.250 8.062 510 HB2 ASP 69 1HB ASP 69 21.305 -17.090 6.511 511 HB3 ASP 69 2HB ASP 69 20.818 -15.538 7.190 512 HA PRO 70 HA PRO 70 17.728 -15.866 11.275 513 HB2 PRO 70 1HB PRO 70 17.137 -17.913 12.872 514 HB3 PRO 70 2HB PRO 70 16.259 -17.669 11.357 515 HG2 PRO 70 1HG PRO 70 18.423 -19.619 12.001 516 HG3 PRO 70 2HG PRO 70 16.986 -19.832 10.986 517 HD2 PRO 70 1HD PRO 70 19.575 -19.258 10.080 518 HD3 PRO 70 2HD PRO 70 18.081 -19.101 9.137 519 H LEU 71 H LEU 71 20.712 -17.161 11.037 520 HA LEU 71 HA LEU 71 21.373 -17.199 13.868 521 HG LEU 71 HG LEU 71 21.432 -19.423 11.664 522 HB2 LEU 71 1HB LEU 71 23.127 -17.620 11.444 523 HB3 LEU 71 2HB LEU 71 23.600 -17.895 13.109 524 HD11 LEU 71 1HD1 LEU 71 23.622 -19.913 10.737 525 HD12 LEU 71 2HD1 LEU 71 23.025 -21.280 11.677 526 HD13 LEU 71 3HD1 LEU 71 24.256 -20.214 12.354 527 HD21 LEU 71 3HD2 LEU 71 21.059 -19.293 14.064 528 HD22 LEU 71 1HD2 LEU 71 22.708 -19.842 14.364 529 HD23 LEU 71 2HD2 LEU 71 21.545 -20.922 13.596 530 H ALA 72 H ALA 72 22.162 -15.376 10.941 531 HA ALA 72 HA ALA 72 23.152 -13.364 10.590 532 HB1 ALA 72 3HB ALA 72 21.623 -12.659 13.088 533 HB2 ALA 72 1HB ALA 72 20.972 -12.683 11.450 534 HB3 ALA 72 2HB ALA 72 22.226 -11.524 11.881 535 H PHE 73 H PHE 73 25.261 -14.390 11.121 536 HA PHE 73 HA PHE 73 26.412 -13.957 13.697 537 HD1 PHE 73 HD2 PHE 73 27.690 -15.942 14.557 538 HD2 PHE 73 HD1 PHE 73 26.755 -16.772 10.489 539 HE1 PHE 73 HE2 PHE 73 27.143 -18.261 15.162 540 HE2 PHE 73 HE1 PHE 73 26.206 -19.094 11.089 541 HZ PHE 73 HZ PHE 73 26.402 -19.842 13.425 542 HB2 PHE 73 1HB PHE 73 27.633 -14.713 11.043 543 HB3 PHE 73 2HB PHE 73 28.572 -14.556 12.521 544 H LEU 74 H LEU 74 26.194 -12.085 10.777 545 HA LEU 74 HA LEU 74 28.280 -10.239 11.499 546 HG LEU 74 HG LEU 74 27.865 -11.690 8.857 547 HB2 LEU 74 1HB LEU 74 26.075 -10.100 9.447 548 HB3 LEU 74 2HB LEU 74 27.273 -8.839 9.662 549 HD11 LEU 74 1HD1 LEU 74 28.440 -10.701 6.689 550 HD12 LEU 74 2HD1 LEU 74 27.885 -9.129 7.265 551 HD13 LEU 74 3HD1 LEU 74 26.741 -10.460 7.091 552 HD21 LEU 74 3HD2 LEU 74 29.681 -9.290 9.064 553 HD22 LEU 74 1HD2 LEU 74 30.133 -10.889 8.474 554 HD23 LEU 74 2HD2 LEU 74 29.669 -10.671 10.161 555 H ASP 75 H ASP 75 25.127 -10.735 12.549 556 HA ASP 75 HA ASP 75 24.739 -7.915 13.256 557 HB2 ASP 75 1HB ASP 75 22.889 -9.254 12.123 558 HB3 ASP 75 2HB ASP 75 22.749 -10.154 13.631 559 H GLU 76 H GLU 76 25.115 -7.248 15.244 560 HA GLU 76 HA GLU 76 26.009 -9.079 17.260 561 HB2 GLU 76 1HB GLU 76 25.440 -6.111 17.448 562 HB3 GLU 76 2HB GLU 76 26.339 -7.069 18.620 563 HG2 GLU 76 1HG GLU 76 28.050 -7.531 16.951 564 HG3 GLU 76 2HG GLU 76 27.145 -6.602 15.758 565 HA PRO 77 HA PRO 77 22.186 -10.320 18.892 566 HB2 PRO 77 1HB PRO 77 22.883 -10.450 21.590 567 HB3 PRO 77 2HB PRO 77 23.123 -11.723 20.390 568 HG2 PRO 77 1HG PRO 77 25.053 -9.696 21.420 569 HG3 PRO 77 2HG PRO 77 25.327 -11.393 20.989 570 HD2 PRO 77 1HD PRO 77 26.101 -9.408 19.372 571 HD3 PRO 77 2HD PRO 77 25.449 -10.926 18.718 572 H GLU 78 H GLU 78 21.137 -8.327 18.408 573 HA GLU 78 HA GLU 78 20.138 -7.051 20.843 574 HB2 GLU 78 1HB GLU 78 21.184 -5.662 18.385 575 HB3 GLU 78 2HB GLU 78 19.980 -4.897 19.411 576 HG2 GLU 78 1HG GLU 78 22.521 -5.941 20.583 577 HG3 GLU 78 2HG GLU 78 22.486 -4.381 19.766 578 H ALA 79 H ALA 79 18.251 -8.209 20.735 579 HA ALA 79 HA ALA 79 16.919 -8.583 18.198 580 HB1 ALA 79 3HB ALA 79 17.039 -10.406 19.823 581 HB2 ALA 79 1HB ALA 79 15.370 -9.983 19.443 582 HB3 ALA 79 2HB ALA 79 16.091 -9.451 20.962 583 H GLY 80 H GLY 80 16.161 -6.614 17.529 584 HA2 GLY 80 1HA GLY 80 14.252 -5.337 17.172 585 HA3 GLY 80 2HA GLY 80 13.598 -5.936 18.687 586 H ALA 81 H ALA 81 15.293 -5.153 20.578 587 HA ALA 81 HA ALA 81 14.630 -2.387 20.775 588 HB1 ALA 81 3HB ALA 81 15.607 -2.495 22.991 589 HB2 ALA 81 1HB ALA 81 16.338 -4.055 22.616 590 HB3 ALA 81 2HB ALA 81 14.584 -3.902 22.703 591 H GLY 82 H GLY 82 17.375 -4.048 19.604 592 HA2 GLY 82 1HA GLY 82 19.186 -1.808 20.039 593 HA3 GLY 82 2HA GLY 82 19.589 -3.345 19.286 594 H ALA 83 H ALA 83 16.933 -1.181 18.441 595 HA ALA 83 HA ALA 83 18.287 -0.131 16.126 596 HB1 ALA 83 3HB ALA 83 17.628 -2.335 15.289 597 HB2 ALA 83 1HB ALA 83 16.729 -1.055 14.478 598 HB3 ALA 83 2HB ALA 83 15.955 -2.013 15.740 599 H ARG 84 H ARG 84 16.663 1.210 14.798 600 HA ARG 84 HA ARG 84 14.665 2.403 16.612 601 HE ARG 84 HE ARG 84 14.975 5.844 17.196 602 HB2 ARG 84 1HB ARG 84 16.429 3.774 14.569 603 HB3 ARG 84 2HB ARG 84 15.104 4.560 15.414 604 HG2 ARG 84 1HG ARG 84 17.573 3.398 16.688 605 HG3 ARG 84 2HG ARG 84 17.239 5.111 16.423 606 HD2 ARG 84 1HD ARG 84 15.603 3.247 18.139 607 HD3 ARG 84 2HD ARG 84 16.779 4.417 18.735 608 HH11 ARG 84 1HH1 ARG 84 14.847 3.836 20.057 609 HH12 ARG 84 2HH1 ARG 84 13.561 4.743 20.796 610 HH21 ARG 84 1HH2 ARG 84 13.250 7.016 18.127 611 HH22 ARG 84 2HH2 ARG 84 12.634 6.545 19.690 612 HA PRO 85 HA PRO 85 11.647 1.742 13.436 613 HB2 PRO 85 1HB PRO 85 10.041 3.915 13.708 614 HB3 PRO 85 2HB PRO 85 10.062 2.579 14.866 615 HG2 PRO 85 1HG PRO 85 11.411 5.247 15.025 616 HG3 PRO 85 2HG PRO 85 10.544 4.352 16.287 617 HD2 PRO 85 1HD PRO 85 13.248 4.390 16.124 618 HD3 PRO 85 2HD PRO 85 12.345 2.991 16.737 619 H ALA 86 H ALA 86 14.064 3.818 13.028 620 HA ALA 86 HA ALA 86 13.137 5.405 10.831 621 HB1 ALA 86 3HB ALA 86 15.489 5.975 10.520 622 HB2 ALA 86 1HB ALA 86 15.957 4.718 11.666 623 HB3 ALA 86 2HB ALA 86 15.031 6.114 12.217 624 H ASN 87 H ASN 87 14.154 2.180 11.267 625 HA ASN 87 HA ASN 87 14.897 1.751 8.494 626 HB2 ASN 87 1HB ASN 87 14.573 -0.179 10.804 627 HB3 ASN 87 2HB ASN 87 15.138 -0.629 9.199 628 HD21 ASN 87 2HD2 ASN 87 17.198 -0.047 8.558 629 HD22 ASN 87 1HD2 ASN 87 18.384 0.535 9.669 630 H ALA 88 H ALA 88 12.073 2.280 9.933 631 HA ALA 88 HA ALA 88 10.564 0.144 8.630 632 HB1 ALA 88 3HB ALA 88 10.023 0.655 10.962 633 HB2 ALA 88 1HB ALA 88 8.654 0.989 9.902 634 HB3 ALA 88 2HB ALA 88 9.641 2.316 10.514 635 HA PRO 89 HA PRO 89 9.052 2.526 5.187 636 HB2 PRO 89 1HB PRO 89 6.313 1.945 6.207 637 HB3 PRO 89 2HB PRO 89 6.991 1.696 4.594 638 HG2 PRO 89 1HG PRO 89 6.620 -0.359 6.244 639 HG3 PRO 89 2HG PRO 89 8.049 -0.275 5.195 640 HD2 PRO 89 1HD PRO 89 7.812 0.222 8.127 641 HD3 PRO 89 2HD PRO 89 9.149 -0.496 7.206 642 H GLU 90 H GLU 90 8.589 4.633 4.847 643 HA GLU 90 HA GLU 90 7.966 6.240 7.182 644 HB2 GLU 90 1HB GLU 90 9.844 6.854 5.707 645 HB3 GLU 90 2HB GLU 90 8.723 7.053 4.371 646 HG2 GLU 90 1HG GLU 90 7.729 8.949 5.358 647 HG3 GLU 90 2HG GLU 90 8.528 8.652 6.903 648 H VAL 91 H VAL 91 6.605 5.410 4.042 649 HA VAL 91 HA VAL 91 4.020 6.333 5.016 650 HB VAL 91 HB VAL 91 4.879 8.234 3.746 651 HG11 VAL 91 1HG1 VAL 91 5.039 6.320 1.426 652 HG12 VAL 91 2HG1 VAL 91 6.394 7.109 2.236 653 HG13 VAL 91 3HG1 VAL 91 5.231 8.070 1.322 654 HG21 VAL 91 3HG2 VAL 91 3.004 8.502 2.188 655 HG22 VAL 91 1HG2 VAL 91 2.488 7.837 3.738 656 HG23 VAL 91 2HG2 VAL 91 2.648 6.782 2.334 657 H LEU 92 H LEU 92 2.351 5.121 4.401 658 HA LEU 92 HA LEU 92 2.852 2.904 2.522 659 HG LEU 92 HG LEU 92 0.143 1.509 3.083 660 HB2 LEU 92 1HB LEU 92 2.494 2.190 4.854 661 HB3 LEU 92 2HB LEU 92 0.965 3.045 4.882 662 HD11 LEU 92 1HD1 LEU 92 2.298 0.832 2.174 663 HD12 LEU 92 2HD1 LEU 92 1.373 -0.573 2.705 664 HD13 LEU 92 3HD1 LEU 92 2.700 0.034 3.695 665 HD21 LEU 92 3HD2 LEU 92 1.063 0.219 5.650 666 HD22 LEU 92 1HD2 LEU 92 -0.203 -0.392 4.585 667 HD23 LEU 92 2HD2 LEU 92 -0.423 1.143 5.425 668 H LEU 93 H LEU 93 1.790 3.112 0.669 669 HA LEU 93 HA LEU 93 -0.644 4.766 0.615 670 HG LEU 93 HG LEU 93 2.198 5.750 -0.234 671 HB2 LEU 93 1HB LEU 93 1.220 3.971 -1.626 672 HB3 LEU 93 2HB LEU 93 -0.236 4.927 -1.825 673 HD11 LEU 93 1HD1 LEU 93 2.513 7.396 -2.017 674 HD12 LEU 93 2HD1 LEU 93 1.153 6.701 -2.899 675 HD13 LEU 93 3HD1 LEU 93 2.613 5.747 -2.632 676 HD21 LEU 93 3HD2 LEU 93 -0.331 7.262 -0.889 677 HD22 LEU 93 1HD2 LEU 93 1.089 7.927 -0.080 678 HD23 LEU 93 2HD2 LEU 93 0.139 6.663 0.701 679 H VAL 94 H VAL 94 -2.508 3.734 0.460 680 HA VAL 94 HA VAL 94 -2.479 0.951 -0.502 681 HB VAL 94 HB VAL 94 -4.561 2.320 1.215 682 HG11 VAL 94 1HG1 VAL 94 -5.409 0.054 1.595 683 HG12 VAL 94 2HG1 VAL 94 -4.203 -0.582 0.476 684 HG13 VAL 94 3HG1 VAL 94 -5.471 0.493 -0.112 685 HG21 VAL 94 3HG2 VAL 94 -3.657 0.983 3.059 686 HG22 VAL 94 1HG2 VAL 94 -2.452 2.099 2.416 687 HG23 VAL 94 2HG2 VAL 94 -2.380 0.387 2.000 688 H GLY 95 H GLY 95 -3.299 0.590 -2.446 689 HA2 GLY 95 1HA GLY 95 -5.189 2.519 -3.605 690 HA3 GLY 95 2HA GLY 95 -4.330 1.254 -4.481 691 H THR 96 H THR 96 -7.247 2.137 -3.071 692 HA THR 96 HA THR 96 -8.035 -0.501 -2.206 693 HB THR 96 HB THR 96 -10.252 0.707 -1.759 694 HG1 THR 96 HG1 THR 96 -10.231 2.584 -2.798 695 HG21 THR 96 3HG2 THR 96 -7.724 1.651 -0.399 696 HG22 THR 96 1HG2 THR 96 -8.621 0.182 -0.015 697 HG23 THR 96 2HG2 THR 96 -9.354 1.761 0.266 698 H GLY 97 H GLY 97 -7.718 0.477 -5.206 699 HA2 GLY 97 1HA GLY 97 -8.442 -0.548 -7.128 700 HA3 GLY 97 2HA GLY 97 -9.468 -1.565 -6.133 701 H ARG 98 H ARG 98 -11.604 -1.110 -5.943 702 HA ARG 98 HA ARG 98 -12.733 0.115 -8.205 703 HE ARG 98 HE ARG 98 -14.546 -4.963 -7.404 704 HB2 ARG 98 1HB ARG 98 -14.011 -0.891 -5.663 705 HB3 ARG 98 2HB ARG 98 -14.925 -0.333 -7.057 706 HG2 ARG 98 1HG ARG 98 -13.790 -2.093 -8.414 707 HG3 ARG 98 2HG ARG 98 -13.070 -2.702 -6.923 708 HD2 ARG 98 1HD ARG 98 -15.262 -3.148 -6.001 709 HD3 ARG 98 2HD ARG 98 -16.037 -2.420 -7.408 710 HH11 ARG 98 1HH1 ARG 98 -16.897 -2.793 -8.827 711 HH12 ARG 98 2HH1 ARG 98 -17.399 -3.929 -10.037 712 HH21 ARG 98 1HH2 ARG 98 -15.229 -6.478 -9.006 713 HH22 ARG 98 2HH2 ARG 98 -16.459 -6.010 -10.141 714 H ARG 99 H ARG 99 -12.651 1.155 -4.821 715 HA ARG 99 HA ARG 99 -13.273 3.876 -5.679 716 HE ARG 99 HE ARG 99 -17.436 1.435 -5.676 717 HB2 ARG 99 1HB ARG 99 -14.957 2.172 -3.912 718 HB3 ARG 99 2HB ARG 99 -14.764 3.859 -3.460 719 HG2 ARG 99 1HG ARG 99 -15.718 4.600 -5.506 720 HG3 ARG 99 2HG ARG 99 -15.687 2.968 -6.177 721 HD2 ARG 99 1HD ARG 99 -17.213 3.594 -3.676 722 HD3 ARG 99 2HD ARG 99 -17.915 3.881 -5.267 723 HH11 ARG 99 1HH1 ARG 99 -17.939 2.665 -2.426 724 HH12 ARG 99 2HH1 ARG 99 -18.654 1.192 -1.846 725 HH21 ARG 99 1HH2 ARG 99 -18.410 -0.495 -4.914 726 HH22 ARG 99 2HH2 ARG 99 -18.921 -0.605 -3.254 727 H GLN 100 H GLN 100 -12.252 5.418 -4.487 728 HA GLN 100 HA GLN 100 -10.136 4.660 -2.778 729 HB2 GLN 100 1HB GLN 100 -10.199 6.764 -4.130 730 HB3 GLN 100 2HB GLN 100 -11.406 7.395 -3.017 731 HG2 GLN 100 1HG GLN 100 -9.786 7.168 -1.176 732 HG3 GLN 100 2HG GLN 100 -8.578 6.624 -2.337 733 HE21 GLN 100 2HE2 GLN 100 -8.463 8.897 -0.599 734 HE22 GLN 100 1HE2 GLN 100 -8.310 10.294 -1.603 735 H HIS 101 H HIS 101 -10.762 3.523 -1.025 736 HA HIS 101 HA HIS 101 -12.774 4.689 0.760 737 HD1 HIS 101 HD1 HIS 101 -11.139 1.823 3.326 738 HD2 HIS 101 HD2 HIS 101 -15.044 2.645 2.170 739 HE1 HIS 101 HE1 HIS 101 -12.539 1.476 5.385 740 HE2 HIS 101 HE2 HIS 101 -14.848 2.229 4.718 741 HB2 HIS 101 1HB HIS 101 -13.090 2.325 0.181 742 HB3 HIS 101 2HB HIS 101 -11.473 1.951 0.766 743 H LEU 102 H LEU 102 -11.735 6.257 1.895 744 HA LEU 102 HA LEU 102 -9.105 6.126 2.860 745 HG LEU 102 HG LEU 102 -10.906 8.336 1.654 746 HB2 LEU 102 1HB LEU 102 -11.476 7.641 3.960 747 HB3 LEU 102 2HB LEU 102 -9.812 7.910 4.435 748 HD11 LEU 102 1HD1 LEU 102 -10.616 10.720 2.148 749 HD12 LEU 102 2HD1 LEU 102 -10.169 10.315 3.806 750 HD13 LEU 102 3HD1 LEU 102 -11.795 9.965 3.220 751 HD21 LEU 102 3HD2 LEU 102 -8.210 8.965 2.845 752 HD22 LEU 102 1HD2 LEU 102 -8.752 9.413 1.228 753 HD23 LEU 102 2HD2 LEU 102 -8.553 7.713 1.652 754 H LEU 103 H LEU 103 -8.229 5.352 4.714 755 HA LEU 103 HA LEU 103 -9.713 3.302 6.069 756 HG LEU 103 HG LEU 103 -7.182 3.205 4.318 757 HB2 LEU 103 1HB LEU 103 -6.914 4.343 6.495 758 HB3 LEU 103 2HB LEU 103 -7.591 2.938 7.299 759 HD11 LEU 103 1HD1 LEU 103 -5.067 3.036 5.495 760 HD12 LEU 103 2HD1 LEU 103 -5.419 1.533 4.641 761 HD13 LEU 103 3HD1 LEU 103 -5.654 1.631 6.386 762 HD21 LEU 103 3HD2 LEU 103 -8.070 0.855 5.988 763 HD22 LEU 103 1HD2 LEU 103 -7.734 0.825 4.256 764 HD23 LEU 103 2HD2 LEU 103 -9.081 1.780 4.876 765 H GLY 104 H GLY 104 -9.076 3.274 8.630 766 HA2 GLY 104 1HA GLY 104 -10.383 5.736 9.590 767 HA3 GLY 104 2HA GLY 104 -10.500 4.160 10.364 768 HA PRO 105 HA PRO 105 -6.880 7.100 11.826 769 HB2 PRO 105 1HB PRO 105 -8.137 7.840 14.198 770 HB3 PRO 105 2HB PRO 105 -7.978 8.855 12.763 771 HG2 PRO 105 1HG PRO 105 -10.290 7.203 13.674 772 HG3 PRO 105 2HG PRO 105 -10.286 8.791 12.888 773 HD2 PRO 105 1HD PRO 105 -10.895 6.566 11.531 774 HD3 PRO 105 2HD PRO 105 -9.972 7.883 10.774 775 H GLU 106 H GLU 106 -9.170 5.072 13.612 776 HA GLU 106 HA GLU 106 -7.399 4.332 15.681 777 HB2 GLU 106 1HB GLU 106 -9.820 2.851 14.636 778 HB3 GLU 106 2HB GLU 106 -9.044 2.593 16.194 779 HG2 GLU 106 1HG GLU 106 -9.614 4.863 16.864 780 HG3 GLU 106 2HG GLU 106 -10.374 5.139 15.298 781 H GLN 107 H GLN 107 -7.871 3.146 12.454 782 HA GLN 107 HA GLN 107 -6.588 0.615 12.841 783 HB2 GLN 107 1HB GLN 107 -7.168 2.188 10.326 784 HB3 GLN 107 2HB GLN 107 -6.559 0.539 10.354 785 HG2 GLN 107 1HG GLN 107 -8.579 -0.241 11.396 786 HG3 GLN 107 2HG GLN 107 -9.180 1.410 11.548 787 HE21 GLN 107 2HE2 GLN 107 -10.325 -0.911 10.173 788 HE22 GLN 107 1HE2 GLN 107 -10.540 -0.424 8.525 789 H VAL 108 H VAL 108 -5.562 3.827 11.852 790 HA VAL 108 HA VAL 108 -2.967 2.805 11.019 791 HB VAL 108 HB VAL 108 -2.520 5.076 10.204 792 HG11 VAL 108 1HG1 VAL 108 -3.621 3.471 8.739 793 HG12 VAL 108 2HG1 VAL 108 -4.196 5.108 8.420 794 HG13 VAL 108 3HG1 VAL 108 -5.196 3.984 9.341 795 HG21 VAL 108 3HG2 VAL 108 -5.283 5.708 11.239 796 HG22 VAL 108 1HG2 VAL 108 -4.303 6.766 10.222 797 HG23 VAL 108 2HG2 VAL 108 -3.763 6.360 11.852 798 H ARG 109 H ARG 109 -4.296 3.924 13.882 799 HA ARG 109 HA ARG 109 -2.418 5.642 14.939 800 HE ARG 109 HE ARG 109 -5.629 3.538 17.559 801 HB2 ARG 109 1HB ARG 109 -4.128 3.569 16.289 802 HB3 ARG 109 2HB ARG 109 -3.119 4.697 17.173 803 HG2 ARG 109 1HG ARG 109 -4.340 6.552 16.015 804 HG3 ARG 109 2HG ARG 109 -5.450 5.328 15.397 805 HD2 ARG 109 1HD ARG 109 -4.915 6.008 18.283 806 HD3 ARG 109 2HD ARG 109 -6.388 6.333 17.373 807 HH11 ARG 109 1HH1 ARG 109 -7.521 6.161 18.902 808 HH12 ARG 109 2HH1 ARG 109 -8.605 5.109 19.757 809 HH21 ARG 109 1HH2 ARG 109 -7.028 2.154 18.703 810 HH22 ARG 109 2HH2 ARG 109 -8.311 2.834 19.670 811 HA PRO 110 HA PRO 110 0.045 1.689 16.646 812 HB2 PRO 110 1HB PRO 110 -0.509 -0.020 14.263 813 HB3 PRO 110 2HB PRO 110 -0.249 -0.489 15.947 814 HG2 PRO 110 1HG PRO 110 -2.695 -0.504 14.921 815 HG3 PRO 110 2HG PRO 110 -2.415 0.067 16.578 816 HD2 PRO 110 1HD PRO 110 -2.944 1.634 14.092 817 HD3 PRO 110 2HD PRO 110 -3.485 1.936 15.756 818 H LEU 111 H LEU 111 -0.340 2.322 13.175 819 HA LEU 111 HA LEU 111 2.468 2.011 12.648 820 HG LEU 111 HG LEU 111 -0.071 0.715 11.382 821 HB2 LEU 111 1HB LEU 111 0.251 3.111 10.919 822 HB3 LEU 111 2HB LEU 111 1.885 2.784 10.373 823 HD11 LEU 111 1HD1 LEU 111 -0.071 -0.065 9.059 824 HD12 LEU 111 2HD1 LEU 111 0.939 1.307 8.606 825 HD13 LEU 111 3HD1 LEU 111 -0.698 1.578 9.202 826 HD21 LEU 111 3HD2 LEU 111 1.597 -0.907 10.622 827 HD22 LEU 111 1HD2 LEU 111 2.230 0.120 11.910 828 HD23 LEU 111 2HD2 LEU 111 2.700 0.413 10.236 829 H LEU 112 H LEU 112 0.214 4.705 13.019 830 HA LEU 112 HA LEU 112 2.009 6.786 12.421 831 HG LEU 112 HG LEU 112 -1.036 6.370 11.953 832 HB2 LEU 112 1HB LEU 112 -0.370 6.756 14.280 833 HB3 LEU 112 2HB LEU 112 0.490 8.207 13.802 834 HD11 LEU 112 1HD1 LEU 112 -2.493 7.685 13.384 835 HD12 LEU 112 2HD1 LEU 112 -2.556 8.279 11.725 836 HD13 LEU 112 3HD1 LEU 112 -1.626 9.155 12.941 837 HD21 LEU 112 3HD2 LEU 112 0.900 7.366 10.848 838 HD22 LEU 112 1HD2 LEU 112 0.391 8.967 11.389 839 HD23 LEU 112 2HD2 LEU 112 -0.605 8.063 10.247 840 H ALA 113 H ALA 113 1.456 4.929 15.335 841 HA ALA 113 HA ALA 113 2.934 6.500 17.140 842 HB1 ALA 113 3HB ALA 113 3.054 4.495 18.521 843 HB2 ALA 113 1HB ALA 113 2.550 3.506 17.151 844 HB3 ALA 113 2HB ALA 113 1.437 4.686 17.843 845 H MET 114 H MET 114 3.887 4.044 14.820 846 HA MET 114 HA MET 114 6.635 3.993 15.661 847 HB2 MET 114 1HB MET 114 5.384 3.022 13.083 848 HB3 MET 114 2HB MET 114 7.000 2.633 13.652 849 HG2 MET 114 1HG MET 114 6.056 1.445 15.555 850 HG3 MET 114 2HG MET 114 4.430 1.864 15.019 851 HE1 MET 114 3HE MET 114 4.529 -1.959 14.291 852 HE2 MET 114 1HE MET 114 3.663 -0.637 15.076 853 HE3 MET 114 2HE MET 114 5.257 -1.117 15.658 854 H GLY 115 H GLY 115 4.732 5.573 13.176 855 HA2 GLY 115 1HA GLY 115 5.570 7.886 12.664 856 HA3 GLY 115 2HA GLY 115 7.123 7.111 12.380 857 H VAL 116 H VAL 116 4.482 5.226 11.418 858 HA VAL 116 HA VAL 116 5.172 5.636 8.621 859 HB VAL 116 HB VAL 116 3.235 3.637 9.803 860 HG11 VAL 116 1HG1 VAL 116 2.911 4.010 7.432 861 HG12 VAL 116 2HG1 VAL 116 3.616 2.416 7.705 862 HG13 VAL 116 3HG1 VAL 116 4.628 3.741 7.132 863 HG21 VAL 116 3HG2 VAL 116 6.162 3.280 9.164 864 HG22 VAL 116 1HG2 VAL 116 5.050 1.995 9.636 865 HG23 VAL 116 2HG2 VAL 116 5.437 3.287 10.773 866 H GLY 117 H GLY 117 4.088 7.142 7.514 867 HA2 GLY 117 1HA GLY 117 1.401 7.928 8.294 868 HA3 GLY 117 2HA GLY 117 2.346 8.603 6.972 869 H VAL 118 H VAL 118 -0.476 7.285 7.336 870 HA VAL 118 HA VAL 118 -0.193 5.404 5.074 871 HB VAL 118 HB VAL 118 -2.219 5.183 7.307 872 HG11 VAL 118 1HG1 VAL 118 -3.008 4.274 5.187 873 HG12 VAL 118 2HG1 VAL 118 -2.696 2.982 6.346 874 HG13 VAL 118 3HG1 VAL 118 -1.545 3.298 5.049 875 HG21 VAL 118 3HG2 VAL 118 -0.937 3.223 8.043 876 HG22 VAL 118 1HG2 VAL 118 0.007 4.708 8.155 877 HG23 VAL 118 2HG2 VAL 118 0.290 3.580 6.829 878 H GLU 119 H GLU 119 -1.268 5.963 3.313 879 HA GLU 119 HA GLU 119 -3.711 7.575 3.599 880 HB2 GLU 119 1HB GLU 119 -1.554 8.016 1.523 881 HB3 GLU 119 2HB GLU 119 -3.086 8.873 1.604 882 HG2 GLU 119 1HG GLU 119 -2.406 9.712 3.853 883 HG3 GLU 119 2HG GLU 119 -0.825 8.983 3.582 884 H ALA 120 H ALA 120 -5.405 6.856 2.455 885 HA ALA 120 HA ALA 120 -4.946 4.592 0.632 886 HB1 ALA 120 3HB ALA 120 -6.393 4.136 2.553 887 HB2 ALA 120 1HB ALA 120 -7.278 3.997 1.034 888 HB3 ALA 120 2HB ALA 120 -7.479 5.428 2.043 889 H MET 121 H MET 121 -5.371 4.770 -1.474 890 HA MET 121 HA MET 121 -7.138 6.872 -2.464 891 HB2 MET 121 1HB MET 121 -4.233 6.613 -3.260 892 HB3 MET 121 2HB MET 121 -5.414 7.534 -4.177 893 HG2 MET 121 1HG MET 121 -5.776 8.990 -2.250 894 HG3 MET 121 2HG MET 121 -4.592 8.063 -1.331 895 HE1 MET 121 3HE MET 121 -2.384 7.462 -3.553 896 HE2 MET 121 1HE MET 121 -2.002 7.986 -1.913 897 HE3 MET 121 2HE MET 121 -1.282 8.813 -3.293 898 H ASP 122 H ASP 122 -6.841 6.646 -5.115 899 HA ASP 122 HA ASP 122 -7.859 4.095 -5.797 900 HB2 ASP 122 1HB ASP 122 -6.690 6.262 -7.562 901 HB3 ASP 122 2HB ASP 122 -7.539 4.841 -8.159 902 H THR 123 H THR 123 -6.880 2.499 -7.194 903 HA THR 123 HA THR 123 -4.340 1.667 -6.415 904 HB THR 123 HB THR 123 -5.790 0.932 -8.966 905 HG1 THR 123 HG1 THR 123 -6.215 -0.947 -7.286 906 HG21 THR 123 3HG2 THR 123 -4.554 -1.179 -8.790 907 HG22 THR 123 1HG2 THR 123 -3.709 -0.571 -7.366 908 HG23 THR 123 2HG2 THR 123 -3.452 0.191 -8.936 909 H GLN 124 H GLN 124 -5.359 3.407 -9.333 910 HA GLN 124 HA GLN 124 -2.780 3.537 -10.498 911 HB2 GLN 124 1HB GLN 124 -5.190 5.311 -10.925 912 HB3 GLN 124 2HB GLN 124 -3.757 5.293 -11.944 913 HG2 GLN 124 1HG GLN 124 -4.201 2.938 -12.490 914 HG3 GLN 124 2HG GLN 124 -5.675 3.013 -11.524 915 HE21 GLN 124 2HE2 GLN 124 -5.387 2.439 -14.357 916 HE22 GLN 124 1HE2 GLN 124 -6.315 3.635 -15.197 917 H ALA 125 H ALA 125 -4.580 5.717 -8.381 918 HA ALA 125 HA ALA 125 -2.754 7.875 -8.509 919 HB1 ALA 125 3HB ALA 125 -4.689 7.186 -6.298 920 HB2 ALA 125 1HB ALA 125 -5.072 8.127 -7.739 921 HB3 ALA 125 2HB ALA 125 -3.915 8.747 -6.562 922 H ALA 126 H ALA 126 -3.080 5.137 -6.296 923 HA ALA 126 HA ALA 126 -1.021 5.898 -4.524 924 HB1 ALA 126 3HB ALA 126 -2.739 4.219 -3.983 925 HB2 ALA 126 1HB ALA 126 -1.103 3.617 -3.713 926 HB3 ALA 126 2HB ALA 126 -2.003 3.115 -5.144 927 H ALA 127 H ALA 127 -1.033 3.751 -7.355 928 HA ALA 127 HA ALA 127 1.669 2.973 -7.172 929 HB1 ALA 127 3HB ALA 127 1.408 2.175 -9.459 930 HB2 ALA 127 1HB ALA 127 -0.101 3.075 -9.614 931 HB3 ALA 127 2HB ALA 127 0.013 1.732 -8.475 932 H ARG 128 H ARG 128 0.080 5.621 -8.916 933 HA ARG 128 HA ARG 128 2.350 6.509 -10.320 934 HE ARG 128 HE ARG 128 -0.061 8.761 -13.114 935 HB2 ARG 128 1HB ARG 128 0.089 7.231 -10.909 936 HB3 ARG 128 2HB ARG 128 -0.052 8.085 -9.376 937 HG2 ARG 128 1HG ARG 128 1.772 9.579 -10.045 938 HG3 ARG 128 2HG ARG 128 1.895 8.732 -11.587 939 HD2 ARG 128 1HD ARG 128 -0.551 10.179 -10.582 940 HD3 ARG 128 2HD ARG 128 0.603 10.823 -11.749 941 HH11 ARG 128 1HH1 ARG 128 -2.212 10.467 -10.935 942 HH12 ARG 128 2HH1 ARG 128 -3.647 10.066 -11.824 943 HH21 ARG 128 1HH2 ARG 128 -1.954 8.254 -14.301 944 HH22 ARG 128 2HH2 ARG 128 -3.501 8.803 -13.727 945 H THR 129 H THR 129 0.967 7.609 -7.229 946 HA THR 129 HA THR 129 2.953 9.527 -6.666 947 HB THR 129 HB THR 129 1.337 7.970 -4.639 948 HG1 THR 129 HG1 THR 129 -0.186 8.819 -5.976 949 HG21 THR 129 3HG2 THR 129 1.524 10.023 -3.307 950 HG22 THR 129 1HG2 THR 129 2.504 10.759 -4.575 951 HG23 THR 129 2HG2 THR 129 3.115 9.362 -3.687 952 H TYR 130 H TYR 130 2.683 6.093 -5.974 953 HA TYR 130 HA TYR 130 4.913 5.724 -4.347 954 HD1 TYR 130 HD2 TYR 130 5.554 3.255 -3.314 955 HD2 TYR 130 HD1 TYR 130 4.928 2.474 -7.447 956 HE1 TYR 130 HE2 TYR 130 7.229 1.457 -3.225 957 HE2 TYR 130 HE1 TYR 130 6.595 0.672 -7.369 958 HH TYR 130 HH TYR 130 8.490 -0.034 -6.047 959 HB2 TYR 130 1HB TYR 130 3.395 3.925 -4.627 960 HB3 TYR 130 2HB TYR 130 3.537 3.972 -6.377 961 H ASN 131 H ASN 131 4.662 5.739 -7.887 962 HA ASN 131 HA ASN 131 7.374 5.184 -8.423 963 HB2 ASN 131 1HB ASN 131 5.552 5.004 -10.095 964 HB3 ASN 131 2HB ASN 131 5.413 6.758 -10.110 965 HD21 ASN 131 2HD2 ASN 131 5.939 7.010 -12.235 966 HD22 ASN 131 1HD2 ASN 131 7.515 6.693 -12.869 967 H ILE 132 H ILE 132 5.621 8.211 -7.926 968 HA ILE 132 HA ILE 132 7.725 9.972 -8.583 969 HB ILE 132 HB ILE 132 5.442 10.413 -6.650 970 HG12 ILE 132 1HG1 ILE 132 5.691 11.118 -9.583 971 HG13 ILE 132 2HG1 ILE 132 4.719 9.800 -8.938 972 HG21 ILE 132 1HG2 ILE 132 5.830 12.807 -7.085 973 HG22 ILE 132 2HG2 ILE 132 7.257 12.386 -8.031 974 HG23 ILE 132 3HG2 ILE 132 7.210 12.033 -6.305 975 HD11 ILE 132 3HD1 ILE 132 3.335 11.411 -7.738 976 HD12 ILE 132 1HD1 ILE 132 3.346 11.723 -9.474 977 HD13 ILE 132 2HD1 ILE 132 4.308 12.729 -8.392 978 H LEU 133 H LEU 133 6.631 8.707 -5.437 979 HA LEU 133 HA LEU 133 8.675 9.991 -3.944 980 HG LEU 133 HG LEU 133 5.599 9.582 -3.548 981 HB2 LEU 133 1HB LEU 133 6.985 7.585 -3.260 982 HB3 LEU 133 2HB LEU 133 8.007 8.445 -2.123 983 HD11 LEU 133 1HD1 LEU 133 5.018 7.982 -1.805 984 HD12 LEU 133 2HD1 LEU 133 4.593 9.626 -1.327 985 HD13 LEU 133 3HD1 LEU 133 6.030 8.856 -0.656 986 HD21 LEU 133 3HD2 LEU 133 5.934 11.541 -2.120 987 HD22 LEU 133 1HD2 LEU 133 7.312 11.283 -3.190 988 HD23 LEU 133 2HD2 LEU 133 7.418 10.831 -1.488 989 H MET 134 H MET 134 8.512 6.987 -5.685 990 HA MET 134 HA MET 134 10.790 5.708 -4.657 991 HB2 MET 134 1HB MET 134 9.214 4.604 -6.184 992 HB3 MET 134 2HB MET 134 9.702 5.686 -7.482 993 HG2 MET 134 1HG MET 134 12.038 4.763 -7.189 994 HG3 MET 134 2HG MET 134 11.315 3.524 -6.164 995 HE1 MET 134 3HE MET 134 8.469 3.260 -7.692 996 HE2 MET 134 1HE MET 134 9.351 1.866 -7.070 997 HE3 MET 134 2HE MET 134 8.789 1.878 -8.742 998 H ALA 135 H ALA 135 10.424 7.917 -7.415 999 HA ALA 135 HA ALA 135 13.173 8.069 -8.046 1000 HB1 ALA 135 3HB ALA 135 12.568 10.003 -9.400 1001 HB2 ALA 135 1HB ALA 135 10.994 10.077 -8.609 1002 HB3 ALA 135 2HB ALA 135 11.406 8.694 -9.624 1003 H GLU 136 H GLU 136 11.072 9.978 -5.962 1004 HA GLU 136 HA GLU 136 12.878 11.994 -5.246 1005 HB2 GLU 136 1HB GLU 136 10.466 12.054 -4.738 1006 HB3 GLU 136 2HB GLU 136 10.680 10.745 -3.584 1007 HG2 GLU 136 1HG GLU 136 12.156 12.194 -2.252 1008 HG3 GLU 136 2HG GLU 136 11.861 13.507 -3.392 1009 H GLY 137 H GLY 137 12.271 8.818 -3.831 1010 HA2 GLY 137 1HA GLY 137 14.084 7.506 -2.937 1011 HA3 GLY 137 2HA GLY 137 14.878 9.003 -2.469 1012 H ARG 138 H ARG 138 11.488 8.316 -1.980 1013 HA ARG 138 HA ARG 138 11.903 8.575 0.909 1014 HE ARG 138 HE ARG 138 9.058 11.666 0.161 1015 HB2 ARG 138 1HB ARG 138 10.330 10.139 -0.183 1016 HB3 ARG 138 2HB ARG 138 9.370 8.777 -0.744 1017 HG2 ARG 138 1HG ARG 138 8.817 8.188 1.532 1018 HG3 ARG 138 2HG ARG 138 9.857 9.475 2.144 1019 HD2 ARG 138 1HD ARG 138 7.395 9.837 0.437 1020 HD3 ARG 138 2HD ARG 138 7.504 10.140 2.171 1021 HH11 ARG 138 1HH1 ARG 138 7.093 11.505 3.056 1022 HH12 ARG 138 2HH1 ARG 138 7.237 13.196 3.405 1023 HH21 ARG 138 1HH2 ARG 138 9.221 13.888 0.592 1024 HH22 ARG 138 2HH2 ARG 138 8.447 14.563 1.996 1025 H ARG 139 H ARG 139 11.148 7.025 2.354 1026 HA ARG 139 HA ARG 139 10.957 4.346 1.406 1027 HE ARG 139 HE ARG 139 14.283 3.386 5.794 1028 HB2 ARG 139 1HB ARG 139 10.476 5.573 4.119 1029 HB3 ARG 139 2HB ARG 139 10.328 3.849 3.815 1030 HG2 ARG 139 1HG ARG 139 12.636 3.666 3.282 1031 HG3 ARG 139 2HG ARG 139 12.835 5.419 3.280 1032 HD2 ARG 139 1HD ARG 139 12.378 5.510 5.652 1033 HD3 ARG 139 2HD ARG 139 12.042 3.780 5.685 1034 HH11 ARG 139 1HH1 ARG 139 13.793 6.662 4.657 1035 HH12 ARG 139 2HH1 ARG 139 15.483 7.071 4.713 1036 HH21 ARG 139 1HH2 ARG 139 16.500 3.915 5.896 1037 HH22 ARG 139 2HH2 ARG 139 17.022 5.513 5.429 1038 H VAL 140 H VAL 140 9.196 4.582 -0.086 1039 HA VAL 140 HA VAL 140 6.553 4.758 1.172 1040 HB VAL 140 HB VAL 140 6.826 6.358 -0.611 1041 HG11 VAL 140 1HG1 VAL 140 7.508 4.026 -2.400 1042 HG12 VAL 140 2HG1 VAL 140 8.627 5.271 -1.841 1043 HG13 VAL 140 3HG1 VAL 140 7.294 5.701 -2.914 1044 HG21 VAL 140 3HG2 VAL 140 4.979 5.721 -2.082 1045 HG22 VAL 140 1HG2 VAL 140 4.629 5.334 -0.398 1046 HG23 VAL 140 2HG2 VAL 140 5.103 4.055 -1.516 1047 H VAL 141 H VAL 141 5.363 2.999 1.384 1048 HA VAL 141 HA VAL 141 5.992 0.646 -0.280 1049 HB VAL 141 HB VAL 141 4.513 0.653 2.360 1050 HG11 VAL 141 1HG1 VAL 141 4.917 -1.766 2.305 1051 HG12 VAL 141 2HG1 VAL 141 5.679 -1.597 0.725 1052 HG13 VAL 141 3HG1 VAL 141 3.965 -1.228 0.922 1053 HG21 VAL 141 3HG2 VAL 141 7.401 -0.028 1.832 1054 HG22 VAL 141 1HG2 VAL 141 6.552 -0.270 3.357 1055 HG23 VAL 141 2HG2 VAL 141 6.807 1.362 2.737 1056 H VAL 142 H VAL 142 4.390 -0.091 -1.615 1057 HA VAL 142 HA VAL 142 1.808 1.310 -1.375 1058 HB VAL 142 HB VAL 142 3.122 1.981 -3.364 1059 HG11 VAL 142 1HG1 VAL 142 4.276 -0.094 -3.839 1060 HG12 VAL 142 2HG1 VAL 142 3.349 0.422 -5.248 1061 HG13 VAL 142 3HG1 VAL 142 2.747 -0.883 -4.225 1062 HG21 VAL 142 3HG2 VAL 142 0.577 0.492 -3.986 1063 HG22 VAL 142 1HG2 VAL 142 1.304 1.757 -4.977 1064 HG23 VAL 142 2HG2 VAL 142 0.691 2.141 -3.368 1065 H ALA 143 H ALA 143 0.026 0.151 -1.189 1066 HA ALA 143 HA ALA 143 0.171 -2.753 -1.683 1067 HB1 ALA 143 3HB ALA 143 -1.684 -1.231 0.153 1068 HB2 ALA 143 1HB ALA 143 -0.284 -2.179 0.653 1069 HB3 ALA 143 2HB ALA 143 -1.672 -2.979 -0.084 1070 H LEU 144 H LEU 144 -0.761 -3.288 -3.558 1071 HA LEU 144 HA LEU 144 -2.838 -1.493 -4.615 1072 HG LEU 144 HG LEU 144 0.173 -1.303 -5.350 1073 HB2 LEU 144 1HB LEU 144 -0.968 -3.369 -6.055 1074 HB3 LEU 144 2HB LEU 144 -2.214 -2.414 -6.833 1075 HD11 LEU 144 1HD1 LEU 144 0.928 -0.595 -7.566 1076 HD12 LEU 144 2HD1 LEU 144 -0.441 -1.432 -8.299 1077 HD13 LEU 144 3HD1 LEU 144 0.803 -2.350 -7.451 1078 HD21 LEU 144 3HD2 LEU 144 -0.557 0.854 -6.260 1079 HD22 LEU 144 1HD2 LEU 144 -1.764 0.160 -5.176 1080 HD23 LEU 144 2HD2 LEU 144 -1.999 0.082 -6.922 1081 H LEU 145 H LEU 145 -4.835 -2.217 -4.530 1082 HA LEU 145 HA LEU 145 -5.383 -5.084 -4.606 1083 HG LEU 145 HG LEU 145 -5.870 -3.031 -2.264 1084 HB2 LEU 145 1HB LEU 145 -7.250 -2.726 -4.283 1085 HB3 LEU 145 2HB LEU 145 -7.730 -4.410 -4.207 1086 HD11 LEU 145 1HD1 LEU 145 -7.707 -3.277 -0.678 1087 HD12 LEU 145 2HD1 LEU 145 -8.720 -3.972 -1.943 1088 HD13 LEU 145 3HD1 LEU 145 -8.194 -2.293 -2.058 1089 HD21 LEU 145 3HD2 LEU 145 -6.026 -5.089 -0.974 1090 HD22 LEU 145 1HD2 LEU 145 -5.344 -5.404 -2.569 1091 HD23 LEU 145 2HD2 LEU 145 -7.024 -5.819 -2.231 1092 HA PRO 146 HA PRO 146 -6.071 -4.740 -9.007 1093 HB2 PRO 146 1HB PRO 146 -6.858 -7.298 -9.422 1094 HB3 PRO 146 2HB PRO 146 -5.169 -6.848 -9.165 1095 HG2 PRO 146 1HG PRO 146 -7.131 -8.025 -7.245 1096 HG3 PRO 146 2HG PRO 146 -5.407 -8.382 -7.448 1097 HD2 PRO 146 1HD PRO 146 -6.406 -6.772 -5.473 1098 HD3 PRO 146 2HD PRO 146 -4.765 -6.622 -6.134 1099 H ASP 147 H ASP 147 -7.789 -3.697 -9.742 1100 HA ASP 147 HA ASP 147 -10.400 -3.942 -8.684 1101 HB2 ASP 147 1HB ASP 147 -9.740 -1.863 -9.685 1102 HB3 ASP 147 2HB ASP 147 -9.363 -2.653 -11.211 1103 H GLY 148 H GLY 148 -11.725 -5.567 -8.957 1104 HA2 GLY 148 1HA GLY 148 -12.716 -6.542 -11.327 1105 HA3 GLY 148 2HA GLY 148 -11.344 -7.576 -10.946 1106 H ASP 149 H ASP 149 -11.494 -7.699 -8.219 1107 HA ASP 149 HA ASP 149 -12.486 -8.735 -6.456 1108 HB2 ASP 149 1HB ASP 149 -14.382 -7.034 -7.137 1109 HB3 ASP 149 2HB ASP 149 -15.211 -8.480 -7.696 1110 H SER 150 H SER 150 -14.332 -10.585 -6.114 1111 HA SER 150 HA SER 150 -14.493 -12.494 -8.258 1112 HG SER 150 HG SER 150 -12.137 -12.122 -8.226 1113 HB2 SER 150 1HB SER 150 -12.753 -13.137 -5.858 1114 HB3 SER 150 2HB SER 150 -13.267 -14.301 -7.078 1115 H LEU 151 H LEU 151 -15.095 -11.403 -5.058 1116 HA LEU 151 HA LEU 151 -16.905 -13.571 -4.383 1117 HG LEU 151 HG LEU 151 -18.389 -11.766 -2.239 1118 HB2 LEU 151 1HB LEU 151 -15.525 -12.642 -2.624 1119 HB3 LEU 151 2HB LEU 151 -16.115 -11.027 -2.959 1120 HD11 LEU 151 1HD1 LEU 151 -18.112 -14.161 -2.629 1121 HD12 LEU 151 2HD1 LEU 151 -18.602 -13.827 -0.969 1122 HD13 LEU 151 3HD1 LEU 151 -16.924 -14.238 -1.326 1123 HD21 LEU 151 3HD2 LEU 151 -17.871 -11.732 0.149 1124 HD22 LEU 151 1HD2 LEU 151 -16.907 -10.550 -0.736 1125 HD23 LEU 151 2HD2 LEU 151 -16.178 -12.069 -0.212 1126 H GLU 152 H GLU 152 -16.979 -10.167 -5.280 1127 HA GLU 152 HA GLU 152 -19.922 -10.264 -5.340 1128 HB2 GLU 152 1HB GLU 152 -18.890 -8.548 -3.886 1129 HB3 GLU 152 2HB GLU 152 -18.086 -7.864 -5.289 1130 HG2 GLU 152 1HG GLU 152 -20.156 -7.180 -6.242 1131 HG3 GLU 152 2HG GLU 152 -21.073 -8.078 -5.032 1132 H HIS 153 H HIS 153 -20.726 -10.655 -7.280 1133 HA HIS 153 HA HIS 153 -19.332 -9.573 -9.645 1134 HD1 HIS 153 HD1 HIS 153 -19.202 -12.912 -11.959 1135 HD2 HIS 153 HD2 HIS 153 -18.109 -12.122 -8.019 1136 HE1 HIS 153 HE1 HIS 153 -17.016 -14.101 -11.606 1137 HE2 HIS 153 HE2 HIS 153 -16.465 -13.763 -9.173 1138 HB2 HIS 153 1HB HIS 153 -21.067 -12.013 -9.289 1139 HB3 HIS 153 2HB HIS 153 -20.752 -11.329 -10.876 1140 H HIS 154 H HIS 154 -20.758 -8.958 -11.470 1141 HA HIS 154 HA HIS 154 -22.938 -7.308 -10.667 1142 HD1 HIS 154 HD1 HIS 154 -22.954 -4.715 -12.677 1143 HD2 HIS 154 HD2 HIS 154 -24.853 -8.024 -14.336 1144 HE1 HIS 154 HE1 HIS 154 -24.992 -3.817 -13.846 1145 HE2 HIS 154 HE2 HIS 154 -26.166 -5.846 -14.785 1146 HB2 HIS 154 1HB HIS 154 -21.527 -6.834 -12.654 1147 HB3 HIS 154 2HB HIS 154 -22.173 -8.268 -13.440 1148 H HIS 155 H HIS 155 -22.738 -10.364 -12.480 1149 HA HIS 155 HA HIS 155 -25.584 -10.836 -12.206 1150 HD1 HIS 155 HD1 HIS 155 -25.896 -13.140 -15.478 1151 HD2 HIS 155 HD2 HIS 155 -23.719 -9.670 -14.723 1152 HE1 HIS 155 HE1 HIS 155 -26.152 -11.706 -17.534 1153 HE2 HIS 155 HE2 HIS 155 -24.784 -9.640 -17.073 1154 HB2 HIS 155 1HB HIS 155 -23.317 -12.496 -13.322 1155 HB3 HIS 155 2HB HIS 155 -24.960 -13.111 -13.184 1156 H HIS 156 H HIS 156 -26.550 -12.120 -10.702 1157 HA HIS 156 HA HIS 156 -24.834 -12.927 -8.473 1158 HD1 HIS 156 HD1 HIS 156 -28.545 -10.232 -8.227 1159 HD2 HIS 156 HD2 HIS 156 -24.652 -10.935 -6.931 1160 HE1 HIS 156 HE1 HIS 156 -27.670 -8.006 -7.448 1161 HE2 HIS 156 HE2 HIS 156 -25.249 -8.421 -6.880 1162 HB2 HIS 156 1HB HIS 156 -27.833 -12.577 -8.637 1163 HB3 HIS 156 2HB HIS 156 -26.969 -13.098 -7.192 1164 H HIS 157 H HIS 157 -26.599 -14.240 -11.061 1165 HA HIS 157 HA HIS 157 -26.177 -16.942 -9.947 1166 HD1 HIS 157 HD1 HIS 157 -29.611 -18.566 -9.824 1167 HD2 HIS 157 HD2 HIS 157 -28.916 -14.491 -9.357 1168 HE1 HIS 157 HE1 HIS 157 -31.102 -17.832 -7.932 1169 HE2 HIS 157 HE2 HIS 157 -30.608 -15.377 -7.621 1170 HB2 HIS 157 1HB HIS 157 -28.307 -16.041 -11.909 1171 HB3 HIS 157 2HB HIS 157 -27.993 -17.716 -11.476 1172 H HIS 158 H HIS 158 -27.139 -16.203 -13.195 1173 HA HIS 158 HA HIS 158 -24.459 -16.194 -14.267 1174 HD1 HIS 158 HD1 HIS 158 -25.831 -19.917 -12.854 1175 HD2 HIS 158 HD2 HIS 158 -22.455 -18.468 -14.807 1176 HE1 HIS 158 HE1 HIS 158 -23.879 -21.133 -11.836 1177 HE2 HIS 158 HE2 HIS 158 -21.838 -20.115 -12.910 1178 HB2 HIS 158 1HB HIS 158 -26.392 -18.456 -14.813 1179 HB3 HIS 158 2HB HIS 158 -25.088 -18.046 -15.921 Start of MODEL 3 1 HA MET 1 HA MET 1 23.085 -5.080 -24.544 2 H1 MET 1 1H MET 1 22.788 -4.966 -22.156 3 H2 MET 1 2H MET 1 22.322 -6.598 -22.119 4 H3 MET 1 3H MET 1 21.363 -5.463 -22.929 5 HB2 MET 1 1HB MET 1 24.549 -7.218 -22.987 6 HB3 MET 1 2HB MET 1 25.017 -6.679 -24.593 7 HG2 MET 1 1HG MET 1 25.328 -4.402 -23.706 8 HG3 MET 1 2HG MET 1 24.938 -5.004 -22.095 9 HE1 MET 1 3HE MET 1 28.656 -6.290 -24.515 10 HE2 MET 1 1HE MET 1 27.492 -5.084 -25.065 11 HE3 MET 1 2HE MET 1 27.015 -6.777 -24.942 12 H LYS 2 H LYS 2 22.740 -8.444 -23.324 13 HA LYS 2 HA LYS 2 21.825 -9.444 -25.822 14 HB2 LYS 2 1HB LYS 2 22.753 -10.901 -24.037 15 HB3 LYS 2 2HB LYS 2 21.350 -10.552 -23.040 16 HG2 LYS 2 1HG LYS 2 21.205 -12.742 -24.130 17 HG3 LYS 2 2HG LYS 2 19.900 -11.663 -24.628 18 HD2 LYS 2 1HD LYS 2 21.022 -11.194 -26.712 19 HD3 LYS 2 2HD LYS 2 22.433 -12.124 -26.204 20 HE2 LYS 2 1HE LYS 2 20.966 -13.348 -27.784 21 HE3 LYS 2 2HE LYS 2 21.168 -14.168 -26.237 22 HZ1 LYS 2 3HZ LYS 2 19.017 -13.562 -25.564 23 HZ2 LYS 2 1HZ LYS 2 18.841 -14.083 -27.168 24 HZ3 LYS 2 2HZ LYS 2 18.840 -12.422 -26.812 25 H LEU 3 H LEU 3 20.158 -8.549 -22.810 26 HA LEU 3 HA LEU 3 17.657 -8.106 -24.173 27 HG LEU 3 HG LEU 3 16.658 -5.860 -22.226 28 HB2 LEU 3 1HB LEU 3 17.756 -8.634 -21.750 29 HB3 LEU 3 2HB LEU 3 18.630 -7.141 -21.471 30 HD11 LEU 3 1HD1 LEU 3 14.514 -7.013 -22.499 31 HD12 LEU 3 2HD1 LEU 3 15.338 -8.566 -22.363 32 HD13 LEU 3 3HD1 LEU 3 15.683 -7.502 -23.726 33 HD21 LEU 3 3HD2 LEU 3 16.112 -7.842 -20.021 34 HD22 LEU 3 1HD2 LEU 3 15.262 -6.316 -20.269 35 HD23 LEU 3 2HD2 LEU 3 16.977 -6.314 -19.857 36 H HIS 4 H HIS 4 17.132 -6.291 -25.278 37 HA HIS 4 HA HIS 4 19.199 -4.642 -26.168 38 HD1 HIS 4 HD1 HIS 4 18.964 -4.119 -28.937 39 HD2 HIS 4 HD2 HIS 4 16.534 -1.325 -27.040 40 HE1 HIS 4 HE1 HIS 4 19.327 -1.957 -30.166 41 HE2 HIS 4 HE2 HIS 4 18.021 -0.243 -28.863 42 HB2 HIS 4 1HB HIS 4 17.041 -5.111 -27.372 43 HB3 HIS 4 2HB HIS 4 16.264 -3.951 -26.298 44 H THR 5 H THR 5 16.512 -3.777 -24.006 45 HA THR 5 HA THR 5 17.830 -1.295 -23.288 46 HB THR 5 HB THR 5 15.284 -2.481 -22.155 47 HG1 THR 5 HG1 THR 5 14.642 -0.556 -23.785 48 HG21 THR 5 3HG2 THR 5 14.770 -0.161 -21.555 49 HG22 THR 5 1HG2 THR 5 16.323 0.355 -22.212 50 HG23 THR 5 2HG2 THR 5 16.270 -0.698 -20.799 51 H ASP 6 H ASP 6 19.383 -1.322 -21.771 52 HA ASP 6 HA ASP 6 19.549 -3.467 -19.827 53 HB2 ASP 6 1HB ASP 6 21.254 -0.978 -20.136 54 HB3 ASP 6 2HB ASP 6 21.601 -2.325 -19.059 55 HA PRO 7 HA PRO 7 17.115 -0.748 -17.184 56 HB2 PRO 7 1HB PRO 7 15.570 -2.646 -16.111 57 HB3 PRO 7 2HB PRO 7 15.368 -2.140 -17.791 58 HG2 PRO 7 1HG PRO 7 16.508 -4.638 -16.705 59 HG3 PRO 7 2HG PRO 7 15.769 -4.333 -18.283 60 HD2 PRO 7 1HD PRO 7 18.569 -4.397 -17.606 61 HD3 PRO 7 2HD PRO 7 17.830 -4.128 -19.198 62 H ALA 8 H ALA 8 16.956 -0.339 -14.964 63 HA ALA 8 HA ALA 8 18.943 -1.712 -13.301 64 HB1 ALA 8 3HB ALA 8 17.367 0.810 -12.774 65 HB2 ALA 8 1HB ALA 8 19.032 0.731 -13.349 66 HB3 ALA 8 2HB ALA 8 18.628 0.146 -11.735 67 H THR 9 H THR 9 18.118 -3.521 -12.425 68 HA THR 9 HA THR 9 15.352 -3.924 -11.970 69 HB THR 9 HB THR 9 16.972 -5.762 -10.460 70 HG1 THR 9 HG1 THR 9 18.688 -5.856 -11.684 71 HG21 THR 9 3HG2 THR 9 14.798 -6.297 -11.428 72 HG22 THR 9 1HG2 THR 9 16.038 -7.373 -12.070 73 HG23 THR 9 2HG2 THR 9 15.439 -6.035 -13.051 74 H ALA 10 H ALA 10 17.723 -2.353 -10.135 75 HA ALA 10 HA ALA 10 16.625 -2.833 -7.539 76 HB1 ALA 10 3HB ALA 10 18.397 -0.584 -8.486 77 HB2 ALA 10 1HB ALA 10 18.951 -2.134 -7.853 78 HB3 ALA 10 2HB ALA 10 18.072 -1.018 -6.808 79 H LEU 11 H LEU 11 15.606 -1.013 -10.188 80 HA LEU 11 HA LEU 11 13.998 0.769 -8.495 81 HG LEU 11 HG LEU 11 16.518 1.632 -10.121 82 HB2 LEU 11 1HB LEU 11 14.577 0.909 -11.457 83 HB3 LEU 11 2HB LEU 11 13.560 2.035 -10.579 84 HD11 LEU 11 1HD1 LEU 11 16.763 3.839 -11.117 85 HD12 LEU 11 2HD1 LEU 11 15.028 3.906 -11.424 86 HD13 LEU 11 3HD1 LEU 11 16.025 2.714 -12.257 87 HD21 LEU 11 3HD2 LEU 11 15.367 2.277 -8.081 88 HD22 LEU 11 1HD2 LEU 11 14.578 3.608 -8.927 89 HD23 LEU 11 2HD2 LEU 11 16.326 3.622 -8.697 90 H ASN 12 H ASN 12 12.377 -0.575 -7.890 91 HA ASN 12 HA ASN 12 11.034 -2.322 -9.705 92 HB2 ASN 12 1HB ASN 12 11.202 -2.898 -7.355 93 HB3 ASN 12 2HB ASN 12 10.351 -1.429 -6.897 94 HD21 ASN 12 2HD2 ASN 12 8.866 -2.733 -5.773 95 HD22 ASN 12 1HD2 ASN 12 7.609 -3.574 -6.613 96 H THR 13 H THR 13 9.424 -1.892 -11.020 97 HA THR 13 HA THR 13 7.469 0.156 -10.459 98 HB THR 13 HB THR 13 9.230 0.371 -12.919 99 HG1 THR 13 HG1 THR 13 9.600 1.343 -10.517 100 HG21 THR 13 3HG2 THR 13 7.915 2.364 -13.466 101 HG22 THR 13 1HG2 THR 13 6.872 2.063 -12.075 102 HG23 THR 13 2HG2 THR 13 6.895 0.926 -13.423 103 H VAL 14 H VAL 14 5.542 -0.233 -11.522 104 HA VAL 14 HA VAL 14 5.109 -2.838 -12.560 105 HB VAL 14 HB VAL 14 3.273 -0.444 -12.764 106 HG11 VAL 14 1HG1 VAL 14 2.697 -3.403 -12.852 107 HG12 VAL 14 2HG1 VAL 14 2.619 -2.284 -14.212 108 HG13 VAL 14 3HG1 VAL 14 1.486 -2.120 -12.870 109 HG21 VAL 14 3HG2 VAL 14 3.487 -2.507 -10.574 110 HG22 VAL 14 1HG2 VAL 14 2.246 -1.259 -10.693 111 HG23 VAL 14 2HG2 VAL 14 3.932 -0.805 -10.450 112 H THR 15 H THR 15 5.727 -3.493 -14.507 113 HA THR 15 HA THR 15 6.483 -1.648 -16.553 114 HB THR 15 HB THR 15 6.768 -3.844 -17.888 115 HG1 THR 15 HG1 THR 15 5.883 -5.496 -16.890 116 HG21 THR 15 3HG2 THR 15 8.309 -3.394 -15.330 117 HG22 THR 15 1HG2 THR 15 8.638 -2.636 -16.887 118 HG23 THR 15 2HG2 THR 15 8.849 -4.376 -16.690 119 H ALA 16 H ALA 16 3.721 -3.698 -15.933 120 HA ALA 16 HA ALA 16 2.394 -2.491 -18.259 121 HB1 ALA 16 3HB ALA 16 2.143 -5.371 -17.401 122 HB2 ALA 16 1HB ALA 16 2.992 -4.786 -18.832 123 HB3 ALA 16 2HB ALA 16 1.243 -4.599 -18.705 124 H TYR 17 H TYR 17 1.370 -0.984 -16.925 125 HA TYR 17 HA TYR 17 -0.602 -2.090 -15.048 126 HD1 TYR 17 HD1 TYR 17 -1.081 -1.343 -12.681 127 HD2 TYR 17 HD2 TYR 17 -1.388 2.256 -14.931 128 HE1 TYR 17 HE1 TYR 17 -2.946 -0.614 -11.252 129 HE2 TYR 17 HE2 TYR 17 -3.251 2.993 -13.508 130 HH TYR 17 HH TYR 17 -4.963 1.985 -12.063 131 HB2 TYR 17 1HB TYR 17 0.864 -0.315 -14.162 132 HB3 TYR 17 2HB TYR 17 0.314 0.775 -15.430 133 H GLY 18 H GLY 18 -0.336 -1.241 -18.209 134 HA2 GLY 18 1HA GLY 18 -2.837 0.119 -18.585 135 HA3 GLY 18 2HA GLY 18 -1.829 -0.578 -19.846 136 H ASP 19 H ASP 19 -1.841 -3.167 -18.309 137 HA ASP 19 HA ASP 19 -4.125 -4.296 -19.621 138 HB2 ASP 19 1HB ASP 19 -1.894 -5.446 -17.949 139 HB3 ASP 19 2HB ASP 19 -3.219 -6.429 -18.555 140 H GLY 20 H GLY 20 -5.089 -6.240 -18.114 141 HA2 GLY 20 1HA GLY 20 -6.597 -4.769 -16.101 142 HA3 GLY 20 2HA GLY 20 -6.980 -6.363 -16.734 143 H TYR 21 H TYR 21 -3.735 -5.972 -15.825 144 HA TYR 21 HA TYR 21 -4.131 -6.799 -13.083 145 HD1 TYR 21 HD2 TYR 21 -0.652 -8.411 -14.906 146 HD2 TYR 21 HD1 TYR 21 -4.538 -9.293 -16.394 147 HE1 TYR 21 HE2 TYR 21 0.323 -9.030 -17.076 148 HE2 TYR 21 HE1 TYR 21 -3.574 -9.916 -18.565 149 HH TYR 21 HH TYR 21 -1.547 -9.470 -19.878 150 HB2 TYR 21 1HB TYR 21 -2.594 -8.785 -13.390 151 HB3 TYR 21 2HB TYR 21 -4.208 -8.966 -14.064 152 H ILE 22 H ILE 22 -1.807 -7.264 -12.121 153 HA ILE 22 HA ILE 22 -0.272 -4.878 -12.891 154 HB ILE 22 HB ILE 22 -0.236 -6.352 -10.251 155 HG12 ILE 22 1HG1 ILE 22 -1.619 -3.750 -10.944 156 HG13 ILE 22 2HG1 ILE 22 -2.440 -5.300 -10.787 157 HG21 ILE 22 1HG2 ILE 22 0.876 -3.661 -11.045 158 HG22 ILE 22 2HG2 ILE 22 1.813 -5.119 -10.717 159 HG23 ILE 22 3HG2 ILE 22 0.900 -4.346 -9.420 160 HD11 ILE 22 3HD1 ILE 22 -0.943 -3.866 -8.606 161 HD12 ILE 22 1HD1 ILE 22 -1.762 -5.420 -8.449 162 HD13 ILE 22 2HD1 ILE 22 -2.695 -3.963 -8.783 163 H GLU 23 H GLU 23 1.366 -5.451 -14.206 164 HA GLU 23 HA GLU 23 2.894 -7.866 -13.614 165 HB2 GLU 23 1HB GLU 23 2.335 -7.431 -15.965 166 HB3 GLU 23 2HB GLU 23 3.179 -5.889 -15.886 167 HG2 GLU 23 1HG GLU 23 5.280 -7.056 -15.453 168 HG3 GLU 23 2HG GLU 23 4.437 -8.601 -15.529 169 H VAL 24 H VAL 24 4.420 -7.710 -12.144 170 HA VAL 24 HA VAL 24 5.828 -5.167 -11.785 171 HB VAL 24 HB VAL 24 5.815 -7.639 -10.039 172 HG11 VAL 24 1HG1 VAL 24 7.047 -4.927 -9.564 173 HG12 VAL 24 2HG1 VAL 24 7.918 -6.437 -9.839 174 HG13 VAL 24 3HG1 VAL 24 6.948 -6.230 -8.380 175 HG21 VAL 24 3HG2 VAL 24 4.509 -6.260 -8.484 176 HG22 VAL 24 1HG2 VAL 24 3.674 -6.490 -10.021 177 HG23 VAL 24 2HG2 VAL 24 4.480 -4.960 -9.676 178 H ASN 25 H ASN 25 7.277 -5.133 -13.399 179 HA ASN 25 HA ASN 25 9.217 -5.466 -14.498 180 HB2 ASN 25 1HB ASN 25 9.823 -7.212 -12.112 181 HB3 ASN 25 2HB ASN 25 10.982 -6.905 -13.399 182 HD21 ASN 25 2HD2 ASN 25 10.084 -4.139 -13.770 183 HD22 ASN 25 1HD2 ASN 25 10.718 -3.263 -12.425 184 H GLN 26 H GLN 26 8.873 -8.728 -13.144 185 HA GLN 26 HA GLN 26 8.725 -9.744 -15.910 186 HB2 GLN 26 1HB GLN 26 10.086 -10.993 -13.516 187 HB3 GLN 26 2HB GLN 26 9.908 -11.766 -15.083 188 HG2 GLN 26 1HG GLN 26 11.285 -10.058 -16.111 189 HG3 GLN 26 2HG GLN 26 11.421 -9.214 -14.568 190 HE21 GLN 26 2HE2 GLN 26 13.498 -10.360 -16.287 191 HE22 GLN 26 1HE2 GLN 26 14.362 -11.490 -15.301 192 H VAL 27 H VAL 27 7.433 -9.850 -12.690 193 HA VAL 27 HA VAL 27 5.919 -12.290 -13.286 194 HB VAL 27 HB VAL 27 6.164 -10.835 -10.648 195 HG11 VAL 27 1HG1 VAL 27 4.151 -12.188 -10.808 196 HG12 VAL 27 2HG1 VAL 27 5.299 -12.923 -9.690 197 HG13 VAL 27 3HG1 VAL 27 5.104 -13.582 -11.315 198 HG21 VAL 27 3HG2 VAL 27 7.720 -12.621 -10.006 199 HG22 VAL 27 1HG2 VAL 27 8.336 -11.668 -11.355 200 HG23 VAL 27 2HG2 VAL 27 7.649 -13.266 -11.646 201 H ARG 28 H ARG 28 3.827 -12.241 -13.744 202 HA ARG 28 HA ARG 28 2.414 -9.679 -13.540 203 HE ARG 28 HE ARG 28 1.781 -12.983 -17.029 204 HB2 ARG 28 1HB ARG 28 1.767 -12.187 -15.104 205 HB3 ARG 28 2HB ARG 28 0.772 -10.735 -15.087 206 HG2 ARG 28 1HG ARG 28 2.578 -9.454 -16.069 207 HG3 ARG 28 2HG ARG 28 3.626 -10.872 -16.031 208 HD2 ARG 28 1HD ARG 28 1.044 -10.668 -17.574 209 HD3 ARG 28 2HD ARG 28 2.652 -10.442 -18.260 210 HH11 ARG 28 1HH1 ARG 28 3.308 -11.184 -19.626 211 HH12 ARG 28 2HH1 ARG 28 3.829 -12.618 -20.466 212 HH21 ARG 28 1HH2 ARG 28 2.452 -14.850 -18.148 213 HH22 ARG 28 2HH2 ARG 28 3.349 -14.691 -19.629 214 H PHE 29 H PHE 29 1.304 -9.418 -11.730 215 HA PHE 29 HA PHE 29 0.347 -11.755 -10.279 216 HD1 PHE 29 HD1 PHE 29 1.370 -11.839 -7.591 217 HD2 PHE 29 HD2 PHE 29 2.813 -8.518 -9.824 218 HE1 PHE 29 HE1 PHE 29 3.645 -12.277 -6.765 219 HE2 PHE 29 HE2 PHE 29 5.091 -8.950 -9.003 220 HZ PHE 29 HZ PHE 29 5.508 -10.833 -7.472 221 HB2 PHE 29 1HB PHE 29 0.474 -8.835 -9.514 222 HB3 PHE 29 2HB PHE 29 -0.148 -10.109 -8.468 223 H SER 30 H SER 30 -1.697 -12.331 -10.088 224 HA SER 30 HA SER 30 -3.693 -10.796 -11.575 225 HG SER 30 HG SER 30 -3.422 -14.801 -11.064 226 HB2 SER 30 1HB SER 30 -4.935 -13.080 -11.284 227 HB3 SER 30 2HB SER 30 -3.606 -12.958 -12.437 228 H HIS 31 H HIS 31 -2.743 -10.520 -8.635 229 HA HIS 31 HA HIS 31 -5.394 -10.178 -7.509 230 HD1 HIS 31 HD1 HIS 31 -3.458 -14.241 -6.970 231 HD2 HIS 31 HD2 HIS 31 -1.662 -10.866 -5.317 232 HE1 HIS 31 HE1 HIS 31 -1.056 -14.882 -6.533 233 HE2 HIS 31 HE2 HIS 31 -0.022 -12.872 -5.421 234 HB2 HIS 31 1HB HIS 31 -4.697 -11.366 -5.374 235 HB3 HIS 31 2HB HIS 31 -5.050 -12.402 -6.751 236 H ALA 32 H ALA 32 -5.024 -9.386 -5.076 237 HA ALA 32 HA ALA 32 -3.730 -6.889 -5.301 238 HB1 ALA 32 3HB ALA 32 -4.721 -8.292 -2.825 239 HB2 ALA 32 1HB ALA 32 -5.688 -7.263 -3.881 240 HB3 ALA 32 2HB ALA 32 -4.345 -6.575 -2.970 241 H ILE 33 H ILE 33 -1.836 -6.120 -4.461 242 HA ILE 33 HA ILE 33 -0.037 -7.968 -3.080 243 HB ILE 33 HB ILE 33 1.827 -7.352 -4.669 244 HG12 ILE 33 1HG1 ILE 33 -0.487 -6.595 -6.469 245 HG13 ILE 33 2HG1 ILE 33 0.666 -5.467 -5.763 246 HG21 ILE 33 1HG2 ILE 33 -0.419 -9.055 -5.740 247 HG22 ILE 33 2HG2 ILE 33 0.864 -9.577 -4.647 248 HG23 ILE 33 3HG2 ILE 33 1.255 -9.096 -6.299 249 HD11 ILE 33 3HD1 ILE 33 1.183 -5.936 -8.088 250 HD12 ILE 33 1HD1 ILE 33 1.321 -7.656 -7.720 251 HD13 ILE 33 2HD1 ILE 33 2.467 -6.510 -7.023 252 H ALA 34 H ALA 34 1.772 -6.967 -2.128 253 HA ALA 34 HA ALA 34 1.720 -4.020 -2.062 254 HB1 ALA 34 3HB ALA 34 0.810 -4.897 0.037 255 HB2 ALA 34 1HB ALA 34 2.363 -4.106 0.301 256 HB3 ALA 34 2HB ALA 34 2.265 -5.866 0.268 257 H PHE 35 H PHE 35 3.668 -3.073 -2.449 258 HA PHE 35 HA PHE 35 6.094 -4.632 -2.177 259 HD1 PHE 35 HD2 PHE 35 3.152 -4.775 -4.983 260 HD2 PHE 35 HD1 PHE 35 6.436 -2.172 -5.719 261 HE1 PHE 35 HE2 PHE 35 1.784 -3.509 -6.590 262 HE2 PHE 35 HE1 PHE 35 5.076 -0.903 -7.327 263 HZ PHE 35 HZ PHE 35 2.748 -1.572 -7.766 264 HB2 PHE 35 1HB PHE 35 6.759 -4.233 -4.561 265 HB3 PHE 35 2HB PHE 35 5.448 -5.384 -4.348 266 H ALA 36 H ALA 36 8.013 -3.452 -2.415 267 HA ALA 36 HA ALA 36 7.697 -0.525 -2.265 268 HB1 ALA 36 3HB ALA 36 8.307 -1.490 -0.097 269 HB2 ALA 36 1HB ALA 36 9.624 -0.512 -0.745 270 HB3 ALA 36 2HB ALA 36 9.707 -2.271 -0.833 271 HA PRO 37 HA PRO 37 10.609 -0.112 -5.598 272 HB2 PRO 37 1HB PRO 37 12.318 1.683 -3.989 273 HB3 PRO 37 2HB PRO 37 11.465 2.002 -5.502 274 HG2 PRO 37 1HG PRO 37 10.632 3.055 -3.186 275 HG3 PRO 37 2HG PRO 37 9.485 2.526 -4.430 276 HD2 PRO 37 1HD PRO 37 10.296 1.160 -1.894 277 HD3 PRO 37 2HD PRO 37 8.690 1.288 -2.641 278 H GLU 38 H GLU 38 12.189 -0.293 -2.437 279 HA GLU 38 HA GLU 38 14.111 -2.209 -3.575 280 HB2 GLU 38 1HB GLU 38 15.194 -0.072 -2.944 281 HB3 GLU 38 2HB GLU 38 14.578 -0.253 -1.309 282 HG2 GLU 38 1HG GLU 38 16.908 -0.885 -1.425 283 HG3 GLU 38 2HG GLU 38 15.908 -2.283 -1.032 284 H GLY 39 H GLY 39 13.220 -4.107 -2.988 285 HA2 GLY 39 1HA GLY 39 13.465 -5.305 -0.611 286 HA3 GLY 39 2HA GLY 39 11.969 -4.410 -0.387 287 HA PRO 40 HA PRO 40 10.765 -8.322 -2.398 288 HB2 PRO 40 1HB PRO 40 9.134 -9.200 -0.383 289 HB3 PRO 40 2HB PRO 40 10.863 -9.532 -0.473 290 HG2 PRO 40 1HG PRO 40 9.444 -7.864 1.411 291 HG3 PRO 40 2HG PRO 40 11.154 -8.313 1.406 292 HD2 PRO 40 1HD PRO 40 9.871 -5.838 0.482 293 HD3 PRO 40 2HD PRO 40 11.576 -6.145 0.871 294 H VAL 41 H VAL 41 8.723 -9.104 -3.162 295 HA VAL 41 HA VAL 41 6.511 -7.164 -2.999 296 HB VAL 41 HB VAL 41 7.038 -9.169 -5.208 297 HG11 VAL 41 1HG1 VAL 41 5.008 -6.946 -5.006 298 HG12 VAL 41 2HG1 VAL 41 4.673 -8.674 -4.905 299 HG13 VAL 41 3HG1 VAL 41 5.270 -7.979 -6.412 300 HG21 VAL 41 3HG2 VAL 41 7.621 -7.237 -6.601 301 HG22 VAL 41 1HG2 VAL 41 8.721 -7.406 -5.233 302 HG23 VAL 41 2HG2 VAL 41 7.455 -6.179 -5.199 303 H ALA 42 H ALA 42 4.830 -7.878 -1.815 304 HA ALA 42 HA ALA 42 4.661 -10.788 -1.364 305 HB1 ALA 42 3HB ALA 42 3.823 -10.315 0.866 306 HB2 ALA 42 1HB ALA 42 3.923 -8.582 0.553 307 HB3 ALA 42 2HB ALA 42 5.393 -9.553 0.620 308 H SER 43 H SER 43 2.672 -11.774 -1.339 309 HA SER 43 HA SER 43 0.548 -10.437 -2.739 310 HG SER 43 HG SER 43 -1.495 -12.682 -1.954 311 HB2 SER 43 1HB SER 43 1.080 -12.841 -3.105 312 HB3 SER 43 2HB SER 43 0.591 -13.179 -1.446 313 H TRP 44 H TRP 44 -1.163 -9.448 -1.858 314 HA TRP 44 HA TRP 44 -1.362 -9.462 1.065 315 HD1 TRP 44 HD1 TRP 44 -1.410 -8.293 2.720 316 HE1 TRP 44 HE1 TRP 44 -2.284 -6.532 4.384 317 HE3 TRP 44 HE3 TRP 44 -3.766 -5.166 -0.570 318 HZ2 TRP 44 HZ2 TRP 44 -3.773 -4.137 4.309 319 HZ3 TRP 44 HZ3 TRP 44 -4.887 -3.160 0.309 320 HH2 TRP 44 HH2 TRP 44 -4.891 -2.657 2.698 321 HB2 TRP 44 1HB TRP 44 -1.202 -7.330 -0.474 322 HB3 TRP 44 2HB TRP 44 -2.922 -7.612 -0.713 323 HA PRO 45 HA PRO 45 -4.836 -12.240 0.455 324 HB2 PRO 45 1HB PRO 45 -5.105 -12.098 3.368 325 HB3 PRO 45 2HB PRO 45 -4.691 -13.480 2.351 326 HG2 PRO 45 1HG PRO 45 -2.888 -12.311 3.976 327 HG3 PRO 45 2HG PRO 45 -2.434 -13.022 2.416 328 HD2 PRO 45 1HD PRO 45 -2.898 -10.144 3.124 329 HD3 PRO 45 2HD PRO 45 -1.605 -10.867 2.139 330 H VAL 46 H VAL 46 -5.213 -9.345 0.306 331 HA VAL 46 HA VAL 46 -7.831 -9.066 1.627 332 HB VAL 46 HB VAL 46 -5.858 -6.923 0.796 333 HG11 VAL 46 1HG1 VAL 46 -8.210 -6.233 0.448 334 HG12 VAL 46 2HG1 VAL 46 -7.391 -5.300 1.700 335 HG13 VAL 46 3HG1 VAL 46 -8.523 -6.572 2.149 336 HG21 VAL 46 3HG2 VAL 46 -5.738 -6.445 3.196 337 HG22 VAL 46 1HG2 VAL 46 -5.223 -8.091 2.832 338 HG23 VAL 46 2HG2 VAL 46 -6.823 -7.798 3.515 339 H GLN 47 H GLN 47 -9.546 -8.965 0.293 340 HA GLN 47 HA GLN 47 -8.993 -8.827 -2.585 341 HB2 GLN 47 1HB GLN 47 -11.485 -9.753 -1.147 342 HB3 GLN 47 2HB GLN 47 -11.204 -9.836 -2.880 343 HG2 GLN 47 1HG GLN 47 -9.386 -11.408 -2.530 344 HG3 GLN 47 2HG GLN 47 -9.616 -11.301 -0.784 345 HE21 GLN 47 2HE2 GLN 47 -9.781 -13.626 -2.506 346 HE22 GLN 47 1HE2 GLN 47 -11.381 -14.270 -2.302 347 H ARG 48 H ARG 48 -11.222 -7.567 -0.143 348 HA ARG 48 HA ARG 48 -12.107 -5.521 -2.066 349 HE ARG 48 HE ARG 48 -15.208 -9.643 -1.758 350 HB2 ARG 48 1HB ARG 48 -13.456 -6.342 0.510 351 HB3 ARG 48 2HB ARG 48 -14.142 -5.395 -0.804 352 HG2 ARG 48 1HG ARG 48 -14.261 -7.275 -2.226 353 HG3 ARG 48 2HG ARG 48 -13.260 -8.244 -1.145 354 HD2 ARG 48 1HD ARG 48 -15.074 -7.994 0.578 355 HD3 ARG 48 2HD ARG 48 -16.076 -7.287 -0.691 356 HH11 ARG 48 1HH1 ARG 48 -16.913 -8.753 1.175 357 HH12 ARG 48 2HH1 ARG 48 -17.749 -10.277 1.298 358 HH21 ARG 48 1HH2 ARG 48 -16.288 -11.621 -1.607 359 HH22 ARG 48 2HH2 ARG 48 -17.409 -11.911 -0.308 360 HA PRO 49 HA PRO 49 -10.242 -2.299 0.393 361 HB2 PRO 49 1HB PRO 49 -12.268 -0.417 0.189 362 HB3 PRO 49 2HB PRO 49 -10.979 -0.652 -0.993 363 HG2 PRO 49 1HG PRO 49 -13.794 -1.641 -1.033 364 HG3 PRO 49 2HG PRO 49 -12.790 -1.052 -2.369 365 HD2 PRO 49 1HD PRO 49 -13.248 -3.671 -1.988 366 HD3 PRO 49 2HD PRO 49 -11.693 -3.073 -2.603 367 H ALA 50 H ALA 50 -13.380 -3.607 1.012 368 HA ALA 50 HA ALA 50 -13.757 -2.357 3.569 369 HB1 ALA 50 3HB ALA 50 -15.687 -3.820 3.778 370 HB2 ALA 50 1HB ALA 50 -15.163 -4.741 2.368 371 HB3 ALA 50 2HB ALA 50 -15.658 -3.058 2.187 372 H ASP 51 H ASP 51 -12.055 -5.104 2.399 373 HA ASP 51 HA ASP 51 -12.073 -6.698 4.755 374 HB2 ASP 51 1HB ASP 51 -10.299 -6.580 2.333 375 HB3 ASP 51 2HB ASP 51 -9.867 -7.600 3.698 376 H ILE 52 H ILE 52 -10.321 -3.902 3.765 377 HA ILE 52 HA ILE 52 -7.871 -4.242 5.005 378 HB ILE 52 HB ILE 52 -9.356 -1.651 4.573 379 HG12 ILE 52 1HG1 ILE 52 -7.302 -3.082 2.869 380 HG13 ILE 52 2HG1 ILE 52 -9.026 -2.980 2.520 381 HG21 ILE 52 1HG2 ILE 52 -7.549 -1.375 6.174 382 HG22 ILE 52 2HG2 ILE 52 -7.125 -0.615 4.640 383 HG23 ILE 52 3HG2 ILE 52 -6.427 -2.177 5.076 384 HD11 ILE 52 3HD1 ILE 52 -8.830 -0.554 2.306 385 HD12 ILE 52 1HD1 ILE 52 -7.773 -1.404 1.179 386 HD13 ILE 52 2HD1 ILE 52 -7.101 -0.671 2.636 387 H THR 53 H THR 53 -7.435 -4.647 7.014 388 HA THR 53 HA THR 53 -8.798 -3.141 9.148 389 HB THR 53 HB THR 53 -7.539 -5.874 9.477 390 HG1 THR 53 HG1 THR 53 -9.671 -5.377 8.055 391 HG21 THR 53 3HG2 THR 53 -7.879 -4.585 11.536 392 HG22 THR 53 1HG2 THR 53 -8.958 -5.981 11.477 393 HG23 THR 53 2HG2 THR 53 -9.581 -4.369 11.121 394 H ALA 54 H ALA 54 -7.361 -2.713 11.050 395 HA ALA 54 HA ALA 54 -5.011 -1.433 10.348 396 HB1 ALA 54 3HB ALA 54 -4.517 -1.302 12.727 397 HB2 ALA 54 1HB ALA 54 -5.699 -2.570 13.054 398 HB3 ALA 54 2HB ALA 54 -6.230 -1.010 12.427 399 H SER 55 H SER 55 -5.383 -4.697 11.682 400 HA SER 55 HA SER 55 -2.652 -5.292 11.925 401 HG SER 55 HG SER 55 -6.027 -7.201 12.352 402 HB2 SER 55 1HB SER 55 -3.537 -7.714 11.781 403 HB3 SER 55 2HB SER 55 -4.129 -6.697 13.096 404 H LEU 56 H LEU 56 -4.878 -5.560 9.229 405 HA LEU 56 HA LEU 56 -3.181 -7.123 7.566 406 HG LEU 56 HG LEU 56 -6.385 -6.873 8.254 407 HB2 LEU 56 1HB LEU 56 -5.415 -5.266 6.738 408 HB3 LEU 56 2HB LEU 56 -4.711 -6.545 5.766 409 HD11 LEU 56 1HD1 LEU 56 -7.654 -6.363 6.248 410 HD12 LEU 56 2HD1 LEU 56 -7.910 -8.037 6.739 411 HD13 LEU 56 3HD1 LEU 56 -6.842 -7.668 5.386 412 HD21 LEU 56 3HD2 LEU 56 -6.151 -9.281 7.900 413 HD22 LEU 56 1HD2 LEU 56 -4.599 -8.522 8.254 414 HD23 LEU 56 2HD2 LEU 56 -5.001 -8.976 6.599 415 H LEU 57 H LEU 57 -3.595 -3.700 8.139 416 HA LEU 57 HA LEU 57 -2.019 -2.761 5.982 417 HG LEU 57 HG LEU 57 -4.619 -1.764 7.258 418 HB2 LEU 57 1HB LEU 57 -2.607 -1.535 8.679 419 HB3 LEU 57 2HB LEU 57 -1.798 -0.694 7.370 420 HD11 LEU 57 1HD1 LEU 57 -4.433 0.107 8.799 421 HD12 LEU 57 2HD1 LEU 57 -5.273 0.597 7.328 422 HD13 LEU 57 3HD1 LEU 57 -3.588 1.052 7.573 423 HD21 LEU 57 3HD2 LEU 57 -3.508 -1.728 5.080 424 HD22 LEU 57 1HD2 LEU 57 -3.073 -0.038 5.327 425 HD23 LEU 57 2HD2 LEU 57 -4.768 -0.499 5.177 426 H GLN 58 H GLN 58 -1.282 -3.827 9.247 427 HA GLN 58 HA GLN 58 1.449 -3.101 9.272 428 HB2 GLN 58 1HB GLN 58 -0.005 -5.313 10.734 429 HB3 GLN 58 2HB GLN 58 1.645 -4.810 11.076 430 HG2 GLN 58 1HG GLN 58 0.868 -2.604 11.713 431 HG3 GLN 58 2HG GLN 58 -0.789 -3.056 11.311 432 HE21 GLN 58 2HE2 GLN 58 0.405 -2.174 13.842 433 HE22 GLN 58 1HE2 GLN 58 0.036 -3.412 14.988 434 H GLN 59 H GLN 59 -0.284 -5.918 8.104 435 HA GLN 59 HA GLN 59 2.021 -7.474 7.508 436 HB2 GLN 59 1HB GLN 59 -0.774 -7.633 6.359 437 HB3 GLN 59 2HB GLN 59 0.473 -8.860 6.178 438 HG2 GLN 59 1HG GLN 59 0.480 -9.225 8.584 439 HG3 GLN 59 2HG GLN 59 -0.741 -7.972 8.785 440 HE21 GLN 59 2HE2 GLN 59 -0.839 -10.783 9.510 441 HE22 GLN 59 1HE2 GLN 59 -2.205 -11.445 8.685 442 H ALA 60 H ALA 60 0.029 -5.211 5.675 443 HA ALA 60 HA ALA 60 1.344 -5.581 3.182 444 HB1 ALA 60 3HB ALA 60 -0.896 -4.616 3.342 445 HB2 ALA 60 1HB ALA 60 0.209 -3.526 2.504 446 HB3 ALA 60 2HB ALA 60 -0.237 -3.213 4.181 447 H ALA 61 H ALA 61 2.059 -3.772 6.027 448 HA ALA 61 HA ALA 61 3.960 -2.013 4.773 449 HB1 ALA 61 3HB ALA 61 4.449 -1.265 7.040 450 HB2 ALA 61 1HB ALA 61 3.482 -2.587 7.696 451 HB3 ALA 61 2HB ALA 61 2.708 -1.310 6.757 452 H GLY 62 H GLY 62 3.989 -5.237 5.590 453 HA2 GLY 62 1HA GLY 62 5.673 -6.800 5.607 454 HA3 GLY 62 2HA GLY 62 6.761 -5.528 5.072 455 H LEU 63 H LEU 63 4.859 -5.580 8.042 456 HA LEU 63 HA LEU 63 7.239 -4.969 9.559 457 HG LEU 63 HG LEU 63 4.671 -3.314 9.016 458 HB2 LEU 63 1HB LEU 63 4.369 -5.310 10.424 459 HB3 LEU 63 2HB LEU 63 5.671 -4.769 11.467 460 HD11 LEU 63 1HD1 LEU 63 3.076 -3.253 10.854 461 HD12 LEU 63 2HD1 LEU 63 3.822 -1.673 10.611 462 HD13 LEU 63 3HD1 LEU 63 4.344 -2.698 11.948 463 HD21 LEU 63 3HD2 LEU 63 6.130 -1.500 9.765 464 HD22 LEU 63 1HD2 LEU 63 7.053 -2.954 9.387 465 HD23 LEU 63 2HD2 LEU 63 6.737 -2.523 11.068 466 H ALA 64 H ALA 64 6.441 -7.750 8.378 467 HA ALA 64 HA ALA 64 6.713 -9.358 10.797 468 HB1 ALA 64 3HB ALA 64 6.425 -11.288 9.333 469 HB2 ALA 64 1HB ALA 64 6.450 -10.235 7.918 470 HB3 ALA 64 2HB ALA 64 5.130 -10.117 9.081 471 H GLU 65 H GLU 65 8.800 -8.645 11.376 472 HA GLU 65 HA GLU 65 10.966 -8.849 9.492 473 HB2 GLU 65 1HB GLU 65 10.802 -7.036 11.203 474 HB3 GLU 65 2HB GLU 65 11.088 -8.245 12.448 475 HG2 GLU 65 1HG GLU 65 13.113 -6.999 11.878 476 HG3 GLU 65 2HG GLU 65 13.271 -8.722 11.533 477 H VAL 66 H VAL 66 12.686 -10.221 9.564 478 HA VAL 66 HA VAL 66 12.578 -12.532 11.376 479 HB VAL 66 HB VAL 66 12.927 -12.824 8.374 480 HG11 VAL 66 1HG1 VAL 66 14.017 -14.571 9.666 481 HG12 VAL 66 2HG1 VAL 66 12.627 -15.217 8.793 482 HG13 VAL 66 3HG1 VAL 66 12.512 -14.898 10.524 483 HG21 VAL 66 3HG2 VAL 66 10.467 -13.404 10.018 484 HG22 VAL 66 1HG2 VAL 66 10.690 -13.836 8.323 485 HG23 VAL 66 2HG2 VAL 66 10.640 -12.139 8.802 486 H VAL 67 H VAL 67 14.706 -13.753 11.277 487 HA VAL 67 HA VAL 67 16.992 -12.137 11.261 488 HB VAL 67 HB VAL 67 16.884 -15.118 10.730 489 HG11 VAL 67 1HG1 VAL 67 19.119 -13.399 11.802 490 HG12 VAL 67 2HG1 VAL 67 19.060 -14.147 10.206 491 HG13 VAL 67 3HG1 VAL 67 19.151 -15.155 11.651 492 HG21 VAL 67 3HG2 VAL 67 15.702 -14.553 12.779 493 HG22 VAL 67 1HG2 VAL 67 17.092 -13.624 13.341 494 HG23 VAL 67 2HG2 VAL 67 17.221 -15.371 13.143 495 H ARG 68 H ARG 68 15.278 -13.683 8.708 496 HA ARG 68 HA ARG 68 15.296 -13.395 6.463 497 HE ARG 68 HE ARG 68 14.693 -8.437 7.813 498 HB2 ARG 68 1HB ARG 68 17.634 -11.526 6.878 499 HB3 ARG 68 2HB ARG 68 16.681 -11.690 5.413 500 HG2 ARG 68 1HG ARG 68 14.725 -10.812 6.557 501 HG3 ARG 68 2HG ARG 68 15.640 -10.705 8.064 502 HD2 ARG 68 1HD ARG 68 17.242 -9.194 6.864 503 HD3 ARG 68 2HD ARG 68 16.111 -9.178 5.513 504 HH11 ARG 68 1HH1 ARG 68 17.316 -7.276 5.822 505 HH12 ARG 68 2HH1 ARG 68 17.037 -5.595 6.165 506 HH21 ARG 68 1HH2 ARG 68 14.295 -6.219 8.294 507 HH22 ARG 68 2HH2 ARG 68 15.309 -5.003 7.565 508 H ASP 69 H ASP 69 18.746 -13.188 7.314 509 HA ASP 69 HA ASP 69 19.348 -15.819 6.481 510 HB2 ASP 69 1HB ASP 69 19.011 -15.121 4.230 511 HB3 ASP 69 2HB ASP 69 19.889 -13.618 4.486 512 HA PRO 70 HA PRO 70 23.307 -13.667 7.792 513 HB2 PRO 70 1HB PRO 70 23.722 -11.040 7.506 514 HB3 PRO 70 2HB PRO 70 23.844 -12.145 6.134 515 HG2 PRO 70 1HG PRO 70 21.711 -10.202 6.814 516 HG3 PRO 70 2HG PRO 70 22.241 -10.786 5.229 517 HD2 PRO 70 1HD PRO 70 20.000 -11.674 6.733 518 HD3 PRO 70 2HD PRO 70 20.624 -12.368 5.225 519 H LEU 71 H LEU 71 23.870 -13.307 9.878 520 HA LEU 71 HA LEU 71 21.922 -12.332 11.734 521 HG LEU 71 HG LEU 71 22.241 -14.206 13.320 522 HB2 LEU 71 1HB LEU 71 24.767 -13.249 11.965 523 HB3 LEU 71 2HB LEU 71 23.997 -12.446 13.318 524 HD11 LEU 71 1HD1 LEU 71 24.005 -15.531 11.268 525 HD12 LEU 71 2HD1 LEU 71 22.384 -14.895 10.990 526 HD13 LEU 71 3HD1 LEU 71 22.620 -16.269 12.072 527 HD21 LEU 71 3HD2 LEU 71 25.078 -15.194 13.569 528 HD22 LEU 71 1HD2 LEU 71 23.654 -15.960 14.273 529 HD23 LEU 71 2HD2 LEU 71 24.153 -14.358 14.816 530 H ALA 72 H ALA 72 24.407 -10.939 9.875 531 HA ALA 72 HA ALA 72 24.190 -8.405 11.349 532 HB1 ALA 72 3HB ALA 72 26.229 -7.723 10.181 533 HB2 ALA 72 1HB ALA 72 26.263 -9.267 9.330 534 HB3 ALA 72 2HB ALA 72 26.480 -9.220 11.079 535 H PHE 73 H PHE 73 22.627 -7.181 10.535 536 HA PHE 73 HA PHE 73 21.685 -7.494 7.839 537 HD1 PHE 73 HD1 PHE 73 18.907 -7.818 8.015 538 HD2 PHE 73 HD2 PHE 73 20.528 -6.808 11.817 539 HE1 PHE 73 HE1 PHE 73 17.466 -9.507 9.074 540 HE2 PHE 73 HE2 PHE 73 19.090 -8.494 12.883 541 HZ PHE 73 HZ PHE 73 17.555 -9.848 11.511 542 HB2 PHE 73 1HB PHE 73 20.969 -5.445 9.950 543 HB3 PHE 73 2HB PHE 73 20.116 -5.671 8.426 544 H LEU 74 H LEU 74 22.084 -6.231 6.092 545 HA LEU 74 HA LEU 74 24.228 -4.258 6.425 546 HG LEU 74 HG LEU 74 24.606 -7.212 5.409 547 HB2 LEU 74 1HB LEU 74 23.309 -5.742 3.966 548 HB3 LEU 74 2HB LEU 74 24.592 -4.546 3.990 549 HD11 LEU 74 1HD1 LEU 74 26.442 -7.725 3.875 550 HD12 LEU 74 2HD1 LEU 74 26.213 -6.165 3.083 551 HD13 LEU 74 3HD1 LEU 74 24.944 -7.387 3.008 552 HD21 LEU 74 3HD2 LEU 74 26.917 -6.645 6.020 553 HD22 LEU 74 1HD2 LEU 74 25.750 -5.541 6.749 554 HD23 LEU 74 2HD2 LEU 74 26.688 -5.030 5.347 555 H ASP 75 H ASP 75 21.097 -4.720 4.828 556 HA ASP 75 HA ASP 75 20.876 -2.170 3.687 557 HB2 ASP 75 1HB ASP 75 18.356 -2.632 3.868 558 HB3 ASP 75 2HB ASP 75 19.320 -3.771 2.934 559 H GLU 76 H GLU 76 19.163 -3.270 6.636 560 HA GLU 76 HA GLU 76 19.231 -0.603 7.733 561 HB2 GLU 76 1HB GLU 76 18.366 -3.269 8.864 562 HB3 GLU 76 2HB GLU 76 18.323 -1.775 9.791 563 HG2 GLU 76 1HG GLU 76 16.810 -2.346 7.253 564 HG3 GLU 76 2HG GLU 76 16.141 -2.272 8.884 565 HA PRO 77 HA PRO 77 23.472 -1.349 8.901 566 HB2 PRO 77 1HB PRO 77 23.302 1.345 10.069 567 HB3 PRO 77 2HB PRO 77 24.347 0.743 8.778 568 HG2 PRO 77 1HG PRO 77 22.316 2.428 8.281 569 HG3 PRO 77 2HG PRO 77 22.776 1.156 7.135 570 HD2 PRO 77 1HD PRO 77 20.517 1.210 9.101 571 HD3 PRO 77 2HD PRO 77 20.535 0.629 7.422 572 H GLU 78 H GLU 78 21.258 0.281 11.156 573 HA GLU 78 HA GLU 78 22.306 -1.330 13.349 574 HB2 GLU 78 1HB GLU 78 22.233 1.695 13.362 575 HB3 GLU 78 2HB GLU 78 22.529 0.699 14.779 576 HG2 GLU 78 1HG GLU 78 24.582 -0.106 13.872 577 HG3 GLU 78 2HG GLU 78 24.253 0.657 12.317 578 H ALA 79 H ALA 79 20.976 -1.018 15.342 579 HA ALA 79 HA ALA 79 18.157 -0.555 14.627 580 HB1 ALA 79 3HB ALA 79 18.659 -2.769 15.534 581 HB2 ALA 79 1HB ALA 79 17.616 -1.861 16.628 582 HB3 ALA 79 2HB ALA 79 19.335 -2.030 16.985 583 H GLY 80 H GLY 80 20.718 0.997 15.949 584 HA2 GLY 80 1HA GLY 80 20.843 3.064 16.948 585 HA3 GLY 80 2HA GLY 80 19.087 3.117 16.946 586 H ALA 81 H ALA 81 18.677 3.764 18.969 587 HA ALA 81 HA ALA 81 19.969 2.368 21.201 588 HB1 ALA 81 3HB ALA 81 18.275 4.866 21.202 589 HB2 ALA 81 1HB ALA 81 20.038 4.817 21.215 590 HB3 ALA 81 2HB ALA 81 19.128 4.188 22.588 591 H GLY 82 H GLY 82 17.740 1.330 19.453 592 HA2 GLY 82 1HA GLY 82 15.985 0.524 21.659 593 HA3 GLY 82 2HA GLY 82 15.251 1.195 20.209 594 H ALA 83 H ALA 83 14.138 -0.767 19.861 595 HA ALA 83 HA ALA 83 15.864 -2.931 18.836 596 HB1 ALA 83 3HB ALA 83 13.117 -3.182 20.061 597 HB2 ALA 83 1HB ALA 83 14.639 -3.611 20.842 598 HB3 ALA 83 2HB ALA 83 14.093 -4.505 19.423 599 H ARG 84 H ARG 84 14.330 -0.445 17.712 600 HA ARG 84 HA ARG 84 13.086 -1.895 15.481 601 HE ARG 84 HE ARG 84 10.004 0.064 18.053 602 HB2 ARG 84 1HB ARG 84 11.467 -0.043 15.252 603 HB3 ARG 84 2HB ARG 84 11.317 -0.878 16.791 604 HG2 ARG 84 1HG ARG 84 12.496 0.917 17.912 605 HG3 ARG 84 2HG ARG 84 12.745 1.741 16.372 606 HD2 ARG 84 1HD ARG 84 10.898 2.756 17.545 607 HD3 ARG 84 2HD ARG 84 10.305 1.927 16.107 608 HH11 ARG 84 1HH1 ARG 84 9.069 3.429 17.816 609 HH12 ARG 84 2HH1 ARG 84 7.631 3.240 18.768 610 HH21 ARG 84 1HH2 ARG 84 8.109 -0.199 19.329 611 HH22 ARG 84 2HH2 ARG 84 7.079 1.175 19.623 612 HA PRO 85 HA PRO 85 15.963 0.648 13.176 613 HB2 PRO 85 1HB PRO 85 15.435 -0.919 10.867 614 HB3 PRO 85 2HB PRO 85 16.794 -1.085 11.979 615 HG2 PRO 85 1HG PRO 85 14.751 -2.949 11.616 616 HG3 PRO 85 2HG PRO 85 15.871 -2.896 12.987 617 HD2 PRO 85 1HD PRO 85 13.062 -1.904 12.793 618 HD3 PRO 85 2HD PRO 85 13.911 -2.643 14.169 619 H ALA 86 H ALA 86 15.551 0.935 10.402 620 HA ALA 86 HA ALA 86 13.141 2.628 10.387 621 HB1 ALA 86 3HB ALA 86 15.546 2.660 8.561 622 HB2 ALA 86 1HB ALA 86 15.250 3.768 9.901 623 HB3 ALA 86 2HB ALA 86 14.186 3.781 8.495 624 H ASN 87 H ASN 87 13.412 -0.338 9.953 625 HA ASN 87 HA ASN 87 12.953 -0.902 7.210 626 HB2 ASN 87 1HB ASN 87 12.356 -3.152 7.962 627 HB3 ASN 87 2HB ASN 87 13.811 -2.597 8.780 628 HD21 ASN 87 2HD2 ASN 87 12.011 -4.683 9.601 629 HD22 ASN 87 1HD2 ASN 87 11.365 -4.211 11.136 630 H ALA 88 H ALA 88 10.980 0.369 9.662 631 HA ALA 88 HA ALA 88 8.455 -0.464 8.611 632 HB1 ALA 88 3HB ALA 88 7.510 1.215 10.111 633 HB2 ALA 88 1HB ALA 88 9.124 1.859 10.419 634 HB3 ALA 88 2HB ALA 88 8.709 0.228 10.947 635 HA PRO 89 HA PRO 89 8.299 2.131 5.029 636 HB2 PRO 89 1HB PRO 89 5.382 2.177 5.601 637 HB3 PRO 89 2HB PRO 89 6.234 1.718 4.122 638 HG2 PRO 89 1HG PRO 89 5.159 -0.137 5.697 639 HG3 PRO 89 2HG PRO 89 6.723 -0.408 4.904 640 HD2 PRO 89 1HD PRO 89 6.135 0.302 7.749 641 HD3 PRO 89 2HD PRO 89 7.368 -0.794 7.090 642 H GLU 90 H GLU 90 8.702 4.217 4.916 643 HA GLU 90 HA GLU 90 8.106 6.095 6.931 644 HB2 GLU 90 1HB GLU 90 9.979 6.290 5.314 645 HB3 GLU 90 2HB GLU 90 8.817 6.560 4.026 646 HG2 GLU 90 1HG GLU 90 8.043 8.584 5.286 647 HG3 GLU 90 2HG GLU 90 9.424 8.347 6.359 648 H VAL 91 H VAL 91 6.731 5.490 3.733 649 HA VAL 91 HA VAL 91 4.188 6.585 4.670 650 HB VAL 91 HB VAL 91 5.104 8.419 3.420 651 HG11 VAL 91 1HG1 VAL 91 5.576 6.482 1.163 652 HG12 VAL 91 2HG1 VAL 91 6.815 7.234 2.169 653 HG13 VAL 91 3HG1 VAL 91 5.826 8.226 1.096 654 HG21 VAL 91 3HG2 VAL 91 3.101 6.935 1.720 655 HG22 VAL 91 1HG2 VAL 91 3.469 8.657 1.610 656 HG23 VAL 91 2HG2 VAL 91 2.735 8.005 3.075 657 H LEU 92 H LEU 92 2.487 5.370 4.132 658 HA LEU 92 HA LEU 92 2.961 3.102 2.308 659 HG LEU 92 HG LEU 92 0.257 1.698 2.972 660 HB2 LEU 92 1HB LEU 92 2.656 2.432 4.655 661 HB3 LEU 92 2HB LEU 92 1.120 3.273 4.700 662 HD11 LEU 92 1HD1 LEU 92 2.856 0.258 3.470 663 HD12 LEU 92 2HD1 LEU 92 2.387 1.061 1.972 664 HD13 LEU 92 3HD1 LEU 92 1.495 -0.355 2.530 665 HD21 LEU 92 3HD2 LEU 92 1.316 0.443 5.502 666 HD22 LEU 92 1HD2 LEU 92 0.023 -0.208 4.493 667 HD23 LEU 92 2HD2 LEU 92 -0.201 1.327 5.331 668 H LEU 93 H LEU 93 1.884 3.264 0.468 669 HA LEU 93 HA LEU 93 -0.522 4.944 0.389 670 HG LEU 93 HG LEU 93 2.352 5.732 -0.651 671 HB2 LEU 93 1HB LEU 93 1.220 3.927 -1.858 672 HB3 LEU 93 2HB LEU 93 -0.198 4.937 -2.061 673 HD11 LEU 93 1HD1 LEU 93 2.607 7.286 -2.520 674 HD12 LEU 93 2HD1 LEU 93 1.160 6.619 -3.273 675 HD13 LEU 93 3HD1 LEU 93 2.592 5.610 -3.071 676 HD21 LEU 93 3HD2 LEU 93 0.415 6.775 0.387 677 HD22 LEU 93 1HD2 LEU 93 -0.162 7.307 -1.193 678 HD23 LEU 93 2HD2 LEU 93 1.338 7.961 -0.537 679 H VAL 94 H VAL 94 -2.400 3.935 0.475 680 HA VAL 94 HA VAL 94 -2.536 1.141 -0.429 681 HB VAL 94 HB VAL 94 -4.502 2.646 1.307 682 HG11 VAL 94 1HG1 VAL 94 -5.445 0.437 1.772 683 HG12 VAL 94 2HG1 VAL 94 -4.296 -0.290 0.648 684 HG13 VAL 94 3HG1 VAL 94 -5.526 0.824 0.053 685 HG21 VAL 94 3HG2 VAL 94 -2.373 2.363 2.453 686 HG22 VAL 94 1HG2 VAL 94 -2.385 0.640 2.079 687 HG23 VAL 94 2HG2 VAL 94 -3.602 1.316 3.161 688 H GLY 95 H GLY 95 -3.178 0.973 -2.473 689 HA2 GLY 95 1HA GLY 95 -5.081 2.913 -3.569 690 HA3 GLY 95 2HA GLY 95 -4.175 1.711 -4.484 691 H THR 96 H THR 96 -7.075 2.417 -2.793 692 HA THR 96 HA THR 96 -7.906 -0.325 -2.490 693 HB THR 96 HB THR 96 -10.062 0.732 -1.727 694 HG1 THR 96 HG1 THR 96 -10.242 2.719 -2.473 695 HG21 THR 96 3HG2 THR 96 -9.113 1.613 0.357 696 HG22 THR 96 1HG2 THR 96 -7.522 1.694 -0.401 697 HG23 THR 96 2HG2 THR 96 -8.296 0.130 -0.141 698 H GLY 97 H GLY 97 -8.055 1.989 -4.972 699 HA2 GLY 97 1HA GLY 97 -8.676 1.651 -7.162 700 HA3 GLY 97 2HA GLY 97 -9.245 0.055 -6.709 701 H ARG 98 H ARG 98 -11.368 -0.279 -6.325 702 HA ARG 98 HA ARG 98 -13.144 1.399 -7.721 703 HE ARG 98 HE ARG 98 -17.899 -0.809 -7.430 704 HB2 ARG 98 1HB ARG 98 -13.367 -1.064 -7.472 705 HB3 ARG 98 2HB ARG 98 -13.803 -0.828 -5.787 706 HG2 ARG 98 1HG ARG 98 -15.823 0.311 -6.411 707 HG3 ARG 98 2HG ARG 98 -15.358 0.280 -8.116 708 HD2 ARG 98 1HD ARG 98 -15.379 -2.188 -8.036 709 HD3 ARG 98 2HD ARG 98 -15.937 -2.107 -6.368 710 HH11 ARG 98 1HH1 ARG 98 -16.134 -3.378 -9.001 711 HH12 ARG 98 2HH1 ARG 98 -17.521 -3.999 -9.851 712 HH21 ARG 98 1HH2 ARG 98 -19.718 -1.572 -8.564 713 HH22 ARG 98 2HH2 ARG 98 -19.568 -2.945 -9.627 714 H ARG 99 H ARG 99 -13.131 0.568 -4.262 715 HA ARG 99 HA ARG 99 -14.524 3.104 -3.711 716 HE ARG 99 HE ARG 99 -18.955 2.410 -2.282 717 HB2 ARG 99 1HB ARG 99 -14.565 0.418 -2.404 718 HB3 ARG 99 2HB ARG 99 -14.800 1.835 -1.392 719 HG2 ARG 99 1HG ARG 99 -16.456 1.171 -3.814 720 HG3 ARG 99 2HG ARG 99 -16.905 0.802 -2.147 721 HD2 ARG 99 1HD ARG 99 -16.763 3.217 -1.622 722 HD3 ARG 99 2HD ARG 99 -16.434 3.539 -3.324 723 HH11 ARG 99 1HH1 ARG 99 -17.155 4.306 -4.611 724 HH12 ARG 99 2HH1 ARG 99 -18.566 4.754 -5.529 725 HH21 ARG 99 1HH2 ARG 99 -20.818 3.030 -3.458 726 HH22 ARG 99 2HH2 ARG 99 -20.652 4.044 -4.856 727 H GLN 100 H GLN 100 -13.288 4.670 -2.833 728 HA GLN 100 HA GLN 100 -10.687 4.064 -1.793 729 HB2 GLN 100 1HB GLN 100 -11.147 6.220 -2.924 730 HB3 GLN 100 2HB GLN 100 -12.229 6.662 -1.608 731 HG2 GLN 100 1HG GLN 100 -10.379 6.586 -0.035 732 HG3 GLN 100 2HG GLN 100 -9.287 6.087 -1.323 733 HE21 GLN 100 2HE2 GLN 100 -9.199 8.406 0.439 734 HE22 GLN 100 1HE2 GLN 100 -9.147 9.792 -0.598 735 H HIS 101 H HIS 101 -10.749 2.810 -0.048 736 HA HIS 101 HA HIS 101 -12.710 3.091 2.005 737 HD1 HIS 101 HD1 HIS 101 -9.433 0.976 4.237 738 HD2 HIS 101 HD2 HIS 101 -13.570 1.052 3.900 739 HE1 HIS 101 HE1 HIS 101 -10.300 0.305 6.496 740 HE2 HIS 101 HE2 HIS 101 -12.790 0.650 6.331 741 HB2 HIS 101 1HB HIS 101 -11.775 0.899 1.514 742 HB3 HIS 101 2HB HIS 101 -10.158 1.467 1.919 743 H LEU 102 H LEU 102 -12.671 4.911 3.142 744 HA LEU 102 HA LEU 102 -10.305 6.221 4.017 745 HG LEU 102 HG LEU 102 -13.066 7.082 2.739 746 HB2 LEU 102 1HB LEU 102 -13.118 6.403 5.108 747 HB3 LEU 102 2HB LEU 102 -11.814 7.523 5.454 748 HD11 LEU 102 1HD1 LEU 102 -14.576 8.209 4.275 749 HD12 LEU 102 2HD1 LEU 102 -13.983 9.328 3.047 750 HD13 LEU 102 3HD1 LEU 102 -13.317 9.375 4.679 751 HD21 LEU 102 3HD2 LEU 102 -10.989 9.074 3.649 752 HD22 LEU 102 1HD2 LEU 102 -11.751 9.032 2.059 753 HD23 LEU 102 2HD2 LEU 102 -10.713 7.703 2.575 754 H LEU 103 H LEU 103 -9.291 6.140 6.008 755 HA LEU 103 HA LEU 103 -9.745 3.657 7.462 756 HG LEU 103 HG LEU 103 -7.424 4.404 5.507 757 HB2 LEU 103 1HB LEU 103 -7.486 5.653 7.633 758 HB3 LEU 103 2HB LEU 103 -7.565 4.139 8.513 759 HD11 LEU 103 1HD1 LEU 103 -5.341 5.035 6.619 760 HD12 LEU 103 2HD1 LEU 103 -5.172 3.515 5.742 761 HD13 LEU 103 3HD1 LEU 103 -5.346 3.506 7.497 762 HD21 LEU 103 3HD2 LEU 103 -8.669 2.425 6.206 763 HD22 LEU 103 1HD2 LEU 103 -7.344 1.960 7.275 764 HD23 LEU 103 2HD2 LEU 103 -7.102 1.981 5.528 765 H GLY 104 H GLY 104 -9.662 3.657 9.806 766 HA2 GLY 104 1HA GLY 104 -10.976 6.052 10.912 767 HA3 GLY 104 2HA GLY 104 -11.132 4.421 11.553 768 HA PRO 105 HA PRO 105 -7.741 7.226 13.575 769 HB2 PRO 105 1HB PRO 105 -9.463 6.752 15.952 770 HB3 PRO 105 2HB PRO 105 -8.615 8.219 15.449 771 HG2 PRO 105 1HG PRO 105 -11.257 8.006 15.161 772 HG3 PRO 105 2HG PRO 105 -10.266 8.813 13.932 773 HD2 PRO 105 1HD PRO 105 -11.492 6.089 13.891 774 HD3 PRO 105 2HD PRO 105 -11.292 7.257 12.570 775 H GLU 106 H GLU 106 -9.564 4.582 15.116 776 HA GLU 106 HA GLU 106 -7.429 3.602 16.649 777 HB2 GLU 106 1HB GLU 106 -9.990 2.345 15.695 778 HB3 GLU 106 2HB GLU 106 -8.834 1.454 16.673 779 HG2 GLU 106 1HG GLU 106 -10.640 2.398 18.014 780 HG3 GLU 106 2HG GLU 106 -9.069 3.051 18.471 781 H GLN 107 H GLN 107 -8.194 3.163 13.308 782 HA GLN 107 HA GLN 107 -6.764 0.693 13.000 783 HB2 GLN 107 1HB GLN 107 -7.753 2.662 10.935 784 HB3 GLN 107 2HB GLN 107 -7.109 1.064 10.582 785 HG2 GLN 107 1HG GLN 107 -8.937 0.061 11.877 786 HG3 GLN 107 2HG GLN 107 -9.596 1.671 12.166 787 HE21 GLN 107 2HE2 GLN 107 -10.751 -0.639 10.801 788 HE22 GLN 107 1HE2 GLN 107 -11.163 -0.097 9.216 789 H VAL 108 H VAL 108 -6.026 4.100 12.634 790 HA VAL 108 HA VAL 108 -3.480 3.483 11.366 791 HB VAL 108 HB VAL 108 -3.169 5.929 11.208 792 HG11 VAL 108 1HG1 VAL 108 -5.816 4.919 10.174 793 HG12 VAL 108 2HG1 VAL 108 -4.245 4.719 9.396 794 HG13 VAL 108 3HG1 VAL 108 -4.946 6.329 9.569 795 HG21 VAL 108 3HG2 VAL 108 -4.406 6.604 13.201 796 HG22 VAL 108 1HG2 VAL 108 -5.913 6.075 12.454 797 HG23 VAL 108 2HG2 VAL 108 -5.017 7.431 11.768 798 H ARG 109 H ARG 109 -4.632 3.826 14.507 799 HA ARG 109 HA ARG 109 -2.732 5.297 15.841 800 HE ARG 109 HE ARG 109 -5.826 2.418 17.804 801 HB2 ARG 109 1HB ARG 109 -4.235 2.853 16.759 802 HB3 ARG 109 2HB ARG 109 -3.270 3.856 17.818 803 HG2 ARG 109 1HG ARG 109 -4.716 5.785 17.197 804 HG3 ARG 109 2HG ARG 109 -5.745 4.650 16.320 805 HD2 ARG 109 1HD ARG 109 -5.167 4.717 19.275 806 HD3 ARG 109 2HD ARG 109 -6.714 4.982 18.472 807 HH11 ARG 109 1HH1 ARG 109 -7.007 4.201 20.572 808 HH12 ARG 109 2HH1 ARG 109 -7.506 2.779 21.435 809 HH21 ARG 109 1HH2 ARG 109 -6.503 0.541 18.928 810 HH22 ARG 109 2HH2 ARG 109 -7.222 0.703 20.506 811 HA PRO 110 HA PRO 110 -0.096 1.289 16.661 812 HB2 PRO 110 1HB PRO 110 -0.267 -0.643 14.711 813 HB3 PRO 110 2HB PRO 110 -1.145 -0.688 16.242 814 HG2 PRO 110 1HG PRO 110 -2.086 0.195 13.542 815 HG3 PRO 110 2HG PRO 110 -2.933 -0.774 14.763 816 HD2 PRO 110 1HD PRO 110 -3.471 1.828 14.431 817 HD3 PRO 110 2HD PRO 110 -3.475 1.082 16.042 818 H LEU 111 H LEU 111 -0.733 2.227 13.309 819 HA LEU 111 HA LEU 111 2.004 1.764 12.532 820 HG LEU 111 HG LEU 111 -0.551 0.560 11.374 821 HB2 LEU 111 1HB LEU 111 -0.323 2.985 11.054 822 HB3 LEU 111 2HB LEU 111 1.267 2.744 10.351 823 HD11 LEU 111 1HD1 LEU 111 -0.737 -0.074 9.027 824 HD12 LEU 111 2HD1 LEU 111 0.235 1.323 8.569 825 HD13 LEU 111 3HD1 LEU 111 -1.350 1.556 9.304 826 HD21 LEU 111 3HD2 LEU 111 1.810 0.021 11.690 827 HD22 LEU 111 1HD2 LEU 111 2.127 0.390 9.995 828 HD23 LEU 111 2HD2 LEU 111 1.093 -0.973 10.423 829 H LEU 112 H LEU 112 -0.028 4.567 13.262 830 HA LEU 112 HA LEU 112 1.963 6.494 12.625 831 HG LEU 112 HG LEU 112 -1.104 6.433 12.105 832 HB2 LEU 112 1HB LEU 112 -0.440 6.660 14.439 833 HB3 LEU 112 2HB LEU 112 0.579 8.029 14.038 834 HD11 LEU 112 1HD1 LEU 112 -1.348 9.266 13.106 835 HD12 LEU 112 2HD1 LEU 112 -2.401 7.918 13.535 836 HD13 LEU 112 3HD1 LEU 112 -2.363 8.515 11.876 837 HD21 LEU 112 3HD2 LEU 112 -0.412 8.087 10.437 838 HD22 LEU 112 1HD2 LEU 112 0.966 7.171 11.049 839 HD23 LEU 112 2HD2 LEU 112 0.679 8.817 11.614 840 H ALA 113 H ALA 113 1.365 4.462 15.354 841 HA ALA 113 HA ALA 113 2.964 5.819 17.258 842 HB1 ALA 113 3HB ALA 113 2.982 3.696 18.464 843 HB2 ALA 113 1HB ALA 113 2.345 2.873 17.040 844 HB3 ALA 113 2HB ALA 113 1.362 4.074 17.879 845 H MET 114 H MET 114 3.653 3.663 14.620 846 HA MET 114 HA MET 114 6.433 3.323 15.395 847 HB2 MET 114 1HB MET 114 4.957 2.411 12.916 848 HB3 MET 114 2HB MET 114 6.597 1.955 13.354 849 HG2 MET 114 1HG MET 114 5.796 0.792 15.308 850 HG3 MET 114 2HG MET 114 4.148 1.328 14.986 851 HE1 MET 114 3HE MET 114 3.221 -1.138 15.119 852 HE2 MET 114 1HE MET 114 4.846 -1.701 15.508 853 HE3 MET 114 2HE MET 114 3.919 -2.494 14.234 854 H GLY 115 H GLY 115 4.491 5.077 13.057 855 HA2 GLY 115 1HA GLY 115 5.393 7.322 12.496 856 HA3 GLY 115 2HA GLY 115 6.930 6.516 12.218 857 H VAL 116 H VAL 116 4.216 4.730 11.223 858 HA VAL 116 HA VAL 116 4.999 5.031 8.450 859 HB VAL 116 HB VAL 116 2.814 3.300 9.626 860 HG11 VAL 116 1HG1 VAL 116 3.039 2.014 7.553 861 HG12 VAL 116 2HG1 VAL 116 4.224 3.179 6.964 862 HG13 VAL 116 3HG1 VAL 116 2.556 3.682 7.240 863 HG21 VAL 116 3HG2 VAL 116 4.436 1.460 9.495 864 HG22 VAL 116 1HG2 VAL 116 4.956 2.720 10.615 865 HG23 VAL 116 2HG2 VAL 116 5.686 2.608 9.014 866 H GLY 117 H GLY 117 4.222 6.772 7.416 867 HA2 GLY 117 1HA GLY 117 1.631 7.888 8.065 868 HA3 GLY 117 2HA GLY 117 2.753 8.487 6.851 869 H VAL 118 H VAL 118 0.053 6.438 7.489 870 HA VAL 118 HA VAL 118 0.080 5.244 4.838 871 HB VAL 118 HB VAL 118 -1.998 4.964 7.016 872 HG11 VAL 118 1HG1 VAL 118 -2.824 4.363 4.804 873 HG12 VAL 118 2HG1 VAL 118 -2.645 2.929 5.815 874 HG13 VAL 118 3HG1 VAL 118 -1.447 3.285 4.570 875 HG21 VAL 118 3HG2 VAL 118 -0.900 2.855 7.570 876 HG22 VAL 118 1HG2 VAL 118 0.188 4.224 7.801 877 HG23 VAL 118 2HG2 VAL 118 0.357 3.194 6.379 878 H GLU 119 H GLU 119 -1.027 5.969 3.146 879 HA GLU 119 HA GLU 119 -3.247 7.850 3.606 880 HB2 GLU 119 1HB GLU 119 -1.154 7.985 1.425 881 HB3 GLU 119 2HB GLU 119 -2.598 8.987 1.484 882 HG2 GLU 119 1HG GLU 119 -1.813 9.885 3.665 883 HG3 GLU 119 2HG GLU 119 -0.318 8.976 3.447 884 H ALA 120 H ALA 120 -5.061 7.553 2.366 885 HA ALA 120 HA ALA 120 -5.142 5.024 0.876 886 HB1 ALA 120 3HB ALA 120 -6.732 5.276 2.726 887 HB2 ALA 120 1HB ALA 120 -7.560 5.123 1.176 888 HB3 ALA 120 2HB ALA 120 -7.411 6.704 1.944 889 H MET 121 H MET 121 -5.383 4.985 -1.261 890 HA MET 121 HA MET 121 -6.471 7.329 -2.654 891 HB2 MET 121 1HB MET 121 -3.873 5.960 -3.383 892 HB3 MET 121 2HB MET 121 -4.676 7.184 -4.352 893 HG2 MET 121 1HG MET 121 -4.344 8.814 -2.573 894 HG3 MET 121 2HG MET 121 -3.542 7.583 -1.597 895 HE1 MET 121 3HE MET 121 -2.225 10.381 -2.241 896 HE2 MET 121 1HE MET 121 -0.574 9.893 -2.627 897 HE3 MET 121 2HE MET 121 -1.433 9.121 -1.293 898 H ASP 122 H ASP 122 -6.358 6.631 -5.177 899 HA ASP 122 HA ASP 122 -7.659 4.022 -5.352 900 HB2 ASP 122 1HB ASP 122 -8.215 4.637 -7.654 901 HB3 ASP 122 2HB ASP 122 -8.707 5.913 -6.547 902 H THR 123 H THR 123 -6.966 2.698 -7.373 903 HA THR 123 HA THR 123 -4.394 1.762 -6.815 904 HB THR 123 HB THR 123 -5.854 1.251 -9.405 905 HG1 THR 123 HG1 THR 123 -6.359 -0.527 -7.384 906 HG21 THR 123 3HG2 THR 123 -4.074 -0.486 -7.685 907 HG22 THR 123 1HG2 THR 123 -3.612 0.279 -9.206 908 HG23 THR 123 2HG2 THR 123 -4.849 -0.977 -9.191 909 H GLN 124 H GLN 124 -5.514 4.051 -9.240 910 HA GLN 124 HA GLN 124 -3.114 3.934 -10.815 911 HB2 GLN 124 1HB GLN 124 -5.620 4.690 -11.394 912 HB3 GLN 124 2HB GLN 124 -4.959 6.266 -10.991 913 HG2 GLN 124 1HG GLN 124 -3.764 4.414 -13.036 914 HG3 GLN 124 2HG GLN 124 -4.918 5.688 -13.413 915 HE21 GLN 124 2HE2 GLN 124 -2.179 5.298 -14.311 916 HE22 GLN 124 1HE2 GLN 124 -1.317 6.729 -13.864 917 H ALA 125 H ALA 125 -4.590 6.332 -8.646 918 HA ALA 125 HA ALA 125 -2.495 8.205 -8.766 919 HB1 ALA 125 3HB ALA 125 -4.440 7.766 -6.506 920 HB2 ALA 125 1HB ALA 125 -4.752 8.729 -7.949 921 HB3 ALA 125 2HB ALA 125 -3.499 9.226 -6.812 922 H ALA 126 H ALA 126 -3.084 5.514 -6.540 923 HA ALA 126 HA ALA 126 -1.000 6.103 -4.740 924 HB1 ALA 126 3HB ALA 126 -2.185 3.410 -5.406 925 HB2 ALA 126 1HB ALA 126 -2.814 4.546 -4.212 926 HB3 ALA 126 2HB ALA 126 -1.233 3.803 -3.975 927 H ALA 127 H ALA 127 -1.101 4.008 -7.609 928 HA ALA 127 HA ALA 127 1.568 3.094 -7.359 929 HB1 ALA 127 3HB ALA 127 -0.160 3.212 -9.826 930 HB2 ALA 127 1HB ALA 127 -0.133 1.897 -8.651 931 HB3 ALA 127 2HB ALA 127 1.300 2.245 -9.618 932 H ARG 128 H ARG 128 0.110 5.858 -8.974 933 HA ARG 128 HA ARG 128 2.459 6.537 -10.452 934 HE ARG 128 HE ARG 128 1.883 9.951 -13.689 935 HB2 ARG 128 1HB ARG 128 0.021 7.208 -10.948 936 HB3 ARG 128 2HB ARG 128 0.268 8.476 -9.754 937 HG2 ARG 128 1HG ARG 128 2.088 9.392 -11.056 938 HG3 ARG 128 2HG ARG 128 1.941 8.080 -12.226 939 HD2 ARG 128 1HD ARG 128 -0.459 8.860 -12.548 940 HD3 ARG 128 2HD ARG 128 0.013 10.313 -11.667 941 HH11 ARG 128 1HH1 ARG 128 -1.525 10.681 -13.351 942 HH12 ARG 128 2HH1 ARG 128 -1.653 11.413 -14.922 943 HH21 ARG 128 1HH2 ARG 128 1.735 10.943 -15.728 944 HH22 ARG 128 2HH2 ARG 128 0.208 11.579 -16.276 945 H THR 129 H THR 129 0.975 7.777 -7.459 946 HA THR 129 HA THR 129 2.951 9.708 -6.896 947 HB THR 129 HB THR 129 1.311 8.166 -4.869 948 HG1 THR 129 HG1 THR 129 -0.198 9.056 -6.176 949 HG21 THR 129 3HG2 THR 129 2.524 10.933 -4.770 950 HG22 THR 129 1HG2 THR 129 3.117 9.517 -3.903 951 HG23 THR 129 2HG2 THR 129 1.536 10.192 -3.511 952 H TYR 130 H TYR 130 2.670 6.285 -6.167 953 HA TYR 130 HA TYR 130 4.874 5.861 -4.554 954 HD1 TYR 130 HD1 TYR 130 5.478 3.210 -3.663 955 HD2 TYR 130 HD2 TYR 130 5.056 2.918 -7.887 956 HE1 TYR 130 HE1 TYR 130 7.174 1.428 -3.708 957 HE2 TYR 130 HE2 TYR 130 6.750 1.141 -7.943 958 HH TYR 130 HH TYR 130 7.807 -0.466 -5.182 959 HB2 TYR 130 1HB TYR 130 3.419 4.048 -4.934 960 HB3 TYR 130 2HB TYR 130 3.537 4.204 -6.679 961 H ASN 131 H ASN 131 4.746 5.993 -8.111 962 HA ASN 131 HA ASN 131 7.490 5.526 -8.549 963 HB2 ASN 131 1HB ASN 131 5.452 6.993 -10.233 964 HB3 ASN 131 2HB ASN 131 7.088 6.639 -10.774 965 HD21 ASN 131 2HD2 ASN 131 7.133 4.044 -9.412 966 HD22 ASN 131 1HD2 ASN 131 6.152 2.999 -10.373 967 H ILE 132 H ILE 132 5.652 8.502 -8.080 968 HA ILE 132 HA ILE 132 7.761 10.307 -8.570 969 HB ILE 132 HB ILE 132 5.334 10.675 -6.801 970 HG12 ILE 132 1HG1 ILE 132 5.786 11.442 -9.696 971 HG13 ILE 132 2HG1 ILE 132 4.817 10.077 -9.154 972 HG21 ILE 132 1HG2 ILE 132 7.070 12.319 -6.319 973 HG22 ILE 132 2HG2 ILE 132 5.696 13.073 -7.128 974 HG23 ILE 132 3HG2 ILE 132 7.171 12.728 -8.031 975 HD11 ILE 132 3HD1 ILE 132 3.277 11.606 -8.046 976 HD12 ILE 132 1HD1 ILE 132 3.427 11.974 -9.764 977 HD13 ILE 132 2HD1 ILE 132 4.255 12.976 -8.570 978 H LEU 133 H LEU 133 6.530 8.893 -5.545 979 HA LEU 133 HA LEU 133 8.399 10.223 -3.877 980 HG LEU 133 HG LEU 133 5.360 9.691 -3.686 981 HB2 LEU 133 1HB LEU 133 6.796 7.712 -3.402 982 HB3 LEU 133 2HB LEU 133 7.713 8.555 -2.168 983 HD11 LEU 133 1HD1 LEU 133 4.693 7.962 -2.115 984 HD12 LEU 133 2HD1 LEU 133 4.203 9.554 -1.535 985 HD13 LEU 133 3HD1 LEU 133 5.609 8.752 -0.833 986 HD21 LEU 133 3HD2 LEU 133 5.516 11.551 -2.108 987 HD22 LEU 133 1HD2 LEU 133 6.982 11.409 -3.078 988 HD23 LEU 133 2HD2 LEU 133 6.971 10.840 -1.409 989 H MET 134 H MET 134 8.511 7.258 -5.708 990 HA MET 134 HA MET 134 10.839 6.157 -4.544 991 HB2 MET 134 1HB MET 134 9.388 4.858 -6.023 992 HB3 MET 134 2HB MET 134 9.777 5.920 -7.369 993 HG2 MET 134 1HG MET 134 12.105 5.192 -7.274 994 HG3 MET 134 2HG MET 134 11.717 4.132 -5.920 995 HE1 MET 134 3HE MET 134 9.976 3.563 -10.160 996 HE2 MET 134 1HE MET 134 11.093 4.864 -9.738 997 HE3 MET 134 2HE MET 134 9.463 4.844 -9.063 998 H ALA 135 H ALA 135 10.308 8.544 -7.075 999 HA ALA 135 HA ALA 135 13.063 8.818 -7.781 1000 HB1 ALA 135 3HB ALA 135 12.345 10.801 -9.008 1001 HB2 ALA 135 1HB ALA 135 10.770 10.731 -8.219 1002 HB3 ALA 135 2HB ALA 135 11.261 9.444 -9.321 1003 H GLU 136 H GLU 136 10.972 10.172 -5.368 1004 HA GLU 136 HA GLU 136 12.598 12.337 -4.548 1005 HB2 GLU 136 1HB GLU 136 10.586 10.681 -3.013 1006 HB3 GLU 136 2HB GLU 136 11.320 12.156 -2.403 1007 HG2 GLU 136 1HG GLU 136 9.726 12.059 -4.946 1008 HG3 GLU 136 2HG GLU 136 9.004 12.368 -3.368 1009 H GLY 137 H GLY 137 12.542 8.917 -3.767 1010 HA2 GLY 137 1HA GLY 137 14.451 7.713 -3.029 1011 HA3 GLY 137 2HA GLY 137 15.124 9.215 -2.408 1012 H ARG 138 H ARG 138 11.877 8.915 -1.647 1013 HA ARG 138 HA ARG 138 12.503 8.456 1.140 1014 HE ARG 138 HE ARG 138 9.777 13.016 -1.271 1015 HB2 ARG 138 1HB ARG 138 9.811 9.023 -0.108 1016 HB3 ARG 138 2HB ARG 138 10.301 9.278 1.556 1017 HG2 ARG 138 1HG ARG 138 11.848 11.022 0.851 1018 HG3 ARG 138 2HG ARG 138 11.371 10.764 -0.825 1019 HD2 ARG 138 1HD ARG 138 8.984 11.271 0.016 1020 HD3 ARG 138 2HD ARG 138 9.793 11.954 1.428 1021 HH11 ARG 138 1HH1 ARG 138 11.143 13.210 1.954 1022 HH12 ARG 138 2HH1 ARG 138 11.915 14.745 1.663 1023 HH21 ARG 138 1HH2 ARG 138 10.771 15.007 -1.653 1024 HH22 ARG 138 2HH2 ARG 138 11.696 15.778 -0.388 1025 H ARG 139 H ARG 139 11.247 6.885 2.413 1026 HA ARG 139 HA ARG 139 11.161 4.398 0.936 1027 HE ARG 139 HE ARG 139 15.182 3.951 3.758 1028 HB2 ARG 139 1HB ARG 139 10.898 4.984 3.884 1029 HB3 ARG 139 2HB ARG 139 10.796 3.366 3.200 1030 HG2 ARG 139 1HG ARG 139 13.064 3.697 2.239 1031 HG3 ARG 139 2HG ARG 139 13.156 5.228 3.106 1032 HD2 ARG 139 1HD ARG 139 12.950 4.073 5.227 1033 HD3 ARG 139 2HD ARG 139 12.747 2.530 4.393 1034 HH11 ARG 139 1HH1 ARG 139 13.711 1.606 5.917 1035 HH12 ARG 139 2HH1 ARG 139 15.227 0.826 6.282 1036 HH21 ARG 139 1HH2 ARG 139 17.142 2.912 4.239 1037 HH22 ARG 139 2HH2 ARG 139 17.153 1.562 5.337 1038 H VAL 140 H VAL 140 9.377 4.642 -0.347 1039 HA VAL 140 HA VAL 140 6.776 4.782 0.995 1040 HB VAL 140 HB VAL 140 7.039 6.422 -0.766 1041 HG11 VAL 140 1HG1 VAL 140 7.384 5.777 -3.106 1042 HG12 VAL 140 2HG1 VAL 140 7.613 4.101 -2.604 1043 HG13 VAL 140 3HG1 VAL 140 8.759 5.340 -2.091 1044 HG21 VAL 140 3HG2 VAL 140 5.219 4.182 -1.642 1045 HG22 VAL 140 1HG2 VAL 140 5.118 5.861 -2.175 1046 HG23 VAL 140 2HG2 VAL 140 4.825 5.454 -0.484 1047 H VAL 141 H VAL 141 5.476 3.076 1.085 1048 HA VAL 141 HA VAL 141 6.059 0.772 -0.663 1049 HB VAL 141 HB VAL 141 4.880 0.686 2.129 1050 HG11 VAL 141 1HG1 VAL 141 5.604 -1.550 0.238 1051 HG12 VAL 141 2HG1 VAL 141 3.974 -1.062 0.699 1052 HG13 VAL 141 3HG1 VAL 141 5.062 -1.750 1.904 1053 HG21 VAL 141 3HG2 VAL 141 7.589 -0.205 1.144 1054 HG22 VAL 141 1HG2 VAL 141 6.956 -0.435 2.773 1055 HG23 VAL 141 2HG2 VAL 141 7.266 1.194 2.169 1056 H VAL 142 H VAL 142 4.326 -0.052 -1.803 1057 HA VAL 142 HA VAL 142 1.781 1.364 -1.381 1058 HB VAL 142 HB VAL 142 2.954 2.183 -3.393 1059 HG11 VAL 142 1HG1 VAL 142 3.179 0.754 -5.358 1060 HG12 VAL 142 2HG1 VAL 142 2.622 -0.630 -4.418 1061 HG13 VAL 142 3HG1 VAL 142 4.145 0.158 -4.008 1062 HG21 VAL 142 3HG2 VAL 142 0.427 0.646 -3.980 1063 HG22 VAL 142 1HG2 VAL 142 1.077 1.972 -4.945 1064 HG23 VAL 142 2HG2 VAL 142 0.525 2.268 -3.296 1065 H ALA 143 H ALA 143 -0.014 0.205 -1.294 1066 HA ALA 143 HA ALA 143 0.126 -2.664 -1.968 1067 HB1 ALA 143 3HB ALA 143 -0.159 -2.290 0.442 1068 HB2 ALA 143 1HB ALA 143 -1.588 -3.047 -0.265 1069 HB3 ALA 143 2HB ALA 143 -1.601 -1.326 0.120 1070 H LEU 144 H LEU 144 -1.111 -3.215 -3.656 1071 HA LEU 144 HA LEU 144 -3.144 -1.262 -4.503 1072 HG LEU 144 HG LEU 144 -0.226 -1.165 -5.529 1073 HB2 LEU 144 1HB LEU 144 -1.498 -3.170 -6.156 1074 HB3 LEU 144 2HB LEU 144 -2.783 -2.163 -6.793 1075 HD11 LEU 144 1HD1 LEU 144 0.320 -0.400 -7.785 1076 HD12 LEU 144 2HD1 LEU 144 -1.151 -1.155 -8.399 1077 HD13 LEU 144 3HD1 LEU 144 0.137 -2.153 -7.724 1078 HD21 LEU 144 3HD2 LEU 144 -2.104 0.335 -5.107 1079 HD22 LEU 144 1HD2 LEU 144 -2.488 0.351 -6.828 1080 HD23 LEU 144 2HD2 LEU 144 -0.970 1.044 -6.258 1081 H LEU 145 H LEU 145 -5.157 -1.836 -4.472 1082 HA LEU 145 HA LEU 145 -5.887 -4.680 -4.394 1083 HG LEU 145 HG LEU 145 -5.809 -2.880 -1.914 1084 HB2 LEU 145 1HB LEU 145 -7.435 -2.192 -3.653 1085 HB3 LEU 145 2HB LEU 145 -8.109 -3.809 -3.636 1086 HD11 LEU 145 1HD1 LEU 145 -7.914 -1.800 -1.305 1087 HD12 LEU 145 2HD1 LEU 145 -7.416 -2.970 -0.082 1088 HD13 LEU 145 3HD1 LEU 145 -8.702 -3.376 -1.219 1089 HD21 LEU 145 3HD2 LEU 145 -5.738 -5.267 -2.443 1090 HD22 LEU 145 1HD2 LEU 145 -7.404 -5.440 -1.892 1091 HD23 LEU 145 2HD2 LEU 145 -6.138 -4.994 -0.747 1092 HA PRO 146 HA PRO 146 -7.765 -4.229 -8.404 1093 HB2 PRO 146 1HB PRO 146 -9.603 -6.378 -7.904 1094 HB3 PRO 146 2HB PRO 146 -8.095 -6.426 -8.817 1095 HG2 PRO 146 1HG PRO 146 -8.510 -7.720 -6.420 1096 HG3 PRO 146 2HG PRO 146 -6.919 -7.265 -7.055 1097 HD2 PRO 146 1HD PRO 146 -8.602 -5.901 -4.991 1098 HD3 PRO 146 2HD PRO 146 -6.838 -6.123 -5.045 1099 H ASP 147 H ASP 147 -9.959 -4.099 -9.445 1100 HA ASP 147 HA ASP 147 -11.673 -2.332 -7.986 1101 HB2 ASP 147 1HB ASP 147 -11.275 -2.105 -10.416 1102 HB3 ASP 147 2HB ASP 147 -12.076 -3.648 -10.679 1103 H GLY 148 H GLY 148 -11.674 -5.664 -8.906 1104 HA2 GLY 148 1HA GLY 148 -13.176 -6.763 -6.958 1105 HA3 GLY 148 2HA GLY 148 -14.392 -6.183 -8.096 1106 H ASP 149 H ASP 149 -13.079 -6.523 -10.450 1107 HA ASP 149 HA ASP 149 -13.214 -9.373 -10.862 1108 HB2 ASP 149 1HB ASP 149 -14.098 -7.980 -12.597 1109 HB3 ASP 149 2HB ASP 149 -12.617 -7.038 -12.686 1110 H SER 150 H SER 150 -11.530 -10.748 -11.409 1111 HA SER 150 HA SER 150 -8.808 -9.687 -11.339 1112 HG SER 150 HG SER 150 -9.682 -9.243 -9.184 1113 HB2 SER 150 1HB SER 150 -9.729 -11.944 -9.538 1114 HB3 SER 150 2HB SER 150 -8.097 -11.282 -9.639 1115 H LEU 151 H LEU 151 -7.228 -11.201 -12.173 1116 HA LEU 151 HA LEU 151 -8.227 -12.715 -14.363 1117 HG LEU 151 HG LEU 151 -4.919 -11.434 -15.413 1118 HB2 LEU 151 1HB LEU 151 -5.502 -12.272 -13.202 1119 HB3 LEU 151 2HB LEU 151 -5.740 -13.505 -14.422 1120 HD11 LEU 151 1HD1 LEU 151 -6.618 -11.163 -17.149 1121 HD12 LEU 151 2HD1 LEU 151 -7.782 -12.024 -16.142 1122 HD13 LEU 151 3HD1 LEU 151 -6.356 -12.862 -16.752 1123 HD21 LEU 151 3HD2 LEU 151 -5.826 -9.840 -13.813 1124 HD22 LEU 151 1HD2 LEU 151 -7.463 -10.196 -14.368 1125 HD23 LEU 151 2HD2 LEU 151 -6.310 -9.422 -15.457 1126 H GLU 152 H GLU 152 -7.301 -13.486 -11.100 1127 HA GLU 152 HA GLU 152 -7.467 -16.319 -11.501 1128 HB2 GLU 152 1HB GLU 152 -7.683 -14.706 -8.946 1129 HB3 GLU 152 2HB GLU 152 -7.521 -16.457 -9.039 1130 HG2 GLU 152 1HG GLU 152 -5.361 -16.023 -10.313 1131 HG3 GLU 152 2HG GLU 152 -5.510 -14.355 -9.767 1132 H HIS 153 H HIS 153 -9.258 -17.210 -12.123 1133 HA HIS 153 HA HIS 153 -11.650 -15.748 -12.361 1134 HD1 HIS 153 HD1 HIS 153 -11.606 -16.013 -15.283 1135 HD2 HIS 153 HD2 HIS 153 -9.018 -19.035 -14.070 1136 HE1 HIS 153 HE1 HIS 153 -9.784 -16.082 -17.014 1137 HE2 HIS 153 HE2 HIS 153 -8.134 -17.781 -16.155 1138 HB2 HIS 153 1HB HIS 153 -11.344 -18.741 -12.658 1139 HB3 HIS 153 2HB HIS 153 -12.554 -17.709 -13.415 1140 H HIS 154 H HIS 154 -10.607 -18.226 -10.107 1141 HA HIS 154 HA HIS 154 -13.017 -17.651 -8.523 1142 HD1 HIS 154 HD1 HIS 154 -12.672 -22.296 -8.755 1143 HD2 HIS 154 HD2 HIS 154 -14.484 -18.720 -9.873 1144 HE1 HIS 154 HE1 HIS 154 -14.654 -22.944 -10.163 1145 HE2 HIS 154 HE2 HIS 154 -15.834 -20.778 -10.673 1146 HB2 HIS 154 1HB HIS 154 -11.175 -20.044 -8.508 1147 HB3 HIS 154 2HB HIS 154 -12.323 -19.727 -7.210 1148 H HIS 155 H HIS 155 -12.658 -16.080 -7.164 1149 HA HIS 155 HA HIS 155 -10.172 -14.953 -6.632 1150 HD1 HIS 155 HD1 HIS 155 -13.786 -14.233 -7.670 1151 HD2 HIS 155 HD2 HIS 155 -10.948 -11.522 -6.290 1152 HE1 HIS 155 HE1 HIS 155 -13.991 -12.219 -9.156 1153 HE2 HIS 155 HE2 HIS 155 -12.426 -10.519 -8.162 1154 HB2 HIS 155 1HB HIS 155 -12.819 -14.683 -5.215 1155 HB3 HIS 155 2HB HIS 155 -11.405 -13.743 -4.760 1156 H HIS 156 H HIS 156 -8.600 -15.345 -5.235 1157 HA HIS 156 HA HIS 156 -8.997 -17.435 -3.225 1158 HD1 HIS 156 HD1 HIS 156 -6.295 -19.724 -3.775 1159 HD2 HIS 156 HD2 HIS 156 -7.497 -17.178 -6.836 1160 HE1 HIS 156 HE1 HIS 156 -6.279 -21.118 -5.864 1161 HE2 HIS 156 HE2 HIS 156 -6.720 -19.477 -7.725 1162 HB2 HIS 156 1HB HIS 156 -6.471 -16.149 -4.285 1163 HB3 HIS 156 2HB HIS 156 -6.505 -17.366 -3.018 1164 H HIS 157 H HIS 157 -9.049 -17.003 -1.111 1165 HA HIS 157 HA HIS 157 -7.882 -14.453 -0.178 1166 HD1 HIS 157 HD1 HIS 157 -10.851 -12.715 1.432 1167 HD2 HIS 157 HD2 HIS 157 -7.957 -14.979 3.390 1168 HE1 HIS 157 HE1 HIS 157 -10.244 -11.411 3.489 1169 HE2 HIS 157 HE2 HIS 157 -8.493 -12.787 4.661 1170 HB2 HIS 157 1HB HIS 157 -10.384 -14.823 0.241 1171 HB3 HIS 157 2HB HIS 157 -9.912 -16.125 1.326 1172 H HIS 158 H HIS 158 -8.288 -17.881 0.269 1173 HA HIS 158 HA HIS 158 -5.589 -18.327 0.904 1174 HD1 HIS 158 HD1 HIS 158 -4.048 -18.004 4.074 1175 HD2 HIS 158 HD2 HIS 158 -6.295 -21.411 3.273 1176 HE1 HIS 158 HE1 HIS 158 -2.681 -19.938 4.925 1177 HE2 HIS 158 HE2 HIS 158 -3.959 -21.989 4.202 1178 HB2 HIS 158 1HB HIS 158 -6.293 -17.459 3.139 1179 HB3 HIS 158 2HB HIS 158 -7.505 -18.732 3.225 Start of MODEL 4 1 HA MET 1 HA MET 1 22.695 -17.835 -19.454 2 H1 MET 1 1H MET 1 20.133 -18.851 -18.368 3 H2 MET 1 2H MET 1 21.290 -17.922 -17.544 4 H3 MET 1 3H MET 1 21.659 -19.505 -18.022 5 HB2 MET 1 1HB MET 1 20.548 -19.535 -20.738 6 HB3 MET 1 2HB MET 1 21.848 -18.750 -21.621 7 HG2 MET 1 1HG MET 1 23.489 -20.069 -20.410 8 HG3 MET 1 2HG MET 1 22.202 -20.834 -19.480 9 HE1 MET 1 3HE MET 1 20.369 -22.424 -20.529 10 HE2 MET 1 1HE MET 1 20.287 -22.843 -22.240 11 HE3 MET 1 2HE MET 1 19.944 -21.194 -21.719 12 H LYS 2 H LYS 2 22.282 -15.682 -19.285 13 HA LYS 2 HA LYS 2 20.117 -14.672 -20.972 14 HB2 LYS 2 1HB LYS 2 20.555 -13.787 -18.110 15 HB3 LYS 2 2HB LYS 2 19.548 -12.930 -19.268 16 HG2 LYS 2 1HG LYS 2 18.163 -14.994 -19.477 17 HG3 LYS 2 2HG LYS 2 19.109 -15.692 -18.162 18 HD2 LYS 2 1HD LYS 2 18.405 -13.877 -16.685 19 HD3 LYS 2 2HD LYS 2 17.481 -13.156 -18.005 20 HE2 LYS 2 1HE LYS 2 17.005 -15.853 -16.743 21 HE3 LYS 2 2HE LYS 2 16.014 -14.411 -16.537 22 HZ1 LYS 2 3HZ LYS 2 15.004 -15.874 -18.137 23 HZ2 LYS 2 1HZ LYS 2 16.422 -15.921 -19.068 24 HZ3 LYS 2 2HZ LYS 2 15.540 -14.477 -18.936 25 H LEU 3 H LEU 3 20.526 -12.605 -21.834 26 HA LEU 3 HA LEU 3 23.278 -11.910 -22.095 27 HG LEU 3 HG LEU 3 20.921 -12.500 -24.132 28 HB2 LEU 3 1HB LEU 3 20.804 -10.383 -22.916 29 HB3 LEU 3 2HB LEU 3 22.442 -9.992 -23.407 30 HD11 LEU 3 1HD1 LEU 3 20.155 -10.514 -25.317 31 HD12 LEU 3 2HD1 LEU 3 21.011 -11.611 -26.399 32 HD13 LEU 3 3HD1 LEU 3 21.812 -10.156 -25.804 33 HD21 LEU 3 3HD2 LEU 3 22.844 -13.026 -25.548 34 HD22 LEU 3 1HD2 LEU 3 23.300 -12.966 -23.844 35 HD23 LEU 3 2HD2 LEU 3 23.700 -11.621 -24.913 36 H HIS 4 H HIS 4 20.729 -11.004 -19.994 37 HA HIS 4 HA HIS 4 22.580 -9.207 -18.589 38 HD1 HIS 4 HD1 HIS 4 19.637 -7.959 -21.293 39 HD2 HIS 4 HD2 HIS 4 22.372 -6.125 -18.753 40 HE1 HIS 4 HE1 HIS 4 20.519 -5.968 -22.562 41 HE2 HIS 4 HE2 HIS 4 22.272 -4.952 -21.055 42 HB2 HIS 4 1HB HIS 4 19.596 -8.897 -18.956 43 HB3 HIS 4 2HB HIS 4 20.499 -8.033 -17.717 44 H THR 5 H THR 5 23.293 -10.515 -17.012 45 HA THR 5 HA THR 5 21.474 -12.348 -15.692 46 HB THR 5 HB THR 5 23.613 -12.923 -14.376 47 HG1 THR 5 HG1 THR 5 25.254 -12.124 -16.355 48 HG21 THR 5 3HG2 THR 5 22.702 -14.335 -16.154 49 HG22 THR 5 1HG2 THR 5 24.464 -14.307 -16.218 50 HG23 THR 5 2HG2 THR 5 23.526 -13.352 -17.366 51 H ASP 6 H ASP 6 20.620 -12.079 -13.723 52 HA ASP 6 HA ASP 6 19.767 -10.954 -11.955 53 HB2 ASP 6 1HB ASP 6 22.660 -10.126 -11.722 54 HB3 ASP 6 2HB ASP 6 21.445 -9.642 -10.544 55 HA PRO 7 HA PRO 7 19.502 -6.954 -14.270 56 HB2 PRO 7 1HB PRO 7 17.206 -7.305 -15.591 57 HB3 PRO 7 2HB PRO 7 18.716 -8.004 -16.188 58 HG2 PRO 7 1HG PRO 7 16.443 -9.319 -14.779 59 HG3 PRO 7 2HG PRO 7 17.483 -9.949 -16.068 60 HD2 PRO 7 1HD PRO 7 17.744 -10.467 -13.323 61 HD3 PRO 7 2HD PRO 7 18.964 -10.791 -14.567 62 H ALA 8 H ALA 8 18.013 -8.448 -11.781 63 HA ALA 8 HA ALA 8 15.727 -6.732 -11.455 64 HB1 ALA 8 3HB ALA 8 16.990 -8.652 -9.499 65 HB2 ALA 8 1HB ALA 8 15.687 -9.036 -10.625 66 HB3 ALA 8 2HB ALA 8 15.416 -7.874 -9.325 67 H THR 9 H THR 9 16.585 -4.654 -11.452 68 HA THR 9 HA THR 9 18.555 -3.802 -9.578 69 HB THR 9 HB THR 9 17.649 -1.491 -10.170 70 HG1 THR 9 HG1 THR 9 15.574 -2.699 -10.934 71 HG21 THR 9 3HG2 THR 9 19.594 -2.461 -11.291 72 HG22 THR 9 1HG2 THR 9 18.612 -1.537 -12.427 73 HG23 THR 9 2HG2 THR 9 18.533 -3.299 -12.424 74 H ALA 10 H ALA 10 18.158 -2.332 -7.780 75 HA ALA 10 HA ALA 10 16.058 -3.350 -6.105 76 HB1 ALA 10 3HB ALA 10 18.298 -2.893 -5.235 77 HB2 ALA 10 1HB ALA 10 17.064 -1.978 -4.366 78 HB3 ALA 10 2HB ALA 10 18.076 -1.174 -5.567 79 H LEU 11 H LEU 11 14.798 -2.159 -8.182 80 HA LEU 11 HA LEU 11 13.294 -0.094 -6.799 81 HG LEU 11 HG LEU 11 15.833 1.220 -7.531 82 HB2 LEU 11 1HB LEU 11 14.589 0.320 -9.487 83 HB3 LEU 11 2HB LEU 11 13.183 1.236 -8.982 84 HD11 LEU 11 1HD1 LEU 11 14.620 3.283 -9.361 85 HD12 LEU 11 2HD1 LEU 11 16.028 2.281 -9.709 86 HD13 LEU 11 3HD1 LEU 11 16.098 3.482 -8.421 87 HD21 LEU 11 3HD2 LEU 11 14.896 3.123 -6.312 88 HD22 LEU 11 1HD2 LEU 11 13.937 1.664 -6.065 89 HD23 LEU 11 2HD2 LEU 11 13.366 2.919 -7.166 90 H ASN 12 H ASN 12 11.860 -1.938 -6.669 91 HA ASN 12 HA ASN 12 10.745 -3.147 -8.959 92 HB2 ASN 12 1HB ASN 12 9.652 -2.837 -6.160 93 HB3 ASN 12 2HB ASN 12 8.822 -3.744 -7.420 94 HD21 ASN 12 2HD2 ASN 12 11.355 -3.732 -5.123 95 HD22 ASN 12 1HD2 ASN 12 11.911 -5.343 -5.398 96 H THR 13 H THR 13 9.968 -1.903 -10.508 97 HA THR 13 HA THR 13 8.044 0.212 -9.811 98 HB THR 13 HB THR 13 9.439 -0.092 -12.471 99 HG1 THR 13 HG1 THR 13 10.751 0.249 -10.312 100 HG21 THR 13 3HG2 THR 13 8.248 2.300 -11.056 101 HG22 THR 13 1HG2 THR 13 7.501 1.414 -12.386 102 HG23 THR 13 2HG2 THR 13 8.996 2.310 -12.654 103 H VAL 14 H VAL 14 6.038 0.242 -10.858 104 HA VAL 14 HA VAL 14 5.001 -2.238 -11.774 105 HB VAL 14 HB VAL 14 3.792 0.517 -12.107 106 HG11 VAL 14 1HG1 VAL 14 1.658 -0.687 -12.236 107 HG12 VAL 14 2HG1 VAL 14 2.526 -2.220 -12.152 108 HG13 VAL 14 3HG1 VAL 14 2.753 -1.153 -13.537 109 HG21 VAL 14 3HG2 VAL 14 2.545 0.031 -10.054 110 HG22 VAL 14 1HG2 VAL 14 4.283 0.073 -9.763 111 HG23 VAL 14 2HG2 VAL 14 3.442 -1.475 -9.866 112 H THR 15 H THR 15 5.573 -3.107 -13.656 113 HA THR 15 HA THR 15 6.720 -1.571 -15.757 114 HB THR 15 HB THR 15 6.016 -4.140 -16.719 115 HG1 THR 15 HG1 THR 15 5.969 -5.333 -14.976 116 HG21 THR 15 3HG2 THR 15 8.613 -3.101 -15.575 117 HG22 THR 15 1HG2 THR 15 8.068 -2.911 -17.242 118 HG23 THR 15 2HG2 THR 15 8.435 -4.516 -16.612 119 H ALA 16 H ALA 16 3.614 -3.270 -15.359 120 HA ALA 16 HA ALA 16 2.551 -1.585 -17.507 121 HB1 ALA 16 3HB ALA 16 1.414 -3.452 -18.564 122 HB2 ALA 16 1HB ALA 16 2.125 -4.566 -17.399 123 HB3 ALA 16 2HB ALA 16 3.157 -3.719 -18.548 124 H TYR 17 H TYR 17 0.935 -0.495 -16.673 125 HA TYR 17 HA TYR 17 -1.090 -1.952 -15.147 126 HD1 TYR 17 HD2 TYR 17 -1.981 -1.747 -12.527 127 HD2 TYR 17 HD1 TYR 17 -1.758 2.198 -14.112 128 HE1 TYR 17 HE2 TYR 17 -4.076 -1.169 -11.374 129 HE2 TYR 17 HE1 TYR 17 -3.851 2.783 -12.967 130 HH TYR 17 HH TYR 17 -5.886 1.531 -12.114 131 HB2 TYR 17 1HB TYR 17 0.173 -0.751 -13.454 132 HB3 TYR 17 2HB TYR 17 0.067 0.742 -14.383 133 H GLY 18 H GLY 18 -3.155 -1.383 -15.583 134 HA2 GLY 18 1HA GLY 18 -3.720 1.057 -17.060 135 HA3 GLY 18 2HA GLY 18 -4.098 -0.453 -17.884 136 H ASP 19 H ASP 19 -5.771 -1.739 -17.139 137 HA ASP 19 HA ASP 19 -7.239 -0.859 -14.782 138 HB2 ASP 19 1HB ASP 19 -8.245 0.297 -16.768 139 HB3 ASP 19 2HB ASP 19 -8.617 -1.288 -17.443 140 H GLY 20 H GLY 20 -8.175 -2.526 -13.686 141 HA2 GLY 20 1HA GLY 20 -9.094 -4.737 -13.553 142 HA3 GLY 20 2HA GLY 20 -8.153 -5.171 -14.973 143 H TYR 21 H TYR 21 -5.941 -5.649 -14.744 144 HA TYR 21 HA TYR 21 -5.197 -6.330 -11.977 145 HD1 TYR 21 HD1 TYR 21 -6.169 -7.893 -15.755 146 HD2 TYR 21 HD2 TYR 21 -2.117 -7.783 -14.469 147 HE1 TYR 21 HE1 TYR 21 -5.428 -8.062 -18.093 148 HE2 TYR 21 HE2 TYR 21 -1.362 -7.949 -16.803 149 HH TYR 21 HH TYR 21 -3.470 -7.538 -19.448 150 HB2 TYR 21 1HB TYR 21 -3.892 -8.184 -12.889 151 HB3 TYR 21 2HB TYR 21 -5.569 -8.298 -13.409 152 H ILE 22 H ILE 22 -2.651 -6.763 -11.949 153 HA ILE 22 HA ILE 22 -1.362 -4.385 -13.119 154 HB ILE 22 HB ILE 22 -0.936 -5.385 -10.296 155 HG12 ILE 22 1HG1 ILE 22 -2.383 -2.892 -11.217 156 HG13 ILE 22 2HG1 ILE 22 -3.186 -4.360 -10.666 157 HG21 ILE 22 1HG2 ILE 22 0.306 -3.286 -10.004 158 HG22 ILE 22 2HG2 ILE 22 0.069 -2.918 -11.713 159 HG23 ILE 22 3HG2 ILE 22 1.033 -4.317 -11.237 160 HD11 ILE 22 3HD1 ILE 22 -2.142 -4.094 -8.473 161 HD12 ILE 22 1HD1 ILE 22 -3.118 -2.694 -8.914 162 HD13 ILE 22 2HD1 ILE 22 -1.360 -2.616 -9.031 163 H GLU 23 H GLU 23 0.655 -4.726 -13.946 164 HA GLU 23 HA GLU 23 1.853 -7.378 -13.495 165 HB2 GLU 23 1HB GLU 23 1.054 -6.949 -15.817 166 HB3 GLU 23 2HB GLU 23 2.156 -5.589 -15.914 167 HG2 GLU 23 1HG GLU 23 3.262 -8.262 -15.240 168 HG3 GLU 23 2HG GLU 23 2.770 -7.946 -16.901 169 H VAL 24 H VAL 24 3.661 -7.361 -12.368 170 HA VAL 24 HA VAL 24 5.422 -5.012 -12.525 171 HB VAL 24 HB VAL 24 4.794 -6.541 -9.987 172 HG11 VAL 24 1HG1 VAL 24 6.578 -4.153 -10.452 173 HG12 VAL 24 2HG1 VAL 24 7.105 -5.787 -10.051 174 HG13 VAL 24 3HG1 VAL 24 6.181 -4.847 -8.880 175 HG21 VAL 24 3HG2 VAL 24 3.794 -4.439 -9.205 176 HG22 VAL 24 1HG2 VAL 24 2.948 -5.086 -10.611 177 HG23 VAL 24 2HG2 VAL 24 4.059 -3.729 -10.796 178 H ASN 25 H ASN 25 7.269 -5.619 -13.368 179 HA ASN 25 HA ASN 25 9.214 -6.713 -13.768 180 HB2 ASN 25 1HB ASN 25 9.143 -6.812 -11.181 181 HB3 ASN 25 2HB ASN 25 8.699 -8.500 -11.399 182 HD21 ASN 25 2HD2 ASN 25 11.051 -7.372 -10.151 183 HD22 ASN 25 1HD2 ASN 25 12.410 -7.998 -11.016 184 H GLN 26 H GLN 26 7.087 -7.478 -15.223 185 HA GLN 26 HA GLN 26 6.645 -8.957 -16.866 186 HB2 GLN 26 1HB GLN 26 8.982 -10.492 -15.728 187 HB3 GLN 26 2HB GLN 26 8.148 -10.911 -17.219 188 HG2 GLN 26 1HG GLN 26 8.718 -8.561 -18.007 189 HG3 GLN 26 2HG GLN 26 9.817 -8.490 -16.631 190 HE21 GLN 26 2HE2 GLN 26 10.372 -8.393 -19.478 191 HE22 GLN 26 1HE2 GLN 26 11.458 -9.700 -19.817 192 H VAL 27 H VAL 27 5.657 -9.239 -13.988 193 HA VAL 27 HA VAL 27 4.391 -11.852 -14.453 194 HB VAL 27 HB VAL 27 5.210 -10.758 -11.750 195 HG11 VAL 27 1HG1 VAL 27 4.329 -12.860 -10.847 196 HG12 VAL 27 2HG1 VAL 27 3.757 -13.309 -12.453 197 HG13 VAL 27 3HG1 VAL 27 3.065 -11.910 -11.631 198 HG21 VAL 27 3HG2 VAL 27 7.084 -11.700 -13.009 199 HG22 VAL 27 1HG2 VAL 27 6.173 -13.190 -13.258 200 HG23 VAL 27 2HG2 VAL 27 6.665 -12.719 -11.632 201 H ARG 28 H ARG 28 2.288 -11.666 -14.713 202 HA ARG 28 HA ARG 28 0.969 -9.176 -13.986 203 HE ARG 28 HE ARG 28 -0.940 -12.212 -17.279 204 HB2 ARG 28 1HB ARG 28 -0.139 -11.587 -15.444 205 HB3 ARG 28 2HB ARG 28 -0.898 -10.006 -15.315 206 HG2 ARG 28 1HG ARG 28 0.921 -9.018 -16.602 207 HG3 ARG 28 2HG ARG 28 1.701 -10.596 -16.714 208 HD2 ARG 28 1HD ARG 28 -0.988 -9.837 -17.852 209 HD3 ARG 28 2HD ARG 28 0.499 -10.100 -18.762 210 HH11 ARG 28 1HH1 ARG 28 1.052 -11.135 -19.957 211 HH12 ARG 28 2HH1 ARG 28 1.086 -12.695 -20.723 212 HH21 ARG 28 1HH2 ARG 28 -0.906 -14.264 -18.309 213 HH22 ARG 28 2HH2 ARG 28 -0.043 -14.457 -19.808 214 H PHE 29 H PHE 29 0.177 -9.002 -12.012 215 HA PHE 29 HA PHE 29 -0.431 -11.409 -10.490 216 HD1 PHE 29 HD2 PHE 29 1.180 -11.562 -8.173 217 HD2 PHE 29 HD1 PHE 29 1.927 -7.974 -10.334 218 HE1 PHE 29 HE2 PHE 29 3.597 -11.872 -7.845 219 HE2 PHE 29 HE1 PHE 29 4.347 -8.278 -10.009 220 HZ PHE 29 HZ PHE 29 5.183 -10.228 -8.763 221 HB2 PHE 29 1HB PHE 29 -0.269 -8.510 -9.646 222 HB3 PHE 29 2HB PHE 29 -0.586 -9.856 -8.557 223 H SER 30 H SER 30 -2.415 -12.190 -10.624 224 HA SER 30 HA SER 30 -4.691 -10.402 -10.985 225 HG SER 30 HG SER 30 -3.479 -12.920 -12.564 226 HB2 SER 30 1HB SER 30 -4.644 -13.422 -10.760 227 HB3 SER 30 2HB SER 30 -5.979 -12.425 -11.339 228 H HIS 31 H HIS 31 -3.124 -10.393 -8.521 229 HA HIS 31 HA HIS 31 -5.329 -10.560 -6.670 230 HD1 HIS 31 HD1 HIS 31 -1.553 -10.839 -4.897 231 HD2 HIS 31 HD2 HIS 31 -2.244 -14.133 -7.345 232 HE1 HIS 31 HE1 HIS 31 0.702 -11.866 -5.311 233 HE2 HIS 31 HE2 HIS 31 0.213 -14.007 -6.539 234 HB2 HIS 31 1HB HIS 31 -4.122 -11.893 -4.984 235 HB3 HIS 31 2HB HIS 31 -4.429 -12.826 -6.441 236 H ALA 32 H ALA 32 -4.601 -9.685 -4.476 237 HA ALA 32 HA ALA 32 -3.437 -7.156 -4.902 238 HB1 ALA 32 3HB ALA 32 -3.927 -8.582 -2.293 239 HB2 ALA 32 1HB ALA 32 -5.099 -7.592 -3.159 240 HB3 ALA 32 2HB ALA 32 -3.639 -6.855 -2.497 241 H ILE 33 H ILE 33 -1.498 -6.281 -4.188 242 HA ILE 33 HA ILE 33 0.593 -8.130 -3.312 243 HB ILE 33 HB ILE 33 2.178 -7.047 -4.964 244 HG12 ILE 33 1HG1 ILE 33 -0.421 -6.280 -6.318 245 HG13 ILE 33 2HG1 ILE 33 0.722 -5.156 -5.592 246 HG21 ILE 33 1HG2 ILE 33 1.425 -9.339 -5.196 247 HG22 ILE 33 2HG2 ILE 33 1.568 -8.573 -6.778 248 HG23 ILE 33 3HG2 ILE 33 -0.021 -8.798 -6.048 249 HD11 ILE 33 3HD1 ILE 33 0.948 -5.200 -8.003 250 HD12 ILE 33 1HD1 ILE 33 1.251 -6.936 -7.960 251 HD13 ILE 33 2HD1 ILE 33 2.407 -5.821 -7.232 252 H ALA 34 H ALA 34 2.191 -7.213 -2.111 253 HA ALA 34 HA ALA 34 2.175 -4.291 -1.770 254 HB1 ALA 34 3HB ALA 34 2.375 -6.321 0.458 255 HB2 ALA 34 1HB ALA 34 0.998 -5.268 0.138 256 HB3 ALA 34 2HB ALA 34 2.540 -4.575 0.639 257 H PHE 35 H PHE 35 4.159 -3.465 -2.119 258 HA PHE 35 HA PHE 35 6.510 -5.012 -1.450 259 HD1 PHE 35 HD1 PHE 35 3.889 -5.052 -4.613 260 HD2 PHE 35 HD2 PHE 35 7.604 -3.028 -5.101 261 HE1 PHE 35 HE1 PHE 35 2.949 -3.785 -6.500 262 HE2 PHE 35 HE2 PHE 35 6.666 -1.758 -6.986 263 HZ PHE 35 HZ PHE 35 4.336 -2.134 -7.687 264 HB2 PHE 35 1HB PHE 35 7.462 -4.950 -3.721 265 HB3 PHE 35 2HB PHE 35 5.998 -5.919 -3.641 266 H ALA 36 H ALA 36 8.512 -3.860 -1.828 267 HA ALA 36 HA ALA 36 8.176 -0.932 -1.795 268 HB1 ALA 36 3HB ALA 36 10.043 -0.821 -0.218 269 HB2 ALA 36 1HB ALA 36 10.164 -2.580 -0.227 270 HB3 ALA 36 2HB ALA 36 8.727 -1.800 0.432 271 HA PRO 37 HA PRO 37 10.895 -0.563 -5.216 272 HB2 PRO 37 1HB PRO 37 12.764 1.277 -4.246 273 HB3 PRO 37 2HB PRO 37 11.236 1.673 -5.035 274 HG2 PRO 37 1HG PRO 37 11.907 1.577 -2.133 275 HG3 PRO 37 2HG PRO 37 10.826 2.682 -3.002 276 HD2 PRO 37 1HD PRO 37 9.870 0.680 -1.499 277 HD3 PRO 37 2HD PRO 37 9.078 1.158 -3.017 278 H GLU 38 H GLU 38 12.916 -0.325 -2.293 279 HA GLU 38 HA GLU 38 14.863 -2.138 -3.502 280 HB2 GLU 38 1HB GLU 38 14.983 -0.415 -1.018 281 HB3 GLU 38 2HB GLU 38 16.286 -1.466 -1.557 282 HG2 GLU 38 1HG GLU 38 16.511 -0.188 -3.601 283 HG3 GLU 38 2HG GLU 38 15.153 0.832 -3.134 284 H GLY 39 H GLY 39 12.255 -3.061 -2.504 285 HA2 GLY 39 1HA GLY 39 13.219 -4.892 -0.399 286 HA3 GLY 39 2HA GLY 39 11.626 -4.153 -0.313 287 HA PRO 40 HA PRO 40 11.203 -8.118 -2.668 288 HB2 PRO 40 1HB PRO 40 9.899 -9.609 -0.879 289 HB3 PRO 40 2HB PRO 40 11.651 -9.396 -0.780 290 HG2 PRO 40 1HG PRO 40 9.489 -8.100 0.816 291 HG3 PRO 40 2HG PRO 40 11.088 -8.656 1.337 292 HD2 PRO 40 1HD PRO 40 10.402 -6.023 0.709 293 HD3 PRO 40 2HD PRO 40 12.053 -6.663 0.810 294 H VAL 41 H VAL 41 9.142 -9.300 -3.222 295 HA VAL 41 HA VAL 41 6.852 -7.447 -3.144 296 HB VAL 41 HB VAL 41 7.372 -9.677 -5.124 297 HG11 VAL 41 1HG1 VAL 41 4.998 -9.216 -4.794 298 HG12 VAL 41 2HG1 VAL 41 5.526 -8.688 -6.391 299 HG13 VAL 41 3HG1 VAL 41 5.278 -7.504 -5.109 300 HG21 VAL 41 3HG2 VAL 41 7.837 -7.897 -6.741 301 HG22 VAL 41 1HG2 VAL 41 8.988 -7.876 -5.406 302 HG23 VAL 41 2HG2 VAL 41 7.679 -6.694 -5.461 303 H ALA 42 H ALA 42 5.344 -8.020 -1.717 304 HA ALA 42 HA ALA 42 5.092 -10.870 -1.030 305 HB1 ALA 42 3HB ALA 42 4.120 -10.138 1.075 306 HB2 ALA 42 1HB ALA 42 4.225 -8.455 0.555 307 HB3 ALA 42 2HB ALA 42 5.696 -9.389 0.825 308 H SER 43 H SER 43 3.262 -11.931 -1.412 309 HA SER 43 HA SER 43 1.117 -10.674 -2.827 310 HG SER 43 HG SER 43 2.880 -12.884 -3.382 311 HB2 SER 43 1HB SER 43 1.385 -13.468 -1.687 312 HB3 SER 43 2HB SER 43 0.096 -12.935 -2.768 313 H TRP 44 H TRP 44 -0.628 -9.736 -1.983 314 HA TRP 44 HA TRP 44 -1.033 -9.940 0.913 315 HD1 TRP 44 HD1 TRP 44 -0.633 -8.621 2.531 316 HE1 TRP 44 HE1 TRP 44 -1.571 -7.024 4.323 317 HE3 TRP 44 HE3 TRP 44 -3.756 -5.841 -0.414 318 HZ2 TRP 44 HZ2 TRP 44 -3.388 -4.875 4.464 319 HZ3 TRP 44 HZ3 TRP 44 -5.052 -4.027 0.630 320 HH2 TRP 44 HH2 TRP 44 -4.871 -3.556 3.016 321 HB2 TRP 44 1HB TRP 44 -0.792 -7.725 -0.560 322 HB3 TRP 44 2HB TRP 44 -2.520 -7.975 -0.774 323 HA PRO 45 HA PRO 45 -4.500 -12.513 -0.069 324 HB2 PRO 45 1HB PRO 45 -5.116 -12.792 2.696 325 HB3 PRO 45 2HB PRO 45 -4.184 -13.892 1.683 326 HG2 PRO 45 1HG PRO 45 -3.170 -12.401 3.795 327 HG3 PRO 45 2HG PRO 45 -2.209 -13.137 2.502 328 HD2 PRO 45 1HD PRO 45 -3.110 -10.312 2.826 329 HD3 PRO 45 2HD PRO 45 -1.594 -10.948 2.153 330 H VAL 46 H VAL 46 -4.771 -9.415 0.836 331 HA VAL 46 HA VAL 46 -7.575 -9.506 1.638 332 HB VAL 46 HB VAL 46 -5.793 -7.095 1.226 333 HG11 VAL 46 1HG1 VAL 46 -7.489 -5.902 2.535 334 HG12 VAL 46 2HG1 VAL 46 -8.475 -7.363 2.581 335 HG13 VAL 46 3HG1 VAL 46 -8.161 -6.558 1.044 336 HG21 VAL 46 3HG2 VAL 46 -4.939 -8.515 3.007 337 HG22 VAL 46 1HG2 VAL 46 -6.531 -8.546 3.764 338 HG23 VAL 46 2HG2 VAL 46 -5.629 -7.034 3.670 339 H GLN 47 H GLN 47 -9.239 -8.957 0.309 340 HA GLN 47 HA GLN 47 -8.527 -8.252 -2.459 341 HB2 GLN 47 1HB GLN 47 -10.752 -10.058 -1.496 342 HB3 GLN 47 2HB GLN 47 -10.507 -9.571 -3.168 343 HG2 GLN 47 1HG GLN 47 -8.376 -10.703 -3.223 344 HG3 GLN 47 2HG GLN 47 -8.522 -11.116 -1.516 345 HE21 GLN 47 2HE2 GLN 47 -8.218 -12.837 -3.845 346 HE22 GLN 47 1HE2 GLN 47 -9.560 -13.925 -3.816 347 H ARG 48 H ARG 48 -11.102 -8.081 -0.010 348 HA ARG 48 HA ARG 48 -12.403 -5.983 -1.561 349 HE ARG 48 HE ARG 48 -16.004 -10.705 -0.387 350 HB2 ARG 48 1HB ARG 48 -13.389 -7.170 1.031 351 HB3 ARG 48 2HB ARG 48 -14.320 -6.316 -0.193 352 HG2 ARG 48 1HG ARG 48 -13.671 -8.250 -1.750 353 HG3 ARG 48 2HG ARG 48 -13.219 -9.099 -0.272 354 HD2 ARG 48 1HD ARG 48 -15.502 -8.720 0.597 355 HD3 ARG 48 2HD ARG 48 -15.936 -7.969 -0.936 356 HH11 ARG 48 1HH1 ARG 48 -14.763 -8.592 -2.892 357 HH12 ARG 48 2HH1 ARG 48 -14.843 -9.798 -4.139 358 HH21 ARG 48 1HH2 ARG 48 -16.190 -12.275 -2.053 359 HH22 ARG 48 2HH2 ARG 48 -15.704 -11.866 -3.674 360 HA PRO 49 HA PRO 49 -10.617 -2.739 0.835 361 HB2 PRO 49 1HB PRO 49 -13.041 -1.172 0.250 362 HB3 PRO 49 2HB PRO 49 -11.369 -0.876 -0.235 363 HG2 PRO 49 1HG PRO 49 -13.225 -1.673 -2.001 364 HG3 PRO 49 2HG PRO 49 -11.537 -2.206 -2.114 365 HD2 PRO 49 1HD PRO 49 -13.922 -3.677 -1.045 366 HD3 PRO 49 2HD PRO 49 -12.600 -4.272 -2.072 367 H ALA 50 H ALA 50 -13.604 -4.183 1.580 368 HA ALA 50 HA ALA 50 -13.915 -2.716 4.085 369 HB1 ALA 50 3HB ALA 50 -15.923 -3.179 2.754 370 HB2 ALA 50 1HB ALA 50 -15.997 -3.950 4.338 371 HB3 ALA 50 2HB ALA 50 -15.620 -4.909 2.906 372 H ASP 51 H ASP 51 -11.959 -5.079 3.103 373 HA ASP 51 HA ASP 51 -12.234 -6.674 5.566 374 HB2 ASP 51 1HB ASP 51 -11.033 -7.313 2.876 375 HB3 ASP 51 2HB ASP 51 -10.663 -8.275 4.304 376 H ILE 52 H ILE 52 -10.605 -4.096 4.496 377 HA ILE 52 HA ILE 52 -7.898 -4.801 5.118 378 HB ILE 52 HB ILE 52 -9.133 -2.053 4.839 379 HG12 ILE 52 1HG1 ILE 52 -7.663 -3.745 2.802 380 HG13 ILE 52 2HG1 ILE 52 -9.399 -3.454 2.817 381 HG21 ILE 52 1HG2 ILE 52 -6.832 -1.303 4.421 382 HG22 ILE 52 2HG2 ILE 52 -6.252 -2.936 4.747 383 HG23 ILE 52 3HG2 ILE 52 -7.015 -2.000 6.032 384 HD11 ILE 52 3HD1 ILE 52 -8.277 -2.060 1.175 385 HD12 ILE 52 1HD1 ILE 52 -7.266 -1.364 2.442 386 HD13 ILE 52 2HD1 ILE 52 -9.006 -1.077 2.446 387 H THR 53 H THR 53 -6.935 -4.809 7.040 388 HA THR 53 HA THR 53 -8.139 -3.324 9.269 389 HB THR 53 HB THR 53 -7.152 -6.179 9.526 390 HG1 THR 53 HG1 THR 53 -9.127 -5.945 8.246 391 HG21 THR 53 3HG2 THR 53 -7.053 -4.862 11.593 392 HG22 THR 53 1HG2 THR 53 -8.301 -6.106 11.695 393 HG23 THR 53 2HG2 THR 53 -8.751 -4.427 11.400 394 H ALA 54 H ALA 54 -6.599 -2.963 11.046 395 HA ALA 54 HA ALA 54 -4.268 -1.783 10.189 396 HB1 ALA 54 3HB ALA 54 -4.841 -2.822 12.959 397 HB2 ALA 54 1HB ALA 54 -5.374 -1.272 12.306 398 HB3 ALA 54 2HB ALA 54 -3.653 -1.590 12.532 399 H SER 55 H SER 55 -4.548 -4.964 11.789 400 HA SER 55 HA SER 55 -1.843 -5.576 11.925 401 HG SER 55 HG SER 55 -3.490 -7.280 14.024 402 HB2 SER 55 1HB SER 55 -4.069 -7.567 11.454 403 HB3 SER 55 2HB SER 55 -2.529 -7.855 12.266 404 H LEU 56 H LEU 56 -4.125 -6.003 9.280 405 HA LEU 56 HA LEU 56 -2.461 -7.601 7.636 406 HG LEU 56 HG LEU 56 -5.454 -7.524 8.438 407 HB2 LEU 56 1HB LEU 56 -4.718 -5.752 6.853 408 HB3 LEU 56 2HB LEU 56 -4.019 -6.999 5.835 409 HD11 LEU 56 1HD1 LEU 56 -6.983 -6.639 6.758 410 HD12 LEU 56 2HD1 LEU 56 -7.279 -8.356 7.037 411 HD13 LEU 56 3HD1 LEU 56 -6.409 -7.835 5.595 412 HD21 LEU 56 3HD2 LEU 56 -3.800 -9.222 7.890 413 HD22 LEU 56 1HD2 LEU 56 -4.479 -9.381 6.270 414 HD23 LEU 56 2HD2 LEU 56 -5.432 -9.854 7.677 415 H LEU 57 H LEU 57 -2.869 -4.154 8.062 416 HA LEU 57 HA LEU 57 -1.238 -3.395 5.839 417 HG LEU 57 HG LEU 57 -3.998 -2.447 6.787 418 HB2 LEU 57 1HB LEU 57 -2.116 -1.852 8.279 419 HB3 LEU 57 2HB LEU 57 -1.273 -1.150 6.913 420 HD11 LEU 57 1HD1 LEU 57 -4.043 -0.358 8.040 421 HD12 LEU 57 2HD1 LEU 57 -4.837 -0.173 6.475 422 HD13 LEU 57 3HD1 LEU 57 -3.210 0.463 6.721 423 HD21 LEU 57 3HD2 LEU 57 -4.081 -1.480 4.533 424 HD22 LEU 57 1HD2 LEU 57 -2.776 -2.654 4.695 425 HD23 LEU 57 2HD2 LEU 57 -2.416 -0.927 4.716 426 H GLN 58 H GLN 58 -0.709 -3.975 9.271 427 HA GLN 58 HA GLN 58 1.942 -3.044 9.434 428 HB2 GLN 58 1HB GLN 58 0.541 -5.246 10.960 429 HB3 GLN 58 2HB GLN 58 2.134 -4.626 11.368 430 HG2 GLN 58 1HG GLN 58 1.203 -2.431 11.801 431 HG3 GLN 58 2HG GLN 58 -0.396 -2.993 11.314 432 HE21 GLN 58 2HE2 GLN 58 0.547 -1.886 13.869 433 HE22 GLN 58 1HE2 GLN 58 0.153 -3.068 15.069 434 H GLN 59 H GLN 59 0.602 -6.197 8.561 435 HA GLN 59 HA GLN 59 3.087 -7.492 8.179 436 HB2 GLN 59 1HB GLN 59 0.377 -8.073 6.975 437 HB3 GLN 59 2HB GLN 59 1.768 -9.141 6.858 438 HG2 GLN 59 1HG GLN 59 1.801 -9.352 9.298 439 HG3 GLN 59 2HG GLN 59 0.386 -8.305 9.397 440 HE21 GLN 59 2HE2 GLN 59 0.779 -11.100 10.226 441 HE22 GLN 59 1HE2 GLN 59 -0.452 -12.006 9.407 442 H ALA 60 H ALA 60 0.953 -5.701 5.999 443 HA ALA 60 HA ALA 60 2.380 -6.254 3.618 444 HB1 ALA 60 3HB ALA 60 1.088 -4.449 2.634 445 HB2 ALA 60 1HB ALA 60 0.593 -3.905 4.237 446 HB3 ALA 60 2HB ALA 60 0.058 -5.474 3.634 447 H ALA 61 H ALA 61 2.807 -3.913 6.154 448 HA ALA 61 HA ALA 61 4.610 -2.240 4.662 449 HB1 ALA 61 3HB ALA 61 4.090 -2.339 7.631 450 HB2 ALA 61 1HB ALA 61 3.219 -1.338 6.471 451 HB3 ALA 61 2HB ALA 61 4.936 -1.061 6.763 452 H GLY 62 H GLY 62 4.921 -5.273 5.944 453 HA2 GLY 62 1HA GLY 62 6.801 -6.613 6.069 454 HA3 GLY 62 2HA GLY 62 7.786 -5.206 5.696 455 H LEU 63 H LEU 63 5.588 -4.842 8.293 456 HA LEU 63 HA LEU 63 7.812 -4.659 10.146 457 HG LEU 63 HG LEU 63 6.038 -2.431 9.040 458 HB2 LEU 63 1HB LEU 63 4.870 -4.073 10.482 459 HB3 LEU 63 2HB LEU 63 6.081 -3.814 11.723 460 HD11 LEU 63 1HD1 LEU 63 5.305 -1.414 11.780 461 HD12 LEU 63 2HD1 LEU 63 4.181 -1.733 10.459 462 HD13 LEU 63 3HD1 LEU 63 5.384 -0.451 10.305 463 HD21 LEU 63 3HD2 LEU 63 8.287 -2.699 9.942 464 HD22 LEU 63 1HD2 LEU 63 7.766 -2.006 11.478 465 HD23 LEU 63 2HD2 LEU 63 7.776 -1.013 10.020 466 H ALA 64 H ALA 64 5.681 -7.011 9.146 467 HA ALA 64 HA ALA 64 5.603 -8.411 11.699 468 HB1 ALA 64 3HB ALA 64 4.169 -10.018 10.550 469 HB2 ALA 64 1HB ALA 64 4.442 -9.180 9.022 470 HB3 ALA 64 2HB ALA 64 3.577 -8.372 10.329 471 H GLU 65 H GLU 65 5.826 -10.997 11.090 472 HA GLU 65 HA GLU 65 8.620 -11.354 10.729 473 HB2 GLU 65 1HB GLU 65 6.368 -13.362 10.850 474 HB3 GLU 65 2HB GLU 65 8.076 -13.777 10.874 475 HG2 GLU 65 1HG GLU 65 8.393 -12.722 12.970 476 HG3 GLU 65 2HG GLU 65 6.795 -11.980 12.908 477 H VAL 66 H VAL 66 9.508 -11.037 8.797 478 HA VAL 66 HA VAL 66 8.289 -11.499 6.302 479 HB VAL 66 HB VAL 66 11.248 -11.447 6.941 480 HG11 VAL 66 1HG1 VAL 66 11.520 -10.791 4.592 481 HG12 VAL 66 2HG1 VAL 66 9.787 -11.000 4.340 482 HG13 VAL 66 3HG1 VAL 66 10.792 -12.391 4.744 483 HG21 VAL 66 3HG2 VAL 66 10.135 -9.430 7.724 484 HG22 VAL 66 1HG2 VAL 66 9.393 -9.206 6.140 485 HG23 VAL 66 2HG2 VAL 66 11.142 -9.078 6.321 486 H VAL 67 H VAL 67 8.059 -13.293 5.117 487 HA VAL 67 HA VAL 67 8.534 -15.792 6.409 488 HB VAL 67 HB VAL 67 7.510 -16.763 4.290 489 HG11 VAL 67 1HG1 VAL 67 5.254 -16.015 4.912 490 HG12 VAL 67 2HG1 VAL 67 5.959 -14.715 5.873 491 HG13 VAL 67 3HG1 VAL 67 6.233 -16.396 6.328 492 HG21 VAL 67 3HG2 VAL 67 6.301 -15.188 2.850 493 HG22 VAL 67 1HG2 VAL 67 8.043 -14.921 2.775 494 HG23 VAL 67 2HG2 VAL 67 7.024 -13.837 3.721 495 H ARG 68 H ARG 68 10.904 -15.450 6.428 496 HA ARG 68 HA ARG 68 11.965 -17.055 4.206 497 HE ARG 68 HE ARG 68 13.322 -13.361 1.383 498 HB2 ARG 68 1HB ARG 68 13.328 -14.771 5.637 499 HB3 ARG 68 2HB ARG 68 14.223 -15.982 4.730 500 HG2 ARG 68 1HG ARG 68 12.959 -15.356 2.706 501 HG3 ARG 68 2HG ARG 68 12.143 -14.097 3.636 502 HD2 ARG 68 1HD ARG 68 14.223 -12.961 4.028 503 HD3 ARG 68 2HD ARG 68 15.130 -14.279 3.286 504 HH11 ARG 68 1HH1 ARG 68 16.078 -12.091 3.148 505 HH12 ARG 68 2HH1 ARG 68 16.552 -11.015 1.859 506 HH21 ARG 68 1HH2 ARG 68 13.940 -11.971 -0.289 507 HH22 ARG 68 2HH2 ARG 68 15.323 -10.936 -0.090 508 H ASP 69 H ASP 69 13.781 -16.074 7.033 509 HA ASP 69 HA ASP 69 12.810 -17.990 8.841 510 HB2 ASP 69 1HB ASP 69 13.971 -19.570 7.271 511 HB3 ASP 69 2HB ASP 69 15.490 -18.763 7.664 512 HA PRO 70 HA PRO 70 14.982 -14.543 10.808 513 HB2 PRO 70 1HB PRO 70 13.481 -15.574 13.138 514 HB3 PRO 70 2HB PRO 70 13.534 -13.941 12.465 515 HG2 PRO 70 1HG PRO 70 11.377 -15.498 12.166 516 HG3 PRO 70 2HG PRO 70 11.910 -14.396 10.883 517 HD2 PRO 70 1HD PRO 70 12.263 -17.362 11.104 518 HD3 PRO 70 2HD PRO 70 11.891 -16.372 9.676 519 H LEU 71 H LEU 71 17.042 -15.429 10.813 520 HA LEU 71 HA LEU 71 17.737 -17.370 12.859 521 HG LEU 71 HG LEU 71 17.985 -17.633 9.786 522 HB2 LEU 71 1HB LEU 71 19.420 -15.921 10.814 523 HB3 LEU 71 2HB LEU 71 20.039 -17.115 11.939 524 HD11 LEU 71 1HD1 LEU 71 20.876 -18.459 9.988 525 HD12 LEU 71 2HD1 LEU 71 20.228 -17.232 8.900 526 HD13 LEU 71 3HD1 LEU 71 19.750 -18.919 8.714 527 HD21 LEU 71 3HD2 LEU 71 18.258 -19.984 10.389 528 HD22 LEU 71 1HD2 LEU 71 17.650 -19.046 11.754 529 HD23 LEU 71 2HD2 LEU 71 19.346 -19.528 11.700 530 H ALA 72 H ALA 72 17.840 -13.961 12.273 531 HA ALA 72 HA ALA 72 19.473 -13.489 14.641 532 HB1 ALA 72 3HB ALA 72 18.302 -11.535 12.661 533 HB2 ALA 72 1HB ALA 72 19.956 -12.149 12.658 534 HB3 ALA 72 2HB ALA 72 19.395 -11.131 13.985 535 H PHE 73 H PHE 73 18.271 -13.885 16.412 536 HA PHE 73 HA PHE 73 15.527 -13.004 16.594 537 HD1 PHE 73 HD1 PHE 73 14.032 -15.169 17.270 538 HD2 PHE 73 HD2 PHE 73 18.138 -16.202 17.702 539 HE1 PHE 73 HE1 PHE 73 13.577 -17.377 16.286 540 HE2 PHE 73 HE2 PHE 73 17.689 -18.411 16.719 541 HZ PHE 73 HZ PHE 73 15.408 -19.000 16.009 542 HB2 PHE 73 1HB PHE 73 17.332 -14.245 18.683 543 HB3 PHE 73 2HB PHE 73 15.602 -13.969 18.862 544 H LEU 74 H LEU 74 14.769 -11.277 17.728 545 HA LEU 74 HA LEU 74 16.681 -9.164 18.189 546 HG LEU 74 HG LEU 74 14.288 -9.495 16.168 547 HB2 LEU 74 1HB LEU 74 13.679 -9.205 18.532 548 HB3 LEU 74 2HB LEU 74 14.690 -7.776 18.619 549 HD11 LEU 74 1HD1 LEU 74 12.315 -8.191 16.722 550 HD12 LEU 74 2HD1 LEU 74 13.103 -7.546 15.283 551 HD13 LEU 74 3HD1 LEU 74 13.293 -6.729 16.835 552 HD21 LEU 74 3HD2 LEU 74 15.547 -7.773 14.993 553 HD22 LEU 74 1HD2 LEU 74 16.528 -8.514 16.258 554 HD23 LEU 74 2HD2 LEU 74 15.819 -6.919 16.512 555 H ASP 75 H ASP 75 15.838 -11.682 19.988 556 HA ASP 75 HA ASP 75 15.278 -10.505 22.530 557 HB2 ASP 75 1HB ASP 75 16.338 -13.273 21.909 558 HB3 ASP 75 2HB ASP 75 15.592 -12.758 23.417 559 H GLU 76 H GLU 76 18.056 -10.754 20.675 560 HA GLU 76 HA GLU 76 19.811 -10.598 23.031 561 HB2 GLU 76 1HB GLU 76 20.407 -11.395 20.177 562 HB3 GLU 76 2HB GLU 76 21.642 -11.166 21.411 563 HG2 GLU 76 1HG GLU 76 20.659 -12.935 22.750 564 HG3 GLU 76 2HG GLU 76 19.384 -13.149 21.553 565 HA PRO 77 HA PRO 77 20.719 -6.358 22.466 566 HB2 PRO 77 1HB PRO 77 23.502 -6.429 22.607 567 HB3 PRO 77 2HB PRO 77 22.401 -6.331 23.982 568 HG2 PRO 77 1HG PRO 77 23.782 -8.702 22.820 569 HG3 PRO 77 2HG PRO 77 23.450 -8.312 24.518 570 HD2 PRO 77 1HD PRO 77 22.000 -10.133 23.202 571 HD3 PRO 77 2HD PRO 77 21.247 -9.036 24.380 572 H GLU 78 H GLU 78 20.721 -5.153 20.712 573 HA GLU 78 HA GLU 78 21.859 -6.184 18.240 574 HB2 GLU 78 1HB GLU 78 19.557 -5.219 18.338 575 HB3 GLU 78 2HB GLU 78 20.264 -3.661 18.736 576 HG2 GLU 78 1HG GLU 78 21.568 -3.922 16.537 577 HG3 GLU 78 2HG GLU 78 20.384 -5.175 16.159 578 H ALA 79 H ALA 79 23.453 -5.170 17.051 579 HA ALA 79 HA ALA 79 25.166 -3.293 18.441 580 HB1 ALA 79 3HB ALA 79 26.666 -3.577 16.538 581 HB2 ALA 79 1HB ALA 79 25.427 -4.496 15.682 582 HB3 ALA 79 2HB ALA 79 26.144 -5.143 17.157 583 H GLY 80 H GLY 80 26.128 -1.699 16.401 584 HA2 GLY 80 1HA GLY 80 24.002 0.223 16.151 585 HA3 GLY 80 2HA GLY 80 25.652 0.411 15.577 586 H ALA 81 H ALA 81 22.824 -1.632 14.856 587 HA ALA 81 HA ALA 81 23.457 -1.381 11.992 588 HB1 ALA 81 3HB ALA 81 23.313 -3.671 12.849 589 HB2 ALA 81 1HB ALA 81 22.047 -3.346 11.664 590 HB3 ALA 81 2HB ALA 81 21.660 -3.367 13.385 591 H GLY 82 H GLY 82 20.484 -1.740 13.945 592 HA2 GLY 82 1HA GLY 82 19.142 0.126 12.111 593 HA3 GLY 82 2HA GLY 82 18.346 -0.952 13.253 594 H ALA 83 H ALA 83 19.876 -0.411 15.498 595 HA ALA 83 HA ALA 83 20.369 1.024 17.174 596 HB1 ALA 83 3HB ALA 83 20.771 3.379 16.747 597 HB2 ALA 83 1HB ALA 83 20.040 3.230 15.149 598 HB3 ALA 83 2HB ALA 83 21.540 2.377 15.517 599 H ARG 84 H ARG 84 17.449 1.257 15.438 600 HA ARG 84 HA ARG 84 16.152 2.407 17.813 601 HE ARG 84 HE ARG 84 17.389 6.525 13.998 602 HB2 ARG 84 1HB ARG 84 15.259 2.948 14.977 603 HB3 ARG 84 2HB ARG 84 14.624 3.667 16.449 604 HG2 ARG 84 1HG ARG 84 16.821 4.756 16.805 605 HG3 ARG 84 2HG ARG 84 17.343 4.124 15.242 606 HD2 ARG 84 1HD ARG 84 15.373 5.300 14.224 607 HD3 ARG 84 2HD ARG 84 15.103 6.060 15.791 608 HH11 ARG 84 1HH1 ARG 84 15.630 7.346 16.920 609 HH12 ARG 84 2HH1 ARG 84 16.397 8.897 17.088 610 HH21 ARG 84 1HH2 ARG 84 18.374 8.553 14.212 611 HH22 ARG 84 2HH2 ARG 84 17.935 9.599 15.532 612 HA PRO 85 HA PRO 85 13.750 -1.328 17.459 613 HB2 PRO 85 1HB PRO 85 11.847 -0.714 19.288 614 HB3 PRO 85 2HB PRO 85 13.488 -1.189 19.742 615 HG2 PRO 85 1HG PRO 85 12.290 1.549 19.560 616 HG3 PRO 85 2HG PRO 85 13.346 0.872 20.812 617 HD2 PRO 85 1HD PRO 85 14.267 2.495 18.846 618 HD3 PRO 85 2HD PRO 85 15.254 1.205 19.561 619 H ALA 86 H ALA 86 12.649 1.846 16.786 620 HA ALA 86 HA ALA 86 10.253 0.759 15.476 621 HB1 ALA 86 3HB ALA 86 10.555 3.502 16.695 622 HB2 ALA 86 1HB ALA 86 9.651 2.159 17.394 623 HB3 ALA 86 2HB ALA 86 9.124 2.879 15.872 624 H ASN 87 H ASN 87 11.781 0.436 13.690 625 HA ASN 87 HA ASN 87 12.130 2.906 12.132 626 HB2 ASN 87 1HB ASN 87 13.595 0.267 11.964 627 HB3 ASN 87 2HB ASN 87 13.680 1.479 10.691 628 HD21 ASN 87 2HD2 ASN 87 15.840 0.459 12.256 629 HD22 ASN 87 1HD2 ASN 87 16.510 1.801 13.126 630 H ALA 88 H ALA 88 9.807 2.679 11.823 631 HA ALA 88 HA ALA 88 8.918 0.542 10.058 632 HB1 ALA 88 3HB ALA 88 7.500 1.194 11.946 633 HB2 ALA 88 1HB ALA 88 6.687 1.476 10.406 634 HB3 ALA 88 2HB ALA 88 7.385 2.829 11.296 635 HA PRO 89 HA PRO 89 9.091 2.707 6.186 636 HB2 PRO 89 1HB PRO 89 6.161 2.186 5.969 637 HB3 PRO 89 2HB PRO 89 7.452 1.857 4.806 638 HG2 PRO 89 1HG PRO 89 6.394 -0.118 6.230 639 HG3 PRO 89 2HG PRO 89 8.138 -0.065 5.913 640 HD2 PRO 89 1HD PRO 89 6.640 0.595 8.411 641 HD3 PRO 89 2HD PRO 89 8.227 -0.179 8.216 642 H GLU 90 H GLU 90 8.912 4.776 5.571 643 HA GLU 90 HA GLU 90 7.827 6.659 7.389 644 HB2 GLU 90 1HB GLU 90 8.839 7.089 4.574 645 HB3 GLU 90 2HB GLU 90 8.623 8.332 5.799 646 HG2 GLU 90 1HG GLU 90 10.344 7.293 7.172 647 HG3 GLU 90 2HG GLU 90 10.547 6.022 5.968 648 H VAL 91 H VAL 91 6.849 5.493 4.206 649 HA VAL 91 HA VAL 91 4.188 6.597 4.679 650 HB VAL 91 HB VAL 91 5.198 8.317 3.356 651 HG11 VAL 91 1HG1 VAL 91 6.028 6.155 1.431 652 HG12 VAL 91 2HG1 VAL 91 7.090 7.108 2.469 653 HG13 VAL 91 3HG1 VAL 91 6.203 7.888 1.161 654 HG21 VAL 91 3HG2 VAL 91 3.802 8.286 1.336 655 HG22 VAL 91 1HG2 VAL 91 2.905 7.778 2.767 656 HG23 VAL 91 2HG2 VAL 91 3.467 6.576 1.606 657 H LEU 92 H LEU 92 2.553 5.372 3.939 658 HA LEU 92 HA LEU 92 3.243 2.938 2.425 659 HG LEU 92 HG LEU 92 0.485 1.564 2.982 660 HB2 LEU 92 1HB LEU 92 2.768 2.406 4.772 661 HB3 LEU 92 2HB LEU 92 1.236 3.248 4.666 662 HD11 LEU 92 1HD1 LEU 92 2.662 0.844 2.175 663 HD12 LEU 92 2HD1 LEU 92 1.740 -0.526 2.792 664 HD13 LEU 92 3HD1 LEU 92 3.039 0.169 3.760 665 HD21 LEU 92 3HD2 LEU 92 -0.128 1.375 5.337 666 HD22 LEU 92 1HD2 LEU 92 1.348 0.462 5.652 667 HD23 LEU 92 2HD2 LEU 92 0.099 -0.213 4.605 668 H LEU 93 H LEU 93 2.273 2.912 0.509 669 HA LEU 93 HA LEU 93 -0.051 4.649 0.093 670 HG LEU 93 HG LEU 93 2.935 5.128 -0.830 671 HB2 LEU 93 1HB LEU 93 1.744 3.275 -1.910 672 HB3 LEU 93 2HB LEU 93 0.418 4.352 -2.309 673 HD11 LEU 93 1HD1 LEU 93 1.990 5.756 -3.620 674 HD12 LEU 93 2HD1 LEU 93 3.324 4.688 -3.187 675 HD13 LEU 93 3HD1 LEU 93 3.431 6.415 -2.849 676 HD21 LEU 93 3HD2 LEU 93 0.602 6.805 -1.745 677 HD22 LEU 93 1HD2 LEU 93 2.099 7.420 -1.047 678 HD23 LEU 93 2HD2 LEU 93 1.015 6.424 -0.073 679 H VAL 94 H VAL 94 -1.996 3.770 0.106 680 HA VAL 94 HA VAL 94 -2.238 0.906 -0.539 681 HB VAL 94 HB VAL 94 -4.099 2.627 1.115 682 HG11 VAL 94 1HG1 VAL 94 -5.257 0.527 1.629 683 HG12 VAL 94 2HG1 VAL 94 -4.184 -0.333 0.526 684 HG13 VAL 94 3HG1 VAL 94 -5.300 0.881 -0.098 685 HG21 VAL 94 3HG2 VAL 94 -3.334 1.265 3.003 686 HG22 VAL 94 1HG2 VAL 94 -2.000 2.153 2.265 687 HG23 VAL 94 2HG2 VAL 94 -2.201 0.432 1.938 688 H GLY 95 H GLY 95 -2.967 0.549 -2.497 689 HA2 GLY 95 1HA GLY 95 -4.777 2.509 -3.742 690 HA3 GLY 95 2HA GLY 95 -3.839 1.289 -4.600 691 H THR 96 H THR 96 -6.834 2.071 -3.314 692 HA THR 96 HA THR 96 -7.699 -0.571 -2.632 693 HB THR 96 HB THR 96 -10.001 0.602 -2.640 694 HG1 THR 96 HG1 THR 96 -8.338 2.917 -2.618 695 HG21 THR 96 3HG2 THR 96 -7.796 1.537 -0.799 696 HG22 THR 96 1HG2 THR 96 -8.729 0.050 -0.622 697 HG23 THR 96 2HG2 THR 96 -9.524 1.614 -0.460 698 H GLY 97 H GLY 97 -7.889 1.436 -5.496 699 HA2 GLY 97 1HA GLY 97 -8.274 0.801 -7.682 700 HA3 GLY 97 2HA GLY 97 -8.451 -0.854 -7.121 701 H ARG 98 H ARG 98 -10.542 -1.051 -5.676 702 HA ARG 98 HA ARG 98 -12.713 -0.679 -7.500 703 HE ARG 98 HE ARG 98 -12.828 -6.169 -5.727 704 HB2 ARG 98 1HB ARG 98 -12.748 -1.633 -4.630 705 HB3 ARG 98 2HB ARG 98 -14.047 -1.827 -5.798 706 HG2 ARG 98 1HG ARG 98 -12.841 -3.397 -7.047 707 HG3 ARG 98 2HG ARG 98 -11.317 -2.975 -6.262 708 HD2 ARG 98 1HD ARG 98 -12.100 -3.910 -4.169 709 HD3 ARG 98 2HD ARG 98 -13.678 -4.242 -4.881 710 HH11 ARG 98 1HH1 ARG 98 -10.123 -4.019 -5.115 711 HH12 ARG 98 2HH1 ARG 98 -8.936 -5.212 -5.509 712 HH21 ARG 98 1HH2 ARG 98 -11.280 -7.731 -6.199 713 HH22 ARG 98 2HH2 ARG 98 -9.589 -7.319 -6.151 714 H ARG 99 H ARG 99 -12.668 0.105 -4.059 715 HA ARG 99 HA ARG 99 -13.860 2.722 -4.614 716 HE ARG 99 HE ARG 99 -18.968 0.592 -4.870 717 HB2 ARG 99 1HB ARG 99 -14.887 0.689 -2.617 718 HB3 ARG 99 2HB ARG 99 -15.451 2.350 -2.739 719 HG2 ARG 99 1HG ARG 99 -16.457 1.971 -4.825 720 HG3 ARG 99 2HG ARG 99 -15.601 0.446 -5.053 721 HD2 ARG 99 1HD ARG 99 -16.863 -0.539 -3.205 722 HD3 ARG 99 2HD ARG 99 -17.707 0.990 -2.962 723 HH11 ARG 99 1HH1 ARG 99 -16.510 -1.871 -4.503 724 HH12 ARG 99 2HH1 ARG 99 -17.239 -2.954 -5.641 725 HH21 ARG 99 1HH2 ARG 99 -19.957 -0.858 -6.339 726 HH22 ARG 99 2HH2 ARG 99 -19.199 -2.389 -6.676 727 H GLN 100 H GLN 100 -13.161 4.315 -3.240 728 HA GLN 100 HA GLN 100 -10.743 3.743 -1.832 729 HB2 GLN 100 1HB GLN 100 -11.045 5.839 -3.075 730 HB3 GLN 100 2HB GLN 100 -12.339 6.305 -1.977 731 HG2 GLN 100 1HG GLN 100 -10.692 6.232 -0.112 732 HG3 GLN 100 2HG GLN 100 -9.428 5.954 -1.309 733 HE21 GLN 100 2HE2 GLN 100 -8.369 7.860 -0.778 734 HE22 GLN 100 1HE2 GLN 100 -8.995 9.416 -1.226 735 H HIS 101 H HIS 101 -10.853 2.711 0.054 736 HA HIS 101 HA HIS 101 -12.885 3.144 2.008 737 HD1 HIS 101 HD1 HIS 101 -12.332 -0.270 3.889 738 HD2 HIS 101 HD2 HIS 101 -10.722 3.408 4.985 739 HE1 HIS 101 HE1 HIS 101 -12.534 -0.152 6.393 740 HE2 HIS 101 HE2 HIS 101 -11.668 2.130 7.019 741 HB2 HIS 101 1HB HIS 101 -11.607 1.030 1.914 742 HB3 HIS 101 2HB HIS 101 -10.130 1.903 2.300 743 H LEU 102 H LEU 102 -13.092 5.121 2.872 744 HA LEU 102 HA LEU 102 -10.916 6.902 3.295 745 HG LEU 102 HG LEU 102 -13.749 7.131 2.034 746 HB2 LEU 102 1HB LEU 102 -13.689 6.898 4.488 747 HB3 LEU 102 2HB LEU 102 -12.554 8.233 4.579 748 HD11 LEU 102 1HD1 LEU 102 -15.388 8.290 3.407 749 HD12 LEU 102 2HD1 LEU 102 -14.992 9.226 1.966 750 HD13 LEU 102 3HD1 LEU 102 -14.313 9.682 3.529 751 HD21 LEU 102 3HD2 LEU 102 -11.505 8.054 1.708 752 HD22 LEU 102 1HD2 LEU 102 -12.007 9.551 2.494 753 HD23 LEU 102 2HD2 LEU 102 -12.738 9.071 0.963 754 H LEU 103 H LEU 103 -9.362 6.501 4.681 755 HA LEU 103 HA LEU 103 -9.538 4.597 6.741 756 HG LEU 103 HG LEU 103 -7.549 5.120 4.415 757 HB2 LEU 103 1HB LEU 103 -7.486 6.751 6.250 758 HB3 LEU 103 2HB LEU 103 -7.303 5.447 7.406 759 HD11 LEU 103 1HD1 LEU 103 -5.184 4.803 6.258 760 HD12 LEU 103 2HD1 LEU 103 -5.418 6.093 5.078 761 HD13 LEU 103 3HD1 LEU 103 -5.207 4.428 4.536 762 HD21 LEU 103 3HD2 LEU 103 -8.517 3.233 5.622 763 HD22 LEU 103 1HD2 LEU 103 -7.045 3.082 6.582 764 HD23 LEU 103 2HD2 LEU 103 -7.001 2.775 4.846 765 H GLY 104 H GLY 104 -9.816 4.753 8.883 766 HA2 GLY 104 1HA GLY 104 -10.508 7.404 9.958 767 HA3 GLY 104 2HA GLY 104 -11.019 5.864 10.640 768 HA PRO 105 HA PRO 105 -6.829 7.706 12.303 769 HB2 PRO 105 1HB PRO 105 -8.451 8.569 14.626 770 HB3 PRO 105 2HB PRO 105 -7.172 9.431 13.763 771 HG2 PRO 105 1HG PRO 105 -9.737 10.130 13.487 772 HG3 PRO 105 2HG PRO 105 -8.612 10.192 12.118 773 HD2 PRO 105 1HD PRO 105 -10.707 8.155 12.763 774 HD3 PRO 105 2HD PRO 105 -10.244 8.840 11.191 775 H GLU 106 H GLU 106 -9.459 5.814 13.491 776 HA GLU 106 HA GLU 106 -7.846 4.672 15.635 777 HB2 GLU 106 1HB GLU 106 -10.733 4.168 14.895 778 HB3 GLU 106 2HB GLU 106 -9.920 3.576 16.340 779 HG2 GLU 106 1HG GLU 106 -9.589 5.850 17.117 780 HG3 GLU 106 2HG GLU 106 -10.332 6.478 15.646 781 H GLN 107 H GLN 107 -8.669 4.038 12.407 782 HA GLN 107 HA GLN 107 -8.279 1.162 12.583 783 HB2 GLN 107 1HB GLN 107 -8.658 3.023 10.228 784 HB3 GLN 107 2HB GLN 107 -8.433 1.286 10.071 785 HG2 GLN 107 1HG GLN 107 -10.476 0.852 11.234 786 HG3 GLN 107 2HG GLN 107 -10.669 2.561 11.625 787 HE21 GLN 107 2HE2 GLN 107 -12.464 0.767 10.218 788 HE22 GLN 107 1HE2 GLN 107 -12.752 1.498 8.675 789 H VAL 108 H VAL 108 -6.591 4.025 11.440 790 HA VAL 108 HA VAL 108 -4.186 2.460 10.856 791 HB VAL 108 HB VAL 108 -4.482 5.442 10.519 792 HG11 VAL 108 1HG1 VAL 108 -2.235 4.559 10.287 793 HG12 VAL 108 2HG1 VAL 108 -2.841 5.101 8.722 794 HG13 VAL 108 3HG1 VAL 108 -2.799 3.380 9.103 795 HG21 VAL 108 3HG2 VAL 108 -6.390 4.427 9.400 796 HG22 VAL 108 1HG2 VAL 108 -5.316 3.319 8.546 797 HG23 VAL 108 2HG2 VAL 108 -5.237 5.049 8.219 798 H ARG 109 H ARG 109 -5.442 3.264 13.531 799 HA ARG 109 HA ARG 109 -4.079 5.219 14.883 800 HE ARG 109 HE ARG 109 -5.222 3.327 20.295 801 HB2 ARG 109 1HB ARG 109 -6.046 4.117 15.765 802 HB3 ARG 109 2HB ARG 109 -5.161 2.611 15.946 803 HG2 ARG 109 1HG ARG 109 -3.840 3.502 17.705 804 HG3 ARG 109 2HG ARG 109 -4.438 5.136 17.407 805 HD2 ARG 109 1HD ARG 109 -6.663 4.490 18.086 806 HD3 ARG 109 2HD ARG 109 -6.154 2.812 18.265 807 HH11 ARG 109 1HH1 ARG 109 -6.040 6.297 18.637 808 HH12 ARG 109 2HH1 ARG 109 -5.817 7.299 20.036 809 HH21 ARG 109 1HH2 ARG 109 -4.971 4.613 22.142 810 HH22 ARG 109 2HH2 ARG 109 -5.204 6.337 22.046 811 HA PRO 110 HA PRO 110 -0.730 2.107 16.481 812 HB2 PRO 110 1HB PRO 110 -0.311 -0.132 14.965 813 HB3 PRO 110 2HB PRO 110 -1.341 -0.095 16.399 814 HG2 PRO 110 1HG PRO 110 -2.105 0.059 13.513 815 HG3 PRO 110 2HG PRO 110 -2.879 -0.842 14.831 816 HD2 PRO 110 1HD PRO 110 -3.867 1.494 13.925 817 HD3 PRO 110 2HD PRO 110 -3.973 1.030 15.636 818 H LEU 111 H LEU 111 -1.336 2.316 13.020 819 HA LEU 111 HA LEU 111 1.424 2.269 12.271 820 HG LEU 111 HG LEU 111 -1.085 0.752 11.306 821 HB2 LEU 111 1HB LEU 111 -1.007 3.169 10.723 822 HB3 LEU 111 2HB LEU 111 0.590 2.925 10.042 823 HD11 LEU 111 1HD1 LEU 111 -0.545 1.354 8.403 824 HD12 LEU 111 2HD1 LEU 111 -2.085 1.555 9.236 825 HD13 LEU 111 3HD1 LEU 111 -1.402 -0.057 9.025 826 HD21 LEU 111 3HD2 LEU 111 1.317 0.358 11.475 827 HD22 LEU 111 1HD2 LEU 111 1.490 0.627 9.741 828 HD23 LEU 111 2HD2 LEU 111 0.568 -0.756 10.332 829 H LEU 112 H LEU 112 -1.028 4.812 12.582 830 HA LEU 112 HA LEU 112 0.623 6.953 11.791 831 HG LEU 112 HG LEU 112 -2.310 6.247 11.248 832 HB2 LEU 112 1HB LEU 112 -1.810 6.908 13.575 833 HB3 LEU 112 2HB LEU 112 -1.050 8.374 12.986 834 HD11 LEU 112 1HD1 LEU 112 -3.265 9.012 11.981 835 HD12 LEU 112 2HD1 LEU 112 -3.963 7.492 12.540 836 HD13 LEU 112 3HD1 LEU 112 -4.039 7.920 10.830 837 HD21 LEU 112 3HD2 LEU 112 -0.457 7.381 10.137 838 HD22 LEU 112 1HD2 LEU 112 -1.158 8.946 10.548 839 HD23 LEU 112 2HD2 LEU 112 -2.002 7.867 9.438 840 H ALA 113 H ALA 113 0.104 5.391 14.887 841 HA ALA 113 HA ALA 113 1.405 7.281 16.519 842 HB1 ALA 113 3HB ALA 113 1.570 5.489 18.160 843 HB2 ALA 113 1HB ALA 113 1.169 4.302 16.920 844 HB3 ALA 113 2HB ALA 113 -0.024 5.507 17.406 845 H MET 114 H MET 114 2.609 4.668 14.519 846 HA MET 114 HA MET 114 5.292 4.874 15.561 847 HB2 MET 114 1HB MET 114 4.140 3.341 13.230 848 HB3 MET 114 2HB MET 114 5.839 3.296 13.681 849 HG2 MET 114 1HG MET 114 5.229 2.407 15.875 850 HG3 MET 114 2HG MET 114 3.530 2.442 15.411 851 HE1 MET 114 3HE MET 114 2.458 0.878 13.576 852 HE2 MET 114 1HE MET 114 3.390 -0.225 12.563 853 HE3 MET 114 2HE MET 114 3.603 1.518 12.399 854 H GLY 115 H GLY 115 3.424 6.288 13.023 855 HA2 GLY 115 1HA GLY 115 4.257 8.445 12.210 856 HA3 GLY 115 2HA GLY 115 5.848 7.704 12.105 857 H VAL 116 H VAL 116 3.662 5.431 11.146 858 HA VAL 116 HA VAL 116 4.543 5.559 8.433 859 HB VAL 116 HB VAL 116 2.320 3.849 9.563 860 HG11 VAL 116 1HG1 VAL 116 4.073 3.505 7.134 861 HG12 VAL 116 2HG1 VAL 116 2.358 3.917 7.138 862 HG13 VAL 116 3HG1 VAL 116 2.886 2.337 7.714 863 HG21 VAL 116 3HG2 VAL 116 4.349 3.534 10.874 864 HG22 VAL 116 1HG2 VAL 116 5.271 3.249 9.398 865 HG23 VAL 116 2HG2 VAL 116 4.014 2.111 9.886 866 H GLY 117 H GLY 117 3.804 7.125 7.142 867 HA2 GLY 117 1HA GLY 117 1.135 8.192 7.386 868 HA3 GLY 117 2HA GLY 117 2.341 8.649 6.190 869 H VAL 118 H VAL 118 -0.357 6.639 6.897 870 HA VAL 118 HA VAL 118 -0.071 5.093 4.453 871 HB VAL 118 HB VAL 118 -2.298 5.037 6.497 872 HG11 VAL 118 1HG1 VAL 118 -1.578 3.098 4.302 873 HG12 VAL 118 2HG1 VAL 118 -2.986 4.160 4.335 874 HG13 VAL 118 3HG1 VAL 118 -2.837 2.856 5.513 875 HG21 VAL 118 3HG2 VAL 118 0.118 3.255 6.216 876 HG22 VAL 118 1HG2 VAL 118 -1.212 3.014 7.350 877 HG23 VAL 118 2HG2 VAL 118 -0.167 4.427 7.502 878 H GLU 119 H GLU 119 -0.807 5.818 2.592 879 HA GLU 119 HA GLU 119 -2.976 7.811 2.572 880 HB2 GLU 119 1HB GLU 119 -0.882 7.162 0.486 881 HB3 GLU 119 2HB GLU 119 -2.174 8.334 0.271 882 HG2 GLU 119 1HG GLU 119 -0.062 8.506 2.404 883 HG3 GLU 119 2HG GLU 119 0.016 9.329 0.847 884 H ALA 120 H ALA 120 -4.883 6.812 2.307 885 HA ALA 120 HA ALA 120 -5.106 4.448 0.630 886 HB1 ALA 120 3HB ALA 120 -7.241 5.938 2.158 887 HB2 ALA 120 1HB ALA 120 -6.346 4.535 2.743 888 HB3 ALA 120 2HB ALA 120 -7.431 4.375 1.361 889 H MET 121 H MET 121 -5.128 4.798 -1.494 890 HA MET 121 HA MET 121 -6.865 6.918 -2.555 891 HB2 MET 121 1HB MET 121 -3.997 6.430 -3.390 892 HB3 MET 121 2HB MET 121 -5.108 7.532 -4.191 893 HG2 MET 121 1HG MET 121 -5.228 8.903 -2.202 894 HG3 MET 121 2HG MET 121 -4.189 7.774 -1.336 895 HE1 MET 121 3HE MET 121 -2.056 6.988 -3.553 896 HE2 MET 121 1HE MET 121 -1.614 7.402 -1.896 897 HE3 MET 121 2HE MET 121 -0.791 8.177 -3.249 898 H ASP 122 H ASP 122 -6.550 6.674 -5.162 899 HA ASP 122 HA ASP 122 -7.666 4.189 -5.925 900 HB2 ASP 122 1HB ASP 122 -6.200 6.075 -7.778 901 HB3 ASP 122 2HB ASP 122 -7.529 4.993 -8.168 902 H THR 123 H THR 123 -6.664 2.577 -7.347 903 HA THR 123 HA THR 123 -4.055 1.799 -6.625 904 HB THR 123 HB THR 123 -4.304 0.431 -8.866 905 HG1 THR 123 HG1 THR 123 -6.084 0.900 -9.888 906 HG21 THR 123 3HG2 THR 123 -6.086 -0.025 -6.472 907 HG22 THR 123 1HG2 THR 123 -4.414 -0.560 -6.638 908 HG23 THR 123 2HG2 THR 123 -5.665 -1.240 -7.680 909 H GLN 124 H GLN 124 -5.356 3.495 -9.424 910 HA GLN 124 HA GLN 124 -2.932 3.790 -10.835 911 HB2 GLN 124 1HB GLN 124 -5.216 4.071 -11.797 912 HB3 GLN 124 2HB GLN 124 -5.372 5.575 -10.902 913 HG2 GLN 124 1HG GLN 124 -3.522 6.535 -12.152 914 HG3 GLN 124 2HG GLN 124 -3.309 5.017 -13.024 915 HE21 GLN 124 2HE2 GLN 124 -3.915 7.676 -14.052 916 HE22 GLN 124 1HE2 GLN 124 -5.395 7.523 -14.931 917 H ALA 125 H ALA 125 -4.609 5.840 -8.487 918 HA ALA 125 HA ALA 125 -2.876 8.054 -8.635 919 HB1 ALA 125 3HB ALA 125 -5.107 8.161 -7.623 920 HB2 ALA 125 1HB ALA 125 -3.861 8.744 -6.519 921 HB3 ALA 125 2HB ALA 125 -4.552 7.136 -6.299 922 H ALA 126 H ALA 126 -2.915 5.210 -6.521 923 HA ALA 126 HA ALA 126 -0.708 5.954 -4.937 924 HB1 ALA 126 3HB ALA 126 -0.652 3.628 -4.228 925 HB2 ALA 126 1HB ALA 126 -1.711 3.181 -5.566 926 HB3 ALA 126 2HB ALA 126 -2.312 4.224 -4.278 927 H ALA 127 H ALA 127 -0.966 4.071 -7.922 928 HA ALA 127 HA ALA 127 1.689 3.211 -8.099 929 HB1 ALA 127 3HB ALA 127 -0.212 3.857 -10.350 930 HB2 ALA 127 1HB ALA 127 -0.098 2.317 -9.499 931 HB3 ALA 127 2HB ALA 127 1.254 2.884 -10.479 932 H ARG 128 H ARG 128 0.157 6.164 -9.361 933 HA ARG 128 HA ARG 128 2.453 7.204 -10.624 934 HE ARG 128 HE ARG 128 -1.674 9.484 -9.917 935 HB2 ARG 128 1HB ARG 128 0.173 8.766 -9.394 936 HB3 ARG 128 2HB ARG 128 1.315 9.365 -10.586 937 HG2 ARG 128 1HG ARG 128 0.458 7.637 -12.166 938 HG3 ARG 128 2HG ARG 128 -0.787 7.254 -10.975 939 HD2 ARG 128 1HD ARG 128 -0.355 9.869 -12.407 940 HD3 ARG 128 2HD ARG 128 -1.722 8.768 -12.572 941 HH11 ARG 128 1HH1 ARG 128 -2.026 11.108 -12.994 942 HH12 ARG 128 2HH1 ARG 128 -2.903 12.459 -12.330 943 HH21 ARG 128 1HH2 ARG 128 -2.856 11.254 -9.032 944 HH22 ARG 128 2HH2 ARG 128 -3.352 12.546 -10.082 945 H THR 129 H THR 129 1.106 7.759 -7.394 946 HA THR 129 HA THR 129 3.049 9.593 -6.512 947 HB THR 129 HB THR 129 1.488 7.664 -4.783 948 HG1 THR 129 HG1 THR 129 -0.046 8.715 -5.985 949 HG21 THR 129 3HG2 THR 129 3.240 8.910 -3.607 950 HG22 THR 129 1HG2 THR 129 1.638 9.453 -3.111 951 HG23 THR 129 2HG2 THR 129 2.589 10.426 -4.234 952 H TYR 130 H TYR 130 2.918 6.097 -6.527 953 HA TYR 130 HA TYR 130 5.070 5.548 -4.809 954 HD1 TYR 130 HD1 TYR 130 4.918 3.619 -3.536 955 HD2 TYR 130 HD2 TYR 130 5.552 2.016 -7.425 956 HE1 TYR 130 HE1 TYR 130 6.231 1.783 -2.560 957 HE2 TYR 130 HE2 TYR 130 6.871 0.183 -6.458 958 HH TYR 130 HH TYR 130 6.826 -0.585 -3.211 959 HB2 TYR 130 1HB TYR 130 3.306 3.958 -5.735 960 HB3 TYR 130 2HB TYR 130 4.263 3.903 -7.209 961 H ASN 131 H ASN 131 4.917 5.995 -8.324 962 HA ASN 131 HA ASN 131 7.673 5.585 -8.814 963 HB2 ASN 131 1HB ASN 131 5.606 7.125 -10.399 964 HB3 ASN 131 2HB ASN 131 7.234 6.777 -10.974 965 HD21 ASN 131 2HD2 ASN 131 4.682 5.971 -12.098 966 HD22 ASN 131 1HD2 ASN 131 4.693 4.245 -12.138 967 H ILE 132 H ILE 132 5.832 8.331 -7.754 968 HA ILE 132 HA ILE 132 7.854 10.293 -8.193 969 HB ILE 132 HB ILE 132 5.515 10.314 -6.275 970 HG12 ILE 132 1HG1 ILE 132 5.825 11.599 -8.997 971 HG13 ILE 132 2HG1 ILE 132 4.904 10.134 -8.673 972 HG21 ILE 132 1HG2 ILE 132 5.827 12.739 -6.186 973 HG22 ILE 132 2HG2 ILE 132 7.271 12.591 -7.187 974 HG23 ILE 132 3HG2 ILE 132 7.243 11.883 -5.573 975 HD11 ILE 132 3HD1 ILE 132 4.329 12.873 -7.568 976 HD12 ILE 132 1HD1 ILE 132 3.413 11.409 -7.211 977 HD13 ILE 132 2HD1 ILE 132 3.442 12.053 -8.853 978 H LEU 133 H LEU 133 6.786 8.466 -5.335 979 HA LEU 133 HA LEU 133 8.631 9.687 -3.572 980 HG LEU 133 HG LEU 133 5.630 9.084 -3.428 981 HB2 LEU 133 1HB LEU 133 7.098 7.103 -3.327 982 HB3 LEU 133 2HB LEU 133 8.001 7.849 -2.021 983 HD11 LEU 133 1HD1 LEU 133 5.866 7.878 -0.676 984 HD12 LEU 133 2HD1 LEU 133 5.003 7.174 -2.045 985 HD13 LEU 133 3HD1 LEU 133 4.445 8.690 -1.336 986 HD21 LEU 133 3HD2 LEU 133 7.208 10.015 -1.032 987 HD22 LEU 133 1HD2 LEU 133 5.740 10.767 -1.659 988 HD23 LEU 133 2HD2 LEU 133 7.212 10.757 -2.631 989 H MET 134 H MET 134 8.800 6.737 -5.525 990 HA MET 134 HA MET 134 11.189 5.771 -4.332 991 HB2 MET 134 1HB MET 134 11.387 4.277 -6.213 992 HB3 MET 134 2HB MET 134 9.698 4.355 -5.734 993 HG2 MET 134 1HG MET 134 9.149 5.724 -7.593 994 HG3 MET 134 2HG MET 134 10.847 5.970 -7.993 995 HE1 MET 134 3HE MET 134 9.112 2.617 -6.891 996 HE2 MET 134 1HE MET 134 8.668 1.925 -8.453 997 HE3 MET 134 2HE MET 134 7.879 3.394 -7.886 998 H ALA 135 H ALA 135 10.530 8.133 -6.809 999 HA ALA 135 HA ALA 135 13.260 8.301 -7.707 1000 HB1 ALA 135 3HB ALA 135 11.393 8.817 -9.215 1001 HB2 ALA 135 1HB ALA 135 12.497 10.182 -9.049 1002 HB3 ALA 135 2HB ALA 135 10.954 10.186 -8.193 1003 H GLU 136 H GLU 136 11.266 9.820 -5.302 1004 HA GLU 136 HA GLU 136 13.065 11.978 -4.751 1005 HB2 GLU 136 1HB GLU 136 10.640 12.034 -4.176 1006 HB3 GLU 136 2HB GLU 136 10.931 10.790 -2.967 1007 HG2 GLU 136 1HG GLU 136 12.559 12.360 -1.887 1008 HG3 GLU 136 2HG GLU 136 11.985 13.603 -2.998 1009 H GLY 137 H GLY 137 12.472 8.771 -3.427 1010 HA2 GLY 137 1HA GLY 137 14.283 7.406 -2.683 1011 HA3 GLY 137 2HA GLY 137 15.164 8.865 -2.260 1012 H ARG 138 H ARG 138 11.804 8.383 -1.393 1013 HA ARG 138 HA ARG 138 12.628 8.260 1.422 1014 HE ARG 138 HE ARG 138 9.829 10.377 4.696 1015 HB2 ARG 138 1HB ARG 138 10.988 10.049 0.608 1016 HB3 ARG 138 2HB ARG 138 9.826 8.745 0.395 1017 HG2 ARG 138 1HG ARG 138 9.918 8.216 2.742 1018 HG3 ARG 138 2HG ARG 138 11.189 9.410 2.993 1019 HD2 ARG 138 1HD ARG 138 9.583 11.169 2.258 1020 HD3 ARG 138 2HD ARG 138 8.323 9.933 2.214 1021 HH11 ARG 138 1HH1 ARG 138 6.787 10.612 2.952 1022 HH12 ARG 138 2HH1 ARG 138 5.831 10.763 4.396 1023 HH21 ARG 138 1HH2 ARG 138 8.584 10.612 6.578 1024 HH22 ARG 138 2HH2 ARG 138 6.852 10.759 6.459 1025 H ARG 139 H ARG 139 11.735 6.649 2.824 1026 HA ARG 139 HA ARG 139 11.507 4.114 1.528 1027 HE ARG 139 HE ARG 139 15.480 3.096 3.653 1028 HB2 ARG 139 1HB ARG 139 11.201 4.918 4.422 1029 HB3 ARG 139 2HB ARG 139 11.118 3.252 3.863 1030 HG2 ARG 139 1HG ARG 139 13.481 5.104 3.616 1031 HG3 ARG 139 2HG ARG 139 13.321 3.741 4.728 1032 HD2 ARG 139 1HD ARG 139 13.166 2.212 2.818 1033 HD3 ARG 139 2HD ARG 139 13.336 3.575 1.715 1034 HH11 ARG 139 1HH1 ARG 139 14.338 2.982 0.348 1035 HH12 ARG 139 2HH1 ARG 139 15.916 2.719 -0.335 1036 HH21 ARG 139 1HH2 ARG 139 17.556 2.776 2.776 1037 HH22 ARG 139 2HH2 ARG 139 17.759 2.617 1.053 1038 H VAL 140 H VAL 140 9.750 3.805 0.340 1039 HA VAL 140 HA VAL 140 7.130 4.155 1.629 1040 HB VAL 140 HB VAL 140 7.389 5.804 -0.135 1041 HG11 VAL 140 1HG1 VAL 140 7.721 5.153 -2.474 1042 HG12 VAL 140 2HG1 VAL 140 7.952 3.478 -1.968 1043 HG13 VAL 140 3HG1 VAL 140 9.100 4.718 -1.465 1044 HG21 VAL 140 3HG2 VAL 140 5.170 4.848 0.149 1045 HG22 VAL 140 1HG2 VAL 140 5.561 3.565 -0.996 1046 HG23 VAL 140 2HG2 VAL 140 5.464 5.237 -1.546 1047 H VAL 141 H VAL 141 5.716 2.510 1.530 1048 HA VAL 141 HA VAL 141 6.389 0.179 -0.151 1049 HB VAL 141 HB VAL 141 4.904 0.112 2.491 1050 HG11 VAL 141 1HG1 VAL 141 4.219 -1.648 0.959 1051 HG12 VAL 141 2HG1 VAL 141 5.144 -2.321 2.301 1052 HG13 VAL 141 3HG1 VAL 141 5.902 -2.117 0.722 1053 HG21 VAL 141 3HG2 VAL 141 7.737 -0.718 1.870 1054 HG22 VAL 141 1HG2 VAL 141 6.898 -0.999 3.397 1055 HG23 VAL 141 2HG2 VAL 141 7.244 0.649 2.870 1056 H VAL 142 H VAL 142 4.650 -0.710 -1.331 1057 HA VAL 142 HA VAL 142 2.169 0.878 -1.203 1058 HB VAL 142 HB VAL 142 3.560 1.341 -3.236 1059 HG11 VAL 142 1HG1 VAL 142 2.851 -1.499 -3.957 1060 HG12 VAL 142 2HG1 VAL 142 4.466 -0.876 -3.619 1061 HG13 VAL 142 3HG1 VAL 142 3.585 -0.316 -5.041 1062 HG21 VAL 142 3HG2 VAL 142 1.686 1.209 -4.815 1063 HG22 VAL 142 1HG2 VAL 142 1.180 1.796 -3.231 1064 HG23 VAL 142 2HG2 VAL 142 0.839 0.132 -3.706 1065 H ALA 143 H ALA 143 0.273 -0.169 -1.200 1066 HA ALA 143 HA ALA 143 0.266 -3.076 -1.694 1067 HB1 ALA 143 3HB ALA 143 -1.458 -3.312 0.043 1068 HB2 ALA 143 1HB ALA 143 -1.314 -1.594 0.414 1069 HB3 ALA 143 2HB ALA 143 0.047 -2.676 0.708 1070 H LEU 144 H LEU 144 -0.935 -3.497 -3.442 1071 HA LEU 144 HA LEU 144 -3.028 -1.543 -4.153 1072 HG LEU 144 HG LEU 144 -0.143 -1.122 -5.036 1073 HB2 LEU 144 1HB LEU 144 -1.233 -3.152 -5.968 1074 HB3 LEU 144 2HB LEU 144 -2.562 -2.152 -6.519 1075 HD11 LEU 144 1HD1 LEU 144 -0.831 -0.981 -7.969 1076 HD12 LEU 144 2HD1 LEU 144 0.460 -1.942 -7.251 1077 HD13 LEU 144 3HD1 LEU 144 0.533 -0.181 -7.189 1078 HD21 LEU 144 3HD2 LEU 144 -2.390 0.327 -6.434 1079 HD22 LEU 144 1HD2 LEU 144 -0.976 1.078 -5.695 1080 HD23 LEU 144 2HD2 LEU 144 -2.148 0.227 -4.689 1081 H LEU 145 H LEU 145 -5.011 -2.232 -4.609 1082 HA LEU 145 HA LEU 145 -5.525 -5.133 -4.574 1083 HG LEU 145 HG LEU 145 -5.765 -3.189 -2.148 1084 HB2 LEU 145 1HB LEU 145 -7.405 -2.837 -4.001 1085 HB3 LEU 145 2HB LEU 145 -7.814 -4.537 -3.908 1086 HD11 LEU 145 1HD1 LEU 145 -8.626 -3.943 -1.571 1087 HD12 LEU 145 2HD1 LEU 145 -7.989 -2.304 -1.708 1088 HD13 LEU 145 3HD1 LEU 145 -7.460 -3.348 -0.389 1089 HD21 LEU 145 3HD2 LEU 145 -7.072 -5.900 -1.996 1090 HD22 LEU 145 1HD2 LEU 145 -5.937 -5.228 -0.824 1091 HD23 LEU 145 2HD2 LEU 145 -5.402 -5.582 -2.467 1092 HA PRO 146 HA PRO 146 -6.571 -4.159 -8.925 1093 HB2 PRO 146 1HB PRO 146 -6.295 -6.708 -9.816 1094 HB3 PRO 146 2HB PRO 146 -4.922 -5.613 -9.615 1095 HG2 PRO 146 1HG PRO 146 -5.885 -7.794 -7.809 1096 HG3 PRO 146 2HG PRO 146 -4.226 -7.368 -8.263 1097 HD2 PRO 146 1HD PRO 146 -5.349 -6.640 -5.896 1098 HD3 PRO 146 2HD PRO 146 -4.107 -5.670 -6.717 1099 H ASP 147 H ASP 147 -8.585 -4.246 -9.802 1100 HA ASP 147 HA ASP 147 -10.632 -5.596 -8.240 1101 HB2 ASP 147 1HB ASP 147 -11.027 -3.261 -8.767 1102 HB3 ASP 147 2HB ASP 147 -10.829 -3.582 -10.488 1103 H GLY 148 H GLY 148 -12.401 -6.741 -9.329 1104 HA2 GLY 148 1HA GLY 148 -12.440 -7.765 -11.870 1105 HA3 GLY 148 2HA GLY 148 -11.303 -8.789 -11.005 1106 H ASP 149 H ASP 149 -13.303 -7.817 -8.681 1107 HA ASP 149 HA ASP 149 -14.495 -10.336 -8.366 1108 HB2 ASP 149 1HB ASP 149 -14.978 -7.688 -7.017 1109 HB3 ASP 149 2HB ASP 149 -15.845 -9.153 -6.565 1110 H SER 150 H SER 150 -16.051 -11.121 -9.613 1111 HA SER 150 HA SER 150 -18.178 -9.455 -10.607 1112 HG SER 150 HG SER 150 -18.025 -12.998 -9.773 1113 HB2 SER 150 1HB SER 150 -19.156 -11.718 -11.285 1114 HB3 SER 150 2HB SER 150 -17.605 -11.293 -12.009 1115 H LEU 151 H LEU 151 -19.248 -8.564 -8.915 1116 HA LEU 151 HA LEU 151 -19.885 -10.047 -6.551 1117 HG LEU 151 HG LEU 151 -22.246 -8.251 -5.627 1118 HB2 LEU 151 1HB LEU 151 -19.424 -7.628 -6.510 1119 HB3 LEU 151 2HB LEU 151 -20.861 -7.341 -7.471 1120 HD11 LEU 151 1HD1 LEU 151 -21.230 -8.554 -3.419 1121 HD12 LEU 151 2HD1 LEU 151 -19.633 -8.305 -4.122 1122 HD13 LEU 151 3HD1 LEU 151 -20.594 -9.706 -4.593 1123 HD21 LEU 151 3HD2 LEU 151 -21.892 -5.853 -5.835 1124 HD22 LEU 151 1HD2 LEU 151 -20.422 -5.973 -4.868 1125 HD23 LEU 151 2HD2 LEU 151 -21.988 -6.325 -4.138 1126 H GLU 152 H GLU 152 -21.397 -11.543 -6.536 1127 HA GLU 152 HA GLU 152 -23.553 -11.669 -8.374 1128 HB2 GLU 152 1HB GLU 152 -23.173 -13.099 -5.736 1129 HB3 GLU 152 2HB GLU 152 -24.382 -13.507 -6.946 1130 HG2 GLU 152 1HG GLU 152 -22.543 -13.981 -8.542 1131 HG3 GLU 152 2HG GLU 152 -21.394 -13.711 -7.230 1132 H HIS 153 H HIS 153 -25.815 -11.550 -7.857 1133 HA HIS 153 HA HIS 153 -26.370 -9.496 -5.829 1134 HD1 HIS 153 HD1 HIS 153 -27.456 -9.531 -10.359 1135 HD2 HIS 153 HD2 HIS 153 -25.766 -7.304 -7.277 1136 HE1 HIS 153 HE1 HIS 153 -25.959 -7.848 -11.476 1137 HE2 HIS 153 HE2 HIS 153 -24.780 -6.670 -9.588 1138 HB2 HIS 153 1HB HIS 153 -28.131 -10.380 -8.135 1139 HB3 HIS 153 2HB HIS 153 -28.411 -9.008 -7.069 1140 H HIS 154 H HIS 154 -26.482 -10.757 -4.035 1141 HA HIS 154 HA HIS 154 -27.910 -13.280 -4.101 1142 HD1 HIS 154 HD1 HIS 154 -27.299 -15.464 -2.981 1143 HD2 HIS 154 HD2 HIS 154 -26.979 -13.177 0.481 1144 HE1 HIS 154 HE1 HIS 154 -27.834 -17.024 -1.079 1145 HE2 HIS 154 HE2 HIS 154 -27.798 -15.577 0.987 1146 HB2 HIS 154 1HB HIS 154 -25.715 -13.057 -2.970 1147 HB3 HIS 154 2HB HIS 154 -26.432 -11.923 -1.834 1148 H HIS 155 H HIS 155 -29.696 -13.803 -2.845 1149 HA HIS 155 HA HIS 155 -31.307 -11.482 -2.022 1150 HD1 HIS 155 HD1 HIS 155 -34.144 -11.809 -4.330 1151 HD2 HIS 155 HD2 HIS 155 -30.658 -13.930 -5.125 1152 HE1 HIS 155 HE1 HIS 155 -33.803 -11.649 -6.816 1153 HE2 HIS 155 HE2 HIS 155 -31.836 -13.156 -7.290 1154 HB2 HIS 155 1HB HIS 155 -32.216 -14.309 -2.623 1155 HB3 HIS 155 2HB HIS 155 -33.256 -12.928 -2.306 1156 H HIS 156 H HIS 156 -32.092 -11.341 0.059 1157 HA HIS 156 HA HIS 156 -31.036 -13.270 1.968 1158 HD1 HIS 156 HD1 HIS 156 -30.746 -8.963 3.600 1159 HD2 HIS 156 HD2 HIS 156 -29.074 -12.564 2.365 1160 HE1 HIS 156 HE1 HIS 156 -28.259 -8.657 3.794 1161 HE2 HIS 156 HE2 HIS 156 -27.264 -10.789 2.887 1162 HB2 HIS 156 1HB HIS 156 -32.377 -10.598 2.249 1163 HB3 HIS 156 2HB HIS 156 -32.224 -11.674 3.637 1164 H HIS 157 H HIS 157 -33.436 -13.485 -0.011 1165 HA HIS 157 HA HIS 157 -35.555 -14.439 1.661 1166 HD1 HIS 157 HD1 HIS 157 -38.301 -13.941 -0.116 1167 HD2 HIS 157 HD2 HIS 157 -36.406 -17.555 -0.945 1168 HE1 HIS 157 HE1 HIS 157 -40.136 -15.650 -0.291 1169 HE2 HIS 157 HE2 HIS 157 -38.983 -17.799 -0.925 1170 HB2 HIS 157 1HB HIS 157 -35.854 -13.674 -0.713 1171 HB3 HIS 157 2HB HIS 157 -34.971 -15.098 -1.241 1172 H HIS 158 H HIS 158 -32.556 -15.594 0.524 1173 HA HIS 158 HA HIS 158 -32.796 -18.034 2.028 1174 HD1 HIS 158 HD1 HIS 158 -33.972 -20.463 -1.643 1175 HD2 HIS 158 HD2 HIS 158 -33.947 -19.633 2.432 1176 HE1 HIS 158 HE1 HIS 158 -35.542 -22.130 -0.599 1177 HE2 HIS 158 HE2 HIS 158 -35.394 -21.703 1.880 1178 HB2 HIS 158 1HB HIS 158 -33.012 -18.040 -0.891 1179 HB3 HIS 158 2HB HIS 158 -31.704 -19.057 -0.299 Start of MODEL 5 1 HA MET 1 HA MET 1 18.083 6.380 -22.965 2 H1 MET 1 1H MET 1 18.233 9.302 -23.427 3 H2 MET 1 2H MET 1 16.991 8.287 -23.966 4 H3 MET 1 3H MET 1 18.561 8.083 -24.565 5 HB2 MET 1 1HB MET 1 19.975 8.487 -21.893 6 HB3 MET 1 2HB MET 1 19.941 6.806 -21.384 7 HG2 MET 1 1HG MET 1 20.526 6.118 -23.663 8 HG3 MET 1 2HG MET 1 20.601 7.814 -24.141 9 HE1 MET 1 3HE MET 1 22.211 4.977 -21.956 10 HE2 MET 1 1HE MET 1 21.772 6.183 -20.745 11 HE3 MET 1 2HE MET 1 23.470 5.861 -21.095 12 H LYS 2 H LYS 2 18.005 5.987 -20.537 13 HA LYS 2 HA LYS 2 16.307 7.996 -19.208 14 HB2 LYS 2 1HB LYS 2 16.193 4.981 -19.035 15 HB3 LYS 2 2HB LYS 2 15.389 6.039 -17.885 16 HG2 LYS 2 1HG LYS 2 14.114 7.033 -19.762 17 HG3 LYS 2 2HG LYS 2 14.852 5.846 -20.839 18 HD2 LYS 2 1HD LYS 2 13.849 4.034 -19.593 19 HD3 LYS 2 2HD LYS 2 13.209 5.166 -18.402 20 HE2 LYS 2 1HE LYS 2 11.443 4.535 -19.906 21 HE3 LYS 2 2HE LYS 2 11.864 6.221 -20.190 22 HZ1 LYS 2 3HZ LYS 2 11.572 5.084 -22.269 23 HZ2 LYS 2 1HZ LYS 2 12.700 3.892 -21.836 24 HZ3 LYS 2 2HZ LYS 2 13.211 5.488 -22.093 25 H LEU 3 H LEU 3 16.631 8.240 -16.941 26 HA LEU 3 HA LEU 3 19.431 7.785 -16.253 27 HG LEU 3 HG LEU 3 18.004 10.445 -17.074 28 HB2 LEU 3 1HB LEU 3 17.323 9.481 -14.913 29 HB3 LEU 3 2HB LEU 3 19.005 9.392 -14.426 30 HD11 LEU 3 1HD1 LEU 3 17.445 11.930 -15.239 31 HD12 LEU 3 2HD1 LEU 3 18.743 12.620 -16.215 32 HD13 LEU 3 3HD1 LEU 3 19.111 11.871 -14.660 33 HD21 LEU 3 3HD2 LEU 3 20.323 11.176 -17.398 34 HD22 LEU 3 1HD2 LEU 3 20.201 9.421 -17.279 35 HD23 LEU 3 2HD2 LEU 3 20.785 10.358 -15.905 36 H HIS 4 H HIS 4 19.846 5.919 -15.262 37 HA HIS 4 HA HIS 4 17.964 4.481 -13.714 38 HD1 HIS 4 HD1 HIS 4 20.821 3.112 -16.403 39 HD2 HIS 4 HD2 HIS 4 18.028 1.593 -13.718 40 HE1 HIS 4 HE1 HIS 4 19.758 1.149 -17.562 41 HE2 HIS 4 HE2 HIS 4 18.172 0.164 -15.866 42 HB2 HIS 4 1HB HIS 4 20.906 4.258 -14.180 43 HB3 HIS 4 2HB HIS 4 20.196 3.371 -12.834 44 H THR 5 H THR 5 17.155 5.115 -11.889 45 HA THR 5 HA THR 5 18.456 7.185 -10.349 46 HB THR 5 HB THR 5 15.813 5.805 -9.832 47 HG1 THR 5 HG1 THR 5 16.416 7.223 -11.903 48 HG21 THR 5 3HG2 THR 5 16.866 8.488 -8.918 49 HG22 THR 5 1HG2 THR 5 16.715 7.050 -7.908 50 HG23 THR 5 2HG2 THR 5 15.272 7.822 -8.565 51 H ASP 6 H ASP 6 20.101 6.448 -9.163 52 HA ASP 6 HA ASP 6 21.261 5.444 -7.505 53 HB2 ASP 6 1HB ASP 6 18.456 5.197 -6.461 54 HB3 ASP 6 2HB ASP 6 19.813 4.516 -5.567 55 HA PRO 7 HA PRO 7 20.961 1.290 -9.344 56 HB2 PRO 7 1HB PRO 7 23.871 1.367 -9.297 57 HB3 PRO 7 2HB PRO 7 22.786 1.276 -10.685 58 HG2 PRO 7 1HG PRO 7 24.279 3.470 -10.126 59 HG3 PRO 7 2HG PRO 7 22.705 3.554 -10.938 60 HD2 PRO 7 1HD PRO 7 23.384 4.064 -8.063 61 HD3 PRO 7 2HD PRO 7 22.299 4.969 -9.142 62 H ALA 8 H ALA 8 21.217 2.120 -6.381 63 HA ALA 8 HA ALA 8 22.992 0.186 -5.229 64 HB1 ALA 8 3HB ALA 8 21.972 0.827 -3.100 65 HB2 ALA 8 1HB ALA 8 20.734 1.739 -3.962 66 HB3 ALA 8 2HB ALA 8 22.421 2.247 -4.044 67 H THR 9 H THR 9 19.517 0.410 -5.789 68 HA THR 9 HA THR 9 19.312 -2.489 -5.370 69 HB THR 9 HB THR 9 16.985 -2.007 -4.421 70 HG1 THR 9 HG1 THR 9 17.210 0.325 -5.067 71 HG21 THR 9 3HG2 THR 9 17.845 -1.644 -2.152 72 HG22 THR 9 1HG2 THR 9 19.403 -1.159 -2.822 73 HG23 THR 9 2HG2 THR 9 18.828 -2.813 -3.033 74 H ALA 10 H ALA 10 17.676 -3.528 -6.603 75 HA ALA 10 HA ALA 10 17.132 -2.233 -9.117 76 HB1 ALA 10 3HB ALA 10 16.233 -4.929 -8.098 77 HB2 ALA 10 1HB ALA 10 17.694 -4.613 -9.036 78 HB3 ALA 10 2HB ALA 10 16.108 -4.354 -9.761 79 H LEU 11 H LEU 11 15.575 -0.778 -9.247 80 HA LEU 11 HA LEU 11 13.447 -0.612 -7.363 81 HG LEU 11 HG LEU 11 15.680 1.354 -8.422 82 HB2 LEU 11 1HB LEU 11 13.845 0.854 -9.972 83 HB3 LEU 11 2HB LEU 11 12.678 1.279 -8.736 84 HD11 LEU 11 1HD1 LEU 11 15.384 3.774 -8.337 85 HD12 LEU 11 2HD1 LEU 11 13.658 3.578 -8.643 86 HD13 LEU 11 3HD1 LEU 11 14.829 3.116 -9.877 87 HD21 LEU 11 3HD2 LEU 11 15.223 2.424 -6.273 88 HD22 LEU 11 1HD2 LEU 11 14.560 0.790 -6.330 89 HD23 LEU 11 2HD2 LEU 11 13.493 2.182 -6.518 90 H ASN 12 H ASN 12 11.675 -1.809 -7.380 91 HA ASN 12 HA ASN 12 10.738 -3.041 -9.838 92 HB2 ASN 12 1HB ASN 12 9.965 -3.309 -6.943 93 HB3 ASN 12 2HB ASN 12 8.924 -3.942 -8.212 94 HD21 ASN 12 2HD2 ASN 12 12.413 -3.917 -8.478 95 HD22 ASN 12 1HD2 ASN 12 12.623 -5.631 -8.347 96 H THR 13 H THR 13 9.473 -1.943 -11.145 97 HA THR 13 HA THR 13 7.598 0.028 -10.011 98 HB THR 13 HB THR 13 8.755 0.033 -12.809 99 HG1 THR 13 HG1 THR 13 9.852 0.824 -10.434 100 HG21 THR 13 3HG2 THR 13 6.640 1.244 -12.563 101 HG22 THR 13 1HG2 THR 13 7.978 2.357 -12.849 102 HG23 THR 13 2HG2 THR 13 7.320 2.169 -11.224 103 H VAL 14 H VAL 14 5.464 -0.042 -10.670 104 HA VAL 14 HA VAL 14 4.374 -2.378 -11.786 105 HB VAL 14 HB VAL 14 3.138 0.386 -11.766 106 HG11 VAL 14 1HG1 VAL 14 1.999 -1.140 -13.282 107 HG12 VAL 14 2HG1 VAL 14 0.998 -0.806 -11.870 108 HG13 VAL 14 3HG1 VAL 14 1.862 -2.339 -11.995 109 HG21 VAL 14 3HG2 VAL 14 3.803 -0.300 -9.522 110 HG22 VAL 14 1HG2 VAL 14 2.949 -1.830 -9.724 111 HG23 VAL 14 2HG2 VAL 14 2.047 -0.314 -9.686 112 H THR 15 H THR 15 4.523 -3.082 -13.798 113 HA THR 15 HA THR 15 5.620 -1.307 -15.813 114 HB THR 15 HB THR 15 5.034 -4.246 -16.149 115 HG1 THR 15 HG1 THR 15 6.781 -3.023 -14.430 116 HG21 THR 15 3HG2 THR 15 6.956 -4.134 -17.670 117 HG22 THR 15 1HG2 THR 15 7.141 -2.417 -17.314 118 HG23 THR 15 2HG2 THR 15 5.700 -2.994 -18.153 119 H ALA 16 H ALA 16 2.795 -3.434 -15.415 120 HA ALA 16 HA ALA 16 1.277 -1.714 -17.195 121 HB1 ALA 16 3HB ALA 16 1.590 -4.655 -17.789 122 HB2 ALA 16 1HB ALA 16 2.298 -3.336 -18.724 123 HB3 ALA 16 2HB ALA 16 0.545 -3.523 -18.647 124 H TYR 17 H TYR 17 -0.856 -1.663 -16.697 125 HA TYR 17 HA TYR 17 -2.100 -3.746 -15.143 126 HD1 TYR 17 HD1 TYR 17 -3.199 -4.300 -13.140 127 HD2 TYR 17 HD2 TYR 17 -3.156 -0.086 -12.563 128 HE1 TYR 17 HE1 TYR 17 -5.166 -4.487 -11.677 129 HE2 TYR 17 HE2 TYR 17 -5.120 -0.257 -11.099 130 HH TYR 17 HH TYR 17 -6.987 -1.778 -10.686 131 HB2 TYR 17 1HB TYR 17 -1.002 -2.551 -13.348 132 HB3 TYR 17 2HB TYR 17 -1.594 -1.010 -13.953 133 H GLY 18 H GLY 18 -3.782 -3.969 -16.478 134 HA2 GLY 18 1HA GLY 18 -5.783 -1.906 -16.521 135 HA3 GLY 18 2HA GLY 18 -5.015 -2.125 -18.084 136 H ASP 19 H ASP 19 -4.649 -5.037 -17.620 137 HA ASP 19 HA ASP 19 -7.135 -5.878 -18.721 138 HB2 ASP 19 1HB ASP 19 -4.785 -7.507 -17.739 139 HB3 ASP 19 2HB ASP 19 -6.116 -8.113 -18.705 140 H GLY 20 H GLY 20 -5.744 -5.865 -15.546 141 HA2 GLY 20 1HA GLY 20 -7.606 -6.115 -13.805 142 HA3 GLY 20 2HA GLY 20 -7.837 -7.687 -14.561 143 H TYR 21 H TYR 21 -4.759 -7.503 -14.970 144 HA TYR 21 HA TYR 21 -4.051 -8.454 -12.280 145 HD1 TYR 21 HD1 TYR 21 -0.793 -8.296 -14.838 146 HD2 TYR 21 HD2 TYR 21 -4.417 -10.020 -16.248 147 HE1 TYR 21 HE1 TYR 21 -0.082 -7.882 -17.154 148 HE2 TYR 21 HE2 TYR 21 -3.713 -9.614 -18.567 149 HH TYR 21 HH TYR 21 -2.186 -7.983 -19.748 150 HB2 TYR 21 1HB TYR 21 -2.245 -9.747 -13.384 151 HB3 TYR 21 2HB TYR 21 -3.839 -10.219 -13.960 152 H ILE 22 H ILE 22 -1.938 -7.893 -11.493 153 HA ILE 22 HA ILE 22 -1.028 -5.308 -12.551 154 HB ILE 22 HB ILE 22 -0.309 -6.596 -9.911 155 HG12 ILE 22 1HG1 ILE 22 -2.346 -4.432 -10.493 156 HG13 ILE 22 2HG1 ILE 22 -2.728 -6.095 -10.063 157 HG21 ILE 22 1HG2 ILE 22 1.334 -4.982 -10.706 158 HG22 ILE 22 2HG2 ILE 22 0.464 -4.345 -9.310 159 HG23 ILE 22 3HG2 ILE 22 0.064 -3.781 -10.933 160 HD11 ILE 22 3HD1 ILE 22 -1.300 -4.102 -8.319 161 HD12 ILE 22 1HD1 ILE 22 -1.675 -5.769 -7.885 162 HD13 ILE 22 2HD1 ILE 22 -2.980 -4.615 -8.161 163 H GLU 23 H GLU 23 0.592 -5.461 -13.959 164 HA GLU 23 HA GLU 23 2.420 -7.731 -13.788 165 HB2 GLU 23 1HB GLU 23 1.399 -7.223 -15.971 166 HB3 GLU 23 2HB GLU 23 2.128 -5.623 -15.936 167 HG2 GLU 23 1HG GLU 23 4.350 -6.633 -15.955 168 HG3 GLU 23 2HG GLU 23 3.619 -8.236 -15.997 169 H VAL 24 H VAL 24 4.129 -7.477 -12.569 170 HA VAL 24 HA VAL 24 5.577 -4.911 -12.680 171 HB VAL 24 HB VAL 24 5.462 -6.820 -10.331 172 HG11 VAL 24 1HG1 VAL 24 6.710 -5.097 -9.128 173 HG12 VAL 24 2HG1 VAL 24 6.794 -4.127 -10.598 174 HG13 VAL 24 3HG1 VAL 24 7.614 -5.687 -10.524 175 HG21 VAL 24 3HG2 VAL 24 4.225 -5.070 -9.175 176 HG22 VAL 24 1HG2 VAL 24 3.364 -5.590 -10.625 177 HG23 VAL 24 2HG2 VAL 24 4.259 -4.069 -10.628 178 H ASN 25 H ASN 25 7.281 -5.221 -13.940 179 HA ASN 25 HA ASN 25 9.205 -6.061 -14.809 180 HB2 ASN 25 1HB ASN 25 9.864 -6.151 -12.387 181 HB3 ASN 25 2HB ASN 25 9.307 -7.820 -12.344 182 HD21 ASN 25 2HD2 ASN 25 11.318 -8.632 -11.845 183 HD22 ASN 25 1HD2 ASN 25 12.620 -8.684 -12.983 184 H GLN 26 H GLN 26 6.873 -7.064 -15.766 185 HA GLN 26 HA GLN 26 6.198 -8.592 -17.295 186 HB2 GLN 26 1HB GLN 26 8.800 -9.987 -16.656 187 HB3 GLN 26 2HB GLN 26 7.697 -10.467 -17.940 188 HG2 GLN 26 1HG GLN 26 8.066 -8.457 -19.135 189 HG3 GLN 26 2HG GLN 26 8.917 -7.728 -17.774 190 HE21 GLN 26 2HE2 GLN 26 9.775 -8.138 -20.524 191 HE22 GLN 26 1HE2 GLN 26 11.246 -9.044 -20.432 192 H VAL 27 H VAL 27 6.610 -9.225 -14.055 193 HA VAL 27 HA VAL 27 5.393 -11.867 -14.131 194 HB VAL 27 HB VAL 27 5.972 -10.150 -11.710 195 HG11 VAL 27 1HG1 VAL 27 5.416 -13.104 -11.982 196 HG12 VAL 27 2HG1 VAL 27 4.318 -11.895 -11.317 197 HG13 VAL 27 3HG1 VAL 27 5.827 -12.268 -10.483 198 HG21 VAL 27 3HG2 VAL 27 7.990 -11.503 -11.419 199 HG22 VAL 27 1HG2 VAL 27 8.033 -10.605 -12.937 200 HG23 VAL 27 2HG2 VAL 27 7.659 -12.329 -12.942 201 H ARG 28 H ARG 28 3.282 -12.105 -14.291 202 HA ARG 28 HA ARG 28 1.561 -9.789 -13.903 203 HE ARG 28 HE ARG 28 2.023 -12.446 -19.215 204 HB2 ARG 28 1HB ARG 28 0.767 -12.504 -14.959 205 HB3 ARG 28 2HB ARG 28 -0.074 -10.974 -15.178 206 HG2 ARG 28 1HG ARG 28 1.841 -10.150 -16.498 207 HG3 ARG 28 2HG ARG 28 2.594 -11.737 -16.343 208 HD2 ARG 28 1HD ARG 28 0.591 -12.718 -17.457 209 HD3 ARG 28 2HD ARG 28 0.000 -11.077 -17.731 210 HH11 ARG 28 1HH1 ARG 28 0.931 -9.294 -18.178 211 HH12 ARG 28 2HH1 ARG 28 1.889 -8.424 -19.330 212 HH21 ARG 28 1HH2 ARG 28 3.247 -11.311 -20.795 213 HH22 ARG 28 2HH2 ARG 28 3.176 -9.577 -20.842 214 H PHE 29 H PHE 29 1.045 -9.518 -11.820 215 HA PHE 29 HA PHE 29 0.507 -11.805 -10.114 216 HD1 PHE 29 HD2 PHE 29 1.988 -11.637 -7.670 217 HD2 PHE 29 HD1 PHE 29 2.740 -8.345 -10.258 218 HE1 PHE 29 HE2 PHE 29 4.398 -11.841 -7.222 219 HE2 PHE 29 HE1 PHE 29 5.151 -8.542 -9.815 220 HZ PHE 29 HZ PHE 29 5.984 -10.292 -8.295 221 HB2 PHE 29 1HB PHE 29 0.528 -8.834 -9.551 222 HB3 PHE 29 2HB PHE 29 0.203 -10.067 -8.338 223 H SER 30 H SER 30 -1.427 -12.598 -9.707 224 HA SER 30 HA SER 30 -3.782 -11.055 -10.553 225 HG SER 30 HG SER 30 -3.400 -12.429 -12.344 226 HB2 SER 30 1HB SER 30 -3.490 -14.024 -10.029 227 HB3 SER 30 2HB SER 30 -4.951 -13.223 -10.608 228 H HIS 31 H HIS 31 -2.154 -11.045 -7.935 229 HA HIS 31 HA HIS 31 -4.488 -11.317 -6.140 230 HD1 HIS 31 HD1 HIS 31 0.054 -12.681 -5.372 231 HD2 HIS 31 HD2 HIS 31 -3.670 -14.345 -6.169 232 HE1 HIS 31 HE1 HIS 31 0.515 -15.023 -6.108 233 HE2 HIS 31 HE2 HIS 31 -1.761 -16.092 -6.304 234 HB2 HIS 31 1HB HIS 31 -1.727 -11.075 -5.015 235 HB3 HIS 31 2HB HIS 31 -3.135 -11.868 -4.337 236 H ALA 32 H ALA 32 -4.397 -9.667 -4.310 237 HA ALA 32 HA ALA 32 -3.562 -7.057 -5.159 238 HB1 ALA 32 3HB ALA 32 -4.389 -8.092 -2.438 239 HB2 ALA 32 1HB ALA 32 -5.430 -7.286 -3.611 240 HB3 ALA 32 2HB ALA 32 -4.121 -6.395 -2.837 241 H ILE 33 H ILE 33 -1.609 -6.007 -4.569 242 HA ILE 33 HA ILE 33 0.282 -7.711 -3.104 243 HB ILE 33 HB ILE 33 2.076 -7.156 -4.767 244 HG12 ILE 33 1HG1 ILE 33 -0.270 -6.445 -6.539 245 HG13 ILE 33 2HG1 ILE 33 0.868 -5.284 -5.866 246 HG21 ILE 33 1HG2 ILE 33 1.415 -8.928 -6.348 247 HG22 ILE 33 2HG2 ILE 33 -0.227 -8.862 -5.710 248 HG23 ILE 33 3HG2 ILE 33 1.103 -9.371 -4.669 249 HD11 ILE 33 3HD1 ILE 33 1.535 -7.501 -7.787 250 HD12 ILE 33 1HD1 ILE 33 2.680 -6.344 -7.110 251 HD13 ILE 33 2HD1 ILE 33 1.391 -5.788 -8.177 252 H ALA 34 H ALA 34 1.860 -6.733 -2.001 253 HA ALA 34 HA ALA 34 2.023 -3.796 -2.105 254 HB1 ALA 34 3HB ALA 34 2.088 -5.510 0.382 255 HB2 ALA 34 1HB ALA 34 0.757 -4.465 -0.116 256 HB3 ALA 34 2HB ALA 34 2.313 -3.762 0.325 257 H PHE 35 H PHE 35 4.054 -3.089 -2.443 258 HA PHE 35 HA PHE 35 6.303 -4.683 -1.546 259 HD1 PHE 35 HD2 PHE 35 3.842 -4.903 -4.822 260 HD2 PHE 35 HD1 PHE 35 7.557 -2.870 -5.240 261 HE1 PHE 35 HE2 PHE 35 2.976 -3.733 -6.805 262 HE2 PHE 35 HE1 PHE 35 6.697 -1.700 -7.227 263 HZ PHE 35 HZ PHE 35 4.404 -2.130 -8.011 264 HB2 PHE 35 1HB PHE 35 7.368 -4.735 -3.782 265 HB3 PHE 35 2HB PHE 35 5.899 -5.695 -3.702 266 H ALA 36 H ALA 36 8.379 -3.608 -1.931 267 HA ALA 36 HA ALA 36 8.202 -0.701 -2.229 268 HB1 ALA 36 3HB ALA 36 9.492 -0.339 -0.195 269 HB2 ALA 36 1HB ALA 36 9.522 -2.075 0.115 270 HB3 ALA 36 2HB ALA 36 7.996 -1.196 0.175 271 HA PRO 37 HA PRO 37 12.058 -0.833 -4.458 272 HB2 PRO 37 1HB PRO 37 13.236 0.817 -2.261 273 HB3 PRO 37 2HB PRO 37 13.307 1.060 -4.011 274 HG2 PRO 37 1HG PRO 37 11.659 2.512 -2.514 275 HG3 PRO 37 2HG PRO 37 11.158 1.928 -4.112 276 HD2 PRO 37 1HD PRO 37 10.358 0.974 -1.408 277 HD3 PRO 37 2HD PRO 37 9.426 1.007 -2.916 278 H GLU 38 H GLU 38 12.370 -1.218 -0.943 279 HA GLU 38 HA GLU 38 14.264 -3.410 -1.456 280 HB2 GLU 38 1HB GLU 38 14.305 -1.400 0.793 281 HB3 GLU 38 2HB GLU 38 15.227 -2.897 0.824 282 HG2 GLU 38 1HG GLU 38 16.172 -2.063 -1.440 283 HG3 GLU 38 2HG GLU 38 15.584 -0.490 -0.901 284 H GLY 39 H GLY 39 11.405 -3.551 -1.282 285 HA2 GLY 39 1HA GLY 39 11.154 -5.135 1.202 286 HA3 GLY 39 2HA GLY 39 9.835 -4.159 0.569 287 HA PRO 40 HA PRO 40 10.008 -8.564 -1.369 288 HB2 PRO 40 1HB PRO 40 8.085 -9.378 0.704 289 HB3 PRO 40 2HB PRO 40 9.530 -10.213 0.129 290 HG2 PRO 40 1HG PRO 40 9.424 -9.076 2.564 291 HG3 PRO 40 2HG PRO 40 10.917 -9.114 1.607 292 HD2 PRO 40 1HD PRO 40 8.981 -6.863 2.014 293 HD3 PRO 40 2HD PRO 40 10.757 -6.829 1.976 294 H VAL 41 H VAL 41 8.395 -9.130 -2.810 295 HA VAL 41 HA VAL 41 6.137 -7.337 -2.992 296 HB VAL 41 HB VAL 41 6.701 -9.761 -4.710 297 HG11 VAL 41 1HG1 VAL 41 4.420 -8.953 -4.883 298 HG12 VAL 41 2HG1 VAL 41 5.309 -8.578 -6.361 299 HG13 VAL 41 3HG1 VAL 41 5.001 -7.313 -5.170 300 HG21 VAL 41 3HG2 VAL 41 7.753 -8.236 -6.297 301 HG22 VAL 41 1HG2 VAL 41 8.609 -8.226 -4.754 302 HG23 VAL 41 2HG2 VAL 41 7.526 -6.897 -5.172 303 H ALA 42 H ALA 42 4.896 -7.768 -1.206 304 HA ALA 42 HA ALA 42 4.242 -10.480 -0.480 305 HB1 ALA 42 3HB ALA 42 3.259 -7.874 0.675 306 HB2 ALA 42 1HB ALA 42 4.660 -8.786 1.238 307 HB3 ALA 42 2HB ALA 42 3.041 -9.474 1.383 308 H SER 43 H SER 43 2.602 -11.593 -1.242 309 HA SER 43 HA SER 43 0.458 -10.324 -2.699 310 HG SER 43 HG SER 43 2.328 -12.851 -3.538 311 HB2 SER 43 1HB SER 43 0.950 -13.214 -1.946 312 HB3 SER 43 2HB SER 43 -0.395 -12.663 -2.946 313 H TRP 44 H TRP 44 -1.339 -9.617 -1.857 314 HA TRP 44 HA TRP 44 -1.933 -10.210 0.958 315 HD1 TRP 44 HD1 TRP 44 -2.268 -9.454 2.775 316 HE1 TRP 44 HE1 TRP 44 -3.018 -7.872 4.664 317 HE3 TRP 44 HE3 TRP 44 -3.516 -5.366 -0.032 318 HZ2 TRP 44 HZ2 TRP 44 -4.007 -5.233 4.923 319 HZ3 TRP 44 HZ3 TRP 44 -4.353 -3.356 1.114 320 HH2 TRP 44 HH2 TRP 44 -4.594 -3.296 3.541 321 HB2 TRP 44 1HB TRP 44 -1.522 -7.826 -0.189 322 HB3 TRP 44 2HB TRP 44 -3.235 -7.985 -0.548 323 HA PRO 45 HA PRO 45 -5.404 -12.482 -0.749 324 HB2 PRO 45 1HB PRO 45 -6.348 -13.471 1.567 325 HB3 PRO 45 2HB PRO 45 -4.855 -14.071 0.834 326 HG2 PRO 45 1HG PRO 45 -5.215 -12.133 3.084 327 HG3 PRO 45 2HG PRO 45 -4.058 -13.467 2.932 328 HD2 PRO 45 1HD PRO 45 -3.431 -10.848 2.444 329 HD3 PRO 45 2HD PRO 45 -2.599 -12.217 1.681 330 H VAL 46 H VAL 46 -5.525 -9.553 0.473 331 HA VAL 46 HA VAL 46 -8.341 -9.526 1.262 332 HB VAL 46 HB VAL 46 -6.335 -7.263 1.261 333 HG11 VAL 46 1HG1 VAL 46 -7.955 -6.122 2.701 334 HG12 VAL 46 2HG1 VAL 46 -9.075 -7.470 2.500 335 HG13 VAL 46 3HG1 VAL 46 -8.631 -6.479 1.111 336 HG21 VAL 46 3HG2 VAL 46 -7.286 -9.010 3.527 337 HG22 VAL 46 1HG2 VAL 46 -6.251 -7.591 3.689 338 HG23 VAL 46 2HG2 VAL 46 -5.673 -9.007 2.814 339 H GLN 47 H GLN 47 -9.754 -9.357 -0.337 340 HA GLN 47 HA GLN 47 -9.020 -8.074 -2.844 341 HB2 GLN 47 1HB GLN 47 -11.563 -9.492 -2.027 342 HB3 GLN 47 2HB GLN 47 -11.200 -8.908 -3.643 343 HG2 GLN 47 1HG GLN 47 -9.347 -10.465 -3.814 344 HG3 GLN 47 2HG GLN 47 -9.648 -11.023 -2.168 345 HE21 GLN 47 2HE2 GLN 47 -9.678 -12.491 -4.700 346 HE22 GLN 47 1HE2 GLN 47 -11.243 -13.212 -4.821 347 H ARG 48 H ARG 48 -10.907 -7.466 -0.008 348 HA ARG 48 HA ARG 48 -12.177 -5.149 -1.306 349 HE ARG 48 HE ARG 48 -15.377 -9.431 -1.518 350 HB2 ARG 48 1HB ARG 48 -13.160 -6.596 1.156 351 HB3 ARG 48 2HB ARG 48 -14.032 -5.415 0.183 352 HG2 ARG 48 1HG ARG 48 -14.340 -6.925 -1.578 353 HG3 ARG 48 2HG ARG 48 -13.109 -8.027 -0.960 354 HD2 ARG 48 1HD ARG 48 -14.638 -8.265 1.086 355 HD3 ARG 48 2HD ARG 48 -15.882 -7.535 0.070 356 HH11 ARG 48 1HH1 ARG 48 -14.896 -9.718 1.932 357 HH12 ARG 48 2HH1 ARG 48 -15.088 -11.445 1.951 358 HH21 ARG 48 1HH2 ARG 48 -15.579 -11.688 -1.528 359 HH22 ARG 48 2HH2 ARG 48 -15.453 -12.576 -0.035 360 HA PRO 49 HA PRO 49 -9.585 -2.738 1.390 361 HB2 PRO 49 1HB PRO 49 -10.865 -0.350 0.983 362 HB3 PRO 49 2HB PRO 49 -9.681 -1.044 -0.129 363 HG2 PRO 49 1HG PRO 49 -12.666 -1.091 -0.264 364 HG3 PRO 49 2HG PRO 49 -11.487 -0.849 -1.567 365 HD2 PRO 49 1HD PRO 49 -12.735 -3.206 -1.178 366 HD3 PRO 49 2HD PRO 49 -11.066 -3.107 -1.777 367 H ALA 50 H ALA 50 -12.772 -3.560 1.933 368 HA ALA 50 HA ALA 50 -13.045 -1.967 4.364 369 HB1 ALA 50 3HB ALA 50 -15.299 -2.880 4.483 370 HB2 ALA 50 1HB ALA 50 -14.957 -3.931 3.108 371 HB3 ALA 50 2HB ALA 50 -14.989 -2.181 2.893 372 H ASP 51 H ASP 51 -11.908 -4.992 3.353 373 HA ASP 51 HA ASP 51 -12.517 -6.400 5.813 374 HB2 ASP 51 1HB ASP 51 -10.766 -7.198 3.472 375 HB3 ASP 51 2HB ASP 51 -11.199 -8.244 4.816 376 H ILE 52 H ILE 52 -10.333 -4.124 4.890 377 HA ILE 52 HA ILE 52 -7.899 -5.154 5.919 378 HB ILE 52 HB ILE 52 -8.680 -2.274 5.441 379 HG12 ILE 52 1HG1 ILE 52 -7.247 -4.244 3.640 380 HG13 ILE 52 2HG1 ILE 52 -8.901 -3.679 3.424 381 HG21 ILE 52 1HG2 ILE 52 -6.737 -2.471 6.884 382 HG22 ILE 52 2HG2 ILE 52 -6.259 -1.884 5.291 383 HG23 ILE 52 3HG2 ILE 52 -5.971 -3.567 5.734 384 HD11 ILE 52 3HD1 ILE 52 -6.421 -1.978 3.292 385 HD12 ILE 52 1HD1 ILE 52 -8.077 -1.407 3.084 386 HD13 ILE 52 2HD1 ILE 52 -7.381 -2.536 1.921 387 H THR 53 H THR 53 -7.160 -5.229 7.919 388 HA THR 53 HA THR 53 -8.504 -3.673 10.023 389 HB THR 53 HB THR 53 -7.461 -5.324 11.593 390 HG1 THR 53 HG1 THR 53 -6.941 -7.384 10.176 391 HG21 THR 53 3HG2 THR 53 -9.241 -6.536 9.472 392 HG22 THR 53 1HG2 THR 53 -9.786 -5.611 10.872 393 HG23 THR 53 2HG2 THR 53 -8.993 -7.170 11.100 394 H ALA 54 H ALA 54 -6.796 -3.382 11.941 395 HA ALA 54 HA ALA 54 -4.697 -1.727 10.964 396 HB1 ALA 54 3HB ALA 54 -5.760 -1.322 13.132 397 HB2 ALA 54 1HB ALA 54 -4.020 -1.547 13.310 398 HB3 ALA 54 2HB ALA 54 -5.125 -2.854 13.735 399 H SER 55 H SER 55 -4.950 -5.022 12.109 400 HA SER 55 HA SER 55 -2.207 -5.652 12.196 401 HG SER 55 HG SER 55 -4.409 -7.829 13.914 402 HB2 SER 55 1HB SER 55 -4.466 -7.550 11.535 403 HB3 SER 55 2HB SER 55 -2.918 -7.942 12.286 404 H LEU 56 H LEU 56 -4.638 -5.872 9.628 405 HA LEU 56 HA LEU 56 -2.972 -7.100 7.711 406 HG LEU 56 HG LEU 56 -5.864 -7.639 8.351 407 HB2 LEU 56 1HB LEU 56 -5.442 -5.407 7.431 408 HB3 LEU 56 2HB LEU 56 -4.625 -6.121 6.054 409 HD11 LEU 56 1HD1 LEU 56 -7.449 -8.414 6.641 410 HD12 LEU 56 2HD1 LEU 56 -6.712 -7.312 5.479 411 HD13 LEU 56 3HD1 LEU 56 -7.540 -6.674 6.899 412 HD21 LEU 56 3HD2 LEU 56 -3.894 -8.769 7.467 413 HD22 LEU 56 1HD2 LEU 56 -4.539 -8.631 5.832 414 HD23 LEU 56 2HD2 LEU 56 -5.369 -9.630 7.026 415 H LEU 57 H LEU 57 -3.555 -3.720 8.530 416 HA LEU 57 HA LEU 57 -2.125 -2.583 6.392 417 HG LEU 57 HG LEU 57 -4.658 -1.661 7.701 418 HB2 LEU 57 1HB LEU 57 -2.684 -1.589 9.179 419 HB3 LEU 57 2HB LEU 57 -1.834 -0.629 7.983 420 HD11 LEU 57 1HD1 LEU 57 -5.284 0.705 7.926 421 HD12 LEU 57 2HD1 LEU 57 -3.601 1.106 8.270 422 HD13 LEU 57 3HD1 LEU 57 -4.509 0.081 9.381 423 HD21 LEU 57 3HD2 LEU 57 -4.744 -0.245 5.716 424 HD22 LEU 57 1HD2 LEU 57 -3.490 -1.474 5.558 425 HD23 LEU 57 2HD2 LEU 57 -3.049 0.190 5.941 426 H GLN 58 H GLN 58 -1.092 -3.791 9.537 427 HA GLN 58 HA GLN 58 1.592 -2.915 9.363 428 HB2 GLN 58 1HB GLN 58 0.432 -5.269 10.867 429 HB3 GLN 58 2HB GLN 58 2.042 -4.605 11.112 430 HG2 GLN 58 1HG GLN 58 1.063 -2.485 11.818 431 HG3 GLN 58 2HG GLN 58 -0.551 -3.147 11.568 432 HE21 GLN 58 2HE2 GLN 58 0.680 -2.095 13.985 433 HE22 GLN 58 1HE2 GLN 58 0.592 -3.362 15.163 434 H GLN 59 H GLN 59 -0.029 -5.899 8.369 435 HA GLN 59 HA GLN 59 2.305 -7.223 7.464 436 HB2 GLN 59 1HB GLN 59 -0.610 -7.570 6.767 437 HB3 GLN 59 2HB GLN 59 0.656 -8.593 6.102 438 HG2 GLN 59 1HG GLN 59 1.270 -9.304 8.356 439 HG3 GLN 59 2HG GLN 59 0.003 -8.277 9.024 440 HE21 GLN 59 2HE2 GLN 59 0.410 -11.201 9.157 441 HE22 GLN 59 1HE2 GLN 59 -1.057 -11.892 8.542 442 H ALA 60 H ALA 60 -0.029 -5.099 5.872 443 HA ALA 60 HA ALA 60 1.042 -5.376 3.258 444 HB1 ALA 60 3HB ALA 60 -0.322 -3.445 2.693 445 HB2 ALA 60 1HB ALA 60 -0.589 -3.116 4.406 446 HB3 ALA 60 2HB ALA 60 -1.236 -4.588 3.679 447 H ALA 61 H ALA 61 1.895 -3.412 5.991 448 HA ALA 61 HA ALA 61 3.541 -1.594 4.468 449 HB1 ALA 61 3HB ALA 61 4.170 -0.665 6.627 450 HB2 ALA 61 1HB ALA 61 3.379 -2.007 7.456 451 HB3 ALA 61 2HB ALA 61 2.419 -0.856 6.523 452 H GLY 62 H GLY 62 3.886 -4.750 5.270 453 HA2 GLY 62 1HA GLY 62 5.697 -6.164 5.136 454 HA3 GLY 62 2HA GLY 62 6.686 -4.774 4.719 455 H LEU 63 H LEU 63 4.787 -4.820 7.632 456 HA LEU 63 HA LEU 63 7.220 -4.477 9.165 457 HG LEU 63 HG LEU 63 4.973 -2.470 8.516 458 HB2 LEU 63 1HB LEU 63 4.328 -4.336 9.995 459 HB3 LEU 63 2HB LEU 63 5.692 -3.968 11.034 460 HD11 LEU 63 1HD1 LEU 63 4.334 -0.680 10.035 461 HD12 LEU 63 2HD1 LEU 63 4.678 -1.725 11.414 462 HD13 LEU 63 3HD1 LEU 63 3.367 -2.129 10.307 463 HD21 LEU 63 3HD2 LEU 63 6.675 -0.883 9.229 464 HD22 LEU 63 1HD2 LEU 63 7.380 -2.481 8.981 465 HD23 LEU 63 2HD2 LEU 63 7.063 -1.900 10.616 466 H ALA 64 H ALA 64 7.616 -6.758 8.448 467 HA ALA 64 HA ALA 64 6.993 -8.489 10.736 468 HB1 ALA 64 3HB ALA 64 5.599 -9.260 8.881 469 HB2 ALA 64 1HB ALA 64 6.857 -10.439 9.251 470 HB3 ALA 64 2HB ALA 64 7.025 -9.382 7.850 471 H GLU 65 H GLU 65 8.801 -9.251 11.653 472 HA GLU 65 HA GLU 65 11.338 -8.447 10.653 473 HB2 GLU 65 1HB GLU 65 10.697 -10.374 12.892 474 HB3 GLU 65 2HB GLU 65 12.249 -9.596 12.609 475 HG2 GLU 65 1HG GLU 65 11.237 -7.413 13.008 476 HG3 GLU 65 2HG GLU 65 9.674 -8.185 13.281 477 H VAL 66 H VAL 66 12.101 -9.350 8.870 478 HA VAL 66 HA VAL 66 11.995 -12.279 8.590 479 HB VAL 66 HB VAL 66 12.389 -10.210 6.415 480 HG11 VAL 66 1HG1 VAL 66 13.447 -12.338 5.894 481 HG12 VAL 66 2HG1 VAL 66 12.033 -12.076 4.872 482 HG13 VAL 66 3HG1 VAL 66 11.939 -13.187 6.238 483 HG21 VAL 66 3HG2 VAL 66 9.940 -11.838 7.082 484 HG22 VAL 66 1HG2 VAL 66 10.123 -10.768 5.693 485 HG23 VAL 66 2HG2 VAL 66 10.129 -10.101 7.325 486 H VAL 67 H VAL 67 13.841 -13.404 8.382 487 HA VAL 67 HA VAL 67 16.034 -13.942 8.158 488 HB VAL 67 HB VAL 67 16.413 -11.075 7.277 489 HG11 VAL 67 1HG1 VAL 67 18.485 -11.949 8.222 490 HG12 VAL 67 2HG1 VAL 67 18.613 -11.784 6.471 491 HG13 VAL 67 3HG1 VAL 67 18.366 -13.374 7.190 492 HG21 VAL 67 3HG2 VAL 67 15.060 -12.384 5.743 493 HG22 VAL 67 1HG2 VAL 67 16.280 -13.658 5.724 494 HG23 VAL 67 2HG2 VAL 67 16.649 -12.076 5.041 495 H ARG 68 H ARG 68 17.052 -14.436 9.929 496 HA ARG 68 HA ARG 68 17.194 -12.630 12.169 497 HE ARG 68 HE ARG 68 15.171 -16.383 14.989 498 HB2 ARG 68 1HB ARG 68 18.262 -15.413 11.707 499 HB3 ARG 68 2HB ARG 68 18.530 -14.522 13.199 500 HG2 ARG 68 1HG ARG 68 16.173 -14.461 13.649 501 HG3 ARG 68 2HG ARG 68 15.816 -15.188 12.082 502 HD2 ARG 68 1HD ARG 68 16.856 -17.241 12.718 503 HD3 ARG 68 2HD ARG 68 17.490 -16.524 14.197 504 HH11 ARG 68 1HH1 ARG 68 15.847 -18.545 12.309 505 HH12 ARG 68 2HH1 ARG 68 14.518 -19.602 12.669 506 HH21 ARG 68 1HH2 ARG 68 13.452 -17.784 15.465 507 HH22 ARG 68 2HH2 ARG 68 13.174 -19.186 14.480 508 H ASP 69 H ASP 69 18.493 -10.916 11.662 509 HA ASP 69 HA ASP 69 21.155 -11.343 10.615 510 HB2 ASP 69 1HB ASP 69 19.798 -9.344 9.990 511 HB3 ASP 69 2HB ASP 69 19.910 -8.789 11.658 512 HA PRO 70 HA PRO 70 22.640 -11.842 14.795 513 HB2 PRO 70 1HB PRO 70 25.019 -12.887 14.187 514 HB3 PRO 70 2HB PRO 70 23.523 -13.792 13.919 515 HG2 PRO 70 1HG PRO 70 25.233 -12.327 11.957 516 HG3 PRO 70 2HG PRO 70 24.383 -13.871 11.772 517 HD2 PRO 70 1HD PRO 70 23.477 -11.409 10.845 518 HD3 PRO 70 2HD PRO 70 22.469 -12.848 11.094 519 H LEU 71 H LEU 71 23.574 -9.492 12.616 520 HA LEU 71 HA LEU 71 26.011 -8.724 14.008 521 HG LEU 71 HG LEU 71 25.668 -9.589 11.026 522 HB2 LEU 71 1HB LEU 71 24.604 -7.483 11.647 523 HB3 LEU 71 2HB LEU 71 26.112 -6.898 12.324 524 HD11 LEU 71 1HD1 LEU 71 27.188 -8.752 9.318 525 HD12 LEU 71 2HD1 LEU 71 27.284 -7.200 10.153 526 HD13 LEU 71 3HD1 LEU 71 25.757 -7.730 9.447 527 HD21 LEU 71 3HD2 LEU 71 27.259 -9.744 12.877 528 HD22 LEU 71 1HD2 LEU 71 28.181 -8.402 12.200 529 HD23 LEU 71 2HD2 LEU 71 28.066 -9.925 11.319 530 H ALA 72 H ALA 72 22.776 -8.271 14.470 531 HA ALA 72 HA ALA 72 22.782 -5.567 15.411 532 HB1 ALA 72 3HB ALA 72 20.725 -6.680 14.668 533 HB2 ALA 72 1HB ALA 72 20.585 -6.093 16.326 534 HB3 ALA 72 2HB ALA 72 20.854 -7.808 16.017 535 H PHE 73 H PHE 73 24.343 -8.186 16.509 536 HA PHE 73 HA PHE 73 23.927 -8.089 19.312 537 HD1 PHE 73 HD1 PHE 73 24.475 -10.253 20.723 538 HD2 PHE 73 HD2 PHE 73 28.186 -9.038 19.033 539 HE1 PHE 73 HE1 PHE 73 25.629 -10.900 22.796 540 HE2 PHE 73 HE2 PHE 73 29.346 -9.681 21.104 541 HZ PHE 73 HZ PHE 73 28.064 -10.614 22.989 542 HB2 PHE 73 1HB PHE 73 24.908 -10.038 18.184 543 HB3 PHE 73 2HB PHE 73 26.297 -9.075 17.703 544 H LEU 74 H LEU 74 25.821 -6.242 17.077 545 HA LEU 74 HA LEU 74 26.857 -4.626 19.298 546 HG LEU 74 HG LEU 74 28.441 -7.158 18.841 547 HB2 LEU 74 1HB LEU 74 28.421 -5.592 16.901 548 HB3 LEU 74 2HB LEU 74 28.967 -4.314 17.969 549 HD11 LEU 74 1HD1 LEU 74 30.326 -7.048 17.302 550 HD12 LEU 74 2HD1 LEU 74 30.876 -7.367 18.947 551 HD13 LEU 74 3HD1 LEU 74 31.045 -5.752 18.258 552 HD21 LEU 74 3HD2 LEU 74 29.636 -6.474 20.873 553 HD22 LEU 74 1HD2 LEU 74 28.163 -5.535 20.632 554 HD23 LEU 74 2HD2 LEU 74 29.732 -4.825 20.254 555 H ASP 75 H ASP 75 27.601 -2.459 18.511 556 HA ASP 75 HA ASP 75 26.368 -1.597 16.012 557 HB2 ASP 75 1HB ASP 75 25.261 0.314 17.064 558 HB3 ASP 75 2HB ASP 75 24.652 -1.191 17.742 559 H GLU 76 H GLU 76 27.286 0.287 15.150 560 HA GLU 76 HA GLU 76 29.953 0.885 15.956 561 HB2 GLU 76 1HB GLU 76 28.120 2.358 14.047 562 HB3 GLU 76 2HB GLU 76 29.844 2.651 14.225 563 HG2 GLU 76 1HG GLU 76 30.251 0.294 13.543 564 HG3 GLU 76 2HG GLU 76 28.525 0.141 13.220 565 HA PRO 77 HA PRO 77 29.631 2.830 19.724 566 HB2 PRO 77 1HB PRO 77 30.708 5.196 18.230 567 HB3 PRO 77 2HB PRO 77 31.154 4.586 19.830 568 HG2 PRO 77 1HG PRO 77 32.478 3.946 17.485 569 HG3 PRO 77 2HG PRO 77 32.522 2.980 18.969 570 HD2 PRO 77 1HD PRO 77 31.415 2.226 16.457 571 HD3 PRO 77 2HD PRO 77 31.289 1.339 17.990 572 H GLU 78 H GLU 78 27.242 2.707 19.253 573 HA GLU 78 HA GLU 78 26.117 5.430 19.389 574 HB2 GLU 78 1HB GLU 78 25.285 4.287 17.418 575 HB3 GLU 78 2HB GLU 78 24.882 2.863 18.367 576 HG2 GLU 78 1HG GLU 78 23.276 4.335 19.646 577 HG3 GLU 78 2HG GLU 78 23.549 5.549 18.396 578 H ALA 79 H ALA 79 25.792 2.071 20.450 579 HA ALA 79 HA ALA 79 25.111 1.101 22.386 580 HB1 ALA 79 3HB ALA 79 26.889 2.502 23.353 581 HB2 ALA 79 1HB ALA 79 25.555 2.243 24.477 582 HB3 ALA 79 2HB ALA 79 25.708 3.782 23.632 583 H GLY 80 H GLY 80 23.191 2.550 20.674 584 HA2 GLY 80 1HA GLY 80 21.152 3.238 22.693 585 HA3 GLY 80 2HA GLY 80 21.195 3.896 21.064 586 H ALA 81 H ALA 81 20.940 2.283 19.279 587 HA ALA 81 HA ALA 81 18.682 0.565 20.014 588 HB1 ALA 81 3HB ALA 81 18.139 0.592 17.632 589 HB2 ALA 81 1HB ALA 81 19.603 1.519 17.305 590 HB3 ALA 81 2HB ALA 81 18.307 2.228 18.269 591 H GLY 82 H GLY 82 21.812 0.450 18.381 592 HA2 GLY 82 1HA GLY 82 23.212 -1.404 18.130 593 HA3 GLY 82 2HA GLY 82 21.947 -2.420 18.810 594 H ALA 83 H ALA 83 21.350 -0.206 16.226 595 HA ALA 83 HA ALA 83 21.679 -1.987 14.043 596 HB1 ALA 83 3HB ALA 83 18.843 -1.537 14.995 597 HB2 ALA 83 1HB ALA 83 19.715 -3.069 15.052 598 HB3 ALA 83 2HB ALA 83 19.317 -2.338 13.497 599 H ARG 84 H ARG 84 19.853 -0.910 12.261 600 HA ARG 84 HA ARG 84 20.718 1.875 12.161 601 HE ARG 84 HE ARG 84 19.083 0.103 8.265 602 HB2 ARG 84 1HB ARG 84 19.014 0.459 10.113 603 HB3 ARG 84 2HB ARG 84 20.005 1.893 9.890 604 HG2 ARG 84 1HG ARG 84 22.014 0.447 10.311 605 HG3 ARG 84 2HG ARG 84 20.930 -0.943 10.249 606 HD2 ARG 84 1HD ARG 84 21.597 1.006 8.058 607 HD3 ARG 84 2HD ARG 84 21.847 -0.738 8.082 608 HH11 ARG 84 1HH1 ARG 84 21.686 -0.920 6.158 609 HH12 ARG 84 2HH1 ARG 84 20.641 -1.272 4.816 610 HH21 ARG 84 1HH2 ARG 84 17.704 -0.348 6.521 611 HH22 ARG 84 2HH2 ARG 84 18.360 -0.923 5.014 612 HA PRO 85 HA PRO 85 16.759 2.819 14.071 613 HB2 PRO 85 1HB PRO 85 17.722 5.567 14.165 614 HB3 PRO 85 2HB PRO 85 17.401 4.458 15.499 615 HG2 PRO 85 1HG PRO 85 19.903 5.252 14.818 616 HG3 PRO 85 2HG PRO 85 19.556 3.667 15.534 617 HD2 PRO 85 1HD PRO 85 20.045 4.386 12.666 618 HD3 PRO 85 2HD PRO 85 20.638 2.992 13.595 619 H ALA 86 H ALA 86 14.904 3.989 13.516 620 HA ALA 86 HA ALA 86 13.365 4.822 12.079 621 HB1 ALA 86 3HB ALA 86 13.914 6.884 10.917 622 HB2 ALA 86 1HB ALA 86 15.633 6.593 11.177 623 HB3 ALA 86 2HB ALA 86 14.574 6.902 12.553 624 H ASN 87 H ASN 87 13.744 2.566 11.123 625 HA ASN 87 HA ASN 87 14.472 2.893 8.281 626 HB2 ASN 87 1HB ASN 87 15.061 0.705 10.205 627 HB3 ASN 87 2HB ASN 87 14.681 0.239 8.552 628 HD21 ASN 87 2HD2 ASN 87 16.266 3.262 9.309 629 HD22 ASN 87 1HD2 ASN 87 17.812 2.826 8.668 630 H ALA 88 H ALA 88 11.942 2.730 10.248 631 HA ALA 88 HA ALA 88 10.268 0.817 8.958 632 HB1 ALA 88 3HB ALA 88 8.444 1.896 10.189 633 HB2 ALA 88 1HB ALA 88 9.526 3.211 10.642 634 HB3 ALA 88 2HB ALA 88 9.825 1.578 11.240 635 HA PRO 89 HA PRO 89 9.082 2.904 5.242 636 HB2 PRO 89 1HB PRO 89 6.300 2.091 5.905 637 HB3 PRO 89 2HB PRO 89 7.246 1.780 4.445 638 HG2 PRO 89 1HG PRO 89 6.804 -0.159 6.214 639 HG3 PRO 89 2HG PRO 89 8.371 -0.012 5.393 640 HD2 PRO 89 1HD PRO 89 7.612 0.748 8.183 641 HD3 PRO 89 2HD PRO 89 9.118 0.028 7.579 642 H GLU 90 H GLU 90 8.869 5.023 5.015 643 HA GLU 90 HA GLU 90 7.785 6.726 6.984 644 HB2 GLU 90 1HB GLU 90 8.389 7.285 4.076 645 HB3 GLU 90 2HB GLU 90 8.079 8.506 5.301 646 HG2 GLU 90 1HG GLU 90 10.080 7.945 6.467 647 HG3 GLU 90 2HG GLU 90 10.352 6.547 5.421 648 H VAL 91 H VAL 91 6.610 5.763 3.775 649 HA VAL 91 HA VAL 91 3.914 6.500 4.650 650 HB VAL 91 HB VAL 91 4.626 8.404 3.392 651 HG11 VAL 91 1HG1 VAL 91 5.403 8.260 1.075 652 HG12 VAL 91 2HG1 VAL 91 5.377 6.500 1.182 653 HG13 VAL 91 3HG1 VAL 91 6.490 7.428 2.187 654 HG21 VAL 91 3HG2 VAL 91 3.011 8.418 1.551 655 HG22 VAL 91 1HG2 VAL 91 2.333 7.705 3.015 656 HG23 VAL 91 2HG2 VAL 91 2.849 6.667 1.687 657 H LEU 92 H LEU 92 2.427 5.066 4.218 658 HA LEU 92 HA LEU 92 3.041 2.878 2.348 659 HG LEU 92 HG LEU 92 0.225 1.515 2.938 660 HB2 LEU 92 1HB LEU 92 2.649 2.138 4.629 661 HB3 LEU 92 2HB LEU 92 1.139 3.023 4.692 662 HD11 LEU 92 1HD1 LEU 92 2.325 0.850 1.897 663 HD12 LEU 92 2HD1 LEU 92 1.402 -0.558 2.425 664 HD13 LEU 92 3HD1 LEU 92 2.789 -0.010 3.367 665 HD21 LEU 92 3HD2 LEU 92 -0.224 1.092 5.290 666 HD22 LEU 92 1HD2 LEU 92 1.267 0.158 5.421 667 HD23 LEU 92 2HD2 LEU 92 -0.053 -0.424 4.406 668 H LEU 93 H LEU 93 2.106 3.120 0.437 669 HA LEU 93 HA LEU 93 -0.270 4.804 0.211 670 HG LEU 93 HG LEU 93 2.602 5.504 -0.722 671 HB2 LEU 93 1HB LEU 93 1.539 3.626 -1.899 672 HB3 LEU 93 2HB LEU 93 0.143 4.628 -2.238 673 HD11 LEU 93 1HD1 LEU 93 3.020 6.903 -2.692 674 HD12 LEU 93 2HD1 LEU 93 1.646 6.152 -3.505 675 HD13 LEU 93 3HD1 LEU 93 3.057 5.184 -3.081 676 HD21 LEU 93 3HD2 LEU 93 1.615 7.749 -0.894 677 HD22 LEU 93 1HD2 LEU 93 0.622 6.655 0.068 678 HD23 LEU 93 2HD2 LEU 93 0.158 7.041 -1.589 679 H VAL 94 H VAL 94 -1.982 3.597 0.829 680 HA VAL 94 HA VAL 94 -2.347 0.946 -0.327 681 HB VAL 94 HB VAL 94 -4.069 2.465 1.648 682 HG11 VAL 94 1HG1 VAL 94 -5.418 0.924 0.338 683 HG12 VAL 94 2HG1 VAL 94 -5.226 0.318 1.983 684 HG13 VAL 94 3HG1 VAL 94 -4.281 -0.383 0.668 685 HG21 VAL 94 3HG2 VAL 94 -3.210 0.876 3.296 686 HG22 VAL 94 1HG2 VAL 94 -1.899 1.802 2.562 687 HG23 VAL 94 2HG2 VAL 94 -2.193 0.136 2.060 688 H GLY 95 H GLY 95 -2.975 1.026 -2.373 689 HA2 GLY 95 1HA GLY 95 -4.880 3.013 -3.296 690 HA3 GLY 95 2HA GLY 95 -4.138 1.740 -4.262 691 H THR 96 H THR 96 -6.941 2.750 -2.735 692 HA THR 96 HA THR 96 -8.012 0.322 -1.810 693 HB THR 96 HB THR 96 -10.256 1.545 -2.139 694 HG1 THR 96 HG1 THR 96 -9.243 3.054 -3.713 695 HG21 THR 96 3HG2 THR 96 -9.107 1.387 0.006 696 HG22 THR 96 1HG2 THR 96 -9.815 2.990 -0.196 697 HG23 THR 96 2HG2 THR 96 -8.083 2.758 -0.425 698 H GLY 97 H GLY 97 -7.619 1.535 -4.989 699 HA2 GLY 97 1HA GLY 97 -7.827 0.457 -6.987 700 HA3 GLY 97 2HA GLY 97 -8.144 -1.006 -6.075 701 H ARG 98 H ARG 98 -10.245 -1.587 -5.608 702 HA ARG 98 HA ARG 98 -11.991 -1.254 -7.760 703 HE ARG 98 HE ARG 98 -10.497 -5.896 -6.161 704 HB2 ARG 98 1HB ARG 98 -12.621 -2.295 -4.994 705 HB3 ARG 98 2HB ARG 98 -13.567 -2.585 -6.450 706 HG2 ARG 98 1HG ARG 98 -11.706 -3.796 -7.440 707 HG3 ARG 98 2HG ARG 98 -10.728 -3.481 -6.007 708 HD2 ARG 98 1HD ARG 98 -12.357 -4.731 -4.651 709 HD3 ARG 98 2HD ARG 98 -13.280 -5.083 -6.111 710 HH11 ARG 98 1HH1 ARG 98 -13.817 -6.841 -5.504 711 HH12 ARG 98 2HH1 ARG 98 -13.479 -8.542 -5.687 712 HH21 ARG 98 1HH2 ARG 98 -10.091 -8.132 -6.403 713 HH22 ARG 98 2HH2 ARG 98 -11.400 -9.271 -6.201 714 H ARG 99 H ARG 99 -12.274 0.027 -4.435 715 HA ARG 99 HA ARG 99 -13.806 2.255 -5.510 716 HE ARG 99 HE ARG 99 -18.026 0.361 -6.665 717 HB2 ARG 99 1HB ARG 99 -14.871 0.341 -3.446 718 HB3 ARG 99 2HB ARG 99 -15.462 1.993 -3.566 719 HG2 ARG 99 1HG ARG 99 -16.064 1.560 -5.925 720 HG3 ARG 99 2HG ARG 99 -15.577 -0.119 -5.705 721 HD2 ARG 99 1HD ARG 99 -17.272 -0.409 -3.995 722 HD3 ARG 99 2HD ARG 99 -17.731 1.289 -4.137 723 HH11 ARG 99 1HH1 ARG 99 -19.233 -0.698 -3.554 724 HH12 ARG 99 2HH1 ARG 99 -20.672 -1.415 -4.209 725 HH21 ARG 99 1HH2 ARG 99 -19.906 -0.567 -7.533 726 HH22 ARG 99 2HH2 ARG 99 -21.061 -1.338 -6.485 727 H GLN 100 H GLN 100 -13.439 4.123 -4.527 728 HA GLN 100 HA GLN 100 -11.215 4.325 -2.770 729 HB2 GLN 100 1HB GLN 100 -11.731 6.002 -4.498 730 HB3 GLN 100 2HB GLN 100 -13.207 6.424 -3.645 731 HG2 GLN 100 1HG GLN 100 -11.556 8.083 -3.190 732 HG3 GLN 100 2HG GLN 100 -11.833 7.152 -1.720 733 HE21 GLN 100 2HE2 GLN 100 -10.179 5.925 -0.874 734 HE22 GLN 100 1HE2 GLN 100 -8.564 5.974 -1.481 735 H HIS 101 H HIS 101 -11.323 3.848 -0.695 736 HA HIS 101 HA HIS 101 -13.717 4.639 0.831 737 HD1 HIS 101 HD1 HIS 101 -12.959 1.291 -0.842 738 HD2 HIS 101 HD2 HIS 101 -15.397 2.036 2.437 739 HE1 HIS 101 HE1 HIS 101 -15.030 -0.088 -1.211 740 HE2 HIS 101 HE2 HIS 101 -16.577 0.562 0.673 741 HB2 HIS 101 1HB HIS 101 -11.759 2.381 1.240 742 HB3 HIS 101 2HB HIS 101 -12.805 2.946 2.537 743 H LEU 102 H LEU 102 -13.457 5.753 2.743 744 HA LEU 102 HA LEU 102 -10.770 6.807 3.260 745 HG LEU 102 HG LEU 102 -11.561 8.314 5.859 746 HB2 LEU 102 1HB LEU 102 -12.617 8.440 3.031 747 HB3 LEU 102 2HB LEU 102 -13.443 7.681 4.378 748 HD11 LEU 102 1HD1 LEU 102 -9.904 9.924 5.069 749 HD12 LEU 102 2HD1 LEU 102 -10.561 9.805 3.437 750 HD13 LEU 102 3HD1 LEU 102 -9.793 8.403 4.183 751 HD21 LEU 102 3HD2 LEU 102 -12.079 10.701 5.940 752 HD22 LEU 102 1HD2 LEU 102 -13.533 9.732 5.700 753 HD23 LEU 102 2HD2 LEU 102 -12.814 10.596 4.340 754 H LEU 103 H LEU 103 -9.650 5.543 4.587 755 HA LEU 103 HA LEU 103 -10.881 3.607 6.262 756 HG LEU 103 HG LEU 103 -8.499 3.774 4.019 757 HB2 LEU 103 1HB LEU 103 -8.004 4.522 6.267 758 HB3 LEU 103 2HB LEU 103 -8.625 3.027 6.941 759 HD11 LEU 103 1HD1 LEU 103 -6.364 3.114 4.974 760 HD12 LEU 103 2HD1 LEU 103 -6.964 1.884 3.863 761 HD13 LEU 103 3HD1 LEU 103 -7.089 1.636 5.605 762 HD21 LEU 103 3HD2 LEU 103 -10.547 2.520 4.479 763 HD22 LEU 103 1HD2 LEU 103 -9.604 1.267 5.287 764 HD23 LEU 103 2HD2 LEU 103 -9.399 1.551 3.558 765 H GLY 104 H GLY 104 -10.053 3.421 8.647 766 HA2 GLY 104 1HA GLY 104 -10.939 5.960 9.861 767 HA3 GLY 104 2HA GLY 104 -11.228 4.365 10.536 768 HA PRO 105 HA PRO 105 -7.165 6.664 11.989 769 HB2 PRO 105 1HB PRO 105 -8.862 7.314 14.343 770 HB3 PRO 105 2HB PRO 105 -7.624 8.290 13.543 771 HG2 PRO 105 1HG PRO 105 -10.196 8.847 13.199 772 HG3 PRO 105 2HG PRO 105 -9.062 8.950 11.839 773 HD2 PRO 105 1HD PRO 105 -11.052 6.809 12.489 774 HD3 PRO 105 2HD PRO 105 -10.621 7.506 10.914 775 H GLU 106 H GLU 106 -9.611 4.630 13.401 776 HA GLU 106 HA GLU 106 -8.284 3.545 15.589 777 HB2 GLU 106 1HB GLU 106 -10.167 2.168 13.664 778 HB3 GLU 106 2HB GLU 106 -9.741 1.577 15.264 779 HG2 GLU 106 1HG GLU 106 -11.183 4.151 14.670 780 HG3 GLU 106 2HG GLU 106 -11.926 2.656 15.237 781 H GLN 107 H GLN 107 -7.868 2.966 12.189 782 HA GLN 107 HA GLN 107 -6.412 0.485 12.593 783 HB2 GLN 107 1HB GLN 107 -7.126 2.011 10.084 784 HB3 GLN 107 2HB GLN 107 -6.376 0.422 10.121 785 HG2 GLN 107 1HG GLN 107 -8.300 -0.603 10.933 786 HG3 GLN 107 2HG GLN 107 -8.998 0.923 11.470 787 HE21 GLN 107 2HE2 GLN 107 -10.074 -1.181 9.717 788 HE22 GLN 107 1HE2 GLN 107 -10.491 -0.382 8.240 789 H VAL 108 H VAL 108 -5.718 3.835 12.182 790 HA VAL 108 HA VAL 108 -3.142 3.297 10.925 791 HB VAL 108 HB VAL 108 -2.964 5.676 10.532 792 HG11 VAL 108 1HG1 VAL 108 -4.228 4.374 8.922 793 HG12 VAL 108 2HG1 VAL 108 -4.914 5.991 9.076 794 HG13 VAL 108 3HG1 VAL 108 -5.704 4.621 9.854 795 HG21 VAL 108 3HG2 VAL 108 -5.509 5.902 12.128 796 HG22 VAL 108 1HG2 VAL 108 -4.817 7.201 11.156 797 HG23 VAL 108 2HG2 VAL 108 -3.931 6.570 12.544 798 H ARG 109 H ARG 109 -4.369 4.054 14.061 799 HA ARG 109 HA ARG 109 -2.361 5.610 15.132 800 HE ARG 109 HE ARG 109 -4.905 3.728 18.735 801 HB2 ARG 109 1HB ARG 109 -3.982 3.480 16.516 802 HB3 ARG 109 2HB ARG 109 -3.032 4.709 17.321 803 HG2 ARG 109 1HG ARG 109 -4.447 6.423 16.151 804 HG3 ARG 109 2HG ARG 109 -5.490 5.091 15.652 805 HD2 ARG 109 1HD ARG 109 -4.917 6.086 18.428 806 HD3 ARG 109 2HD ARG 109 -6.472 5.955 17.607 807 HH11 ARG 109 1HH1 ARG 109 -7.889 5.000 17.426 808 HH12 ARG 109 2HH1 ARG 109 -8.827 3.592 17.830 809 HH21 ARG 109 1HH2 ARG 109 -6.136 1.892 19.316 810 HH22 ARG 109 2HH2 ARG 109 -7.823 1.815 18.901 811 HA PRO 110 HA PRO 110 -0.070 1.485 16.560 812 HB2 PRO 110 1HB PRO 110 -0.256 -0.459 14.576 813 HB3 PRO 110 2HB PRO 110 -1.104 -0.486 16.124 814 HG2 PRO 110 1HG PRO 110 -2.081 0.382 13.441 815 HG3 PRO 110 2HG PRO 110 -2.936 -0.507 14.716 816 HD2 PRO 110 1HD PRO 110 -3.390 2.095 14.307 817 HD3 PRO 110 2HD PRO 110 -3.352 1.418 15.950 818 H LEU 111 H LEU 111 -0.480 2.377 13.164 819 HA LEU 111 HA LEU 111 2.286 1.836 12.545 820 HG LEU 111 HG LEU 111 -0.513 0.908 11.231 821 HB2 LEU 111 1HB LEU 111 0.158 3.207 10.899 822 HB3 LEU 111 2HB LEU 111 1.734 2.704 10.316 823 HD11 LEU 111 1HD1 LEU 111 0.805 1.303 8.551 824 HD12 LEU 111 2HD1 LEU 111 -0.824 1.808 9.004 825 HD13 LEU 111 3HD1 LEU 111 -0.422 0.093 8.922 826 HD21 LEU 111 3HD2 LEU 111 2.266 0.172 10.326 827 HD22 LEU 111 1HD2 LEU 111 0.949 -0.956 10.652 828 HD23 LEU 111 2HD2 LEU 111 1.631 0.008 11.964 829 H LEU 112 H LEU 112 0.267 4.655 13.166 830 HA LEU 112 HA LEU 112 2.192 6.622 12.533 831 HG LEU 112 HG LEU 112 -0.915 6.342 12.214 832 HB2 LEU 112 1HB LEU 112 -0.102 6.737 14.495 833 HB3 LEU 112 2HB LEU 112 0.810 8.125 13.934 834 HD11 LEU 112 1HD1 LEU 112 -2.346 8.322 12.029 835 HD12 LEU 112 2HD1 LEU 112 -1.313 9.168 13.181 836 HD13 LEU 112 3HD1 LEU 112 -2.226 7.749 13.692 837 HD21 LEU 112 3HD2 LEU 112 0.618 8.845 11.520 838 HD22 LEU 112 1HD2 LEU 112 -0.501 7.994 10.456 839 HD23 LEU 112 2HD2 LEU 112 0.993 7.211 10.973 840 H ALA 113 H ALA 113 1.589 4.714 15.400 841 HA ALA 113 HA ALA 113 3.356 6.199 17.096 842 HB1 ALA 113 3HB ALA 113 3.054 4.363 18.677 843 HB2 ALA 113 1HB ALA 113 2.247 3.414 17.427 844 HB3 ALA 113 2HB ALA 113 1.509 4.903 18.019 845 H MET 114 H MET 114 3.856 4.006 14.592 846 HA MET 114 HA MET 114 6.492 3.187 15.575 847 HB2 MET 114 1HB MET 114 4.985 2.456 13.057 848 HB3 MET 114 2HB MET 114 6.588 1.864 13.461 849 HG2 MET 114 1HG MET 114 5.701 0.734 15.414 850 HG3 MET 114 2HG MET 114 4.093 1.369 15.065 851 HE1 MET 114 3HE MET 114 3.085 -1.098 15.144 852 HE2 MET 114 1HE MET 114 4.688 -1.741 15.501 853 HE3 MET 114 2HE MET 114 3.725 -2.442 14.200 854 H GLY 115 H GLY 115 4.925 4.988 12.996 855 HA2 GLY 115 1HA GLY 115 6.230 7.087 12.411 856 HA3 GLY 115 2HA GLY 115 7.560 5.977 12.121 857 H VAL 116 H VAL 116 4.576 4.635 11.285 858 HA VAL 116 HA VAL 116 5.198 4.985 8.447 859 HB VAL 116 HB VAL 116 3.253 3.054 9.726 860 HG11 VAL 116 1HG1 VAL 116 3.363 1.876 7.583 861 HG12 VAL 116 2HG1 VAL 116 4.429 3.130 6.949 862 HG13 VAL 116 3HG1 VAL 116 2.766 3.524 7.386 863 HG21 VAL 116 3HG2 VAL 116 6.102 2.597 8.848 864 HG22 VAL 116 1HG2 VAL 116 4.976 1.337 9.358 865 HG23 VAL 116 2HG2 VAL 116 5.497 2.572 10.505 866 H GLY 117 H GLY 117 3.996 6.296 7.216 867 HA2 GLY 117 1HA GLY 117 1.505 7.376 8.324 868 HA3 GLY 117 2HA GLY 117 2.400 8.026 6.955 869 H VAL 118 H VAL 118 -0.427 6.695 7.676 870 HA VAL 118 HA VAL 118 -0.546 4.779 5.478 871 HB VAL 118 HB VAL 118 -2.751 5.533 7.401 872 HG11 VAL 118 1HG1 VAL 118 -3.521 4.461 5.355 873 HG12 VAL 118 2HG1 VAL 118 -3.724 3.388 6.740 874 HG13 VAL 118 3HG1 VAL 118 -2.392 3.130 5.612 875 HG21 VAL 118 3HG2 VAL 118 -0.840 4.689 8.647 876 HG22 VAL 118 1HG2 VAL 118 -0.765 3.273 7.598 877 HG23 VAL 118 2HG2 VAL 118 -2.157 3.516 8.654 878 H GLU 119 H GLU 119 -0.999 5.525 3.520 879 HA GLU 119 HA GLU 119 -2.883 7.780 3.256 880 HB2 GLU 119 1HB GLU 119 -0.791 6.797 1.298 881 HB3 GLU 119 2HB GLU 119 -1.866 8.165 1.048 882 HG2 GLU 119 1HG GLU 119 0.149 8.007 3.273 883 HG3 GLU 119 2HG GLU 119 0.468 8.747 1.706 884 H ALA 120 H ALA 120 -4.802 7.350 2.343 885 HA ALA 120 HA ALA 120 -5.127 4.781 0.929 886 HB1 ALA 120 3HB ALA 120 -7.516 4.961 1.458 887 HB2 ALA 120 1HB ALA 120 -7.219 6.490 2.284 888 HB3 ALA 120 2HB ALA 120 -6.532 4.995 2.921 889 H MET 121 H MET 121 -4.974 5.097 -1.220 890 HA MET 121 HA MET 121 -6.097 7.593 -2.314 891 HB2 MET 121 1HB MET 121 -3.553 7.565 -1.911 892 HB3 MET 121 2HB MET 121 -3.481 6.430 -3.251 893 HG2 MET 121 1HG MET 121 -4.511 8.104 -4.710 894 HG3 MET 121 2HG MET 121 -4.551 9.240 -3.363 895 HE1 MET 121 3HE MET 121 -2.339 10.179 -2.167 896 HE2 MET 121 1HE MET 121 -0.705 9.751 -2.675 897 HE3 MET 121 2HE MET 121 -1.746 8.534 -1.935 898 H ASP 122 H ASP 122 -6.241 7.519 -4.736 899 HA ASP 122 HA ASP 122 -7.695 5.299 -5.652 900 HB2 ASP 122 1HB ASP 122 -8.138 7.384 -6.685 901 HB3 ASP 122 2HB ASP 122 -6.438 7.661 -7.045 902 H THR 123 H THR 123 -7.178 3.854 -7.404 903 HA THR 123 HA THR 123 -4.910 2.332 -6.982 904 HB THR 123 HB THR 123 -6.111 2.316 -9.702 905 HG1 THR 123 HG1 THR 123 -8.061 2.389 -8.860 906 HG21 THR 123 3HG2 THR 123 -4.524 0.585 -9.000 907 HG22 THR 123 1HG2 THR 123 -6.122 -0.100 -9.292 908 HG23 THR 123 2HG2 THR 123 -5.571 0.176 -7.640 909 H GLN 124 H GLN 124 -5.524 4.644 -9.643 910 HA GLN 124 HA GLN 124 -2.891 4.223 -10.738 911 HB2 GLN 124 1HB GLN 124 -5.073 6.192 -11.430 912 HB3 GLN 124 2HB GLN 124 -3.538 6.100 -12.282 913 HG2 GLN 124 1HG GLN 124 -4.060 3.742 -12.847 914 HG3 GLN 124 2HG GLN 124 -5.650 3.966 -12.119 915 HE21 GLN 124 2HE2 GLN 124 -4.907 3.336 -14.882 916 HE22 GLN 124 1HE2 GLN 124 -5.598 4.583 -15.861 917 H ALA 125 H ALA 125 -4.539 6.668 -8.828 918 HA ALA 125 HA ALA 125 -2.548 8.640 -8.883 919 HB1 ALA 125 3HB ALA 125 -3.607 9.543 -6.888 920 HB2 ALA 125 1HB ALA 125 -4.487 8.032 -6.655 921 HB3 ALA 125 2HB ALA 125 -4.822 9.039 -8.064 922 H ALA 126 H ALA 126 -3.056 5.954 -6.598 923 HA ALA 126 HA ALA 126 -0.842 6.566 -4.944 924 HB1 ALA 126 3HB ALA 126 -1.116 4.323 -4.041 925 HB2 ALA 126 1HB ALA 126 -2.168 3.894 -5.389 926 HB3 ALA 126 2HB ALA 126 -2.684 5.112 -4.223 927 H ALA 127 H ALA 127 -1.236 4.375 -7.699 928 HA ALA 127 HA ALA 127 1.325 3.255 -7.692 929 HB1 ALA 127 3HB ALA 127 -0.446 3.801 -10.075 930 HB2 ALA 127 1HB ALA 127 -0.541 2.383 -9.030 931 HB3 ALA 127 2HB ALA 127 0.897 2.660 -10.014 932 H ARG 128 H ARG 128 0.084 6.176 -9.263 933 HA ARG 128 HA ARG 128 2.458 6.880 -10.613 934 HE ARG 128 HE ARG 128 -1.030 9.651 -11.633 935 HB2 ARG 128 1HB ARG 128 0.196 7.844 -11.078 936 HB3 ARG 128 2HB ARG 128 0.320 8.750 -9.574 937 HG2 ARG 128 1HG ARG 128 2.514 9.668 -10.571 938 HG3 ARG 128 2HG ARG 128 1.873 9.084 -12.106 939 HD2 ARG 128 1HD ARG 128 0.560 11.054 -10.242 940 HD3 ARG 128 2HD ARG 128 1.317 11.422 -11.789 941 HH11 ARG 128 1HH1 ARG 128 0.642 12.425 -12.938 942 HH12 ARG 128 2HH1 ARG 128 -0.649 12.869 -14.016 943 HH21 ARG 128 1HH2 ARG 128 -2.744 10.205 -13.035 944 HH22 ARG 128 2HH2 ARG 128 -2.603 11.618 -14.045 945 H THR 129 H THR 129 1.111 8.001 -7.519 946 HA THR 129 HA THR 129 3.173 9.758 -6.833 947 HB THR 129 HB THR 129 1.433 8.165 -4.935 948 HG1 THR 129 HG1 THR 129 -0.028 9.262 -6.090 949 HG21 THR 129 3HG2 THR 129 1.763 10.077 -3.421 950 HG22 THR 129 1HG2 THR 129 2.857 10.811 -4.594 951 HG23 THR 129 2HG2 THR 129 3.293 9.290 -3.814 952 H TYR 130 H TYR 130 2.807 6.296 -6.279 953 HA TYR 130 HA TYR 130 4.998 5.850 -4.616 954 HD1 TYR 130 HD1 TYR 130 5.763 3.683 -3.617 955 HD2 TYR 130 HD2 TYR 130 4.877 2.358 -7.563 956 HE1 TYR 130 HE1 TYR 130 7.441 1.897 -3.389 957 HE2 TYR 130 HE2 TYR 130 6.552 0.573 -7.347 958 HH TYR 130 HH TYR 130 8.449 -0.029 -6.091 959 HB2 TYR 130 1HB TYR 130 3.427 4.092 -4.977 960 HB3 TYR 130 2HB TYR 130 3.691 4.120 -6.715 961 H ASN 131 H ASN 131 4.833 5.892 -8.167 962 HA ASN 131 HA ASN 131 7.552 5.282 -8.613 963 HB2 ASN 131 1HB ASN 131 5.625 6.831 -10.362 964 HB3 ASN 131 2HB ASN 131 7.189 6.216 -10.884 965 HD21 ASN 131 2HD2 ASN 131 4.559 5.628 -11.921 966 HD22 ASN 131 1HD2 ASN 131 4.345 3.922 -11.776 967 H ILE 132 H ILE 132 5.848 8.307 -8.103 968 HA ILE 132 HA ILE 132 7.991 10.039 -8.752 969 HB ILE 132 HB ILE 132 5.643 10.527 -6.910 970 HG12 ILE 132 1HG1 ILE 132 5.996 11.240 -9.830 971 HG13 ILE 132 2HG1 ILE 132 5.078 9.852 -9.253 972 HG21 ILE 132 1HG2 ILE 132 6.054 12.904 -7.335 973 HG22 ILE 132 2HG2 ILE 132 7.487 12.489 -8.275 974 HG23 ILE 132 3HG2 ILE 132 7.436 12.142 -6.547 975 HD11 ILE 132 3HD1 ILE 132 3.557 11.364 -8.078 976 HD12 ILE 132 1HD1 ILE 132 3.609 11.688 -9.811 977 HD13 ILE 132 2HD1 ILE 132 4.469 12.744 -8.691 978 H LEU 133 H LEU 133 6.821 8.732 -5.660 979 HA LEU 133 HA LEU 133 8.827 9.988 -4.086 980 HG LEU 133 HG LEU 133 5.754 9.573 -3.780 981 HB2 LEU 133 1HB LEU 133 7.135 7.556 -3.509 982 HB3 LEU 133 2HB LEU 133 8.123 8.391 -2.325 983 HD11 LEU 133 1HD1 LEU 133 4.676 9.517 -1.581 984 HD12 LEU 133 2HD1 LEU 133 6.078 8.675 -0.922 985 HD13 LEU 133 3HD1 LEU 133 5.083 7.901 -2.156 986 HD21 LEU 133 3HD2 LEU 133 6.021 11.459 -2.252 987 HD22 LEU 133 1HD2 LEU 133 7.450 11.251 -3.265 988 HD23 LEU 133 2HD2 LEU 133 7.475 10.719 -1.583 989 H MET 134 H MET 134 8.725 7.099 -5.979 990 HA MET 134 HA MET 134 10.929 5.731 -4.870 991 HB2 MET 134 1HB MET 134 9.310 4.739 -6.479 992 HB3 MET 134 2HB MET 134 9.991 5.747 -7.746 993 HG2 MET 134 1HG MET 134 12.192 4.638 -7.329 994 HG3 MET 134 2HG MET 134 11.353 3.528 -6.246 995 HE1 MET 134 3HE MET 134 9.237 2.026 -7.113 996 HE2 MET 134 1HE MET 134 8.775 1.909 -8.812 997 HE3 MET 134 2HE MET 134 8.521 3.415 -7.929 998 H ALA 135 H ALA 135 10.673 8.054 -7.540 999 HA ALA 135 HA ALA 135 13.468 8.138 -8.079 1000 HB1 ALA 135 3HB ALA 135 11.331 10.151 -8.776 1001 HB2 ALA 135 1HB ALA 135 11.784 8.753 -9.750 1002 HB3 ALA 135 2HB ALA 135 12.943 10.055 -9.486 1003 H GLU 136 H GLU 136 11.417 9.654 -5.780 1004 HA GLU 136 HA GLU 136 13.184 11.812 -5.106 1005 HB2 GLU 136 1HB GLU 136 10.720 11.880 -4.734 1006 HB3 GLU 136 2HB GLU 136 10.892 10.617 -3.526 1007 HG2 GLU 136 1HG GLU 136 12.196 12.079 -2.122 1008 HG3 GLU 136 2HG GLU 136 12.172 13.336 -3.358 1009 H GLY 137 H GLY 137 13.200 8.494 -4.568 1010 HA2 GLY 137 1HA GLY 137 14.621 7.150 -3.356 1011 HA3 GLY 137 2HA GLY 137 15.497 8.602 -2.890 1012 H ARG 138 H ARG 138 12.086 8.049 -2.325 1013 HA ARG 138 HA ARG 138 12.611 8.383 0.539 1014 HE ARG 138 HE ARG 138 8.864 10.255 3.076 1015 HB2 ARG 138 1HB ARG 138 11.104 9.991 -0.649 1016 HB3 ARG 138 2HB ARG 138 9.998 8.659 -0.954 1017 HG2 ARG 138 1HG ARG 138 9.652 8.357 1.416 1018 HG3 ARG 138 2HG ARG 138 10.840 9.613 1.773 1019 HD2 ARG 138 1HD ARG 138 9.433 11.243 0.590 1020 HD3 ARG 138 2HD ARG 138 8.238 9.981 0.299 1021 HH11 ARG 138 1HH1 ARG 138 7.004 11.655 0.457 1022 HH12 ARG 138 2HH1 ARG 138 5.784 12.316 1.495 1023 HH21 ARG 138 1HH2 ARG 138 7.248 11.134 4.463 1024 HH22 ARG 138 2HH2 ARG 138 5.910 12.004 3.763 1025 H ARG 139 H ARG 139 11.570 7.050 2.080 1026 HA ARG 139 HA ARG 139 11.325 4.320 1.211 1027 HE ARG 139 HE ARG 139 12.678 6.697 4.835 1028 HB2 ARG 139 1HB ARG 139 11.132 5.643 3.912 1029 HB3 ARG 139 2HB ARG 139 10.903 3.913 3.677 1030 HG2 ARG 139 1HG ARG 139 13.124 3.598 2.994 1031 HG3 ARG 139 2HG ARG 139 13.376 5.325 2.737 1032 HD2 ARG 139 1HD ARG 139 12.823 4.093 5.428 1033 HD3 ARG 139 2HD ARG 139 14.445 4.388 4.800 1034 HH11 ARG 139 1HH1 ARG 139 15.202 4.897 6.466 1035 HH12 ARG 139 2HH1 ARG 139 15.657 6.216 7.499 1036 HH21 ARG 139 1HH2 ARG 139 13.297 8.438 6.173 1037 HH22 ARG 139 2HH2 ARG 139 14.576 8.229 7.325 1038 H VAL 140 H VAL 140 9.541 4.205 -0.055 1039 HA VAL 140 HA VAL 140 6.955 4.574 1.298 1040 HB VAL 140 HB VAL 140 7.171 6.278 -0.406 1041 HG11 VAL 140 1HG1 VAL 140 7.512 5.741 -2.766 1042 HG12 VAL 140 2HG1 VAL 140 7.716 4.039 -2.352 1043 HG13 VAL 140 3HG1 VAL 140 8.886 5.230 -1.784 1044 HG21 VAL 140 3HG2 VAL 140 4.964 5.278 -0.137 1045 HG22 VAL 140 1HG2 VAL 140 5.356 4.061 -1.352 1046 HG23 VAL 140 2HG2 VAL 140 5.234 5.761 -1.812 1047 H VAL 141 H VAL 141 5.560 2.910 1.229 1048 HA VAL 141 HA VAL 141 6.263 0.578 -0.439 1049 HB VAL 141 HB VAL 141 4.673 0.544 2.140 1050 HG11 VAL 141 1HG1 VAL 141 4.984 -1.887 2.022 1051 HG12 VAL 141 2HG1 VAL 141 5.804 -1.701 0.472 1052 HG13 VAL 141 3HG1 VAL 141 4.101 -1.268 0.626 1053 HG21 VAL 141 3HG2 VAL 141 6.635 -0.486 3.176 1054 HG22 VAL 141 1HG2 VAL 141 6.985 1.146 2.608 1055 HG23 VAL 141 2HG2 VAL 141 7.547 -0.247 1.687 1056 H VAL 142 H VAL 142 4.701 -0.139 -1.841 1057 HA VAL 142 HA VAL 142 2.171 1.368 -1.777 1058 HB VAL 142 HB VAL 142 3.587 1.811 -3.758 1059 HG11 VAL 142 1HG1 VAL 142 3.843 0.099 -5.486 1060 HG12 VAL 142 2HG1 VAL 142 3.113 -1.091 -4.409 1061 HG13 VAL 142 3HG1 VAL 142 4.658 -0.352 -3.988 1062 HG21 VAL 142 3HG2 VAL 142 1.835 1.514 -5.438 1063 HG22 VAL 142 1HG2 VAL 142 1.176 2.086 -3.905 1064 HG23 VAL 142 2HG2 VAL 142 0.997 0.392 -4.366 1065 H ALA 143 H ALA 143 0.292 0.322 -1.693 1066 HA ALA 143 HA ALA 143 0.281 -2.595 -2.117 1067 HB1 ALA 143 3HB ALA 143 -1.257 -1.085 -0.001 1068 HB2 ALA 143 1HB ALA 143 0.155 -2.102 0.285 1069 HB3 ALA 143 2HB ALA 143 -1.342 -2.821 -0.308 1070 H LEU 144 H LEU 144 -0.929 -3.014 -3.853 1071 HA LEU 144 HA LEU 144 -3.126 -1.150 -4.470 1072 HG LEU 144 HG LEU 144 -0.308 -0.815 -5.700 1073 HB2 LEU 144 1HB LEU 144 -1.493 -2.883 -6.323 1074 HB3 LEU 144 2HB LEU 144 -2.881 -1.935 -6.820 1075 HD11 LEU 144 1HD1 LEU 144 -0.026 -1.714 -7.945 1076 HD12 LEU 144 2HD1 LEU 144 0.029 0.049 -7.967 1077 HD13 LEU 144 3HD1 LEU 144 -1.424 -0.796 -8.502 1078 HD21 LEU 144 3HD2 LEU 144 -2.241 0.550 -5.107 1079 HD22 LEU 144 1HD2 LEU 144 -2.747 0.582 -6.797 1080 HD23 LEU 144 2HD2 LEU 144 -1.240 1.360 -6.313 1081 H LEU 145 H LEU 145 -5.120 -1.863 -4.471 1082 HA LEU 145 HA LEU 145 -5.623 -4.750 -4.295 1083 HG LEU 145 HG LEU 145 -5.601 -2.630 -2.004 1084 HB2 LEU 145 1HB LEU 145 -7.446 -2.420 -3.674 1085 HB3 LEU 145 2HB LEU 145 -7.822 -4.111 -3.414 1086 HD11 LEU 145 1HD1 LEU 145 -8.351 -3.366 -1.012 1087 HD12 LEU 145 2HD1 LEU 145 -7.791 -1.735 -1.388 1088 HD13 LEU 145 3HD1 LEU 145 -7.061 -2.634 -0.057 1089 HD21 LEU 145 3HD2 LEU 145 -5.592 -4.568 -0.523 1090 HD22 LEU 145 1HD2 LEU 145 -5.242 -5.034 -2.186 1091 HD23 LEU 145 2HD2 LEU 145 -6.841 -5.333 -1.506 1092 HA PRO 146 HA PRO 146 -7.178 -3.966 -8.502 1093 HB2 PRO 146 1HB PRO 146 -6.512 -6.325 -9.560 1094 HB3 PRO 146 2HB PRO 146 -5.291 -5.084 -9.255 1095 HG2 PRO 146 1HG PRO 146 -5.933 -7.539 -7.680 1096 HG3 PRO 146 2HG PRO 146 -4.355 -6.820 -8.044 1097 HD2 PRO 146 1HD PRO 146 -5.749 -6.499 -5.663 1098 HD3 PRO 146 2HD PRO 146 -4.457 -5.431 -6.244 1099 H ASP 147 H ASP 147 -8.689 -5.350 -9.904 1100 HA ASP 147 HA ASP 147 -10.702 -6.560 -8.155 1101 HB2 ASP 147 1HB ASP 147 -11.216 -4.660 -9.862 1102 HB3 ASP 147 2HB ASP 147 -11.129 -5.935 -11.072 1103 H GLY 148 H GLY 148 -12.024 -8.161 -9.939 1104 HA2 GLY 148 1HA GLY 148 -10.796 -9.968 -11.508 1105 HA3 GLY 148 2HA GLY 148 -10.271 -10.466 -9.901 1106 H ASP 149 H ASP 149 -12.979 -9.194 -9.069 1107 HA ASP 149 HA ASP 149 -14.436 -11.727 -9.278 1108 HB2 ASP 149 1HB ASP 149 -14.785 -9.436 -7.332 1109 HB3 ASP 149 2HB ASP 149 -15.676 -10.954 -7.297 1110 H SER 150 H SER 150 -14.642 -8.318 -9.993 1111 HA SER 150 HA SER 150 -17.462 -8.276 -10.464 1112 HG SER 150 HG SER 150 -15.095 -5.965 -9.434 1113 HB2 SER 150 1HB SER 150 -15.358 -6.353 -11.492 1114 HB3 SER 150 2HB SER 150 -17.087 -6.046 -11.340 1115 H LEU 151 H LEU 151 -14.606 -8.870 -12.399 1116 HA LEU 151 HA LEU 151 -16.130 -9.141 -14.847 1117 HG LEU 151 HG LEU 151 -13.564 -7.429 -14.098 1118 HB2 LEU 151 1HB LEU 151 -13.257 -9.860 -14.240 1119 HB3 LEU 151 2HB LEU 151 -13.993 -9.866 -15.832 1120 HD11 LEU 151 1HD1 LEU 151 -12.195 -8.338 -16.625 1121 HD12 LEU 151 2HD1 LEU 151 -11.488 -8.299 -15.010 1122 HD13 LEU 151 3HD1 LEU 151 -11.936 -6.794 -15.813 1123 HD21 LEU 151 3HD2 LEU 151 -15.574 -7.214 -15.458 1124 HD22 LEU 151 1HD2 LEU 151 -14.665 -7.674 -16.897 1125 HD23 LEU 151 2HD2 LEU 151 -14.295 -6.164 -16.065 1126 H GLU 152 H GLU 152 -17.506 -10.803 -14.837 1127 HA GLU 152 HA GLU 152 -17.256 -13.037 -13.147 1128 HB2 GLU 152 1HB GLU 152 -18.985 -12.796 -15.610 1129 HB3 GLU 152 2HB GLU 152 -19.224 -13.899 -14.261 1130 HG2 GLU 152 1HG GLU 152 -19.511 -11.925 -12.781 1131 HG3 GLU 152 2HG GLU 152 -19.444 -10.903 -14.216 1132 H HIS 153 H HIS 153 -16.719 -15.149 -13.498 1133 HA HIS 153 HA HIS 153 -15.088 -15.636 -15.896 1134 HD1 HIS 153 HD1 HIS 153 -11.837 -16.189 -14.713 1135 HD2 HIS 153 HD2 HIS 153 -14.526 -14.419 -12.069 1136 HE1 HIS 153 HE1 HIS 153 -10.553 -14.357 -13.553 1137 HE2 HIS 153 HE2 HIS 153 -12.197 -13.298 -11.957 1138 HB2 HIS 153 1HB HIS 153 -15.051 -17.051 -13.215 1139 HB3 HIS 153 2HB HIS 153 -14.007 -17.431 -14.577 1140 H HIS 154 H HIS 154 -16.394 -16.552 -17.408 1141 HA HIS 154 HA HIS 154 -18.525 -18.332 -16.740 1142 HD1 HIS 154 HD1 HIS 154 -20.834 -17.637 -18.693 1143 HD2 HIS 154 HD2 HIS 154 -18.306 -20.549 -20.258 1144 HE1 HIS 154 HE1 HIS 154 -22.343 -19.366 -19.731 1145 HE2 HIS 154 HE2 HIS 154 -20.790 -21.024 -20.818 1146 HB2 HIS 154 1HB HIS 154 -18.357 -16.919 -18.856 1147 HB3 HIS 154 2HB HIS 154 -17.198 -18.105 -19.447 1148 H HIS 155 H HIS 155 -15.283 -18.809 -18.161 1149 HA HIS 155 HA HIS 155 -15.345 -21.565 -17.246 1150 HD1 HIS 155 HD1 HIS 155 -13.110 -20.246 -21.049 1151 HD2 HIS 155 HD2 HIS 155 -12.504 -18.292 -17.426 1152 HE1 HIS 155 HE1 HIS 155 -12.004 -18.064 -21.631 1153 HE2 HIS 155 HE2 HIS 155 -11.485 -16.983 -19.417 1154 HB2 HIS 155 1HB HIS 155 -12.836 -21.468 -17.934 1155 HB3 HIS 155 2HB HIS 155 -14.069 -21.508 -19.180 1156 H HIS 156 H HIS 156 -14.985 -22.062 -15.206 1157 HA HIS 156 HA HIS 156 -14.567 -19.805 -13.468 1158 HD1 HIS 156 HD1 HIS 156 -15.350 -22.159 -9.978 1159 HD2 HIS 156 HD2 HIS 156 -16.784 -18.968 -12.227 1160 HE1 HIS 156 HE1 HIS 156 -16.283 -20.518 -8.315 1161 HE2 HIS 156 HE2 HIS 156 -17.328 -18.699 -9.714 1162 HB2 HIS 156 1HB HIS 156 -16.333 -21.764 -13.347 1163 HB3 HIS 156 2HB HIS 156 -15.067 -22.539 -12.401 1164 H HIS 157 H HIS 157 -12.839 -22.835 -14.132 1165 HA HIS 157 HA HIS 157 -11.046 -22.236 -11.898 1166 HD1 HIS 157 HD1 HIS 157 -13.198 -25.705 -13.705 1167 HD2 HIS 157 HD2 HIS 157 -9.310 -24.986 -14.999 1168 HE1 HIS 157 HE1 HIS 157 -12.957 -26.967 -15.867 1169 HE2 HIS 157 HE2 HIS 157 -10.525 -26.733 -16.476 1170 HB2 HIS 157 1HB HIS 157 -10.090 -24.474 -12.247 1171 HB3 HIS 157 2HB HIS 157 -11.826 -24.529 -11.989 1172 H HIS 158 H HIS 158 -11.225 -21.708 -15.177 1173 HA HIS 158 HA HIS 158 -8.775 -20.352 -15.277 1174 HD1 HIS 158 HD1 HIS 158 -7.233 -23.099 -18.705 1175 HD2 HIS 158 HD2 HIS 158 -6.448 -19.832 -16.254 1176 HE1 HIS 158 HE1 HIS 158 -5.417 -21.798 -19.865 1177 HE2 HIS 158 HE2 HIS 158 -5.097 -19.727 -18.460 1178 HB2 HIS 158 1HB HIS 158 -7.785 -22.612 -15.388 1179 HB3 HIS 158 2HB HIS 158 -8.794 -22.985 -16.782 Start of MODEL 6 1 HA MET 1 HA MET 1 34.097 2.714 7.747 2 H1 MET 1 1H MET 1 35.679 1.061 8.475 3 H2 MET 1 2H MET 1 34.584 -0.181 8.110 4 H3 MET 1 3H MET 1 34.225 0.938 9.331 5 HB2 MET 1 1HB MET 1 35.761 1.817 6.171 6 HB3 MET 1 2HB MET 1 34.641 0.545 5.709 7 HG2 MET 1 1HG MET 1 33.101 2.205 4.814 8 HG3 MET 1 2HG MET 1 34.197 3.496 5.304 9 HE1 MET 1 3HE MET 1 36.653 3.805 4.274 10 HE2 MET 1 1HE MET 1 37.321 2.755 3.026 11 HE3 MET 1 2HE MET 1 37.022 2.122 4.645 12 H LYS 2 H LYS 2 32.034 2.946 8.336 13 HA LYS 2 HA LYS 2 30.072 1.429 6.773 14 HB2 LYS 2 1HB LYS 2 30.139 1.813 9.725 15 HB3 LYS 2 2HB LYS 2 28.574 1.929 8.932 16 HG2 LYS 2 1HG LYS 2 30.443 -0.417 8.676 17 HG3 LYS 2 2HG LYS 2 29.082 -0.330 9.798 18 HD2 LYS 2 1HD LYS 2 27.555 -0.021 7.892 19 HD3 LYS 2 2HD LYS 2 28.924 -0.159 6.788 20 HE2 LYS 2 1HE LYS 2 28.037 -2.303 8.716 21 HE3 LYS 2 2HE LYS 2 27.615 -2.250 7.004 22 HZ1 LYS 2 3HZ LYS 2 30.333 -2.545 8.162 23 HZ2 LYS 2 1HZ LYS 2 30.025 -2.308 6.510 24 HZ3 LYS 2 2HZ LYS 2 29.462 -3.704 7.289 25 H LEU 3 H LEU 3 27.796 2.763 7.399 26 HA LEU 3 HA LEU 3 28.462 5.460 6.422 27 HG LEU 3 HG LEU 3 27.820 2.990 4.555 28 HB2 LEU 3 1HB LEU 3 25.979 3.810 5.945 29 HB3 LEU 3 2HB LEU 3 26.238 5.437 5.349 30 HD11 LEU 3 1HD1 LEU 3 25.567 3.023 3.630 31 HD12 LEU 3 2HD1 LEU 3 26.770 3.316 2.375 32 HD13 LEU 3 3HD1 LEU 3 25.830 4.658 3.024 33 HD21 LEU 3 3HD2 LEU 3 28.024 5.840 3.588 34 HD22 LEU 3 1HD2 LEU 3 28.889 4.457 2.917 35 HD23 LEU 3 2HD2 LEU 3 29.218 4.988 4.567 36 H HIS 4 H HIS 4 26.414 6.953 6.763 37 HA HIS 4 HA HIS 4 25.820 6.906 9.636 38 HD1 HIS 4 HD1 HIS 4 27.281 10.501 7.108 39 HD2 HIS 4 HD2 HIS 4 27.711 8.380 10.663 40 HE1 HIS 4 HE1 HIS 4 29.585 11.060 7.963 41 HE2 HIS 4 HE2 HIS 4 29.851 9.707 10.075 42 HB2 HIS 4 1HB HIS 4 25.339 9.059 7.558 43 HB3 HIS 4 2HB HIS 4 24.977 9.211 9.274 44 H THR 5 H THR 5 24.278 6.993 6.489 45 HA THR 5 HA THR 5 21.651 6.545 7.697 46 HB THR 5 HB THR 5 22.017 6.769 4.741 47 HG1 THR 5 HG1 THR 5 21.796 9.230 5.928 48 HG21 THR 5 3HG2 THR 5 20.039 7.972 6.685 49 HG22 THR 5 1HG2 THR 5 19.783 6.517 5.721 50 HG23 THR 5 2HG2 THR 5 19.955 8.083 4.927 51 H ASP 6 H ASP 6 20.443 5.115 5.645 52 HA ASP 6 HA ASP 6 21.281 2.458 6.102 53 HB2 ASP 6 1HB ASP 6 19.654 1.917 4.249 54 HB3 ASP 6 2HB ASP 6 18.980 2.841 5.588 55 HA PRO 7 HA PRO 7 24.415 1.978 3.039 56 HB2 PRO 7 1HB PRO 7 23.848 -0.871 2.916 57 HB3 PRO 7 2HB PRO 7 25.217 -0.044 3.659 58 HG2 PRO 7 1HG PRO 7 23.309 -1.327 5.101 59 HG3 PRO 7 2HG PRO 7 24.193 0.085 5.710 60 HD2 PRO 7 1HD PRO 7 21.445 -0.061 4.517 61 HD3 PRO 7 2HD PRO 7 22.009 0.850 5.936 62 H ALA 8 H ALA 8 21.668 2.520 2.050 63 HA ALA 8 HA ALA 8 20.684 2.771 0.034 64 HB1 ALA 8 3HB ALA 8 23.079 1.349 -1.113 65 HB2 ALA 8 1HB ALA 8 22.954 3.086 -0.833 66 HB3 ALA 8 2HB ALA 8 21.894 2.304 -2.006 67 H THR 9 H THR 9 18.871 1.707 -0.190 68 HA THR 9 HA THR 9 18.840 -1.194 -0.335 69 HB THR 9 HB THR 9 16.301 -0.755 -0.461 70 HG1 THR 9 HG1 THR 9 15.739 1.340 0.411 71 HG21 THR 9 3HG2 THR 9 17.873 0.085 1.981 72 HG22 THR 9 1HG2 THR 9 17.421 -1.565 1.550 73 HG23 THR 9 2HG2 THR 9 16.174 -0.391 1.970 74 H ALA 10 H ALA 10 16.371 -1.187 -1.984 75 HA ALA 10 HA ALA 10 17.637 -0.727 -4.604 76 HB1 ALA 10 3HB ALA 10 17.568 -3.113 -4.064 77 HB2 ALA 10 1HB ALA 10 16.524 -2.732 -5.432 78 HB3 ALA 10 2HB ALA 10 15.822 -3.013 -3.839 79 H LEU 11 H LEU 11 16.004 -0.628 -6.407 80 HA LEU 11 HA LEU 11 13.497 0.638 -5.526 81 HG LEU 11 HG LEU 11 16.195 2.310 -5.761 82 HB2 LEU 11 1HB LEU 11 15.220 1.484 -7.862 83 HB3 LEU 11 2HB LEU 11 13.677 2.189 -7.424 84 HD11 LEU 11 1HD1 LEU 11 16.323 3.682 -7.771 85 HD12 LEU 11 2HD1 LEU 11 16.187 4.683 -6.326 86 HD13 LEU 11 3HD1 LEU 11 14.781 4.436 -7.363 87 HD21 LEU 11 3HD2 LEU 11 14.940 3.874 -4.360 88 HD22 LEU 11 1HD2 LEU 11 14.190 2.277 -4.373 89 HD23 LEU 11 2HD2 LEU 11 13.496 3.586 -5.330 90 H ASN 12 H ASN 12 11.712 0.399 -7.007 91 HA ASN 12 HA ASN 12 12.002 -1.445 -9.221 92 HB2 ASN 12 1HB ASN 12 11.817 -2.952 -7.263 93 HB3 ASN 12 2HB ASN 12 10.291 -2.186 -6.832 94 HD21 ASN 12 2HD2 ASN 12 9.193 -4.132 -7.001 95 HD22 ASN 12 1HD2 ASN 12 8.827 -4.851 -8.528 96 H THR 13 H THR 13 10.581 -0.930 -10.773 97 HA THR 13 HA THR 13 8.466 0.993 -10.064 98 HB THR 13 HB THR 13 9.848 0.678 -12.737 99 HG1 THR 13 HG1 THR 13 10.538 2.042 -10.420 100 HG21 THR 13 3HG2 THR 13 7.622 1.705 -12.860 101 HG22 THR 13 1HG2 THR 13 8.888 2.882 -13.212 102 HG23 THR 13 2HG2 THR 13 8.097 2.883 -11.636 103 H VAL 14 H VAL 14 6.394 0.658 -10.771 104 HA VAL 14 HA VAL 14 5.597 -1.920 -11.663 105 HB VAL 14 HB VAL 14 4.031 0.671 -11.680 106 HG11 VAL 14 1HG1 VAL 14 3.050 -0.979 -13.177 107 HG12 VAL 14 2HG1 VAL 14 2.043 -0.763 -11.745 108 HG13 VAL 14 3HG1 VAL 14 3.077 -2.184 -11.888 109 HG21 VAL 14 3HG2 VAL 14 3.054 -0.149 -9.589 110 HG22 VAL 14 1HG2 VAL 14 4.797 0.075 -9.447 111 HG23 VAL 14 2HG2 VAL 14 4.129 -1.546 -9.638 112 H THR 15 H THR 15 5.846 -2.694 -13.646 113 HA THR 15 HA THR 15 6.647 -1.006 -15.801 114 HB THR 15 HB THR 15 6.099 -3.539 -16.843 115 HG1 THR 15 HG1 THR 15 6.187 -4.877 -15.208 116 HG21 THR 15 3HG2 THR 15 8.541 -3.802 -16.785 117 HG22 THR 15 1HG2 THR 15 8.658 -2.451 -15.657 118 HG23 THR 15 2HG2 THR 15 8.083 -2.180 -17.302 119 H ALA 16 H ALA 16 3.766 -3.044 -15.199 120 HA ALA 16 HA ALA 16 2.374 -1.416 -17.210 121 HB1 ALA 16 3HB ALA 16 1.335 -3.362 -18.195 122 HB2 ALA 16 1HB ALA 16 2.184 -4.419 -17.069 123 HB3 ALA 16 2HB ALA 16 3.090 -3.511 -18.277 124 H TYR 17 H TYR 17 0.497 -0.680 -16.577 125 HA TYR 17 HA TYR 17 -0.790 -1.869 -14.214 126 HD1 TYR 17 HD2 TYR 17 -1.365 -0.329 -11.977 127 HD2 TYR 17 HD1 TYR 17 -3.531 1.220 -15.296 128 HE1 TYR 17 HE2 TYR 17 -3.328 0.002 -10.535 129 HE2 TYR 17 HE1 TYR 17 -5.499 1.557 -13.861 130 HH TYR 17 HH TYR 17 -6.419 0.681 -11.761 131 HB2 TYR 17 1HB TYR 17 -0.228 0.543 -14.070 132 HB3 TYR 17 2HB TYR 17 -1.214 0.846 -15.495 133 H GLY 18 H GLY 18 -2.161 -3.415 -14.895 134 HA2 GLY 18 1HA GLY 18 -3.434 -3.181 -17.494 135 HA3 GLY 18 2HA GLY 18 -3.464 -4.584 -16.437 136 H ASP 19 H ASP 19 -5.752 -4.091 -17.566 137 HA ASP 19 HA ASP 19 -7.383 -2.237 -16.109 138 HB2 ASP 19 1HB ASP 19 -8.156 -4.388 -18.092 139 HB3 ASP 19 2HB ASP 19 -9.190 -3.091 -17.521 140 H GLY 20 H GLY 20 -6.470 -5.532 -15.854 141 HA2 GLY 20 1HA GLY 20 -8.476 -5.887 -13.712 142 HA3 GLY 20 2HA GLY 20 -7.965 -7.199 -14.763 143 H TYR 21 H TYR 21 -5.178 -6.565 -14.773 144 HA TYR 21 HA TYR 21 -4.517 -7.179 -11.971 145 HD1 TYR 21 HD2 TYR 21 -1.306 -7.610 -14.416 146 HD2 TYR 21 HD1 TYR 21 -4.837 -9.700 -15.546 147 HE1 TYR 21 HE2 TYR 21 -0.456 -7.793 -16.713 148 HE2 TYR 21 HE1 TYR 21 -3.989 -9.893 -17.846 149 HH TYR 21 HH TYR 21 -2.419 -8.852 -19.332 150 HB2 TYR 21 1HB TYR 21 -2.848 -8.805 -12.727 151 HB3 TYR 21 2HB TYR 21 -4.456 -9.251 -13.279 152 H ILE 22 H ILE 22 -2.083 -6.989 -11.595 153 HA ILE 22 HA ILE 22 -1.054 -4.637 -13.047 154 HB ILE 22 HB ILE 22 -0.635 -5.323 -10.128 155 HG12 ILE 22 1HG1 ILE 22 -2.208 -3.056 -11.375 156 HG13 ILE 22 2HG1 ILE 22 -2.923 -4.508 -10.685 157 HG21 ILE 22 1HG2 ILE 22 0.279 -2.940 -11.736 158 HG22 ILE 22 2HG2 ILE 22 1.305 -4.221 -11.091 159 HG23 ILE 22 3HG2 ILE 22 0.461 -3.130 -9.992 160 HD11 ILE 22 3HD1 ILE 22 -3.052 -2.638 -9.147 161 HD12 ILE 22 1HD1 ILE 22 -1.296 -2.465 -9.194 162 HD13 ILE 22 2HD1 ILE 22 -2.022 -3.916 -8.502 163 H GLU 23 H GLU 23 1.002 -4.789 -13.832 164 HA GLU 23 HA GLU 23 2.408 -7.315 -13.268 165 HB2 GLU 23 1HB GLU 23 1.501 -7.112 -15.576 166 HB3 GLU 23 2HB GLU 23 2.479 -5.674 -15.807 167 HG2 GLU 23 1HG GLU 23 3.879 -8.147 -14.983 168 HG3 GLU 23 2HG GLU 23 3.236 -8.084 -16.622 169 H VAL 24 H VAL 24 4.254 -7.112 -12.235 170 HA VAL 24 HA VAL 24 5.753 -4.588 -12.495 171 HB VAL 24 HB VAL 24 5.573 -6.246 -9.973 172 HG11 VAL 24 1HG1 VAL 24 7.665 -5.034 -10.206 173 HG12 VAL 24 2HG1 VAL 24 6.677 -4.323 -8.930 174 HG13 VAL 24 3HG1 VAL 24 6.783 -3.537 -10.505 175 HG21 VAL 24 3HG2 VAL 24 4.225 -4.418 -9.050 176 HG22 VAL 24 1HG2 VAL 24 3.423 -5.192 -10.416 177 HG23 VAL 24 2HG2 VAL 24 4.218 -3.631 -10.628 178 H ASN 25 H ASN 25 7.479 -5.045 -13.641 179 HA ASN 25 HA ASN 25 9.442 -5.927 -14.330 180 HB2 ASN 25 1HB ASN 25 9.907 -5.746 -11.821 181 HB3 ASN 25 2HB ASN 25 9.584 -7.475 -11.743 182 HD21 ASN 25 2HD2 ASN 25 11.021 -8.910 -12.714 183 HD22 ASN 25 1HD2 ASN 25 12.621 -8.441 -13.180 184 H GLN 26 H GLN 26 7.297 -7.094 -15.368 185 HA GLN 26 HA GLN 26 6.824 -8.803 -16.771 186 HB2 GLN 26 1HB GLN 26 9.386 -10.082 -15.808 187 HB3 GLN 26 2HB GLN 26 8.472 -10.529 -17.241 188 HG2 GLN 26 1HG GLN 26 8.906 -8.288 -18.178 189 HG3 GLN 26 2HG GLN 26 9.893 -7.918 -16.764 190 HE21 GLN 26 2HE2 GLN 26 10.689 -7.960 -19.530 191 HE22 GLN 26 1HE2 GLN 26 11.953 -9.135 -19.663 192 H VAL 27 H VAL 27 6.441 -8.825 -13.690 193 HA VAL 27 HA VAL 27 5.452 -11.601 -13.580 194 HB VAL 27 HB VAL 27 6.142 -9.824 -11.226 195 HG11 VAL 27 1HG1 VAL 27 5.310 -12.722 -11.350 196 HG12 VAL 27 2HG1 VAL 27 4.346 -11.382 -10.728 197 HG13 VAL 27 3HG1 VAL 27 5.824 -11.866 -9.896 198 HG21 VAL 27 3HG2 VAL 27 7.625 -12.203 -12.346 199 HG22 VAL 27 1HG2 VAL 27 8.024 -11.351 -10.854 200 HG23 VAL 27 2HG2 VAL 27 8.158 -10.523 -12.406 201 H ARG 28 H ARG 28 3.355 -11.577 -14.061 202 HA ARG 28 HA ARG 28 1.736 -9.241 -13.521 203 HE ARG 28 HE ARG 28 -0.670 -12.039 -16.107 204 HB2 ARG 28 1HB ARG 28 0.699 -11.881 -14.529 205 HB3 ARG 28 2HB ARG 28 0.032 -10.275 -14.786 206 HG2 ARG 28 1HG ARG 28 2.143 -9.775 -16.104 207 HG3 ARG 28 2HG ARG 28 2.450 -11.511 -16.056 208 HD2 ARG 28 1HD ARG 28 0.219 -10.021 -17.388 209 HD3 ARG 28 2HD ARG 28 1.339 -11.191 -18.082 210 HH11 ARG 28 1HH1 ARG 28 0.778 -12.295 -19.282 211 HH12 ARG 28 2HH1 ARG 28 -0.253 -13.606 -19.785 212 HH21 ARG 28 1HH2 ARG 28 -2.030 -13.759 -16.757 213 HH22 ARG 28 2HH2 ARG 28 -1.810 -14.468 -18.333 214 H PHE 29 H PHE 29 0.760 -8.907 -11.655 215 HA PHE 29 HA PHE 29 0.246 -11.185 -9.888 216 HD1 PHE 29 HD1 PHE 29 1.693 -11.145 -7.634 217 HD2 PHE 29 HD2 PHE 29 2.400 -7.514 -9.740 218 HE1 PHE 29 HE1 PHE 29 4.086 -11.297 -7.084 219 HE2 PHE 29 HE2 PHE 29 4.796 -7.663 -9.198 220 HZ PHE 29 HZ PHE 29 5.641 -9.556 -7.868 221 HB2 PHE 29 1HB PHE 29 0.213 -8.208 -9.349 222 HB3 PHE 29 2HB PHE 29 -0.135 -9.448 -8.148 223 H SER 30 H SER 30 -1.648 -12.097 -10.280 224 HA SER 30 HA SER 30 -3.964 -10.521 -11.040 225 HG SER 30 HG SER 30 -3.570 -14.236 -10.116 226 HB2 SER 30 1HB SER 30 -4.998 -12.923 -11.002 227 HB3 SER 30 2HB SER 30 -3.853 -12.497 -12.276 228 H HIS 31 H HIS 31 -2.592 -10.682 -8.286 229 HA HIS 31 HA HIS 31 -5.073 -10.766 -6.763 230 HD1 HIS 31 HD1 HIS 31 -1.174 -11.445 -4.754 231 HD2 HIS 31 HD2 HIS 31 -2.340 -14.189 -7.649 232 HE1 HIS 31 HE1 HIS 31 0.935 -12.618 -5.464 233 HE2 HIS 31 HE2 HIS 31 0.174 -14.402 -7.081 234 HB2 HIS 31 1HB HIS 31 -3.773 -11.932 -4.875 235 HB3 HIS 31 2HB HIS 31 -4.325 -12.928 -6.215 236 H ALA 32 H ALA 32 -4.800 -9.728 -4.614 237 HA ALA 32 HA ALA 32 -3.715 -7.175 -4.936 238 HB1 ALA 32 3HB ALA 32 -4.268 -6.821 -2.595 239 HB2 ALA 32 1HB ALA 32 -4.450 -8.560 -2.361 240 HB3 ALA 32 2HB ALA 32 -5.565 -7.689 -3.415 241 H ILE 33 H ILE 33 -1.901 -6.167 -4.140 242 HA ILE 33 HA ILE 33 0.177 -7.868 -2.948 243 HB ILE 33 HB ILE 33 1.846 -6.722 -4.478 244 HG12 ILE 33 1HG1 ILE 33 -0.663 -6.172 -6.084 245 HG13 ILE 33 2HG1 ILE 33 0.343 -4.953 -5.308 246 HG21 ILE 33 1HG2 ILE 33 1.498 -8.343 -6.285 247 HG22 ILE 33 2HG2 ILE 33 -0.132 -8.649 -5.684 248 HG23 ILE 33 3HG2 ILE 33 1.266 -9.068 -4.693 249 HD11 ILE 33 3HD1 ILE 33 0.773 -5.074 -7.693 250 HD12 ILE 33 1HD1 ILE 33 1.192 -6.780 -7.545 251 HD13 ILE 33 2HD1 ILE 33 2.199 -5.555 -6.772 252 H ALA 34 H ALA 34 1.461 -6.896 -1.527 253 HA ALA 34 HA ALA 34 1.416 -3.967 -1.311 254 HB1 ALA 34 3HB ALA 34 1.187 -5.898 1.003 255 HB2 ALA 34 1HB ALA 34 -0.096 -4.843 0.406 256 HB3 ALA 34 2HB ALA 34 1.352 -4.148 1.137 257 H PHE 35 H PHE 35 3.470 -3.358 -1.702 258 HA PHE 35 HA PHE 35 5.641 -4.935 -0.575 259 HD1 PHE 35 HD2 PHE 35 3.283 -4.932 -3.952 260 HD2 PHE 35 HD1 PHE 35 7.309 -3.588 -4.274 261 HE1 PHE 35 HE2 PHE 35 2.715 -3.733 -6.025 262 HE2 PHE 35 HE1 PHE 35 6.747 -2.387 -6.346 263 HZ PHE 35 HZ PHE 35 4.447 -2.459 -7.224 264 HB2 PHE 35 1HB PHE 35 6.748 -5.268 -2.719 265 HB3 PHE 35 2HB PHE 35 5.163 -6.027 -2.719 266 H ALA 36 H ALA 36 7.707 -3.985 -0.798 267 HA ALA 36 HA ALA 36 7.668 -1.084 -1.281 268 HB1 ALA 36 3HB ALA 36 8.316 -1.727 1.002 269 HB2 ALA 36 1HB ALA 36 9.662 -0.984 0.139 270 HB3 ALA 36 2HB ALA 36 9.609 -2.734 0.350 271 HA PRO 37 HA PRO 37 10.246 -1.781 -4.802 272 HB2 PRO 37 1HB PRO 37 11.876 0.391 -4.785 273 HB3 PRO 37 2HB PRO 37 10.165 0.481 -5.218 274 HG2 PRO 37 1HG PRO 37 11.498 1.142 -2.620 275 HG3 PRO 37 2HG PRO 37 10.225 2.027 -3.482 276 HD2 PRO 37 1HD PRO 37 9.704 0.408 -1.374 277 HD3 PRO 37 2HD PRO 37 8.560 0.631 -2.713 278 H GLU 38 H GLU 38 11.407 -1.935 -1.705 279 HA GLU 38 HA GLU 38 14.221 -2.048 -2.380 280 HB2 GLU 38 1HB GLU 38 12.924 -2.283 0.334 281 HB3 GLU 38 2HB GLU 38 14.617 -1.942 -0.005 282 HG2 GLU 38 1HG GLU 38 14.030 0.196 -0.972 283 HG3 GLU 38 2HG GLU 38 12.317 -0.148 -0.751 284 H GLY 39 H GLY 39 12.074 -4.202 -2.903 285 HA2 GLY 39 1HA GLY 39 13.363 -6.354 -3.419 286 HA3 GLY 39 2HA GLY 39 13.583 -6.421 -1.681 287 HA PRO 40 HA PRO 40 10.370 -9.270 -1.409 288 HB2 PRO 40 1HB PRO 40 9.236 -8.552 1.013 289 HB3 PRO 40 2HB PRO 40 10.683 -9.544 0.812 290 HG2 PRO 40 1HG PRO 40 10.452 -6.622 1.397 291 HG3 PRO 40 2HG PRO 40 11.583 -7.814 2.063 292 HD2 PRO 40 1HD PRO 40 12.350 -6.093 0.169 293 HD3 PRO 40 2HD PRO 40 12.935 -7.771 0.173 294 H VAL 41 H VAL 41 8.440 -9.539 -2.224 295 HA VAL 41 HA VAL 41 6.508 -7.303 -2.149 296 HB VAL 41 HB VAL 41 6.754 -9.524 -4.192 297 HG11 VAL 41 1HG1 VAL 41 4.429 -8.877 -3.858 298 HG12 VAL 41 2HG1 VAL 41 5.012 -8.333 -5.432 299 HG13 VAL 41 3HG1 VAL 41 4.854 -7.182 -4.105 300 HG21 VAL 41 3HG2 VAL 41 7.320 -6.572 -4.438 301 HG22 VAL 41 1HG2 VAL 41 7.384 -7.746 -5.753 302 HG23 VAL 41 2HG2 VAL 41 8.523 -7.862 -4.410 303 H ALA 42 H ALA 42 4.767 -7.660 -0.882 304 HA ALA 42 HA ALA 42 4.155 -10.428 -0.126 305 HB1 ALA 42 3HB ALA 42 3.230 -7.844 1.134 306 HB2 ALA 42 1HB ALA 42 4.545 -8.864 1.717 307 HB3 ALA 42 2HB ALA 42 2.890 -9.470 1.729 308 H SER 43 H SER 43 1.880 -11.071 -0.018 309 HA SER 43 HA SER 43 0.245 -9.662 -2.015 310 HG SER 43 HG SER 43 2.079 -11.094 -2.955 311 HB2 SER 43 1HB SER 43 0.549 -12.654 -1.672 312 HB3 SER 43 2HB SER 43 -0.583 -11.870 -2.774 313 H TRP 44 H TRP 44 -1.976 -9.697 -1.721 314 HA TRP 44 HA TRP 44 -2.854 -10.416 1.001 315 HD1 TRP 44 HD1 TRP 44 -1.367 -9.083 1.959 316 HE1 TRP 44 HE1 TRP 44 -0.870 -7.133 3.571 317 HE3 TRP 44 HE3 TRP 44 -5.020 -5.843 0.459 318 HZ2 TRP 44 HZ2 TRP 44 -1.902 -4.556 4.125 319 HZ3 TRP 44 HZ3 TRP 44 -5.203 -3.662 1.576 320 HH2 TRP 44 HH2 TRP 44 -3.680 -3.035 3.370 321 HB2 TRP 44 1HB TRP 44 -3.462 -8.074 -0.761 322 HB3 TRP 44 2HB TRP 44 -4.674 -8.615 0.387 323 HA PRO 45 HA PRO 45 -6.149 -12.660 -1.127 324 HB2 PRO 45 1HB PRO 45 -7.277 -13.388 1.377 325 HB3 PRO 45 2HB PRO 45 -6.235 -14.376 0.356 326 HG2 PRO 45 1HG PRO 45 -5.571 -13.378 2.873 327 HG3 PRO 45 2HG PRO 45 -4.427 -14.005 1.674 328 HD2 PRO 45 1HD PRO 45 -5.136 -11.180 2.328 329 HD3 PRO 45 2HD PRO 45 -3.575 -11.871 1.834 330 H VAL 46 H VAL 46 -6.158 -9.789 -0.248 331 HA VAL 46 HA VAL 46 -8.781 -9.318 0.887 332 HB VAL 46 HB VAL 46 -6.576 -7.436 0.016 333 HG11 VAL 46 1HG1 VAL 46 -8.763 -6.338 -0.129 334 HG12 VAL 46 2HG1 VAL 46 -7.777 -5.675 1.176 335 HG13 VAL 46 3HG1 VAL 46 -9.089 -6.791 1.542 336 HG21 VAL 46 3HG2 VAL 46 -6.229 -7.134 2.424 337 HG22 VAL 46 1HG2 VAL 46 -5.987 -8.808 1.926 338 HG23 VAL 46 2HG2 VAL 46 -7.477 -8.339 2.745 339 H GLN 47 H GLN 47 -10.550 -8.747 -0.233 340 HA GLN 47 HA GLN 47 -10.238 -8.382 -3.137 341 HB2 GLN 47 1HB GLN 47 -12.526 -9.593 -1.582 342 HB3 GLN 47 2HB GLN 47 -12.535 -9.317 -3.319 343 HG2 GLN 47 1HG GLN 47 -10.695 -10.854 -3.609 344 HG3 GLN 47 2HG GLN 47 -10.571 -11.074 -1.864 345 HE21 GLN 47 2HE2 GLN 47 -11.058 -13.010 -3.990 346 HE22 GLN 47 1HE2 GLN 47 -12.549 -13.792 -3.590 347 H ARG 48 H ARG 48 -12.099 -7.354 -0.291 348 HA ARG 48 HA ARG 48 -12.930 -4.984 -1.827 349 HE ARG 48 HE ARG 48 -17.150 -7.592 -1.843 350 HB2 ARG 48 1HB ARG 48 -14.020 -6.205 0.709 351 HB3 ARG 48 2HB ARG 48 -14.458 -4.592 0.178 352 HG2 ARG 48 1HG ARG 48 -16.207 -5.875 -0.585 353 HG3 ARG 48 2HG ARG 48 -15.177 -5.750 -2.009 354 HD2 ARG 48 1HD ARG 48 -14.368 -7.957 -1.731 355 HD3 ARG 48 2HD ARG 48 -15.032 -8.071 -0.100 356 HH11 ARG 48 1HH1 ARG 48 -14.826 -10.132 -1.210 357 HH12 ARG 48 2HH1 ARG 48 -15.879 -11.405 -1.746 358 HH21 ARG 48 1HH2 ARG 48 -18.552 -9.253 -2.503 359 HH22 ARG 48 2HH2 ARG 48 -18.014 -10.910 -2.453 360 HA PRO 49 HA PRO 49 -10.120 -2.450 0.543 361 HB2 PRO 49 1HB PRO 49 -11.563 -0.115 0.491 362 HB3 PRO 49 2HB PRO 49 -10.547 -0.682 -0.837 363 HG2 PRO 49 1HG PRO 49 -13.508 -0.903 -0.490 364 HG3 PRO 49 2HG PRO 49 -12.576 -0.515 -1.949 365 HD2 PRO 49 1HD PRO 49 -13.605 -2.965 -1.532 366 HD3 PRO 49 2HD PRO 49 -12.048 -2.731 -2.354 367 H ALA 50 H ALA 50 -13.293 -3.266 1.406 368 HA ALA 50 HA ALA 50 -13.192 -2.025 4.030 369 HB1 ALA 50 3HB ALA 50 -15.330 -2.147 2.845 370 HB2 ALA 50 1HB ALA 50 -15.387 -3.037 4.366 371 HB3 ALA 50 2HB ALA 50 -15.229 -3.908 2.840 372 H ASP 51 H ASP 51 -12.089 -4.857 2.544 373 HA ASP 51 HA ASP 51 -12.271 -6.570 4.868 374 HB2 ASP 51 1HB ASP 51 -10.684 -6.909 2.314 375 HB3 ASP 51 2HB ASP 51 -10.864 -8.135 3.556 376 H ILE 52 H ILE 52 -10.250 -4.107 3.753 377 HA ILE 52 HA ILE 52 -7.730 -4.910 4.682 378 HB ILE 52 HB ILE 52 -8.840 -2.104 4.471 379 HG12 ILE 52 1HG1 ILE 52 -7.216 -3.737 2.503 380 HG13 ILE 52 2HG1 ILE 52 -8.931 -3.371 2.353 381 HG21 ILE 52 1HG2 ILE 52 -6.857 -2.190 5.880 382 HG22 ILE 52 2HG2 ILE 52 -6.493 -1.405 4.344 383 HG23 ILE 52 3HG2 ILE 52 -5.986 -3.071 4.625 384 HD11 ILE 52 3HD1 ILE 52 -6.688 -1.364 2.327 385 HD12 ILE 52 1HD1 ILE 52 -8.406 -0.994 2.177 386 HD13 ILE 52 2HD1 ILE 52 -7.593 -1.937 0.927 387 H THR 53 H THR 53 -7.202 -5.427 6.662 388 HA THR 53 HA THR 53 -8.531 -4.108 8.932 389 HB THR 53 HB THR 53 -7.059 -6.747 9.009 390 HG1 THR 53 HG1 THR 53 -9.426 -6.189 7.820 391 HG21 THR 53 3HG2 THR 53 -7.463 -5.680 11.173 392 HG22 THR 53 1HG2 THR 53 -8.443 -7.137 11.000 393 HG23 THR 53 2HG2 THR 53 -9.181 -5.548 10.796 394 H ALA 54 H ALA 54 -7.197 -3.564 10.772 395 HA ALA 54 HA ALA 54 -4.805 -2.283 10.264 396 HB1 ALA 54 3HB ALA 54 -6.148 -1.930 12.281 397 HB2 ALA 54 1HB ALA 54 -4.458 -2.244 12.674 398 HB3 ALA 54 2HB ALA 54 -5.662 -3.516 12.880 399 H SER 55 H SER 55 -5.319 -5.615 11.308 400 HA SER 55 HA SER 55 -2.700 -6.382 11.817 401 HG SER 55 HG SER 55 -4.739 -7.785 13.247 402 HB2 SER 55 1HB SER 55 -4.705 -8.181 10.467 403 HB3 SER 55 2HB SER 55 -3.496 -8.599 11.683 404 H LEU 56 H LEU 56 -4.491 -6.321 8.767 405 HA LEU 56 HA LEU 56 -2.466 -7.557 7.206 406 HG LEU 56 HG LEU 56 -5.645 -7.688 7.503 407 HB2 LEU 56 1HB LEU 56 -4.714 -5.751 6.306 408 HB3 LEU 56 2HB LEU 56 -3.784 -6.829 5.283 409 HD11 LEU 56 1HD1 LEU 56 -6.808 -6.779 5.547 410 HD12 LEU 56 2HD1 LEU 56 -7.061 -8.516 5.713 411 HD13 LEU 56 3HD1 LEU 56 -5.928 -7.901 4.510 412 HD21 LEU 56 3HD2 LEU 56 -4.093 -9.326 5.499 413 HD22 LEU 56 1HD2 LEU 56 -5.273 -9.948 6.654 414 HD23 LEU 56 2HD2 LEU 56 -3.770 -9.227 7.231 415 H LEU 57 H LEU 57 -3.208 -4.255 8.091 416 HA LEU 57 HA LEU 57 -1.509 -2.970 6.233 417 HG LEU 57 HG LEU 57 -4.308 -2.330 7.284 418 HB2 LEU 57 1HB LEU 57 -2.495 -2.083 8.944 419 HB3 LEU 57 2HB LEU 57 -1.629 -1.046 7.826 420 HD11 LEU 57 1HD1 LEU 57 -5.193 -0.062 7.483 421 HD12 LEU 57 2HD1 LEU 57 -3.593 0.525 7.937 422 HD13 LEU 57 3HD1 LEU 57 -4.452 -0.598 8.991 423 HD21 LEU 57 3HD2 LEU 57 -2.712 -0.322 5.695 424 HD22 LEU 57 1HD2 LEU 57 -4.343 -0.876 5.317 425 HD23 LEU 57 2HD2 LEU 57 -2.992 -2.007 5.257 426 H GLN 58 H GLN 58 -0.987 -4.312 9.442 427 HA GLN 58 HA GLN 58 1.652 -3.306 9.761 428 HB2 GLN 58 1HB GLN 58 0.313 -5.692 11.045 429 HB3 GLN 58 2HB GLN 58 1.840 -4.988 11.563 430 HG2 GLN 58 1HG GLN 58 0.689 -2.879 12.049 431 HG3 GLN 58 2HG GLN 58 -0.839 -3.615 11.567 432 HE21 GLN 58 2HE2 GLN 58 -0.050 -2.469 14.111 433 HE22 GLN 58 1HE2 GLN 58 -0.253 -3.716 15.297 434 H GLN 59 H GLN 59 0.287 -6.208 8.342 435 HA GLN 59 HA GLN 59 2.735 -7.528 7.799 436 HB2 GLN 59 1HB GLN 59 0.087 -7.656 6.341 437 HB3 GLN 59 2HB GLN 59 1.429 -8.760 6.079 438 HG2 GLN 59 1HG GLN 59 1.240 -9.576 8.347 439 HG3 GLN 59 2HG GLN 59 -0.042 -8.412 8.682 440 HE21 GLN 59 2HE2 GLN 59 -0.041 -11.347 8.798 441 HE22 GLN 59 1HE2 GLN 59 -1.330 -11.849 7.757 442 H ALA 60 H ALA 60 0.725 -5.282 5.958 443 HA ALA 60 HA ALA 60 2.263 -5.245 3.601 444 HB1 ALA 60 3HB ALA 60 1.039 -3.216 3.047 445 HB2 ALA 60 1HB ALA 60 0.482 -3.082 4.715 446 HB3 ALA 60 2HB ALA 60 -0.046 -4.435 3.715 447 H ALA 61 H ALA 61 2.470 -3.404 6.586 448 HA ALA 61 HA ALA 61 4.336 -1.479 5.658 449 HB1 ALA 61 3HB ALA 61 2.943 -1.124 7.642 450 HB2 ALA 61 1HB ALA 61 4.656 -0.928 8.005 451 HB3 ALA 61 2HB ALA 61 3.818 -2.405 8.481 452 H GLY 62 H GLY 62 4.659 -4.769 6.347 453 HA2 GLY 62 1HA GLY 62 6.497 -6.142 6.232 454 HA3 GLY 62 2HA GLY 62 7.449 -4.733 5.791 455 H LEU 63 H LEU 63 5.567 -5.261 8.736 456 HA LEU 63 HA LEU 63 7.849 -4.499 10.323 457 HG LEU 63 HG LEU 63 4.925 -3.263 9.947 458 HB2 LEU 63 1HB LEU 63 5.092 -5.348 11.195 459 HB3 LEU 63 2HB LEU 63 6.326 -4.653 12.228 460 HD11 LEU 63 1HD1 LEU 63 4.814 -2.866 12.927 461 HD12 LEU 63 2HD1 LEU 63 3.549 -3.574 11.923 462 HD13 LEU 63 3HD1 LEU 63 3.988 -1.878 11.722 463 HD21 LEU 63 3HD2 LEU 63 7.251 -2.531 10.131 464 HD22 LEU 63 1HD2 LEU 63 7.024 -2.226 11.853 465 HD23 LEU 63 2HD2 LEU 63 6.141 -1.269 10.664 466 H ALA 64 H ALA 64 8.834 -6.487 9.289 467 HA ALA 64 HA ALA 64 8.825 -8.605 11.313 468 HB1 ALA 64 3HB ALA 64 8.822 -9.117 8.336 469 HB2 ALA 64 1HB ALA 64 7.486 -9.448 9.438 470 HB3 ALA 64 2HB ALA 64 9.000 -10.338 9.596 471 H GLU 65 H GLU 65 10.860 -9.567 11.626 472 HA GLU 65 HA GLU 65 13.066 -7.870 11.231 473 HB2 GLU 65 1HB GLU 65 13.264 -10.834 11.764 474 HB3 GLU 65 2HB GLU 65 14.396 -9.576 12.238 475 HG2 GLU 65 1HG GLU 65 11.667 -10.124 13.367 476 HG3 GLU 65 2HG GLU 65 13.225 -10.247 14.180 477 H VAL 66 H VAL 66 12.335 -11.022 9.763 478 HA VAL 66 HA VAL 66 13.754 -10.107 7.347 479 HB VAL 66 HB VAL 66 13.456 -12.975 8.268 480 HG11 VAL 66 1HG1 VAL 66 14.994 -11.774 5.966 481 HG12 VAL 66 2HG1 VAL 66 13.530 -12.751 5.846 482 HG13 VAL 66 3HG1 VAL 66 15.025 -13.471 6.445 483 HG21 VAL 66 3HG2 VAL 66 15.889 -11.192 8.301 484 HG22 VAL 66 1HG2 VAL 66 15.866 -12.911 8.696 485 HG23 VAL 66 2HG2 VAL 66 14.999 -11.761 9.713 486 H VAL 67 H VAL 67 12.146 -9.443 6.059 487 HA VAL 67 HA VAL 67 9.548 -10.597 6.046 488 HB VAL 67 HB VAL 67 10.795 -8.855 3.911 489 HG11 VAL 67 1HG1 VAL 67 8.473 -8.247 3.400 490 HG12 VAL 67 2HG1 VAL 67 7.910 -9.389 4.619 491 HG13 VAL 67 3HG1 VAL 67 8.758 -9.974 3.188 492 HG21 VAL 67 3HG2 VAL 67 9.238 -8.053 6.369 493 HG22 VAL 67 1HG2 VAL 67 9.749 -6.967 5.076 494 HG23 VAL 67 2HG2 VAL 67 10.954 -7.769 6.084 495 H ARG 68 H ARG 68 9.217 -12.589 5.382 496 HA ARG 68 HA ARG 68 10.966 -13.948 3.597 497 HE ARG 68 HE ARG 68 10.806 -16.173 7.998 498 HB2 ARG 68 1HB ARG 68 8.262 -14.751 4.686 499 HB3 ARG 68 2HB ARG 68 9.370 -15.821 3.833 500 HG2 ARG 68 1HG ARG 68 11.014 -15.579 5.580 501 HG3 ARG 68 2HG ARG 68 9.999 -14.401 6.410 502 HD2 ARG 68 1HD ARG 68 8.295 -16.113 6.767 503 HD3 ARG 68 2HD ARG 68 9.296 -17.291 5.916 504 HH11 ARG 68 1HH1 ARG 68 8.009 -18.247 7.592 505 HH12 ARG 68 2HH1 ARG 68 8.321 -19.154 9.045 506 HH21 ARG 68 1HH2 ARG 68 11.212 -17.346 9.877 507 HH22 ARG 68 2HH2 ARG 68 10.167 -18.654 10.340 508 H ASP 69 H ASP 69 10.990 -12.936 1.659 509 HA ASP 69 HA ASP 69 8.685 -12.213 0.179 510 HB2 ASP 69 1HB ASP 69 10.796 -11.124 -0.264 511 HB3 ASP 69 2HB ASP 69 11.552 -12.662 -0.669 512 HA PRO 70 HA PRO 70 7.776 -16.339 -1.211 513 HB2 PRO 70 1HB PRO 70 5.404 -15.808 -2.322 514 HB3 PRO 70 2HB PRO 70 5.634 -15.764 -0.571 515 HG2 PRO 70 1HG PRO 70 5.467 -13.510 -2.517 516 HG3 PRO 70 2HG PRO 70 4.819 -13.624 -0.872 517 HD2 PRO 70 1HD PRO 70 7.179 -12.339 -1.585 518 HD3 PRO 70 2HD PRO 70 6.759 -12.880 0.052 519 H LEU 71 H LEU 71 8.804 -13.806 -3.107 520 HA LEU 71 HA LEU 71 8.199 -15.115 -5.646 521 HG LEU 71 HG LEU 71 7.340 -12.252 -4.656 522 HB2 LEU 71 1HB LEU 71 9.730 -12.579 -5.052 523 HB3 LEU 71 2HB LEU 71 9.394 -13.195 -6.658 524 HD11 LEU 71 1HD1 LEU 71 8.622 -10.435 -5.644 525 HD12 LEU 71 2HD1 LEU 71 6.969 -10.444 -6.259 526 HD13 LEU 71 3HD1 LEU 71 8.285 -11.060 -7.259 527 HD21 LEU 71 3HD2 LEU 71 6.990 -13.253 -7.480 528 HD22 LEU 71 1HD2 LEU 71 5.725 -12.562 -6.464 529 HD23 LEU 71 2HD2 LEU 71 6.484 -14.089 -6.011 530 H ALA 72 H ALA 72 10.972 -14.267 -3.623 531 HA ALA 72 HA ALA 72 12.738 -15.912 -5.256 532 HB1 ALA 72 3HB ALA 72 13.299 -14.396 -2.706 533 HB2 ALA 72 1HB ALA 72 13.573 -13.796 -4.342 534 HB3 ALA 72 2HB ALA 72 14.501 -15.170 -3.739 535 H PHE 73 H PHE 73 14.374 -17.099 -3.439 536 HA PHE 73 HA PHE 73 12.620 -18.893 -1.899 537 HD1 PHE 73 HD1 PHE 73 11.557 -21.146 -3.254 538 HD2 PHE 73 HD2 PHE 73 14.295 -19.109 -5.798 539 HE1 PHE 73 HE1 PHE 73 10.032 -21.474 -5.156 540 HE2 PHE 73 HE2 PHE 73 12.771 -19.431 -7.704 541 HZ PHE 73 HZ PHE 73 10.637 -20.617 -7.383 542 HB2 PHE 73 1HB PHE 73 14.955 -19.749 -3.632 543 HB3 PHE 73 2HB PHE 73 13.958 -20.811 -2.646 544 H LEU 74 H LEU 74 14.249 -16.632 -1.054 545 HA LEU 74 HA LEU 74 16.289 -18.031 0.547 546 HG LEU 74 HG LEU 74 16.983 -17.263 -2.349 547 HB2 LEU 74 1HB LEU 74 16.568 -15.349 -0.815 548 HB3 LEU 74 2HB LEU 74 17.732 -16.030 0.305 549 HD11 LEU 74 1HD1 LEU 74 19.429 -15.691 -1.552 550 HD12 LEU 74 2HD1 LEU 74 18.158 -15.150 -2.651 551 HD13 LEU 74 3HD1 LEU 74 19.185 -16.515 -3.093 552 HD21 LEU 74 3HD2 LEU 74 19.171 -17.937 -0.385 553 HD22 LEU 74 1HD2 LEU 74 18.922 -18.693 -1.958 554 HD23 LEU 74 2HD2 LEU 74 17.719 -18.892 -0.684 555 H ASP 75 H ASP 75 17.188 -15.867 1.991 556 HA ASP 75 HA ASP 75 14.795 -14.909 3.413 557 HB2 ASP 75 1HB ASP 75 17.396 -15.785 4.702 558 HB3 ASP 75 2HB ASP 75 15.979 -15.170 5.542 559 H GLU 76 H GLU 76 14.967 -12.924 2.309 560 HA GLU 76 HA GLU 76 17.483 -11.451 2.625 561 HB2 GLU 76 1HB GLU 76 15.155 -10.711 0.852 562 HB3 GLU 76 2HB GLU 76 16.804 -10.107 0.771 563 HG2 GLU 76 1HG GLU 76 15.939 -12.928 0.162 564 HG3 GLU 76 2HG GLU 76 16.306 -11.684 -1.029 565 HA PRO 77 HA PRO 77 15.040 -8.918 5.468 566 HB2 PRO 77 1HB PRO 77 16.971 -8.530 7.270 567 HB3 PRO 77 2HB PRO 77 16.155 -10.090 7.135 568 HG2 PRO 77 1HG PRO 77 18.887 -9.315 6.301 569 HG3 PRO 77 2HG PRO 77 18.260 -10.905 6.766 570 HD2 PRO 77 1HD PRO 77 18.651 -9.862 4.120 571 HD3 PRO 77 2HD PRO 77 18.003 -11.448 4.584 572 H GLU 78 H GLU 78 16.104 -6.812 6.777 573 HA GLU 78 HA GLU 78 16.823 -4.948 4.704 574 HB2 GLU 78 1HB GLU 78 15.346 -4.301 6.595 575 HB3 GLU 78 2HB GLU 78 16.687 -4.544 7.704 576 HG2 GLU 78 1HG GLU 78 17.937 -2.771 6.548 577 HG3 GLU 78 2HG GLU 78 16.552 -2.506 5.494 578 H ALA 79 H ALA 79 18.831 -4.351 4.147 579 HA ALA 79 HA ALA 79 21.063 -5.724 5.324 580 HB1 ALA 79 3HB ALA 79 22.386 -4.667 3.577 581 HB2 ALA 79 1HB ALA 79 21.022 -3.634 3.148 582 HB3 ALA 79 2HB ALA 79 20.919 -5.377 2.902 583 H GLY 80 H GLY 80 21.924 -5.041 7.166 584 HA2 GLY 80 1HA GLY 80 23.063 -3.640 8.601 585 HA3 GLY 80 2HA GLY 80 22.916 -2.357 7.408 586 H ALA 81 H ALA 81 21.350 -0.865 7.614 587 HA ALA 81 HA ALA 81 19.044 -1.226 9.265 588 HB1 ALA 81 3HB ALA 81 19.551 0.537 10.885 589 HB2 ALA 81 1HB ALA 81 21.167 0.710 10.200 590 HB3 ALA 81 2HB ALA 81 20.708 -0.787 11.012 591 H GLY 82 H GLY 82 17.470 -0.042 8.386 592 HA2 GLY 82 1HA GLY 82 18.103 1.747 6.218 593 HA3 GLY 82 2HA GLY 82 16.497 1.308 6.779 594 H ALA 83 H ALA 83 16.284 3.687 6.230 595 HA ALA 83 HA ALA 83 17.352 5.716 7.808 596 HB1 ALA 83 3HB ALA 83 15.449 7.066 7.100 597 HB2 ALA 83 1HB ALA 83 14.607 5.613 6.559 598 HB3 ALA 83 2HB ALA 83 16.088 6.126 5.751 599 H ARG 84 H ARG 84 14.478 3.720 8.318 600 HA ARG 84 HA ARG 84 14.427 4.668 11.098 601 HE ARG 84 HE ARG 84 10.804 7.488 8.560 602 HB2 ARG 84 1HB ARG 84 12.162 3.467 9.485 603 HB3 ARG 84 2HB ARG 84 12.065 3.949 11.176 604 HG2 ARG 84 1HG ARG 84 12.621 6.270 10.487 605 HG3 ARG 84 2HG ARG 84 12.536 5.746 8.807 606 HD2 ARG 84 1HD ARG 84 10.191 5.079 9.160 607 HD3 ARG 84 2HD ARG 84 10.291 5.670 10.821 608 HH11 ARG 84 1HH1 ARG 84 8.924 6.629 11.395 609 HH12 ARG 84 2HH1 ARG 84 8.094 8.147 11.451 610 HH21 ARG 84 1HH2 ARG 84 9.708 9.471 8.633 611 HH22 ARG 84 2HH2 ARG 84 8.511 9.763 9.862 612 HA PRO 85 HA PRO 85 16.538 1.100 12.137 613 HB2 PRO 85 1HB PRO 85 14.920 1.134 14.637 614 HB3 PRO 85 2HB PRO 85 16.674 1.093 14.425 615 HG2 PRO 85 1HG PRO 85 15.465 3.348 15.127 616 HG3 PRO 85 2HG PRO 85 16.804 3.366 13.963 617 HD2 PRO 85 1HD PRO 85 13.870 3.631 13.485 618 HD3 PRO 85 2HD PRO 85 15.223 4.445 12.676 619 H ALA 86 H ALA 86 13.038 0.839 12.813 620 HA ALA 86 HA ALA 86 13.272 -2.055 12.990 621 HB1 ALA 86 3HB ALA 86 11.818 -0.850 14.542 622 HB2 ALA 86 1HB ALA 86 10.914 -2.020 13.582 623 HB3 ALA 86 2HB ALA 86 10.828 -0.302 13.190 624 H ASN 87 H ASN 87 13.829 -0.796 10.400 625 HA ASN 87 HA ASN 87 13.409 -1.066 8.177 626 HB2 ASN 87 1HB ASN 87 13.457 -3.481 8.898 627 HB3 ASN 87 2HB ASN 87 11.705 -3.420 9.043 628 HD21 ASN 87 2HD2 ASN 87 11.357 -4.973 7.493 629 HD22 ASN 87 1HD2 ASN 87 11.633 -4.695 5.811 630 H ALA 88 H ALA 88 11.692 0.595 9.807 631 HA ALA 88 HA ALA 88 9.022 0.272 8.722 632 HB1 ALA 88 3HB ALA 88 10.113 2.339 10.630 633 HB2 ALA 88 1HB ALA 88 9.283 0.851 11.083 634 HB3 ALA 88 2HB ALA 88 8.416 2.113 10.207 635 HA PRO 89 HA PRO 89 9.846 3.186 5.443 636 HB2 PRO 89 1HB PRO 89 7.334 3.302 4.470 637 HB3 PRO 89 2HB PRO 89 8.378 1.902 4.205 638 HG2 PRO 89 1HG PRO 89 6.183 2.275 6.208 639 HG3 PRO 89 2HG PRO 89 6.548 0.863 5.198 640 HD2 PRO 89 1HD PRO 89 7.276 1.050 7.814 641 HD3 PRO 89 2HD PRO 89 8.195 0.118 6.614 642 H GLU 90 H GLU 90 8.806 5.291 4.705 643 HA GLU 90 HA GLU 90 8.125 6.858 7.066 644 HB2 GLU 90 1HB GLU 90 9.846 7.750 5.580 645 HB3 GLU 90 2HB GLU 90 8.733 7.693 4.220 646 HG2 GLU 90 1HG GLU 90 7.333 9.373 5.257 647 HG3 GLU 90 2HG GLU 90 8.378 9.395 6.676 648 H VAL 91 H VAL 91 6.792 5.836 3.984 649 HA VAL 91 HA VAL 91 4.159 6.746 4.888 650 HB VAL 91 HB VAL 91 4.900 8.569 3.536 651 HG11 VAL 91 1HG1 VAL 91 6.722 7.479 2.379 652 HG12 VAL 91 2HG1 VAL 91 5.663 8.294 1.228 653 HG13 VAL 91 3HG1 VAL 91 5.578 6.543 1.417 654 HG21 VAL 91 3HG2 VAL 91 3.052 6.831 1.904 655 HG22 VAL 91 1HG2 VAL 91 3.278 8.568 1.698 656 HG23 VAL 91 2HG2 VAL 91 2.577 7.941 3.191 657 H LEU 92 H LEU 92 2.458 5.535 4.210 658 HA LEU 92 HA LEU 92 3.064 3.165 2.562 659 HG LEU 92 HG LEU 92 0.240 1.856 3.219 660 HB2 LEU 92 1HB LEU 92 2.658 2.552 4.891 661 HB3 LEU 92 2HB LEU 92 1.153 3.448 4.889 662 HD11 LEU 92 1HD1 LEU 92 2.806 0.357 3.717 663 HD12 LEU 92 2HD1 LEU 92 2.331 1.133 2.206 664 HD13 LEU 92 3HD1 LEU 92 1.416 -0.246 2.814 665 HD21 LEU 92 3HD2 LEU 92 -0.037 -0.015 4.773 666 HD22 LEU 92 1HD2 LEU 92 -0.206 1.540 5.588 667 HD23 LEU 92 2HD2 LEU 92 1.284 0.612 5.760 668 H LEU 93 H LEU 93 2.049 3.227 0.667 669 HA LEU 93 HA LEU 93 -0.311 4.953 0.393 670 HG LEU 93 HG LEU 93 2.601 5.626 -0.550 671 HB2 LEU 93 1HB LEU 93 1.500 3.766 -1.713 672 HB3 LEU 93 2HB LEU 93 0.114 4.787 -2.041 673 HD11 LEU 93 1HD1 LEU 93 2.988 5.318 -2.935 674 HD12 LEU 93 2HD1 LEU 93 3.023 7.028 -2.504 675 HD13 LEU 93 3HD1 LEU 93 1.605 6.349 -3.302 676 HD21 LEU 93 3HD2 LEU 93 0.617 6.777 0.278 677 HD22 LEU 93 1HD2 LEU 93 0.174 7.220 -1.371 678 HD23 LEU 93 2HD2 LEU 93 1.642 7.876 -0.645 679 H VAL 94 H VAL 94 -2.209 3.977 0.515 680 HA VAL 94 HA VAL 94 -2.388 1.159 -0.316 681 HB VAL 94 HB VAL 94 -4.280 2.720 1.454 682 HG11 VAL 94 1HG1 VAL 94 -5.399 0.926 0.252 683 HG12 VAL 94 2HG1 VAL 94 -5.257 0.526 1.963 684 HG13 VAL 94 3HG1 VAL 94 -4.173 -0.222 0.790 685 HG21 VAL 94 3HG2 VAL 94 -2.133 2.388 2.549 686 HG22 VAL 94 1HG2 VAL 94 -2.194 0.664 2.180 687 HG23 VAL 94 2HG2 VAL 94 -3.368 1.371 3.290 688 H GLY 95 H GLY 95 -3.154 0.897 -2.286 689 HA2 GLY 95 1HA GLY 95 -5.120 2.770 -3.384 690 HA3 GLY 95 2HA GLY 95 -4.287 1.495 -4.269 691 H THR 96 H THR 96 -7.134 2.390 -2.734 692 HA THR 96 HA THR 96 -7.894 -0.179 -1.721 693 HB THR 96 HB THR 96 -10.120 1.002 -1.361 694 HG1 THR 96 HG1 THR 96 -10.228 2.752 -2.584 695 HG21 THR 96 3HG2 THR 96 -7.592 2.176 -0.195 696 HG22 THR 96 1HG2 THR 96 -8.471 0.772 0.411 697 HG23 THR 96 2HG2 THR 96 -9.207 2.374 0.482 698 H GLY 97 H GLY 97 -7.708 0.812 -4.815 699 HA2 GLY 97 1HA GLY 97 -8.296 -0.373 -6.692 700 HA3 GLY 97 2HA GLY 97 -9.169 -1.487 -5.659 701 H ARG 98 H ARG 98 -11.344 -1.055 -5.148 702 HA ARG 98 HA ARG 98 -12.728 -0.242 -7.488 703 HE ARG 98 HE ARG 98 -13.659 -4.907 -4.086 704 HB2 ARG 98 1HB ARG 98 -14.035 -0.760 -4.825 705 HB3 ARG 98 2HB ARG 98 -14.687 -1.037 -6.435 706 HG2 ARG 98 1HG ARG 98 -12.926 -2.793 -6.743 707 HG3 ARG 98 2HG ARG 98 -12.531 -2.597 -5.035 708 HD2 ARG 98 1HD ARG 98 -14.992 -3.065 -4.580 709 HD3 ARG 98 2HD ARG 98 -15.088 -3.594 -6.260 710 HH11 ARG 98 1HH1 ARG 98 -14.437 -4.832 -7.501 711 HH12 ARG 98 2HH1 ARG 98 -13.901 -6.460 -7.785 712 HH21 ARG 98 1HH2 ARG 98 -13.005 -7.042 -4.446 713 HH22 ARG 98 2HH2 ARG 98 -13.141 -7.737 -6.027 714 H ARG 99 H ARG 99 -13.018 0.965 -4.150 715 HA ARG 99 HA ARG 99 -13.496 3.653 -5.247 716 HE ARG 99 HE ARG 99 -18.275 1.350 -5.882 717 HB2 ARG 99 1HB ARG 99 -15.030 2.267 -3.039 718 HB3 ARG 99 2HB ARG 99 -15.014 4.013 -3.209 719 HG2 ARG 99 1HG ARG 99 -17.005 3.277 -4.217 720 HG3 ARG 99 2HG ARG 99 -15.914 3.670 -5.546 721 HD2 ARG 99 1HD ARG 99 -15.358 1.289 -5.769 722 HD3 ARG 99 2HD ARG 99 -16.478 0.913 -4.461 723 HH11 ARG 99 1HH1 ARG 99 -15.210 1.940 -7.477 724 HH12 ARG 99 2HH1 ARG 99 -15.882 1.885 -9.083 725 HH21 ARG 99 1HH2 ARG 99 -19.178 1.299 -7.986 726 HH22 ARG 99 2HH2 ARG 99 -18.140 1.528 -9.365 727 H GLN 100 H GLN 100 -12.629 5.352 -4.003 728 HA GLN 100 HA GLN 100 -10.355 4.757 -2.448 729 HB2 GLN 100 1HB GLN 100 -11.949 7.323 -2.621 730 HB3 GLN 100 2HB GLN 100 -10.333 7.168 -1.962 731 HG2 GLN 100 1HG GLN 100 -9.498 6.483 -4.157 732 HG3 GLN 100 2HG GLN 100 -11.124 6.656 -4.817 733 HE21 GLN 100 2HE2 GLN 100 -8.692 8.030 -5.609 734 HE22 GLN 100 1HE2 GLN 100 -8.990 9.720 -5.383 735 H HIS 101 H HIS 101 -10.637 3.602 -0.639 736 HA HIS 101 HA HIS 101 -12.925 4.139 1.087 737 HD1 HIS 101 HD1 HIS 101 -14.399 1.449 2.139 738 HD2 HIS 101 HD2 HIS 101 -10.701 1.874 3.979 739 HE1 HIS 101 HE1 HIS 101 -14.748 0.732 4.524 740 HE2 HIS 101 HE2 HIS 101 -12.509 1.050 5.641 741 HB2 HIS 101 1HB HIS 101 -12.480 1.811 0.497 742 HB3 HIS 101 2HB HIS 101 -10.854 1.933 1.152 743 H LEU 102 H LEU 102 -12.738 5.511 2.690 744 HA LEU 102 HA LEU 102 -10.252 6.483 3.658 745 HG LEU 102 HG LEU 102 -11.196 7.194 6.491 746 HB2 LEU 102 1HB LEU 102 -12.290 7.825 3.752 747 HB3 LEU 102 2HB LEU 102 -13.027 6.663 4.838 748 HD11 LEU 102 1HD1 LEU 102 -10.003 9.305 6.205 749 HD12 LEU 102 2HD1 LEU 102 -10.696 9.482 4.593 750 HD13 LEU 102 3HD1 LEU 102 -9.588 8.152 4.935 751 HD21 LEU 102 3HD2 LEU 102 -13.440 8.086 6.732 752 HD22 LEU 102 1HD2 LEU 102 -13.040 9.429 5.661 753 HD23 LEU 102 2HD2 LEU 102 -12.241 9.282 7.227 754 H LEU 103 H LEU 103 -8.896 5.191 4.719 755 HA LEU 103 HA LEU 103 -9.796 3.142 6.516 756 HG LEU 103 HG LEU 103 -7.677 3.309 4.049 757 HB2 LEU 103 1HB LEU 103 -7.029 4.305 6.158 758 HB3 LEU 103 2HB LEU 103 -7.422 2.828 7.018 759 HD11 LEU 103 1HD1 LEU 103 -5.989 1.549 3.885 760 HD12 LEU 103 2HD1 LEU 103 -5.903 1.469 5.645 761 HD13 LEU 103 3HD1 LEU 103 -5.398 2.934 4.803 762 HD21 LEU 103 3HD2 LEU 103 -8.352 0.941 3.916 763 HD22 LEU 103 1HD2 LEU 103 -9.533 1.932 4.775 764 HD23 LEU 103 2HD2 LEU 103 -8.434 0.884 5.677 765 H GLY 104 H GLY 104 -9.332 3.159 8.842 766 HA2 GLY 104 1HA GLY 104 -9.925 5.882 9.803 767 HA3 GLY 104 2HA GLY 104 -10.505 4.402 10.549 768 HA PRO 105 HA PRO 105 -6.480 6.150 12.462 769 HB2 PRO 105 1HB PRO 105 -7.535 7.221 14.728 770 HB3 PRO 105 2HB PRO 105 -7.319 8.139 13.233 771 HG2 PRO 105 1HG PRO 105 -9.785 6.829 14.311 772 HG3 PRO 105 2HG PRO 105 -9.603 8.427 13.566 773 HD2 PRO 105 1HD PRO 105 -10.565 6.308 12.203 774 HD3 PRO 105 2HD PRO 105 -9.588 7.569 11.425 775 H GLU 106 H GLU 106 -8.932 3.978 13.144 776 HA GLU 106 HA GLU 106 -7.711 2.928 15.562 777 HB2 GLU 106 1HB GLU 106 -9.973 1.822 13.880 778 HB3 GLU 106 2HB GLU 106 -9.485 1.237 15.466 779 HG2 GLU 106 1HG GLU 106 -10.638 3.938 14.824 780 HG3 GLU 106 2HG GLU 106 -11.447 2.614 15.662 781 H GLN 107 H GLN 107 -7.575 2.544 12.177 782 HA GLN 107 HA GLN 107 -6.390 -0.121 12.311 783 HB2 GLN 107 1HB GLN 107 -7.021 1.611 9.914 784 HB3 GLN 107 2HB GLN 107 -6.554 -0.085 9.879 785 HG2 GLN 107 1HG GLN 107 -8.589 -0.761 10.868 786 HG3 GLN 107 2HG GLN 107 -9.020 0.899 11.279 787 HE21 GLN 107 2HE2 GLN 107 -10.492 -1.080 9.742 788 HE22 GLN 107 1HE2 GLN 107 -10.769 -0.373 8.186 789 H VAL 108 H VAL 108 -5.640 3.141 11.173 790 HA VAL 108 HA VAL 108 -2.933 2.376 10.483 791 HB VAL 108 HB VAL 108 -2.676 4.641 9.653 792 HG11 VAL 108 1HG1 VAL 108 -3.773 3.031 8.200 793 HG12 VAL 108 2HG1 VAL 108 -4.441 4.644 7.949 794 HG13 VAL 108 3HG1 VAL 108 -5.341 3.453 8.888 795 HG21 VAL 108 3HG2 VAL 108 -5.414 5.160 10.815 796 HG22 VAL 108 1HG2 VAL 108 -4.509 6.271 9.788 797 HG23 VAL 108 2HG2 VAL 108 -3.893 5.847 11.384 798 H ARG 109 H ARG 109 -4.340 3.055 13.343 799 HA ARG 109 HA ARG 109 -2.926 5.178 14.455 800 HE ARG 109 HE ARG 109 -6.177 4.365 17.227 801 HB2 ARG 109 1HB ARG 109 -4.930 4.088 15.466 802 HB3 ARG 109 2HB ARG 109 -3.909 2.740 15.950 803 HG2 ARG 109 1HG ARG 109 -2.512 4.398 17.224 804 HG3 ARG 109 2HG ARG 109 -3.776 5.586 16.901 805 HD2 ARG 109 1HD ARG 109 -4.206 2.951 18.297 806 HD3 ARG 109 2HD ARG 109 -3.968 4.489 19.120 807 HH11 ARG 109 1HH1 ARG 109 -5.091 4.227 20.555 808 HH12 ARG 109 2HH1 ARG 109 -6.687 4.442 21.219 809 HH21 ARG 109 1HH2 ARG 109 -8.298 4.656 18.113 810 HH22 ARG 109 2HH2 ARG 109 -8.480 4.687 19.846 811 HA PRO 110 HA PRO 110 0.235 1.983 16.403 812 HB2 PRO 110 1HB PRO 110 0.142 -0.153 14.341 813 HB3 PRO 110 2HB PRO 110 0.318 -0.286 16.094 814 HG2 PRO 110 1HG PRO 110 -1.983 -0.914 14.915 815 HG3 PRO 110 2HG PRO 110 -1.960 -0.063 16.473 816 HD2 PRO 110 1HD PRO 110 -2.475 1.017 13.730 817 HD3 PRO 110 2HD PRO 110 -3.270 1.417 15.266 818 H LEU 111 H LEU 111 -0.157 1.994 12.883 819 HA LEU 111 HA LEU 111 2.652 2.082 12.352 820 HG LEU 111 HG LEU 111 0.192 0.390 11.272 821 HB2 LEU 111 1HB LEU 111 0.322 2.727 10.542 822 HB3 LEU 111 2HB LEU 111 1.980 2.481 10.026 823 HD11 LEU 111 1HD1 LEU 111 -0.446 0.958 8.990 824 HD12 LEU 111 2HD1 LEU 111 0.265 -0.653 9.070 825 HD13 LEU 111 3HD1 LEU 111 1.215 0.700 8.455 826 HD21 LEU 111 3HD2 LEU 111 1.997 -1.170 10.753 827 HD22 LEU 111 1HD2 LEU 111 2.530 0.068 11.889 828 HD23 LEU 111 2HD2 LEU 111 2.999 0.169 10.193 829 H LEU 112 H LEU 112 0.030 4.433 12.454 830 HA LEU 112 HA LEU 112 1.433 6.674 11.528 831 HG LEU 112 HG LEU 112 0.182 8.895 13.157 832 HB2 LEU 112 1HB LEU 112 -1.048 6.460 11.862 833 HB3 LEU 112 2HB LEU 112 -0.778 6.647 13.583 834 HD11 LEU 112 1HD1 LEU 112 -0.739 8.373 10.337 835 HD12 LEU 112 2HD1 LEU 112 0.934 8.534 10.871 836 HD13 LEU 112 3HD1 LEU 112 -0.157 9.917 10.960 837 HD21 LEU 112 3HD2 LEU 112 -1.944 9.984 12.670 838 HD22 LEU 112 1HD2 LEU 112 -2.171 8.620 13.765 839 HD23 LEU 112 2HD2 LEU 112 -2.593 8.462 12.060 840 H ALA 113 H ALA 113 1.158 5.235 14.723 841 HA ALA 113 HA ALA 113 2.479 7.296 16.152 842 HB1 ALA 113 3HB ALA 113 2.229 4.370 16.841 843 HB2 ALA 113 1HB ALA 113 1.058 5.626 17.241 844 HB3 ALA 113 2HB ALA 113 2.672 5.667 17.951 845 H MET 114 H MET 114 3.590 4.600 14.255 846 HA MET 114 HA MET 114 6.323 4.770 15.187 847 HB2 MET 114 1HB MET 114 5.117 3.284 12.841 848 HB3 MET 114 2HB MET 114 6.788 3.143 13.369 849 HG2 MET 114 1HG MET 114 6.066 2.218 15.488 850 HG3 MET 114 2HG MET 114 4.380 2.414 15.017 851 HE1 MET 114 3HE MET 114 3.832 -0.124 15.517 852 HE2 MET 114 1HE MET 114 5.493 -0.346 16.068 853 HE3 MET 114 2HE MET 114 4.793 -1.469 14.902 854 H GLY 115 H GLY 115 4.384 6.528 13.127 855 HA2 GLY 115 1HA GLY 115 5.173 8.541 12.124 856 HA3 GLY 115 2HA GLY 115 6.743 7.780 11.909 857 H VAL 116 H VAL 116 4.529 5.510 11.084 858 HA VAL 116 HA VAL 116 5.104 5.852 8.281 859 HB VAL 116 HB VAL 116 3.345 3.770 9.592 860 HG11 VAL 116 1HG1 VAL 116 3.784 2.467 7.562 861 HG12 VAL 116 2HG1 VAL 116 4.701 3.819 6.897 862 HG13 VAL 116 3HG1 VAL 116 2.971 3.989 7.197 863 HG21 VAL 116 3HG2 VAL 116 5.586 3.692 10.537 864 HG22 VAL 116 1HG2 VAL 116 6.284 3.649 8.918 865 HG23 VAL 116 2HG2 VAL 116 5.307 2.298 9.493 866 H GLY 117 H GLY 117 4.006 7.450 7.320 867 HA2 GLY 117 1HA GLY 117 1.294 8.110 7.977 868 HA3 GLY 117 2HA GLY 117 2.235 8.767 6.644 869 H VAL 118 H VAL 118 -0.174 6.542 7.580 870 HA VAL 118 HA VAL 118 -0.105 5.079 5.069 871 HB VAL 118 HB VAL 118 -2.139 4.886 7.297 872 HG11 VAL 118 1HG1 VAL 118 -2.936 4.005 5.175 873 HG12 VAL 118 2HG1 VAL 118 -2.640 2.694 6.316 874 HG13 VAL 118 3HG1 VAL 118 -1.484 3.014 5.024 875 HG21 VAL 118 3HG2 VAL 118 0.343 3.237 6.824 876 HG22 VAL 118 1HG2 VAL 118 -0.894 2.908 8.038 877 HG23 VAL 118 2HG2 VAL 118 0.082 4.372 8.148 878 H GLU 119 H GLU 119 -0.904 6.050 3.339 879 HA GLU 119 HA GLU 119 -3.282 7.767 3.634 880 HB2 GLU 119 1HB GLU 119 -1.057 7.798 1.591 881 HB3 GLU 119 2HB GLU 119 -2.542 8.722 1.413 882 HG2 GLU 119 1HG GLU 119 -0.658 8.997 3.740 883 HG3 GLU 119 2HG GLU 119 -0.619 10.017 2.302 884 H ALA 120 H ALA 120 -5.085 7.322 2.473 885 HA ALA 120 HA ALA 120 -5.026 4.849 0.883 886 HB1 ALA 120 3HB ALA 120 -7.387 4.601 1.424 887 HB2 ALA 120 1HB ALA 120 -7.355 6.125 2.312 888 HB3 ALA 120 2HB ALA 120 -6.419 4.747 2.891 889 H MET 121 H MET 121 -5.368 4.976 -1.205 890 HA MET 121 HA MET 121 -7.062 7.072 -2.336 891 HB2 MET 121 1HB MET 121 -4.203 6.562 -3.196 892 HB3 MET 121 2HB MET 121 -5.363 7.467 -4.154 893 HG2 MET 121 1HG MET 121 -5.548 9.123 -2.373 894 HG3 MET 121 2HG MET 121 -4.393 8.209 -1.404 895 HE1 MET 121 3HE MET 121 -1.834 7.897 -2.053 896 HE2 MET 121 1HE MET 121 -1.117 8.530 -3.536 897 HE3 MET 121 2HE MET 121 -2.314 7.238 -3.617 898 H ASP 122 H ASP 122 -6.845 6.530 -4.975 899 HA ASP 122 HA ASP 122 -7.784 3.796 -5.166 900 HB2 ASP 122 1HB ASP 122 -8.274 4.341 -7.516 901 HB3 ASP 122 2HB ASP 122 -8.963 5.538 -6.422 902 H THR 123 H THR 123 -6.957 2.453 -7.042 903 HA THR 123 HA THR 123 -4.281 1.834 -6.454 904 HB THR 123 HB THR 123 -5.885 0.850 -8.818 905 HG1 THR 123 HG1 THR 123 -6.273 -0.917 -7.140 906 HG21 THR 123 3HG2 THR 123 -3.507 0.240 -8.860 907 HG22 THR 123 1HG2 THR 123 -4.527 -1.171 -8.578 908 HG23 THR 123 2HG2 THR 123 -3.652 -0.432 -7.237 909 H GLN 124 H GLN 124 -5.721 3.701 -9.064 910 HA GLN 124 HA GLN 124 -3.400 3.553 -10.740 911 HB2 GLN 124 1HB GLN 124 -5.792 3.910 -11.528 912 HB3 GLN 124 2HB GLN 124 -5.632 5.566 -10.961 913 HG2 GLN 124 1HG GLN 124 -3.741 5.899 -12.472 914 HG3 GLN 124 2HG GLN 124 -3.916 4.243 -13.048 915 HE21 GLN 124 2HE2 GLN 124 -4.037 6.660 -14.570 916 HE22 GLN 124 1HE2 GLN 124 -5.609 6.720 -15.307 917 H ALA 125 H ALA 125 -4.871 6.078 -8.707 918 HA ALA 125 HA ALA 125 -2.853 8.009 -9.100 919 HB1 ALA 125 3HB ALA 125 -4.629 7.635 -6.691 920 HB2 ALA 125 1HB ALA 125 -5.045 8.544 -8.144 921 HB3 ALA 125 2HB ALA 125 -3.730 9.095 -7.105 922 H ALA 126 H ALA 126 -3.183 5.367 -6.797 923 HA ALA 126 HA ALA 126 -0.992 6.001 -5.154 924 HB1 ALA 126 3HB ALA 126 -2.695 4.358 -4.529 925 HB2 ALA 126 1HB ALA 126 -1.070 3.678 -4.431 926 HB3 ALA 126 2HB ALA 126 -2.114 3.276 -5.795 927 H ALA 127 H ALA 127 -1.227 4.032 -8.095 928 HA ALA 127 HA ALA 127 1.429 3.124 -8.143 929 HB1 ALA 127 3HB ALA 127 -0.410 3.635 -10.480 930 HB2 ALA 127 1HB ALA 127 -0.346 2.154 -9.524 931 HB3 ALA 127 2HB ALA 127 1.043 2.635 -10.499 932 H ARG 128 H ARG 128 -0.079 5.975 -9.635 933 HA ARG 128 HA ARG 128 2.197 6.981 -10.924 934 HE ARG 128 HE ARG 128 -1.681 7.817 -13.923 935 HB2 ARG 128 1HB ARG 128 -0.199 8.409 -9.773 936 HB3 ARG 128 2HB ARG 128 1.030 9.207 -10.739 937 HG2 ARG 128 1HG ARG 128 0.494 7.731 -12.621 938 HG3 ARG 128 2HG ARG 128 -0.766 6.967 -11.645 939 HD2 ARG 128 1HD ARG 128 -1.938 9.075 -11.453 940 HD3 ARG 128 2HD ARG 128 -0.651 9.902 -12.326 941 HH11 ARG 128 1HH1 ARG 128 -2.566 10.960 -12.649 942 HH12 ARG 128 2HH1 ARG 128 -3.618 11.346 -13.981 943 HH21 ARG 128 1HH2 ARG 128 -3.067 8.321 -15.669 944 HH22 ARG 128 2HH2 ARG 128 -3.933 9.829 -15.679 945 H THR 129 H THR 129 0.863 7.750 -7.726 946 HA THR 129 HA THR 129 2.839 9.601 -6.977 947 HB THR 129 HB THR 129 1.258 7.832 -5.099 948 HG1 THR 129 HG1 THR 129 -0.184 8.861 -6.517 949 HG21 THR 129 3HG2 THR 129 1.451 9.740 -3.567 950 HG22 THR 129 1HG2 THR 129 2.411 10.607 -4.765 951 HG23 THR 129 2HG2 THR 129 3.039 9.131 -4.032 952 H TYR 130 H TYR 130 2.607 6.107 -6.580 953 HA TYR 130 HA TYR 130 4.747 5.661 -4.861 954 HD1 TYR 130 HD2 TYR 130 5.114 3.362 -3.708 955 HD2 TYR 130 HD1 TYR 130 5.103 2.349 -7.841 956 HE1 TYR 130 HE2 TYR 130 6.736 1.567 -3.269 957 HE2 TYR 130 HE1 TYR 130 6.720 0.551 -7.412 958 HH TYR 130 HH TYR 130 7.423 -0.579 -4.320 959 HB2 TYR 130 1HB TYR 130 3.156 3.926 -5.401 960 HB3 TYR 130 2HB TYR 130 3.634 3.955 -7.093 961 H ASN 131 H ASN 131 4.726 5.704 -8.421 962 HA ASN 131 HA ASN 131 7.440 5.103 -8.778 963 HB2 ASN 131 1HB ASN 131 5.528 6.647 -10.539 964 HB3 ASN 131 2HB ASN 131 7.148 6.175 -11.040 965 HD21 ASN 131 2HD2 ASN 131 4.563 5.432 -12.151 966 HD22 ASN 131 1HD2 ASN 131 4.497 3.708 -12.097 967 H ILE 132 H ILE 132 5.796 8.231 -8.514 968 HA ILE 132 HA ILE 132 8.111 9.813 -8.970 969 HB ILE 132 HB ILE 132 5.563 10.551 -7.520 970 HG12 ILE 132 1HG1 ILE 132 6.340 10.981 -10.414 971 HG13 ILE 132 2HG1 ILE 132 5.230 9.739 -9.848 972 HG21 ILE 132 1HG2 ILE 132 6.167 12.865 -8.060 973 HG22 ILE 132 2HG2 ILE 132 7.689 12.302 -8.751 974 HG23 ILE 132 3HG2 ILE 132 7.375 12.099 -7.027 975 HD11 ILE 132 3HD1 ILE 132 4.827 12.710 -9.593 976 HD12 ILE 132 1HD1 ILE 132 3.711 11.463 -9.038 977 HD13 ILE 132 2HD1 ILE 132 4.039 11.649 -10.760 978 H LEU 133 H LEU 133 6.470 8.697 -6.057 979 HA LEU 133 HA LEU 133 8.059 10.121 -4.205 980 HG LEU 133 HG LEU 133 7.703 7.738 -1.900 981 HB2 LEU 133 1HB LEU 133 5.838 9.278 -3.694 982 HB3 LEU 133 2HB LEU 133 6.389 7.630 -3.901 983 HD11 LEU 133 1HD1 LEU 133 7.822 9.743 -0.522 984 HD12 LEU 133 2HD1 LEU 133 6.900 10.639 -1.729 985 HD13 LEU 133 3HD1 LEU 133 8.512 10.038 -2.118 986 HD21 LEU 133 3HD2 LEU 133 5.327 7.273 -1.646 987 HD22 LEU 133 1HD2 LEU 133 4.998 8.998 -1.485 988 HD23 LEU 133 2HD2 LEU 133 5.947 8.163 -0.255 989 H MET 134 H MET 134 8.288 6.886 -5.590 990 HA MET 134 HA MET 134 10.463 5.967 -4.058 991 HB2 MET 134 1HB MET 134 9.184 4.424 -5.388 992 HB3 MET 134 2HB MET 134 9.579 5.293 -6.865 993 HG2 MET 134 1HG MET 134 11.969 4.699 -6.483 994 HG3 MET 134 2HG MET 134 11.443 3.684 -5.142 995 HE1 MET 134 3HE MET 134 9.322 4.219 -8.358 996 HE2 MET 134 1HE MET 134 9.955 2.981 -9.444 997 HE3 MET 134 2HE MET 134 10.960 4.358 -8.998 998 H ALA 135 H ALA 135 10.273 7.909 -6.987 999 HA ALA 135 HA ALA 135 13.036 7.908 -7.596 1000 HB1 ALA 135 3HB ALA 135 11.321 8.530 -9.228 1001 HB2 ALA 135 1HB ALA 135 12.537 9.794 -9.051 1002 HB3 ALA 135 2HB ALA 135 10.957 9.979 -8.292 1003 H GLU 136 H GLU 136 11.065 9.812 -5.416 1004 HA GLU 136 HA GLU 136 12.928 11.846 -4.842 1005 HB2 GLU 136 1HB GLU 136 10.791 10.609 -3.097 1006 HB3 GLU 136 2HB GLU 136 11.709 12.043 -2.661 1007 HG2 GLU 136 1HG GLU 136 10.810 13.190 -4.642 1008 HG3 GLU 136 2HG GLU 136 9.847 11.758 -5.010 1009 H GLY 137 H GLY 137 12.565 8.559 -3.685 1010 HA2 GLY 137 1HA GLY 137 14.416 7.285 -2.917 1011 HA3 GLY 137 2HA GLY 137 15.210 8.778 -2.436 1012 H ARG 138 H ARG 138 11.909 8.547 -1.576 1013 HA ARG 138 HA ARG 138 12.684 8.155 1.206 1014 HE ARG 138 HE ARG 138 10.063 12.180 -0.485 1015 HB2 ARG 138 1HB ARG 138 10.239 9.317 -0.113 1016 HB3 ARG 138 2HB ARG 138 10.290 8.943 1.597 1017 HG2 ARG 138 1HG ARG 138 12.288 10.432 1.786 1018 HG3 ARG 138 2HG ARG 138 12.011 10.905 0.110 1019 HD2 ARG 138 1HD ARG 138 9.923 11.163 2.259 1020 HD3 ARG 138 2HD ARG 138 11.072 12.442 1.883 1021 HH11 ARG 138 1HH1 ARG 138 8.294 11.742 2.506 1022 HH12 ARG 138 2HH1 ARG 138 6.815 12.419 1.869 1023 HH21 ARG 138 1HH2 ARG 138 8.135 13.072 -1.322 1024 HH22 ARG 138 2HH2 ARG 138 6.730 13.177 -0.299 1025 H ARG 139 H ARG 139 11.927 6.489 2.438 1026 HA ARG 139 HA ARG 139 11.271 4.114 1.070 1027 HE ARG 139 HE ARG 139 12.910 1.509 3.121 1028 HB2 ARG 139 1HB ARG 139 11.104 4.660 4.038 1029 HB3 ARG 139 2HB ARG 139 11.098 3.073 3.282 1030 HG2 ARG 139 1HG ARG 139 13.373 3.700 2.323 1031 HG3 ARG 139 2HG ARG 139 13.354 5.043 3.467 1032 HD2 ARG 139 1HD ARG 139 14.534 3.278 4.522 1033 HD3 ARG 139 2HD ARG 139 12.942 3.336 5.280 1034 HH11 ARG 139 1HH1 ARG 139 14.180 1.793 6.386 1035 HH12 ARG 139 2HH1 ARG 139 14.265 0.073 6.633 1036 HH21 ARG 139 1HH2 ARG 139 12.952 -0.705 3.471 1037 HH22 ARG 139 2HH2 ARG 139 13.499 -1.345 5.004 1038 H VAL 140 H VAL 140 9.428 3.718 0.156 1039 HA VAL 140 HA VAL 140 6.947 4.268 1.626 1040 HB VAL 140 HB VAL 140 7.080 5.955 -0.094 1041 HG11 VAL 140 1HG1 VAL 140 7.243 5.389 -2.477 1042 HG12 VAL 140 2HG1 VAL 140 7.489 3.696 -2.050 1043 HG13 VAL 140 3HG1 VAL 140 8.685 4.905 -1.584 1044 HG21 VAL 140 3HG2 VAL 140 4.879 5.004 0.315 1045 HG22 VAL 140 1HG2 VAL 140 5.172 3.763 -0.904 1046 HG23 VAL 140 2HG2 VAL 140 5.052 5.457 -1.381 1047 H VAL 141 H VAL 141 5.556 2.620 1.719 1048 HA VAL 141 HA VAL 141 6.046 0.283 -0.006 1049 HB VAL 141 HB VAL 141 4.495 0.377 2.595 1050 HG11 VAL 141 1HG1 VAL 141 5.375 -1.952 0.894 1051 HG12 VAL 141 2HG1 VAL 141 3.723 -1.369 1.093 1052 HG13 VAL 141 3HG1 VAL 141 4.582 -2.071 2.465 1053 HG21 VAL 141 3HG2 VAL 141 6.860 0.764 3.008 1054 HG22 VAL 141 1HG2 VAL 141 7.275 -0.663 2.059 1055 HG23 VAL 141 2HG2 VAL 141 6.387 -0.838 3.573 1056 H VAL 142 H VAL 142 4.329 -0.520 -1.234 1057 HA VAL 142 HA VAL 142 1.921 1.171 -1.206 1058 HB VAL 142 HB VAL 142 3.370 1.674 -3.150 1059 HG11 VAL 142 1HG1 VAL 142 3.574 0.055 -4.972 1060 HG12 VAL 142 2HG1 VAL 142 2.795 -1.168 -3.968 1061 HG13 VAL 142 3HG1 VAL 142 4.364 -0.512 -3.500 1062 HG21 VAL 142 3HG2 VAL 142 0.726 0.396 -3.824 1063 HG22 VAL 142 1HG2 VAL 142 1.613 1.521 -4.853 1064 HG23 VAL 142 2HG2 VAL 142 0.984 2.058 -3.295 1065 H ALA 143 H ALA 143 0.032 0.181 -1.117 1066 HA ALA 143 HA ALA 143 -0.057 -2.739 -1.548 1067 HB1 ALA 143 3HB ALA 143 -1.793 -1.054 0.261 1068 HB2 ALA 143 1HB ALA 143 -0.491 -2.122 0.784 1069 HB3 ALA 143 2HB ALA 143 -1.934 -2.795 0.024 1070 H LEU 144 H LEU 144 -1.072 -3.242 -3.387 1071 HA LEU 144 HA LEU 144 -3.026 -1.301 -4.437 1072 HG LEU 144 HG LEU 144 -0.018 -1.098 -5.059 1073 HB2 LEU 144 1HB LEU 144 -1.148 -3.120 -5.944 1074 HB3 LEU 144 2HB LEU 144 -2.360 -2.092 -6.688 1075 HD11 LEU 144 1HD1 LEU 144 0.714 -2.085 -7.159 1076 HD12 LEU 144 2HD1 LEU 144 0.878 -0.329 -7.198 1077 HD13 LEU 144 3HD1 LEU 144 -0.461 -1.110 -8.040 1078 HD21 LEU 144 3HD2 LEU 144 -1.963 0.378 -4.959 1079 HD22 LEU 144 1HD2 LEU 144 -2.052 0.388 -6.720 1080 HD23 LEU 144 2HD2 LEU 144 -0.660 1.099 -5.901 1081 H LEU 145 H LEU 145 -5.025 -1.984 -4.612 1082 HA LEU 145 HA LEU 145 -5.603 -4.852 -4.664 1083 HG LEU 145 HG LEU 145 -6.036 -3.055 -2.276 1084 HB2 LEU 145 1HB LEU 145 -7.388 -2.444 -4.288 1085 HB3 LEU 145 2HB LEU 145 -7.972 -4.096 -4.349 1086 HD11 LEU 145 1HD1 LEU 145 -7.930 -3.118 -0.740 1087 HD12 LEU 145 2HD1 LEU 145 -9.003 -3.556 -2.070 1088 HD13 LEU 145 3HD1 LEU 145 -8.216 -1.978 -2.054 1089 HD21 LEU 145 3HD2 LEU 145 -5.869 -5.458 -2.706 1090 HD22 LEU 145 1HD2 LEU 145 -7.606 -5.625 -2.438 1091 HD23 LEU 145 2HD2 LEU 145 -6.552 -5.130 -1.113 1092 HA PRO 146 HA PRO 146 -6.500 -4.306 -9.029 1093 HB2 PRO 146 1HB PRO 146 -6.307 -6.981 -9.599 1094 HB3 PRO 146 2HB PRO 146 -4.929 -5.884 -9.514 1095 HG2 PRO 146 1HG PRO 146 -5.643 -8.044 -7.724 1096 HG3 PRO 146 2HG PRO 146 -4.165 -7.074 -7.757 1097 HD2 PRO 146 1HD PRO 146 -6.493 -6.837 -6.010 1098 HD3 PRO 146 2HD PRO 146 -4.892 -6.091 -5.852 1099 H ASP 147 H ASP 147 -8.167 -5.073 -10.482 1100 HA ASP 147 HA ASP 147 -10.339 -5.438 -11.022 1101 HB2 ASP 147 1HB ASP 147 -9.984 -7.748 -10.411 1102 HB3 ASP 147 2HB ASP 147 -10.192 -7.376 -8.704 1103 H GLY 148 H GLY 148 -11.587 -3.723 -10.763 1104 HA2 GLY 148 1HA GLY 148 -12.648 -3.162 -8.087 1105 HA3 GLY 148 2HA GLY 148 -11.820 -1.876 -8.949 1106 H ASP 149 H ASP 149 -12.755 -1.054 -10.879 1107 HA ASP 149 HA ASP 149 -15.636 -1.053 -10.822 1108 HB2 ASP 149 1HB ASP 149 -13.682 0.323 -12.682 1109 HB3 ASP 149 2HB ASP 149 -15.424 0.583 -12.688 1110 H SER 150 H SER 150 -13.100 -2.185 -12.980 1111 HA SER 150 HA SER 150 -14.992 -3.273 -14.864 1112 HG SER 150 HG SER 150 -13.402 -3.465 -17.125 1113 HB2 SER 150 1HB SER 150 -12.706 -2.332 -15.480 1114 HB3 SER 150 2HB SER 150 -12.010 -3.778 -14.748 1115 H LEU 151 H LEU 151 -16.092 -5.030 -14.285 1116 HA LEU 151 HA LEU 151 -14.739 -7.048 -12.614 1117 HG LEU 151 HG LEU 151 -16.550 -4.804 -11.431 1118 HB2 LEU 151 1HB LEU 151 -17.681 -6.426 -12.895 1119 HB3 LEU 151 2HB LEU 151 -17.027 -7.743 -11.940 1120 HD11 LEU 151 1HD1 LEU 151 -17.930 -5.164 -9.444 1121 HD12 LEU 151 2HD1 LEU 151 -18.237 -6.822 -9.957 1122 HD13 LEU 151 3HD1 LEU 151 -18.834 -5.474 -10.926 1123 HD21 LEU 151 3HD2 LEU 151 -15.499 -5.554 -9.358 1124 HD22 LEU 151 1HD2 LEU 151 -14.646 -6.183 -10.768 1125 HD23 LEU 151 2HD2 LEU 151 -15.722 -7.234 -9.848 1126 H GLU 152 H GLU 152 -15.271 -9.280 -12.998 1127 HA GLU 152 HA GLU 152 -15.758 -9.808 -15.843 1128 HB2 GLU 152 1HB GLU 152 -13.679 -10.708 -14.855 1129 HB3 GLU 152 2HB GLU 152 -14.636 -11.621 -13.695 1130 HG2 GLU 152 1HG GLU 152 -15.659 -12.869 -15.540 1131 HG3 GLU 152 2HG GLU 152 -14.657 -11.975 -16.683 1132 H HIS 153 H HIS 153 -17.671 -10.552 -16.458 1133 HA HIS 153 HA HIS 153 -19.516 -11.562 -14.444 1134 HD1 HIS 153 HD1 HIS 153 -19.525 -8.220 -16.803 1135 HD2 HIS 153 HD2 HIS 153 -22.187 -10.055 -14.191 1136 HE1 HIS 153 HE1 HIS 153 -20.590 -6.352 -15.491 1137 HE2 HIS 153 HE2 HIS 153 -22.044 -7.508 -13.784 1138 HB2 HIS 153 1HB HIS 153 -19.872 -10.678 -17.300 1139 HB3 HIS 153 2HB HIS 153 -21.148 -11.517 -16.420 1140 H HIS 154 H HIS 154 -20.711 -13.497 -14.744 1141 HA HIS 154 HA HIS 154 -19.015 -15.686 -15.252 1142 HD1 HIS 154 HD1 HIS 154 -19.504 -17.870 -13.224 1143 HD2 HIS 154 HD2 HIS 154 -22.484 -18.161 -16.109 1144 HE1 HIS 154 HE1 HIS 154 -19.823 -20.334 -13.625 1145 HE2 HIS 154 HE2 HIS 154 -21.468 -20.470 -15.532 1146 HB2 HIS 154 1HB HIS 154 -20.886 -15.681 -13.616 1147 HB3 HIS 154 2HB HIS 154 -22.028 -15.685 -14.954 1148 H HIS 155 H HIS 155 -21.544 -14.167 -17.185 1149 HA HIS 155 HA HIS 155 -21.543 -16.269 -19.152 1150 HD1 HIS 155 HD1 HIS 155 -22.793 -13.731 -22.080 1151 HD2 HIS 155 HD2 HIS 155 -24.517 -16.926 -20.046 1152 HE1 HIS 155 HE1 HIS 155 -24.036 -15.057 -23.821 1153 HE2 HIS 155 HE2 HIS 155 -24.944 -17.064 -22.589 1154 HB2 HIS 155 1HB HIS 155 -23.506 -14.732 -18.569 1155 HB3 HIS 155 2HB HIS 155 -22.687 -13.505 -19.529 1156 H HIS 156 H HIS 156 -19.363 -13.880 -18.471 1157 HA HIS 156 HA HIS 156 -18.732 -13.139 -21.202 1158 HD1 HIS 156 HD1 HIS 156 -18.158 -10.381 -21.628 1159 HD2 HIS 156 HD2 HIS 156 -14.722 -11.863 -19.799 1160 HE1 HIS 156 HE1 HIS 156 -16.232 -9.233 -22.761 1161 HE2 HIS 156 HE2 HIS 156 -14.197 -9.957 -21.469 1162 HB2 HIS 156 1HB HIS 156 -18.470 -11.596 -19.212 1163 HB3 HIS 156 2HB HIS 156 -17.111 -12.589 -18.705 1164 H HIS 157 H HIS 157 -18.487 -15.939 -19.819 1165 HA HIS 157 HA HIS 157 -15.793 -16.557 -20.840 1166 HD1 HIS 157 HD1 HIS 157 -17.644 -17.913 -16.743 1167 HD2 HIS 157 HD2 HIS 157 -14.400 -16.007 -18.519 1168 HE1 HIS 157 HE1 HIS 157 -16.549 -16.584 -14.907 1169 HE2 HIS 157 HE2 HIS 157 -14.551 -15.487 -15.977 1170 HB2 HIS 157 1HB HIS 157 -17.564 -18.333 -19.145 1171 HB3 HIS 157 2HB HIS 157 -15.884 -18.619 -19.574 1172 H HIS 158 H HIS 158 -19.204 -17.201 -21.158 1173 HA HIS 158 HA HIS 158 -18.965 -18.347 -23.737 1174 HD1 HIS 158 HD1 HIS 158 -19.423 -20.253 -25.257 1175 HD2 HIS 158 HD2 HIS 158 -21.141 -22.310 -22.070 1176 HE1 HIS 158 HE1 HIS 158 -20.878 -22.024 -26.292 1177 HE2 HIS 158 HE2 HIS 158 -21.740 -23.379 -24.349 1178 HB2 HIS 158 1HB HIS 158 -18.198 -20.308 -22.521 1179 HB3 HIS 158 2HB HIS 158 -19.577 -20.219 -21.434 Start of MODEL 7 1 HA MET 1 HA MET 1 32.808 -0.102 5.091 2 H1 MET 1 1H MET 1 31.211 2.196 6.058 3 H2 MET 1 2H MET 1 32.693 1.661 6.694 4 H3 MET 1 3H MET 1 31.313 0.684 6.824 5 HB2 MET 1 1HB MET 1 30.201 1.057 4.073 6 HB3 MET 1 2HB MET 1 31.136 -0.190 3.261 7 HG2 MET 1 1HG MET 1 30.755 -1.723 5.071 8 HG3 MET 1 2HG MET 1 29.949 -0.470 6.010 9 HE1 MET 1 3HE MET 1 28.674 -3.330 5.508 10 HE2 MET 1 1HE MET 1 27.007 -2.886 5.142 11 HE3 MET 1 2HE MET 1 27.881 -2.050 6.424 12 H LYS 2 H LYS 2 33.441 0.261 2.781 13 HA LYS 2 HA LYS 2 34.821 2.711 2.464 14 HB2 LYS 2 1HB LYS 2 35.502 0.549 1.438 15 HB3 LYS 2 2HB LYS 2 34.115 0.649 0.366 16 HG2 LYS 2 1HG LYS 2 35.026 2.692 -0.619 17 HG3 LYS 2 2HG LYS 2 36.424 2.576 0.452 18 HD2 LYS 2 1HD LYS 2 36.962 0.379 -0.537 19 HD3 LYS 2 2HD LYS 2 35.603 0.569 -1.646 20 HE2 LYS 2 1HE LYS 2 37.692 1.168 -2.738 21 HE3 LYS 2 2HE LYS 2 36.650 2.581 -2.574 22 HZ1 LYS 2 3HZ LYS 2 39.025 2.972 -2.012 23 HZ2 LYS 2 1HZ LYS 2 38.844 1.930 -0.686 24 HZ3 LYS 2 2HZ LYS 2 37.949 3.367 -0.764 25 H LEU 3 H LEU 3 31.755 1.496 1.332 26 HA LEU 3 HA LEU 3 31.155 4.014 -0.020 27 HG LEU 3 HG LEU 3 29.735 1.438 -2.313 28 HB2 LEU 3 1HB LEU 3 29.625 1.414 0.190 29 HB3 LEU 3 2HB LEU 3 28.981 2.850 -0.574 30 HD11 LEU 3 1HD1 LEU 3 31.818 3.560 -1.846 31 HD12 LEU 3 2HD1 LEU 3 30.266 3.770 -2.657 32 HD13 LEU 3 3HD1 LEU 3 31.506 2.744 -3.378 33 HD21 LEU 3 3HD2 LEU 3 32.364 1.212 -0.854 34 HD22 LEU 3 1HD2 LEU 3 32.009 0.542 -2.447 35 HD23 LEU 3 2HD2 LEU 3 31.151 -0.056 -1.027 36 H HIS 4 H HIS 4 29.516 5.385 0.683 37 HA HIS 4 HA HIS 4 28.896 5.114 3.530 38 HD1 HIS 4 HD1 HIS 4 30.244 6.992 5.036 39 HD2 HIS 4 HD2 HIS 4 31.247 8.000 1.129 40 HE1 HIS 4 HE1 HIS 4 32.670 7.638 5.105 41 HE2 HIS 4 HE2 HIS 4 33.307 7.981 2.693 42 HB2 HIS 4 1HB HIS 4 28.629 7.452 1.634 43 HB3 HIS 4 2HB HIS 4 28.188 7.501 3.340 44 H THR 5 H THR 5 27.558 3.526 1.496 45 HA THR 5 HA THR 5 24.868 3.906 2.409 46 HB THR 5 HB THR 5 24.782 5.447 0.531 47 HG1 THR 5 HG1 THR 5 23.579 2.976 -0.268 48 HG21 THR 5 3HG2 THR 5 26.698 4.632 -0.742 49 HG22 THR 5 1HG2 THR 5 25.264 4.727 -1.765 50 HG23 THR 5 2HG2 THR 5 25.811 3.165 -1.157 51 H ASP 6 H ASP 6 23.597 2.044 2.068 52 HA ASP 6 HA ASP 6 25.005 -0.393 1.553 53 HB2 ASP 6 1HB ASP 6 22.075 0.228 1.984 54 HB3 ASP 6 2HB ASP 6 22.682 -1.403 1.720 55 HA PRO 7 HA PRO 7 24.611 -0.911 -2.801 56 HB2 PRO 7 1HB PRO 7 23.127 -3.441 -2.274 57 HB3 PRO 7 2HB PRO 7 24.547 -3.160 -3.288 58 HG2 PRO 7 1HG PRO 7 24.796 -4.335 -0.918 59 HG3 PRO 7 2HG PRO 7 26.001 -3.161 -1.478 60 HD2 PRO 7 1HD PRO 7 23.824 -2.829 0.538 61 HD3 PRO 7 2HD PRO 7 25.462 -2.146 0.521 62 H ALA 8 H ALA 8 23.246 0.325 -3.902 63 HA ALA 8 HA ALA 8 20.508 0.640 -3.209 64 HB1 ALA 8 3HB ALA 8 21.970 1.537 -5.690 65 HB2 ALA 8 1HB ALA 8 21.831 2.451 -4.189 66 HB3 ALA 8 2HB ALA 8 20.392 2.110 -5.149 67 H THR 9 H THR 9 18.954 -0.758 -3.635 68 HA THR 9 HA THR 9 19.244 -2.879 -5.521 69 HB THR 9 HB THR 9 16.651 -1.990 -4.252 70 HG1 THR 9 HG1 THR 9 17.776 -2.219 -2.441 71 HG21 THR 9 3HG2 THR 9 16.511 -3.788 -5.913 72 HG22 THR 9 1HG2 THR 9 16.146 -4.390 -4.296 73 HG23 THR 9 2HG2 THR 9 17.721 -4.712 -5.022 74 H ALA 10 H ALA 10 18.181 -3.166 -7.491 75 HA ALA 10 HA ALA 10 17.761 -0.957 -9.136 76 HB1 ALA 10 3HB ALA 10 16.762 -2.523 -10.717 77 HB2 ALA 10 1HB ALA 10 16.621 -3.732 -9.442 78 HB3 ALA 10 2HB ALA 10 18.215 -3.205 -9.984 79 H LEU 11 H LEU 11 16.088 0.357 -9.511 80 HA LEU 11 HA LEU 11 13.942 0.492 -7.701 81 HG LEU 11 HG LEU 11 16.044 2.488 -8.891 82 HB2 LEU 11 1HB LEU 11 14.237 1.792 -10.408 83 HB3 LEU 11 2HB LEU 11 13.049 2.239 -9.199 84 HD11 LEU 11 1HD1 LEU 11 13.923 4.597 -9.272 85 HD12 LEU 11 2HD1 LEU 11 15.106 4.092 -10.477 86 HD13 LEU 11 3HD1 LEU 11 15.640 4.888 -8.996 87 HD21 LEU 11 3HD2 LEU 11 14.957 2.030 -6.762 88 HD22 LEU 11 1HD2 LEU 11 13.797 3.325 -7.058 89 HD23 LEU 11 2HD2 LEU 11 15.505 3.705 -6.831 90 H ASN 12 H ASN 12 12.515 -1.109 -7.580 91 HA ASN 12 HA ASN 12 11.586 -2.621 -9.797 92 HB2 ASN 12 1HB ASN 12 11.658 -3.449 -7.435 93 HB3 ASN 12 2HB ASN 12 10.326 -2.360 -7.055 94 HD21 ASN 12 2HD2 ASN 12 8.932 -3.996 -6.495 95 HD22 ASN 12 1HD2 ASN 12 8.255 -5.087 -7.649 96 H THR 13 H THR 13 10.359 -1.760 -11.340 97 HA THR 13 HA THR 13 8.402 0.312 -10.599 98 HB THR 13 HB THR 13 9.516 -0.111 -13.369 99 HG1 THR 13 HG1 THR 13 10.927 0.623 -11.260 100 HG21 THR 13 3HG2 THR 13 8.900 2.241 -13.659 101 HG22 THR 13 1HG2 THR 13 8.329 2.302 -11.991 102 HG23 THR 13 2HG2 THR 13 7.505 1.278 -13.167 103 H VAL 14 H VAL 14 6.309 0.187 -11.400 104 HA VAL 14 HA VAL 14 5.317 -2.362 -12.248 105 HB VAL 14 HB VAL 14 3.906 0.320 -12.272 106 HG11 VAL 14 1HG1 VAL 14 2.810 -1.353 -13.672 107 HG12 VAL 14 2HG1 VAL 14 1.848 -1.002 -12.236 108 HG13 VAL 14 3HG1 VAL 14 2.796 -2.486 -12.321 109 HG21 VAL 14 3HG2 VAL 14 2.945 -0.375 -10.124 110 HG22 VAL 14 1HG2 VAL 14 4.698 -0.215 -10.038 111 HG23 VAL 14 2HG2 VAL 14 3.964 -1.815 -10.140 112 H THR 15 H THR 15 5.174 -3.110 -14.285 113 HA THR 15 HA THR 15 6.163 -1.418 -16.401 114 HB THR 15 HB THR 15 5.779 -3.631 -17.740 115 HG1 THR 15 HG1 THR 15 5.174 -5.304 -16.597 116 HG21 THR 15 3HG2 THR 15 7.851 -3.409 -15.554 117 HG22 THR 15 1HG2 THR 15 7.970 -2.723 -17.175 118 HG23 THR 15 2HG2 THR 15 7.949 -4.473 -16.956 119 H ALA 16 H ALA 16 3.133 -3.181 -15.708 120 HA ALA 16 HA ALA 16 1.710 -1.344 -17.435 121 HB1 ALA 16 3HB ALA 16 0.790 -3.049 -18.903 122 HB2 ALA 16 1HB ALA 16 1.764 -4.282 -18.102 123 HB3 ALA 16 2HB ALA 16 2.548 -3.001 -19.028 124 H TYR 17 H TYR 17 -0.526 -1.383 -17.205 125 HA TYR 17 HA TYR 17 -1.540 -2.761 -14.834 126 HD1 TYR 17 HD2 TYR 17 -0.911 0.867 -16.374 127 HD2 TYR 17 HD1 TYR 17 -3.009 -0.682 -13.011 128 HE1 TYR 17 HE2 TYR 17 0.067 2.625 -14.961 129 HE2 TYR 17 HE1 TYR 17 -2.039 1.074 -11.590 130 HH TYR 17 HH TYR 17 -0.430 3.782 -12.862 131 HB2 TYR 17 1HB TYR 17 -2.799 -0.682 -16.644 132 HB3 TYR 17 2HB TYR 17 -3.588 -1.384 -15.237 133 H GLY 18 H GLY 18 -2.729 -4.590 -15.004 134 HA2 GLY 18 1HA GLY 18 -3.072 -5.608 -17.721 135 HA3 GLY 18 2HA GLY 18 -3.070 -6.565 -16.250 136 H ASP 19 H ASP 19 -5.009 -4.128 -15.427 137 HA ASP 19 HA ASP 19 -7.235 -3.978 -15.042 138 HB2 ASP 19 1HB ASP 19 -7.450 -3.395 -17.368 139 HB3 ASP 19 2HB ASP 19 -7.360 -5.084 -17.851 140 H GLY 20 H GLY 20 -7.239 -5.395 -13.351 141 HA2 GLY 20 1HA GLY 20 -8.563 -7.242 -12.471 142 HA3 GLY 20 2HA GLY 20 -8.236 -8.118 -13.962 143 H TYR 21 H TYR 21 -5.434 -6.952 -13.788 144 HA TYR 21 HA TYR 21 -4.295 -8.262 -11.488 145 HD1 TYR 21 HD1 TYR 21 -5.476 -9.609 -15.309 146 HD2 TYR 21 HD2 TYR 21 -1.364 -8.972 -14.431 147 HE1 TYR 21 HE1 TYR 21 -4.996 -9.439 -17.715 148 HE2 TYR 21 HE2 TYR 21 -0.870 -8.802 -16.832 149 HH TYR 21 HH TYR 21 -3.181 -8.317 -19.159 150 HB2 TYR 21 1HB TYR 21 -2.856 -9.779 -12.737 151 HB3 TYR 21 2HB TYR 21 -4.540 -10.137 -13.093 152 H ILE 22 H ILE 22 -1.993 -7.791 -11.281 153 HA ILE 22 HA ILE 22 -1.258 -5.342 -12.760 154 HB ILE 22 HB ILE 22 -0.297 -6.205 -10.021 155 HG12 ILE 22 1HG1 ILE 22 -2.300 -4.053 -10.751 156 HG13 ILE 22 2HG1 ILE 22 -2.712 -5.616 -10.054 157 HG21 ILE 22 1HG2 ILE 22 0.581 -3.911 -9.883 158 HG22 ILE 22 2HG2 ILE 22 0.063 -3.626 -11.545 159 HG23 ILE 22 3HG2 ILE 22 1.311 -4.823 -11.204 160 HD11 ILE 22 3HD1 ILE 22 -1.045 -3.478 -8.747 161 HD12 ILE 22 1HD1 ILE 22 -1.443 -5.046 -8.045 162 HD13 ILE 22 2HD1 ILE 22 -2.722 -3.874 -8.371 163 H GLU 23 H GLU 23 0.643 -5.335 -13.887 164 HA GLU 23 HA GLU 23 2.193 -7.826 -13.811 165 HB2 GLU 23 1HB GLU 23 1.226 -7.008 -16.007 166 HB3 GLU 23 2HB GLU 23 2.350 -5.656 -15.909 167 HG2 GLU 23 1HG GLU 23 4.129 -7.541 -15.605 168 HG3 GLU 23 2HG GLU 23 2.897 -8.548 -16.362 169 H VAL 24 H VAL 24 4.050 -7.818 -12.773 170 HA VAL 24 HA VAL 24 5.606 -5.314 -12.691 171 HB VAL 24 HB VAL 24 5.581 -7.479 -10.574 172 HG11 VAL 24 1HG1 VAL 24 6.992 -4.816 -10.660 173 HG12 VAL 24 2HG1 VAL 24 7.751 -6.403 -10.783 174 HG13 VAL 24 3HG1 VAL 24 6.962 -5.917 -9.283 175 HG21 VAL 24 3HG2 VAL 24 3.510 -6.191 -10.545 176 HG22 VAL 24 1HG2 VAL 24 4.434 -4.689 -10.501 177 HG23 VAL 24 2HG2 VAL 24 4.505 -5.807 -9.139 178 H ASN 25 H ASN 25 6.886 -5.714 -14.420 179 HA ASN 25 HA ASN 25 8.614 -6.539 -15.640 180 HB2 ASN 25 1HB ASN 25 9.796 -6.375 -13.443 181 HB3 ASN 25 2HB ASN 25 9.354 -8.046 -13.117 182 HD21 ASN 25 2HD2 ASN 25 11.489 -8.672 -12.968 183 HD22 ASN 25 1HD2 ASN 25 12.523 -8.809 -14.350 184 H GLN 26 H GLN 26 6.417 -7.654 -16.323 185 HA GLN 26 HA GLN 26 5.555 -9.353 -17.527 186 HB2 GLN 26 1HB GLN 26 8.218 -10.649 -16.991 187 HB3 GLN 26 2HB GLN 26 6.960 -11.400 -17.963 188 HG2 GLN 26 1HG GLN 26 7.004 -9.360 -19.417 189 HG3 GLN 26 2HG GLN 26 8.437 -8.848 -18.527 190 HE21 GLN 26 2HE2 GLN 26 8.067 -9.558 -21.344 191 HE22 GLN 26 1HE2 GLN 26 9.195 -10.834 -21.666 192 H VAL 27 H VAL 27 6.294 -9.672 -14.264 193 HA VAL 27 HA VAL 27 4.978 -12.248 -13.971 194 HB VAL 27 HB VAL 27 5.775 -10.315 -11.783 195 HG11 VAL 27 1HG1 VAL 27 4.125 -11.969 -11.097 196 HG12 VAL 27 2HG1 VAL 27 5.687 -12.306 -10.350 197 HG13 VAL 27 3HG1 VAL 27 5.143 -13.266 -11.726 198 HG21 VAL 27 3HG2 VAL 27 7.734 -10.939 -13.094 199 HG22 VAL 27 1HG2 VAL 27 7.319 -12.644 -12.924 200 HG23 VAL 27 2HG2 VAL 27 7.779 -11.703 -11.505 201 H ARG 28 H ARG 28 2.845 -12.438 -13.933 202 HA ARG 28 HA ARG 28 1.272 -9.979 -13.686 203 HE ARG 28 HE ARG 28 1.268 -12.369 -19.135 204 HB2 ARG 28 1HB ARG 28 0.357 -12.664 -14.721 205 HB3 ARG 28 2HB ARG 28 -0.458 -11.115 -14.905 206 HG2 ARG 28 1HG ARG 28 1.549 -10.342 -16.213 207 HG3 ARG 28 2HG ARG 28 2.100 -12.016 -16.197 208 HD2 ARG 28 1HD ARG 28 -0.022 -12.679 -17.290 209 HD3 ARG 28 2HD ARG 28 -0.472 -10.976 -17.381 210 HH11 ARG 28 1HH1 ARG 28 0.733 -9.245 -17.665 211 HH12 ARG 28 2HH1 ARG 28 1.694 -8.376 -18.822 212 HH21 ARG 28 1HH2 ARG 28 2.485 -11.237 -20.707 213 HH22 ARG 28 2HH2 ARG 28 2.645 -9.511 -20.580 214 H PHE 29 H PHE 29 0.754 -9.627 -11.627 215 HA PHE 29 HA PHE 29 0.017 -11.841 -9.886 216 HD1 PHE 29 HD1 PHE 29 1.573 -11.794 -7.516 217 HD2 PHE 29 HD2 PHE 29 2.495 -8.475 -10.013 218 HE1 PHE 29 HE1 PHE 29 3.971 -12.126 -7.066 219 HE2 PHE 29 HE2 PHE 29 4.892 -8.800 -9.568 220 HZ PHE 29 HZ PHE 29 5.635 -10.627 -8.095 221 HB2 PHE 29 1HB PHE 29 0.270 -8.873 -9.347 222 HB3 PHE 29 2HB PHE 29 -0.124 -10.080 -8.130 223 H SER 30 H SER 30 -2.007 -12.549 -9.958 224 HA SER 30 HA SER 30 -4.179 -10.763 -10.695 225 HG SER 30 HG SER 30 -4.467 -12.515 -12.584 226 HB2 SER 30 1HB SER 30 -4.183 -13.722 -10.042 227 HB3 SER 30 2HB SER 30 -5.551 -12.812 -10.683 228 H HIS 31 H HIS 31 -2.709 -10.479 -8.142 229 HA HIS 31 HA HIS 31 -5.017 -10.390 -6.388 230 HD1 HIS 31 HD1 HIS 31 -1.849 -13.394 -7.010 231 HD2 HIS 31 HD2 HIS 31 -1.275 -10.769 -3.835 232 HE1 HIS 31 HE1 HIS 31 0.598 -13.531 -6.451 233 HE2 HIS 31 HE2 HIS 31 0.858 -12.134 -4.369 234 HB2 HIS 31 1HB HIS 31 -3.893 -11.508 -4.527 235 HB3 HIS 31 2HB HIS 31 -4.035 -12.595 -5.900 236 H ALA 32 H ALA 32 -4.453 -9.203 -4.330 237 HA ALA 32 HA ALA 32 -3.225 -6.746 -5.010 238 HB1 ALA 32 3HB ALA 32 -3.684 -6.092 -2.721 239 HB2 ALA 32 1HB ALA 32 -4.002 -7.771 -2.283 240 HB3 ALA 32 2HB ALA 32 -5.074 -6.933 -3.405 241 H ILE 33 H ILE 33 -1.259 -5.879 -4.433 242 HA ILE 33 HA ILE 33 0.639 -7.646 -3.054 243 HB ILE 33 HB ILE 33 2.389 -6.931 -4.747 244 HG12 ILE 33 1HG1 ILE 33 -0.083 -6.284 -6.372 245 HG13 ILE 33 2HG1 ILE 33 1.099 -5.116 -5.793 246 HG21 ILE 33 1HG2 ILE 33 0.155 -8.749 -5.633 247 HG22 ILE 33 2HG2 ILE 33 1.549 -9.195 -4.650 248 HG23 ILE 33 3HG2 ILE 33 1.774 -8.713 -6.331 249 HD11 ILE 33 3HD1 ILE 33 1.611 -7.321 -7.777 250 HD12 ILE 33 1HD1 ILE 33 2.808 -6.168 -7.188 251 HD13 ILE 33 2HD1 ILE 33 1.434 -5.603 -8.139 252 H ALA 34 H ALA 34 2.220 -6.658 -1.905 253 HA ALA 34 HA ALA 34 2.251 -3.707 -1.884 254 HB1 ALA 34 3HB ALA 34 1.208 -4.565 0.157 255 HB2 ALA 34 1HB ALA 34 2.761 -3.809 0.513 256 HB3 ALA 34 2HB ALA 34 2.626 -5.568 0.469 257 H PHE 35 H PHE 35 4.135 -3.029 -2.717 258 HA PHE 35 HA PHE 35 6.563 -4.547 -2.103 259 HD1 PHE 35 HD2 PHE 35 3.615 -4.640 -4.913 260 HD2 PHE 35 HD1 PHE 35 7.170 -2.494 -5.844 261 HE1 PHE 35 HE2 PHE 35 2.394 -3.371 -6.629 262 HE2 PHE 35 HE1 PHE 35 5.955 -1.223 -7.564 263 HZ PHE 35 HZ PHE 35 3.565 -1.662 -7.958 264 HB2 PHE 35 1HB PHE 35 7.264 -4.439 -4.485 265 HB3 PHE 35 2HB PHE 35 5.847 -5.447 -4.224 266 H ALA 36 H ALA 36 8.524 -3.430 -2.480 267 HA ALA 36 HA ALA 36 8.344 -0.535 -2.884 268 HB1 ALA 36 3HB ALA 36 9.747 -1.856 -0.557 269 HB2 ALA 36 1HB ALA 36 8.283 -0.877 -0.467 270 HB3 ALA 36 2HB ALA 36 9.809 -0.139 -0.952 271 HA PRO 37 HA PRO 37 12.090 -1.166 -5.247 272 HB2 PRO 37 1HB PRO 37 13.195 1.301 -4.055 273 HB3 PRO 37 2HB PRO 37 12.849 0.931 -5.748 274 HG2 PRO 37 1HG PRO 37 11.336 2.654 -4.355 275 HG3 PRO 37 2HG PRO 37 10.636 1.578 -5.578 276 HD2 PRO 37 1HD PRO 37 10.611 1.331 -2.595 277 HD3 PRO 37 2HD PRO 37 9.319 0.989 -3.764 278 H GLU 38 H GLU 38 12.559 0.080 -1.967 279 HA GLU 38 HA GLU 38 14.787 -1.796 -1.610 280 HB2 GLU 38 1HB GLU 38 14.011 0.708 -0.114 281 HB3 GLU 38 2HB GLU 38 15.176 -0.443 0.519 282 HG2 GLU 38 1HG GLU 38 15.435 1.022 -2.096 283 HG3 GLU 38 2HG GLU 38 16.226 1.481 -0.589 284 H GLY 39 H GLY 39 13.333 -3.580 -1.409 285 HA2 GLY 39 1HA GLY 39 12.810 -4.476 1.103 286 HA3 GLY 39 2HA GLY 39 11.353 -3.589 0.677 287 HA PRO 40 HA PRO 40 10.945 -7.802 -1.159 288 HB2 PRO 40 1HB PRO 40 9.193 -8.912 0.514 289 HB3 PRO 40 2HB PRO 40 10.904 -8.791 0.939 290 HG2 PRO 40 1HG PRO 40 8.593 -7.200 1.922 291 HG3 PRO 40 2HG PRO 40 10.079 -7.667 2.766 292 HD2 PRO 40 1HD PRO 40 9.530 -5.177 1.520 293 HD3 PRO 40 2HD PRO 40 11.081 -5.720 2.187 294 H VAL 41 H VAL 41 8.859 -8.959 -1.833 295 HA VAL 41 HA VAL 41 6.735 -7.000 -2.410 296 HB VAL 41 HB VAL 41 7.397 -9.493 -3.996 297 HG11 VAL 41 1HG1 VAL 41 5.042 -8.888 -4.103 298 HG12 VAL 41 2HG1 VAL 41 5.836 -8.584 -5.649 299 HG13 VAL 41 3HG1 VAL 41 5.473 -7.240 -4.564 300 HG21 VAL 41 3HG2 VAL 41 7.971 -6.601 -4.632 301 HG22 VAL 41 1HG2 VAL 41 8.200 -7.955 -5.737 302 HG23 VAL 41 2HG2 VAL 41 9.160 -7.850 -4.263 303 H ALA 42 H ALA 42 5.175 -7.322 -0.948 304 HA ALA 42 HA ALA 42 4.693 -10.020 0.065 305 HB1 ALA 42 3HB ALA 42 4.954 -8.206 1.687 306 HB2 ALA 42 1HB ALA 42 3.350 -8.934 1.784 307 HB3 ALA 42 2HB ALA 42 3.565 -7.377 0.983 308 H SER 43 H SER 43 2.721 -11.054 -0.074 309 HA SER 43 HA SER 43 0.909 -10.000 -2.116 310 HG SER 43 HG SER 43 2.789 -12.591 -2.538 311 HB2 SER 43 1HB SER 43 1.294 -12.797 -1.030 312 HB3 SER 43 2HB SER 43 0.036 -12.354 -2.187 313 H TRP 44 H TRP 44 -1.065 -9.343 -1.618 314 HA TRP 44 HA TRP 44 -1.942 -9.572 1.166 315 HD1 TRP 44 HD1 TRP 44 -1.034 -8.214 2.332 316 HE1 TRP 44 HE1 TRP 44 -1.269 -6.243 3.975 317 HE3 TRP 44 HE3 TRP 44 -4.415 -5.381 -0.260 318 HZ2 TRP 44 HZ2 TRP 44 -2.690 -3.812 4.144 319 HZ3 TRP 44 HZ3 TRP 44 -5.158 -3.247 0.712 320 HH2 TRP 44 HH2 TRP 44 -4.313 -2.479 2.869 321 HB2 TRP 44 1HB TRP 44 -2.098 -7.538 -0.868 322 HB3 TRP 44 2HB TRP 44 -3.716 -7.945 -0.313 323 HA PRO 45 HA PRO 45 -4.910 -12.623 -0.368 324 HB2 PRO 45 1HB PRO 45 -5.512 -13.084 2.437 325 HB3 PRO 45 2HB PRO 45 -4.724 -14.165 1.286 326 HG2 PRO 45 1HG PRO 45 -3.427 -13.032 3.395 327 HG3 PRO 45 2HG PRO 45 -2.621 -13.473 1.879 328 HD2 PRO 45 1HD PRO 45 -3.580 -10.787 2.806 329 HD3 PRO 45 2HD PRO 45 -2.067 -11.219 1.979 330 H VAL 46 H VAL 46 -5.558 -9.867 -0.284 331 HA VAL 46 HA VAL 46 -8.125 -9.768 1.156 332 HB VAL 46 HB VAL 46 -6.512 -7.441 0.095 333 HG11 VAL 46 1HG1 VAL 46 -8.889 -6.976 0.332 334 HG12 VAL 46 2HG1 VAL 46 -7.954 -6.090 1.537 335 HG13 VAL 46 3HG1 VAL 46 -8.844 -7.540 2.001 336 HG21 VAL 46 3HG2 VAL 46 -5.255 -8.585 1.837 337 HG22 VAL 46 1HG2 VAL 46 -6.655 -8.517 2.907 338 HG23 VAL 46 2HG2 VAL 46 -5.849 -7.028 2.415 339 H GLN 47 H GLN 47 -9.961 -9.585 0.008 340 HA GLN 47 HA GLN 47 -9.709 -9.150 -2.899 341 HB2 GLN 47 1HB GLN 47 -11.747 -10.755 -1.352 342 HB3 GLN 47 2HB GLN 47 -11.857 -10.418 -3.072 343 HG2 GLN 47 1HG GLN 47 -9.779 -11.634 -3.451 344 HG3 GLN 47 2HG GLN 47 -9.653 -11.958 -1.720 345 HE21 GLN 47 2HE2 GLN 47 -9.893 -13.792 -4.019 346 HE22 GLN 47 1HE2 GLN 47 -11.292 -14.764 -3.693 347 H ARG 48 H ARG 48 -11.200 -8.142 0.043 348 HA ARG 48 HA ARG 48 -12.959 -6.313 -1.453 349 HE ARG 48 HE ARG 48 -14.047 -8.661 2.435 350 HB2 ARG 48 1HB ARG 48 -13.298 -7.380 1.357 351 HB3 ARG 48 2HB ARG 48 -14.403 -6.288 0.534 352 HG2 ARG 48 1HG ARG 48 -15.023 -7.969 -1.034 353 HG3 ARG 48 2HG ARG 48 -13.749 -9.050 -0.465 354 HD2 ARG 48 1HD ARG 48 -16.166 -8.140 1.096 355 HD3 ARG 48 2HD ARG 48 -15.900 -9.747 0.421 356 HH11 ARG 48 1HH1 ARG 48 -16.444 -11.049 1.510 357 HH12 ARG 48 2HH1 ARG 48 -16.049 -12.131 2.809 358 HH21 ARG 48 1HH2 ARG 48 -13.527 -10.069 4.124 359 HH22 ARG 48 2HH2 ARG 48 -14.399 -11.566 4.305 360 HA PRO 49 HA PRO 49 -10.311 -3.117 0.125 361 HB2 PRO 49 1HB PRO 49 -11.873 -0.994 -0.560 362 HB3 PRO 49 2HB PRO 49 -10.896 -1.895 -1.723 363 HG2 PRO 49 1HG PRO 49 -13.819 -2.131 -1.120 364 HG3 PRO 49 2HG PRO 49 -12.999 -2.122 -2.693 365 HD2 PRO 49 1HD PRO 49 -13.836 -4.405 -1.521 366 HD3 PRO 49 2HD PRO 49 -12.370 -4.336 -2.519 367 H ALA 50 H ALA 50 -13.397 -3.881 1.321 368 HA ALA 50 HA ALA 50 -13.357 -1.815 3.374 369 HB1 ALA 50 3HB ALA 50 -15.349 -4.025 2.879 370 HB2 ALA 50 1HB ALA 50 -15.491 -2.361 2.315 371 HB3 ALA 50 2HB ALA 50 -15.526 -2.713 4.043 372 H ASP 51 H ASP 51 -11.952 -4.755 2.898 373 HA ASP 51 HA ASP 51 -12.165 -5.751 5.616 374 HB2 ASP 51 1HB ASP 51 -10.646 -6.688 3.180 375 HB3 ASP 51 2HB ASP 51 -10.463 -7.443 4.757 376 H ILE 52 H ILE 52 -10.294 -3.535 3.924 377 HA ILE 52 HA ILE 52 -7.721 -3.922 4.941 378 HB ILE 52 HB ILE 52 -9.021 -1.305 4.160 379 HG12 ILE 52 1HG1 ILE 52 -7.334 -3.230 2.539 380 HG13 ILE 52 2HG1 ILE 52 -9.074 -3.024 2.380 381 HG21 ILE 52 1HG2 ILE 52 -6.730 -0.514 3.803 382 HG22 ILE 52 2HG2 ILE 52 -6.106 -2.054 4.399 383 HG23 ILE 52 3HG2 ILE 52 -6.995 -0.984 5.482 384 HD11 ILE 52 3HD1 ILE 52 -6.987 -0.932 1.819 385 HD12 ILE 52 1HD1 ILE 52 -8.731 -0.712 1.672 386 HD13 ILE 52 2HD1 ILE 52 -7.893 -1.854 0.620 387 H THR 53 H THR 53 -7.188 -4.032 6.973 388 HA THR 53 HA THR 53 -8.211 -2.050 8.879 389 HB THR 53 HB THR 53 -8.096 -3.989 10.584 390 HG1 THR 53 HG1 THR 53 -8.622 -5.591 8.306 391 HG21 THR 53 3HG2 THR 53 -10.196 -2.942 9.912 392 HG22 THR 53 1HG2 THR 53 -10.400 -4.686 10.081 393 HG23 THR 53 2HG2 THR 53 -10.261 -3.965 8.477 394 H ALA 54 H ALA 54 -6.836 -2.431 11.048 395 HA ALA 54 HA ALA 54 -4.253 -1.544 10.535 396 HB1 ALA 54 3HB ALA 54 -3.810 -1.906 12.896 397 HB2 ALA 54 1HB ALA 54 -5.231 -2.944 13.019 398 HB3 ALA 54 2HB ALA 54 -5.421 -1.226 12.667 399 H SER 55 H SER 55 -5.391 -4.816 11.226 400 HA SER 55 HA SER 55 -2.955 -6.109 11.535 401 HG SER 55 HG SER 55 -6.394 -7.304 12.044 402 HB2 SER 55 1HB SER 55 -5.385 -7.293 10.182 403 HB3 SER 55 2HB SER 55 -4.154 -8.143 11.117 404 H LEU 56 H LEU 56 -4.808 -5.487 8.580 405 HA LEU 56 HA LEU 56 -2.985 -6.873 6.875 406 HG LEU 56 HG LEU 56 -6.106 -6.846 7.257 407 HB2 LEU 56 1HB LEU 56 -5.125 -4.853 6.193 408 HB3 LEU 56 2HB LEU 56 -4.293 -5.883 5.043 409 HD11 LEU 56 1HD1 LEU 56 -7.625 -7.445 5.431 410 HD12 LEU 56 2HD1 LEU 56 -6.531 -6.682 4.278 411 HD13 LEU 56 3HD1 LEU 56 -7.340 -5.707 5.506 412 HD21 LEU 56 3HD2 LEU 56 -5.905 -9.028 6.158 413 HD22 LEU 56 1HD2 LEU 56 -4.351 -8.454 6.759 414 HD23 LEU 56 2HD2 LEU 56 -4.722 -8.352 5.038 415 H LEU 57 H LEU 57 -3.457 -3.525 7.835 416 HA LEU 57 HA LEU 57 -1.727 -2.344 5.949 417 HG LEU 57 HG LEU 57 -4.432 -1.516 7.133 418 HB2 LEU 57 1HB LEU 57 -2.537 -1.438 8.711 419 HB3 LEU 57 2HB LEU 57 -1.641 -0.447 7.576 420 HD11 LEU 57 1HD1 LEU 57 -4.371 0.205 8.854 421 HD12 LEU 57 2HD1 LEU 57 -5.126 0.816 7.382 422 HD13 LEU 57 3HD1 LEU 57 -3.468 1.269 7.776 423 HD21 LEU 57 3HD2 LEU 57 -2.754 0.376 5.487 424 HD22 LEU 57 1HD2 LEU 57 -4.439 -0.046 5.179 425 HD23 LEU 57 2HD2 LEU 57 -3.185 -1.279 5.052 426 H GLN 58 H GLN 58 -1.164 -3.624 9.202 427 HA GLN 58 HA GLN 58 1.560 -2.866 9.345 428 HB2 GLN 58 1HB GLN 58 0.011 -5.032 10.766 429 HB3 GLN 58 2HB GLN 58 1.684 -4.632 11.134 430 HG2 GLN 58 1HG GLN 58 1.034 -2.375 11.747 431 HG3 GLN 58 2HG GLN 58 -0.642 -2.730 11.327 432 HE21 GLN 58 2HE2 GLN 58 0.561 -1.891 13.863 433 HE22 GLN 58 1HE2 GLN 58 0.112 -3.096 15.027 434 H GLN 59 H GLN 59 -0.083 -5.752 8.150 435 HA GLN 59 HA GLN 59 2.217 -7.278 7.601 436 HB2 GLN 59 1HB GLN 59 -0.523 -7.254 6.344 437 HB3 GLN 59 2HB GLN 59 0.727 -8.395 5.871 438 HG2 GLN 59 1HG GLN 59 0.806 -9.270 8.138 439 HG3 GLN 59 2HG GLN 59 -0.420 -8.106 8.639 440 HE21 GLN 59 2HE2 GLN 59 -0.416 -11.058 8.658 441 HE22 GLN 59 1HE2 GLN 59 -1.820 -11.520 7.757 442 H ALA 60 H ALA 60 0.450 -4.897 5.679 443 HA ALA 60 HA ALA 60 1.993 -5.185 3.317 444 HB1 ALA 60 3HB ALA 60 -0.244 -4.181 3.335 445 HB2 ALA 60 1HB ALA 60 0.950 -3.105 2.607 446 HB3 ALA 60 2HB ALA 60 0.383 -2.811 4.251 447 H ALA 61 H ALA 61 2.446 -3.404 6.264 448 HA ALA 61 HA ALA 61 4.484 -1.667 5.231 449 HB1 ALA 61 3HB ALA 61 3.749 -2.312 8.084 450 HB2 ALA 61 1HB ALA 61 3.106 -0.984 7.120 451 HB3 ALA 61 2HB ALA 61 4.812 -1.006 7.561 452 H GLY 62 H GLY 62 4.435 -4.910 5.938 453 HA2 GLY 62 1HA GLY 62 6.313 -6.297 5.563 454 HA3 GLY 62 2HA GLY 62 7.361 -4.964 6.022 455 H LEU 63 H LEU 63 4.887 -5.100 8.217 456 HA LEU 63 HA LEU 63 6.679 -6.163 10.230 457 HG LEU 63 HG LEU 63 5.436 -3.310 9.733 458 HB2 LEU 63 1HB LEU 63 3.877 -5.062 10.494 459 HB3 LEU 63 2HB LEU 63 4.956 -5.438 11.824 460 HD11 LEU 63 1HD1 LEU 63 3.613 -2.724 11.228 461 HD12 LEU 63 2HD1 LEU 63 5.037 -1.740 11.568 462 HD13 LEU 63 3HD1 LEU 63 4.621 -3.088 12.627 463 HD21 LEU 63 3HD2 LEU 63 6.983 -3.996 12.232 464 HD22 LEU 63 1HD2 LEU 63 7.300 -2.634 11.158 465 HD23 LEU 63 2HD2 LEU 63 7.514 -4.283 10.574 466 H ALA 64 H ALA 64 5.009 -7.744 8.101 467 HA ALA 64 HA ALA 64 3.462 -9.532 9.760 468 HB1 ALA 64 3HB ALA 64 4.197 -9.731 6.842 469 HB2 ALA 64 1HB ALA 64 2.725 -9.006 7.488 470 HB3 ALA 64 2HB ALA 64 3.015 -10.734 7.684 471 H GLU 65 H GLU 65 6.674 -9.353 8.487 472 HA GLU 65 HA GLU 65 7.179 -12.118 9.351 473 HB2 GLU 65 1HB GLU 65 8.453 -10.491 7.160 474 HB3 GLU 65 2HB GLU 65 9.213 -11.936 7.813 475 HG2 GLU 65 1HG GLU 65 6.467 -11.856 6.582 476 HG3 GLU 65 2HG GLU 65 7.938 -12.330 5.732 477 H VAL 66 H VAL 66 8.395 -12.344 11.078 478 HA VAL 66 HA VAL 66 9.897 -10.096 12.129 479 HB VAL 66 HB VAL 66 9.668 -12.905 13.232 480 HG11 VAL 66 1HG1 VAL 66 11.598 -11.710 14.095 481 HG12 VAL 66 2HG1 VAL 66 10.371 -11.883 15.349 482 HG13 VAL 66 3HG1 VAL 66 10.578 -10.338 14.526 483 HG21 VAL 66 3HG2 VAL 66 7.471 -11.873 13.081 484 HG22 VAL 66 1HG2 VAL 66 8.070 -10.440 13.916 485 HG23 VAL 66 2HG2 VAL 66 7.986 -11.983 14.765 486 H VAL 67 H VAL 67 12.079 -9.889 12.074 487 HA VAL 67 HA VAL 67 13.525 -11.359 10.134 488 HB VAL 67 HB VAL 67 14.651 -9.526 12.260 489 HG11 VAL 67 1HG1 VAL 67 15.763 -10.410 9.599 490 HG12 VAL 67 2HG1 VAL 67 16.352 -10.888 11.191 491 HG13 VAL 67 3HG1 VAL 67 16.493 -9.210 10.667 492 HG21 VAL 67 3HG2 VAL 67 14.519 -7.760 10.567 493 HG22 VAL 67 1HG2 VAL 67 12.922 -8.389 10.974 494 HG23 VAL 67 2HG2 VAL 67 13.702 -8.874 9.470 495 H ARG 68 H ARG 68 13.587 -13.509 10.648 496 HA ARG 68 HA ARG 68 14.803 -14.305 13.172 497 HE ARG 68 HE ARG 68 12.986 -18.437 12.510 498 HB2 ARG 68 1HB ARG 68 13.510 -15.916 10.966 499 HB3 ARG 68 2HB ARG 68 14.273 -16.633 12.378 500 HG2 ARG 68 1HG ARG 68 12.685 -15.448 13.824 501 HG3 ARG 68 2HG ARG 68 11.905 -14.773 12.394 502 HD2 ARG 68 1HD ARG 68 10.705 -16.730 13.273 503 HD3 ARG 68 2HD ARG 68 11.303 -16.993 11.635 504 HH11 ARG 68 1HH1 ARG 68 10.621 -17.387 14.869 505 HH12 ARG 68 2HH1 ARG 68 10.965 -18.668 15.990 506 HH21 ARG 68 1HH2 ARG 68 13.432 -20.156 13.972 507 HH22 ARG 68 2HH2 ARG 68 12.542 -20.264 15.463 508 H ASP 69 H ASP 69 16.906 -13.555 12.772 509 HA ASP 69 HA ASP 69 18.386 -15.105 10.752 510 HB2 ASP 69 1HB ASP 69 18.472 -12.646 10.425 511 HB3 ASP 69 2HB ASP 69 19.175 -12.475 12.030 512 HA PRO 70 HA PRO 70 20.051 -16.734 14.630 513 HB2 PRO 70 1HB PRO 70 19.837 -19.317 14.021 514 HB3 PRO 70 2HB PRO 70 18.402 -18.358 14.399 515 HG2 PRO 70 1HG PRO 70 19.365 -19.363 11.779 516 HG3 PRO 70 2HG PRO 70 17.710 -19.042 12.323 517 HD2 PRO 70 1HD PRO 70 19.398 -17.348 10.757 518 HD3 PRO 70 2HD PRO 70 17.772 -16.990 11.370 519 H LEU 71 H LEU 71 21.637 -15.811 12.243 520 HA LEU 71 HA LEU 71 23.479 -17.855 11.533 521 HG LEU 71 HG LEU 71 25.936 -16.024 10.937 522 HB2 LEU 71 1HB LEU 71 23.023 -15.839 10.159 523 HB3 LEU 71 2HB LEU 71 23.823 -14.858 11.372 524 HD11 LEU 71 1HD1 LEU 71 24.372 -17.473 8.804 525 HD12 LEU 71 2HD1 LEU 71 25.047 -18.185 10.270 526 HD13 LEU 71 3HD1 LEU 71 26.120 -17.544 9.026 527 HD21 LEU 71 3HD2 LEU 71 24.603 -14.937 8.460 528 HD22 LEU 71 1HD2 LEU 71 26.341 -15.134 8.690 529 HD23 LEU 71 2HD2 LEU 71 25.443 -13.998 9.695 530 H ALA 72 H ALA 72 23.574 -15.176 13.841 531 HA ALA 72 HA ALA 72 25.681 -16.634 15.293 532 HB1 ALA 72 3HB ALA 72 25.502 -13.638 14.955 533 HB2 ALA 72 1HB ALA 72 26.687 -14.695 14.188 534 HB3 ALA 72 2HB ALA 72 26.686 -14.496 15.940 535 H PHE 73 H PHE 73 25.335 -16.847 17.454 536 HA PHE 73 HA PHE 73 22.711 -16.215 18.429 537 HD1 PHE 73 HD1 PHE 73 21.663 -18.368 18.781 538 HD2 PHE 73 HD2 PHE 73 25.795 -19.361 18.998 539 HE1 PHE 73 HE1 PHE 73 21.196 -20.533 17.706 540 HE2 PHE 73 HE2 PHE 73 25.336 -21.526 17.927 541 HZ PHE 73 HZ PHE 73 23.035 -22.114 17.276 542 HB2 PHE 73 1HB PHE 73 25.086 -17.380 19.899 543 HB3 PHE 73 2HB PHE 73 23.433 -17.324 20.504 544 H LEU 74 H LEU 74 22.530 -14.018 18.461 545 HA LEU 74 HA LEU 74 23.529 -12.615 20.723 546 HG LEU 74 HG LEU 74 24.197 -9.850 19.386 547 HB2 LEU 74 1HB LEU 74 25.555 -12.547 19.339 548 HB3 LEU 74 2HB LEU 74 24.636 -11.868 18.009 549 HD11 LEU 74 1HD1 LEU 74 24.400 -10.858 21.593 550 HD12 LEU 74 2HD1 LEU 74 25.504 -9.495 21.420 551 HD13 LEU 74 3HD1 LEU 74 26.117 -11.144 21.315 552 HD21 LEU 74 3HD2 LEU 74 26.463 -8.938 19.222 553 HD22 LEU 74 1HD2 LEU 74 26.038 -9.883 17.794 554 HD23 LEU 74 2HD2 LEU 74 27.103 -10.570 19.022 555 H ASP 75 H ASP 75 22.200 -12.405 17.455 556 HA ASP 75 HA ASP 75 20.817 -9.956 17.896 557 HB2 ASP 75 1HB ASP 75 20.460 -12.084 15.776 558 HB3 ASP 75 2HB ASP 75 19.629 -10.531 15.772 559 H GLU 76 H GLU 76 19.774 -13.340 17.757 560 HA GLU 76 HA GLU 76 17.989 -14.447 18.572 561 HB2 GLU 76 1HB GLU 76 17.778 -12.032 20.360 562 HB3 GLU 76 2HB GLU 76 16.735 -13.441 20.507 563 HG2 GLU 76 1HG GLU 76 18.733 -14.841 20.863 564 HG3 GLU 76 2HG GLU 76 19.728 -13.385 20.809 565 HA PRO 77 HA PRO 77 15.219 -12.774 15.503 566 HB2 PRO 77 1HB PRO 77 13.874 -15.370 15.960 567 HB3 PRO 77 2HB PRO 77 14.482 -14.665 14.460 568 HG2 PRO 77 1HG PRO 77 15.744 -16.700 15.639 569 HG3 PRO 77 2HG PRO 77 16.645 -15.400 14.836 570 HD2 PRO 77 1HD PRO 77 16.160 -15.850 17.753 571 HD3 PRO 77 2HD PRO 77 17.631 -15.291 16.927 572 H GLU 78 H GLU 78 14.172 -14.354 18.493 573 HA GLU 78 HA GLU 78 11.518 -13.223 18.295 574 HB2 GLU 78 1HB GLU 78 12.852 -14.927 20.391 575 HB3 GLU 78 2HB GLU 78 11.222 -14.300 20.570 576 HG2 GLU 78 1HG GLU 78 11.001 -16.509 19.800 577 HG3 GLU 78 2HG GLU 78 10.651 -15.472 18.419 578 H ALA 79 H ALA 79 14.388 -11.922 19.115 579 HA ALA 79 HA ALA 79 13.360 -10.295 21.311 580 HB1 ALA 79 3HB ALA 79 15.681 -11.083 21.434 581 HB2 ALA 79 1HB ALA 79 15.589 -9.321 21.404 582 HB3 ALA 79 2HB ALA 79 16.053 -10.205 19.949 583 H GLY 80 H GLY 80 14.198 -10.099 17.919 584 HA2 GLY 80 1HA GLY 80 13.135 -8.691 16.374 585 HA3 GLY 80 2HA GLY 80 12.579 -7.685 17.704 586 H ALA 81 H ALA 81 13.988 -6.136 18.597 587 HA ALA 81 HA ALA 81 16.551 -5.660 17.371 588 HB1 ALA 81 3HB ALA 81 15.040 -4.756 15.668 589 HB2 ALA 81 1HB ALA 81 15.987 -3.480 16.432 590 HB3 ALA 81 2HB ALA 81 14.298 -3.713 16.880 591 H GLY 82 H GLY 82 17.559 -3.652 18.256 592 HA2 GLY 82 1HA GLY 82 16.883 -3.384 21.069 593 HA3 GLY 82 2HA GLY 82 18.317 -2.753 20.276 594 H ALA 83 H ALA 83 18.399 -0.619 20.371 595 HA ALA 83 HA ALA 83 15.952 0.886 20.829 596 HB1 ALA 83 3HB ALA 83 17.439 2.744 21.363 597 HB2 ALA 83 1HB ALA 83 18.829 1.790 20.845 598 HB3 ALA 83 2HB ALA 83 17.890 1.289 22.251 599 H ARG 84 H ARG 84 17.081 -0.203 18.097 600 HA ARG 84 HA ARG 84 17.313 2.209 16.551 601 HE ARG 84 HE ARG 84 19.265 -1.798 16.272 602 HB2 ARG 84 1HB ARG 84 17.314 0.694 14.591 603 HB3 ARG 84 2HB ARG 84 18.515 0.257 15.796 604 HG2 ARG 84 1HG ARG 84 16.876 -1.461 16.639 605 HG3 ARG 84 2HG ARG 84 15.909 -1.116 15.203 606 HD2 ARG 84 1HD ARG 84 17.310 -3.035 14.778 607 HD3 ARG 84 2HD ARG 84 17.862 -1.678 13.795 608 HH11 ARG 84 1HH1 ARG 84 19.114 -3.261 13.075 609 HH12 ARG 84 2HH1 ARG 84 20.768 -3.805 13.125 610 HH21 ARG 84 1HH2 ARG 84 21.426 -2.518 16.309 611 HH22 ARG 84 2HH2 ARG 84 22.075 -3.378 14.945 612 HA PRO 85 HA PRO 85 13.019 3.001 16.396 613 HB2 PRO 85 1HB PRO 85 13.548 4.809 14.162 614 HB3 PRO 85 2HB PRO 85 13.045 5.185 15.811 615 HG2 PRO 85 1HG PRO 85 15.512 5.769 14.889 616 HG3 PRO 85 2HG PRO 85 15.213 5.326 16.580 617 HD2 PRO 85 1HD PRO 85 16.273 3.639 14.341 618 HD3 PRO 85 2HD PRO 85 16.816 3.737 16.031 619 H ALA 86 H ALA 86 13.131 0.668 15.264 620 HA ALA 86 HA ALA 86 11.754 -0.661 14.054 621 HB1 ALA 86 3HB ALA 86 9.895 0.255 12.815 622 HB2 ALA 86 1HB ALA 86 10.612 1.865 12.881 623 HB3 ALA 86 2HB ALA 86 10.062 1.083 14.363 624 H ASN 87 H ASN 87 12.907 2.014 12.009 625 HA ASN 87 HA ASN 87 13.845 2.084 9.937 626 HB2 ASN 87 1HB ASN 87 14.295 -0.890 10.304 627 HB3 ASN 87 2HB ASN 87 14.972 0.086 9.004 628 HD21 ASN 87 2HD2 ASN 87 15.148 -0.756 12.344 629 HD22 ASN 87 1HD2 ASN 87 16.636 0.053 12.681 630 H ALA 88 H ALA 88 11.034 1.456 10.502 631 HA ALA 88 HA ALA 88 10.042 -0.229 8.415 632 HB1 ALA 88 3HB ALA 88 8.838 0.072 10.527 633 HB2 ALA 88 1HB ALA 88 7.844 0.558 9.153 634 HB3 ALA 88 2HB ALA 88 8.616 1.784 10.160 635 HA PRO 89 HA PRO 89 9.546 2.583 4.991 636 HB2 PRO 89 1HB PRO 89 6.810 2.542 4.543 637 HB3 PRO 89 2HB PRO 89 7.961 1.358 3.917 638 HG2 PRO 89 1HG PRO 89 6.187 1.191 6.316 639 HG3 PRO 89 2HG PRO 89 6.599 -0.064 5.131 640 HD2 PRO 89 1HD PRO 89 7.740 -0.014 7.549 641 HD3 PRO 89 2HD PRO 89 8.664 -0.480 6.104 642 H GLU 90 H GLU 90 9.274 4.724 4.664 643 HA GLU 90 HA GLU 90 8.504 6.370 6.860 644 HB2 GLU 90 1HB GLU 90 9.034 7.148 3.985 645 HB3 GLU 90 2HB GLU 90 9.014 8.233 5.366 646 HG2 GLU 90 1HG GLU 90 10.975 7.163 6.281 647 HG3 GLU 90 2HG GLU 90 10.968 5.976 4.978 648 H VAL 91 H VAL 91 7.080 5.487 3.768 649 HA VAL 91 HA VAL 91 4.511 6.511 4.719 650 HB VAL 91 HB VAL 91 5.320 8.320 3.354 651 HG11 VAL 91 1HG1 VAL 91 7.014 7.147 2.082 652 HG12 VAL 91 2HG1 VAL 91 5.932 8.029 1.003 653 HG13 VAL 91 3HG1 VAL 91 5.767 6.283 1.184 654 HG21 VAL 91 3HG2 VAL 91 3.595 8.430 1.624 655 HG22 VAL 91 1HG2 VAL 91 2.948 7.800 3.139 656 HG23 VAL 91 2HG2 VAL 91 3.301 6.701 1.805 657 H LEU 92 H LEU 92 2.805 5.292 4.199 658 HA LEU 92 HA LEU 92 3.288 2.932 2.498 659 HG LEU 92 HG LEU 92 0.610 1.552 3.223 660 HB2 LEU 92 1HB LEU 92 2.996 2.376 4.882 661 HB3 LEU 92 2HB LEU 92 1.455 3.213 4.888 662 HD11 LEU 92 1HD1 LEU 92 2.738 0.851 2.277 663 HD12 LEU 92 2HD1 LEU 92 1.860 -0.533 2.932 664 HD13 LEU 92 3HD1 LEU 92 3.213 0.157 3.828 665 HD21 LEU 92 3HD2 LEU 92 0.124 1.318 5.599 666 HD22 LEU 92 1HD2 LEU 92 1.630 0.430 5.831 667 HD23 LEU 92 2HD2 LEU 92 0.342 -0.261 4.843 668 H LEU 93 H LEU 93 2.201 3.028 0.656 669 HA LEU 93 HA LEU 93 -0.189 4.730 0.522 670 HG LEU 93 HG LEU 93 2.654 5.536 -0.499 671 HB2 LEU 93 1HB LEU 93 1.585 3.671 -1.681 672 HB3 LEU 93 2HB LEU 93 0.151 4.647 -1.935 673 HD11 LEU 93 1HD1 LEU 93 1.528 6.272 -3.196 674 HD12 LEU 93 2HD1 LEU 93 2.986 5.326 -2.893 675 HD13 LEU 93 3HD1 LEU 93 2.924 7.026 -2.428 676 HD21 LEU 93 3HD2 LEU 93 0.656 6.582 0.432 677 HD22 LEU 93 1HD2 LEU 93 0.141 7.058 -1.186 678 HD23 LEU 93 2HD2 LEU 93 1.607 7.748 -0.489 679 H VAL 94 H VAL 94 -2.108 3.819 0.419 680 HA VAL 94 HA VAL 94 -2.297 0.986 -0.345 681 HB VAL 94 HB VAL 94 -4.368 2.713 1.030 682 HG11 VAL 94 1HG1 VAL 94 -5.355 0.871 -0.203 683 HG12 VAL 94 2HG1 VAL 94 -5.474 0.580 1.532 684 HG13 VAL 94 3HG1 VAL 94 -4.256 -0.266 0.578 685 HG21 VAL 94 3HG2 VAL 94 -3.789 1.491 3.071 686 HG22 VAL 94 1HG2 VAL 94 -2.415 2.409 2.454 687 HG23 VAL 94 2HG2 VAL 94 -2.493 0.665 2.209 688 H GLY 95 H GLY 95 -3.147 0.464 -2.258 689 HA2 GLY 95 1HA GLY 95 -4.565 2.569 -3.767 690 HA3 GLY 95 2HA GLY 95 -3.654 1.253 -4.493 691 H THR 96 H THR 96 -6.677 2.347 -3.734 692 HA THR 96 HA THR 96 -7.905 -0.180 -3.128 693 HB THR 96 HB THR 96 -10.035 1.187 -3.352 694 HG1 THR 96 HG1 THR 96 -9.644 2.993 -4.473 695 HG21 THR 96 3HG2 THR 96 -9.575 2.469 -1.268 696 HG22 THR 96 1HG2 THR 96 -7.867 2.073 -1.445 697 HG23 THR 96 2HG2 THR 96 -9.049 0.788 -1.184 698 H GLY 97 H GLY 97 -8.462 2.154 -5.787 699 HA2 GLY 97 1HA GLY 97 -8.506 1.709 -8.080 700 HA3 GLY 97 2HA GLY 97 -8.352 -0.006 -7.731 701 H ARG 98 H ARG 98 -10.616 0.369 -5.743 702 HA ARG 98 HA ARG 98 -12.784 0.168 -7.725 703 HE ARG 98 HE ARG 98 -10.206 -4.238 -6.562 704 HB2 ARG 98 1HB ARG 98 -12.688 -1.143 -5.003 705 HB3 ARG 98 2HB ARG 98 -13.822 -1.471 -6.308 706 HG2 ARG 98 1HG ARG 98 -12.077 -2.429 -7.653 707 HG3 ARG 98 2HG ARG 98 -10.862 -1.984 -6.458 708 HD2 ARG 98 1HD ARG 98 -12.029 -3.465 -4.828 709 HD3 ARG 98 2HD ARG 98 -13.080 -3.997 -6.143 710 HH11 ARG 98 1HH1 ARG 98 -13.209 -5.853 -5.735 711 HH12 ARG 98 2HH1 ARG 98 -12.608 -7.432 -6.125 712 HH21 ARG 98 1HH2 ARG 98 -9.432 -6.311 -7.064 713 HH22 ARG 98 2HH2 ARG 98 -10.474 -7.692 -6.907 714 H ARG 99 H ARG 99 -12.518 0.650 -4.214 715 HA ARG 99 HA ARG 99 -13.838 3.249 -4.465 716 HE ARG 99 HE ARG 99 -18.486 0.783 -4.715 717 HB2 ARG 99 1HB ARG 99 -14.677 1.038 -2.581 718 HB3 ARG 99 2HB ARG 99 -15.121 2.719 -2.342 719 HG2 ARG 99 1HG ARG 99 -16.254 2.658 -4.565 720 HG3 ARG 99 2HG ARG 99 -15.939 0.919 -4.610 721 HD2 ARG 99 1HD ARG 99 -17.168 0.638 -2.521 722 HD3 ARG 99 2HD ARG 99 -17.469 2.371 -2.456 723 HH11 ARG 99 1HH1 ARG 99 -19.027 2.907 -1.986 724 HH12 ARG 99 2HH1 ARG 99 -20.742 3.032 -2.252 725 HH21 ARG 99 1HH2 ARG 99 -20.727 0.955 -5.083 726 HH22 ARG 99 2HH2 ARG 99 -21.705 1.920 -4.019 727 H GLN 100 H GLN 100 -12.692 4.747 -3.369 728 HA GLN 100 HA GLN 100 -10.405 3.989 -1.871 729 HB2 GLN 100 1HB GLN 100 -11.765 6.648 -2.287 730 HB3 GLN 100 2HB GLN 100 -10.276 6.454 -1.384 731 HG2 GLN 100 1HG GLN 100 -9.192 5.523 -3.373 732 HG3 GLN 100 2HG GLN 100 -10.685 5.760 -4.277 733 HE21 GLN 100 2HE2 GLN 100 -11.268 8.289 -2.926 734 HE22 GLN 100 1HE2 GLN 100 -10.196 9.455 -3.621 735 H HIS 101 H HIS 101 -10.931 2.807 -0.113 736 HA HIS 101 HA HIS 101 -12.977 3.525 1.739 737 HD1 HIS 101 HD1 HIS 101 -10.215 1.281 4.409 738 HD2 HIS 101 HD2 HIS 101 -14.286 1.562 3.616 739 HE1 HIS 101 HE1 HIS 101 -11.360 0.803 6.594 740 HE2 HIS 101 HE2 HIS 101 -13.814 1.150 6.131 741 HB2 HIS 101 1HB HIS 101 -12.305 1.189 1.455 742 HB3 HIS 101 2HB HIS 101 -10.672 1.574 1.987 743 H LEU 102 H LEU 102 -12.873 5.085 3.185 744 HA LEU 102 HA LEU 102 -10.445 6.424 3.858 745 HG LEU 102 HG LEU 102 -11.420 7.508 6.605 746 HB2 LEU 102 1HB LEU 102 -12.613 7.571 3.832 747 HB3 LEU 102 2HB LEU 102 -13.185 6.537 5.125 748 HD11 LEU 102 1HD1 LEU 102 -10.349 9.590 5.922 749 HD12 LEU 102 2HD1 LEU 102 -11.067 9.441 4.319 750 HD13 LEU 102 3HD1 LEU 102 -9.879 8.258 4.865 751 HD21 LEU 102 3HD2 LEU 102 -13.377 9.453 5.393 752 HD22 LEU 102 1HD2 LEU 102 -12.600 9.615 6.967 753 HD23 LEU 102 2HD2 LEU 102 -13.728 8.291 6.672 754 H LEU 103 H LEU 103 -8.968 5.699 5.241 755 HA LEU 103 HA LEU 103 -9.488 3.527 7.021 756 HG LEU 103 HG LEU 103 -7.353 4.109 4.767 757 HB2 LEU 103 1HB LEU 103 -7.100 5.374 6.856 758 HB3 LEU 103 2HB LEU 103 -7.170 3.880 7.773 759 HD11 LEU 103 1HD1 LEU 103 -5.154 3.079 6.552 760 HD12 LEU 103 2HD1 LEU 103 -5.116 4.561 5.596 761 HD13 LEU 103 3HD1 LEU 103 -5.174 2.992 4.791 762 HD21 LEU 103 3HD2 LEU 103 -7.294 1.674 6.545 763 HD22 LEU 103 1HD2 LEU 103 -7.249 1.669 4.782 764 HD23 LEU 103 2HD2 LEU 103 -8.684 2.253 5.626 765 H GLY 104 H GLY 104 -9.733 3.563 9.240 766 HA2 GLY 104 1HA GLY 104 -10.535 6.206 10.269 767 HA3 GLY 104 2HA GLY 104 -11.185 4.668 10.818 768 HA PRO 105 HA PRO 105 -7.515 6.483 13.449 769 HB2 PRO 105 1HB PRO 105 -9.765 6.566 15.407 770 HB3 PRO 105 2HB PRO 105 -8.407 7.681 15.202 771 HG2 PRO 105 1HG PRO 105 -10.837 8.343 14.350 772 HG3 PRO 105 2HG PRO 105 -9.397 8.766 13.406 773 HD2 PRO 105 1HD PRO 105 -11.409 6.613 12.937 774 HD3 PRO 105 2HD PRO 105 -10.533 7.617 11.763 775 H GLU 106 H GLU 106 -10.276 4.414 14.262 776 HA GLU 106 HA GLU 106 -9.176 2.798 16.206 777 HB2 GLU 106 1HB GLU 106 -11.548 2.837 15.336 778 HB3 GLU 106 2HB GLU 106 -11.000 1.845 13.994 779 HG2 GLU 106 1HG GLU 106 -12.063 0.502 15.702 780 HG3 GLU 106 2HG GLU 106 -10.358 0.084 15.545 781 H GLN 107 H GLN 107 -8.541 2.816 12.789 782 HA GLN 107 HA GLN 107 -7.168 0.237 12.891 783 HB2 GLN 107 1HB GLN 107 -7.679 2.061 10.534 784 HB3 GLN 107 2HB GLN 107 -7.079 0.409 10.465 785 HG2 GLN 107 1HG GLN 107 -9.183 -0.426 11.311 786 HG3 GLN 107 2HG GLN 107 -9.787 1.219 11.499 787 HE21 GLN 107 2HE2 GLN 107 -10.823 -1.008 9.928 788 HE22 GLN 107 1HE2 GLN 107 -10.890 -0.453 8.292 789 H VAL 108 H VAL 108 -6.520 3.671 12.301 790 HA VAL 108 HA VAL 108 -3.844 3.057 11.380 791 HB VAL 108 HB VAL 108 -3.646 5.474 10.920 792 HG11 VAL 108 1HG1 VAL 108 -4.487 3.959 9.214 793 HG12 VAL 108 2HG1 VAL 108 -5.289 5.525 9.101 794 HG13 VAL 108 3HG1 VAL 108 -6.129 4.154 9.827 795 HG21 VAL 108 3HG2 VAL 108 -5.076 6.337 12.687 796 HG22 VAL 108 1HG2 VAL 108 -6.486 5.586 11.937 797 HG23 VAL 108 2HG2 VAL 108 -5.640 6.895 11.111 798 H ARG 109 H ARG 109 -5.166 3.765 14.428 799 HA ARG 109 HA ARG 109 -3.403 5.536 15.571 800 HE ARG 109 HE ARG 109 -5.895 2.779 18.456 801 HB2 ARG 109 1HB ARG 109 -4.865 3.192 16.725 802 HB3 ARG 109 2HB ARG 109 -3.810 4.178 17.714 803 HG2 ARG 109 1HG ARG 109 -5.150 6.153 17.153 804 HG3 ARG 109 2HG ARG 109 -6.227 5.126 16.204 805 HD2 ARG 109 1HD ARG 109 -5.758 5.106 19.172 806 HD3 ARG 109 2HD ARG 109 -7.268 5.390 18.307 807 HH11 ARG 109 1HH1 ARG 109 -8.831 4.691 18.351 808 HH12 ARG 109 2HH1 ARG 109 -9.877 3.297 18.337 809 HH21 ARG 109 1HH2 ARG 109 -7.246 0.979 18.486 810 HH22 ARG 109 2HH2 ARG 109 -8.974 1.178 18.426 811 HA PRO 110 HA PRO 110 -0.485 1.799 16.915 812 HB2 PRO 110 1HB PRO 110 -0.948 0.055 14.547 813 HB3 PRO 110 2HB PRO 110 -0.621 -0.389 16.226 814 HG2 PRO 110 1HG PRO 110 -3.072 -0.615 15.222 815 HG3 PRO 110 2HG PRO 110 -2.820 -0.042 16.882 816 HD2 PRO 110 1HD PRO 110 -3.510 1.507 14.423 817 HD3 PRO 110 2HD PRO 110 -4.070 1.732 16.092 818 H LEU 111 H LEU 111 -1.072 2.503 13.495 819 HA LEU 111 HA LEU 111 1.730 2.383 12.841 820 HG LEU 111 HG LEU 111 -0.715 0.888 11.687 821 HB2 LEU 111 1HB LEU 111 -0.645 3.308 11.224 822 HB3 LEU 111 2HB LEU 111 0.987 3.135 10.600 823 HD11 LEU 111 1HD1 LEU 111 -1.521 1.745 9.543 824 HD12 LEU 111 2HD1 LEU 111 -0.834 0.128 9.385 825 HD13 LEU 111 3HD1 LEU 111 0.092 1.534 8.858 826 HD21 LEU 111 3HD2 LEU 111 1.663 0.520 12.078 827 HD22 LEU 111 1HD2 LEU 111 2.000 0.845 10.377 828 HD23 LEU 111 2HD2 LEU 111 1.051 -0.570 10.832 829 H LEU 112 H LEU 112 -0.662 4.878 13.489 830 HA LEU 112 HA LEU 112 0.999 7.078 12.805 831 HG LEU 112 HG LEU 112 -2.063 6.504 12.391 832 HB2 LEU 112 1HB LEU 112 -1.358 6.906 14.681 833 HB3 LEU 112 2HB LEU 112 -0.582 8.404 14.210 834 HD11 LEU 112 1HD1 LEU 112 -3.512 7.837 13.825 835 HD12 LEU 112 2HD1 LEU 112 -3.626 8.363 12.145 836 HD13 LEU 112 3HD1 LEU 112 -2.690 9.308 13.304 837 HD21 LEU 112 3HD2 LEU 112 -0.649 9.092 11.756 838 HD22 LEU 112 1HD2 LEU 112 -1.684 8.191 10.648 839 HD23 LEU 112 2HD2 LEU 112 -0.174 7.480 11.218 840 H ALA 113 H ALA 113 0.508 5.194 15.728 841 HA ALA 113 HA ALA 113 2.011 6.787 17.497 842 HB1 ALA 113 3HB ALA 113 0.540 4.974 18.246 843 HB2 ALA 113 1HB ALA 113 2.173 4.788 18.885 844 HB3 ALA 113 2HB ALA 113 1.636 3.792 17.533 845 H MET 114 H MET 114 2.925 4.323 15.174 846 HA MET 114 HA MET 114 5.686 4.270 15.926 847 HB2 MET 114 1HB MET 114 4.302 3.343 13.402 848 HB3 MET 114 2HB MET 114 5.989 3.037 13.786 849 HG2 MET 114 1HG MET 114 5.333 1.738 15.727 850 HG3 MET 114 2HG MET 114 3.637 2.084 15.402 851 HE1 MET 114 3HE MET 114 3.916 -1.725 14.536 852 HE2 MET 114 1HE MET 114 3.083 -0.505 15.500 853 HE3 MET 114 2HE MET 114 4.779 -0.874 15.816 854 H GLY 115 H GLY 115 3.777 5.895 13.436 855 HA2 GLY 115 1HA GLY 115 4.436 8.199 12.904 856 HA3 GLY 115 2HA GLY 115 6.104 7.646 12.939 857 H VAL 116 H VAL 116 3.903 5.465 11.526 858 HA VAL 116 HA VAL 116 5.122 5.887 8.929 859 HB VAL 116 HB VAL 116 3.068 3.826 9.764 860 HG11 VAL 116 1HG1 VAL 116 4.860 3.955 7.340 861 HG12 VAL 116 2HG1 VAL 116 3.115 4.205 7.358 862 HG13 VAL 116 3HG1 VAL 116 3.782 2.622 7.757 863 HG21 VAL 116 3HG2 VAL 116 4.959 2.266 9.887 864 HG22 VAL 116 1HG2 VAL 116 5.116 3.577 11.056 865 HG23 VAL 116 2HG2 VAL 116 6.072 3.598 9.575 866 H GLY 117 H GLY 117 4.274 7.250 7.510 867 HA2 GLY 117 1HA GLY 117 1.593 8.263 7.804 868 HA3 GLY 117 2HA GLY 117 2.744 8.698 6.546 869 H VAL 118 H VAL 118 0.004 6.848 7.339 870 HA VAL 118 HA VAL 118 0.221 5.262 4.877 871 HB VAL 118 HB VAL 118 -1.773 4.960 7.130 872 HG11 VAL 118 1HG1 VAL 118 -2.238 2.781 6.125 873 HG12 VAL 118 2HG1 VAL 118 -1.097 3.135 4.826 874 HG13 VAL 118 3HG1 VAL 118 -2.569 4.094 4.994 875 HG21 VAL 118 3HG2 VAL 118 0.746 3.397 6.575 876 HG22 VAL 118 1HG2 VAL 118 -0.449 3.022 7.818 877 HG23 VAL 118 2HG2 VAL 118 0.488 4.513 7.917 878 H GLU 119 H GLU 119 -0.853 5.913 3.136 879 HA GLU 119 HA GLU 119 -3.279 7.542 3.514 880 HB2 GLU 119 1HB GLU 119 -1.236 7.953 1.321 881 HB3 GLU 119 2HB GLU 119 -2.668 8.929 1.626 882 HG2 GLU 119 1HG GLU 119 -1.680 9.493 3.866 883 HG3 GLU 119 2HG GLU 119 -0.195 8.716 3.319 884 H ALA 120 H ALA 120 -4.980 7.117 2.135 885 HA ALA 120 HA ALA 120 -4.637 4.721 0.453 886 HB1 ALA 120 3HB ALA 120 -6.938 4.140 0.961 887 HB2 ALA 120 1HB ALA 120 -7.114 5.601 1.931 888 HB3 ALA 120 2HB ALA 120 -6.008 4.328 2.448 889 H MET 121 H MET 121 -5.001 4.927 -1.623 890 HA MET 121 HA MET 121 -6.996 6.809 -2.627 891 HB2 MET 121 1HB MET 121 -4.104 6.767 -3.533 892 HB3 MET 121 2HB MET 121 -5.397 7.536 -4.440 893 HG2 MET 121 1HG MET 121 -5.792 9.082 -2.613 894 HG3 MET 121 2HG MET 121 -4.556 8.282 -1.646 895 HE1 MET 121 3HE MET 121 -1.964 8.394 -2.153 896 HE2 MET 121 1HE MET 121 -1.283 9.136 -3.601 897 HE3 MET 121 2HE MET 121 -2.276 7.685 -3.737 898 H ASP 122 H ASP 122 -7.119 6.377 -5.179 899 HA ASP 122 HA ASP 122 -7.536 3.572 -5.486 900 HB2 ASP 122 1HB ASP 122 -7.792 5.914 -7.344 901 HB3 ASP 122 2HB ASP 122 -7.872 4.271 -7.974 902 H THR 123 H THR 123 -6.585 2.214 -7.096 903 HA THR 123 HA THR 123 -3.915 1.818 -6.735 904 HB THR 123 HB THR 123 -5.486 0.992 -9.183 905 HG1 THR 123 HG1 THR 123 -5.595 -0.980 -7.614 906 HG21 THR 123 3HG2 THR 123 -3.981 -0.938 -9.212 907 HG22 THR 123 1HG2 THR 123 -3.113 -0.292 -7.821 908 HG23 THR 123 2HG2 THR 123 -3.073 0.567 -9.361 909 H GLN 124 H GLN 124 -5.368 3.290 -9.652 910 HA GLN 124 HA GLN 124 -2.971 3.736 -11.021 911 HB2 GLN 124 1HB GLN 124 -5.219 3.837 -12.035 912 HB3 GLN 124 2HB GLN 124 -5.528 5.340 -11.178 913 HG2 GLN 124 1HG GLN 124 -3.729 6.425 -12.406 914 HG3 GLN 124 2HG GLN 124 -3.382 4.915 -13.247 915 HE21 GLN 124 2HE2 GLN 124 -3.804 5.794 -15.274 916 HE22 GLN 124 1HE2 GLN 124 -5.409 6.175 -15.794 917 H ALA 125 H ALA 125 -4.754 5.896 -8.834 918 HA ALA 125 HA ALA 125 -3.037 8.125 -9.219 919 HB1 ALA 125 3HB ALA 125 -4.902 7.548 -6.921 920 HB2 ALA 125 1HB ALA 125 -5.350 8.340 -8.431 921 HB3 ALA 125 2HB ALA 125 -4.206 9.115 -7.336 922 H ALA 126 H ALA 126 -3.163 5.517 -6.854 923 HA ALA 126 HA ALA 126 -1.180 6.551 -5.117 924 HB1 ALA 126 3HB ALA 126 -1.123 4.323 -4.150 925 HB2 ALA 126 1HB ALA 126 -2.016 3.683 -5.530 926 HB3 ALA 126 2HB ALA 126 -2.789 4.831 -4.435 927 H ALA 127 H ALA 127 -1.048 4.250 -7.819 928 HA ALA 127 HA ALA 127 1.692 3.626 -7.563 929 HB1 ALA 127 3HB ALA 127 0.107 2.248 -8.826 930 HB2 ALA 127 1HB ALA 127 1.513 2.691 -9.794 931 HB3 ALA 127 2HB ALA 127 -0.024 3.521 -10.039 932 H ARG 128 H ARG 128 -0.009 6.149 -9.349 933 HA ARG 128 HA ARG 128 2.135 7.167 -10.830 934 HE ARG 128 HE ARG 128 -0.223 11.513 -13.406 935 HB2 ARG 128 1HB ARG 128 -0.301 7.825 -11.014 936 HB3 ARG 128 2HB ARG 128 -0.074 8.805 -9.573 937 HG2 ARG 128 1HG ARG 128 1.728 10.034 -10.817 938 HG3 ARG 128 2HG ARG 128 1.213 9.168 -12.266 939 HD2 ARG 128 1HD ARG 128 -1.093 10.063 -11.871 940 HD3 ARG 128 2HD ARG 128 -0.422 11.055 -10.578 941 HH11 ARG 128 1HH1 ARG 128 1.309 12.118 -10.315 942 HH12 ARG 128 2HH1 ARG 128 2.125 13.555 -10.852 943 HH21 ARG 128 1HH2 ARG 128 0.798 13.436 -14.097 944 HH22 ARG 128 2HH2 ARG 128 1.800 14.325 -12.990 945 H THR 129 H THR 129 0.937 8.109 -7.626 946 HA THR 129 HA THR 129 2.970 9.986 -7.061 947 HB THR 129 HB THR 129 1.370 8.398 -5.046 948 HG1 THR 129 HG1 THR 129 -0.187 9.298 -6.288 949 HG21 THR 129 3HG2 THR 129 1.611 10.420 -3.670 950 HG22 THR 129 1HG2 THR 129 2.581 11.166 -4.939 951 HG23 THR 129 2HG2 THR 129 3.183 9.740 -4.093 952 H TYR 130 H TYR 130 2.637 6.536 -6.491 953 HA TYR 130 HA TYR 130 4.825 6.089 -4.820 954 HD1 TYR 130 HD2 TYR 130 4.942 3.768 -3.512 955 HD2 TYR 130 HD1 TYR 130 5.147 2.723 -7.630 956 HE1 TYR 130 HE2 TYR 130 6.496 1.942 -2.968 957 HE2 TYR 130 HE1 TYR 130 6.695 0.892 -7.095 958 HH TYR 130 HH TYR 130 7.165 -0.249 -3.979 959 HB2 TYR 130 1HB TYR 130 3.129 4.401 -5.261 960 HB3 TYR 130 2HB TYR 130 3.609 4.320 -6.950 961 H ASN 131 H ASN 131 4.633 6.113 -8.368 962 HA ASN 131 HA ASN 131 7.308 5.461 -8.897 963 HB2 ASN 131 1HB ASN 131 5.476 5.510 -10.595 964 HB3 ASN 131 2HB ASN 131 5.512 7.268 -10.537 965 HD21 ASN 131 2HD2 ASN 131 7.172 8.365 -11.547 966 HD22 ASN 131 1HD2 ASN 131 8.290 7.593 -12.613 967 H ILE 132 H ILE 132 5.744 8.583 -8.338 968 HA ILE 132 HA ILE 132 7.983 10.231 -8.765 969 HB ILE 132 HB ILE 132 5.699 10.695 -6.839 970 HG12 ILE 132 1HG1 ILE 132 5.976 11.569 -9.724 971 HG13 ILE 132 2HG1 ILE 132 4.987 10.216 -9.186 972 HG21 ILE 132 1HG2 ILE 132 7.592 12.645 -8.151 973 HG22 ILE 132 2HG2 ILE 132 7.589 12.187 -6.448 974 HG23 ILE 132 3HG2 ILE 132 6.222 13.071 -7.124 975 HD11 ILE 132 3HD1 ILE 132 3.621 11.748 -7.863 976 HD12 ILE 132 1HD1 ILE 132 3.639 12.193 -9.570 977 HD13 ILE 132 2HD1 ILE 132 4.612 13.100 -8.412 978 H LEU 133 H LEU 133 6.733 8.755 -5.776 979 HA LEU 133 HA LEU 133 8.720 9.827 -4.072 980 HG LEU 133 HG LEU 133 5.649 9.407 -3.867 981 HB2 LEU 133 1HB LEU 133 7.008 7.362 -3.745 982 HB3 LEU 133 2HB LEU 133 7.977 8.082 -2.473 983 HD11 LEU 133 1HD1 LEU 133 4.505 9.153 -1.732 984 HD12 LEU 133 2HD1 LEU 133 5.899 8.294 -1.078 985 HD13 LEU 133 3HD1 LEU 133 4.965 7.585 -2.395 986 HD21 LEU 133 3HD2 LEU 133 7.342 11.020 -3.179 987 HD22 LEU 133 1HD2 LEU 133 7.345 10.339 -1.552 988 HD23 LEU 133 2HD2 LEU 133 5.903 11.148 -2.167 989 H MET 134 H MET 134 8.582 6.935 -6.039 990 HA MET 134 HA MET 134 10.855 5.632 -4.996 991 HB2 MET 134 1HB MET 134 9.281 4.482 -6.459 992 HB3 MET 134 2HB MET 134 9.677 5.567 -7.784 993 HG2 MET 134 1HG MET 134 11.944 4.696 -7.841 994 HG3 MET 134 2HG MET 134 11.582 3.636 -6.481 995 HE1 MET 134 3HE MET 134 9.177 4.506 -9.473 996 HE2 MET 134 1HE MET 134 9.582 3.230 -10.622 997 HE3 MET 134 2HE MET 134 10.769 4.475 -10.231 998 H ALA 135 H ALA 135 10.442 8.105 -7.471 999 HA ALA 135 HA ALA 135 13.191 8.167 -8.248 1000 HB1 ALA 135 3HB ALA 135 11.051 10.261 -8.626 1001 HB2 ALA 135 1HB ALA 135 11.398 8.934 -9.735 1002 HB3 ALA 135 2HB ALA 135 12.602 10.194 -9.463 1003 H GLU 136 H GLU 136 11.326 9.626 -5.716 1004 HA GLU 136 HA GLU 136 13.265 11.609 -5.010 1005 HB2 GLU 136 1HB GLU 136 10.959 11.926 -4.335 1006 HB3 GLU 136 2HB GLU 136 10.962 10.404 -3.455 1007 HG2 GLU 136 1HG GLU 136 12.461 11.275 -1.815 1008 HG3 GLU 136 2HG GLU 136 12.719 12.741 -2.755 1009 H GLY 137 H GLY 137 12.957 8.232 -4.542 1010 HA2 GLY 137 1HA GLY 137 14.478 6.754 -3.599 1011 HA3 GLY 137 2HA GLY 137 15.423 8.131 -3.043 1012 H ARG 138 H ARG 138 12.028 7.856 -2.410 1013 HA ARG 138 HA ARG 138 12.568 7.991 0.435 1014 HE ARG 138 HE ARG 138 8.260 9.686 2.929 1015 HB2 ARG 138 1HB ARG 138 10.871 9.425 -0.841 1016 HB3 ARG 138 2HB ARG 138 9.869 7.982 -0.909 1017 HG2 ARG 138 1HG ARG 138 9.763 7.900 1.504 1018 HG3 ARG 138 2HG ARG 138 10.854 9.285 1.619 1019 HD2 ARG 138 1HD ARG 138 9.155 10.567 0.259 1020 HD3 ARG 138 2HD ARG 138 8.057 9.214 0.519 1021 HH11 ARG 138 1HH1 ARG 138 9.231 12.145 0.648 1022 HH12 ARG 138 2HH1 ARG 138 8.857 13.470 1.709 1023 HH21 ARG 138 1HH2 ARG 138 7.773 11.432 4.359 1024 HH22 ARG 138 2HH2 ARG 138 8.007 13.064 3.820 1025 H ARG 139 H ARG 139 11.737 6.529 1.964 1026 HA ARG 139 HA ARG 139 11.589 3.803 1.019 1027 HE ARG 139 HE ARG 139 12.158 0.828 5.826 1028 HB2 ARG 139 1HB ARG 139 12.751 4.629 3.145 1029 HB3 ARG 139 2HB ARG 139 11.147 4.773 3.842 1030 HG2 ARG 139 1HG ARG 139 10.786 2.428 3.700 1031 HG3 ARG 139 2HG ARG 139 12.234 2.206 2.716 1032 HD2 ARG 139 1HD ARG 139 13.601 3.017 4.611 1033 HD3 ARG 139 2HD ARG 139 12.140 3.117 5.590 1034 HH11 ARG 139 1HH1 ARG 139 14.521 1.775 3.421 1035 HH12 ARG 139 2HH1 ARG 139 15.293 0.223 3.368 1036 HH21 ARG 139 1HH2 ARG 139 13.183 -1.216 5.779 1037 HH22 ARG 139 2HH2 ARG 139 14.530 -1.486 4.713 1038 H VAL 140 H VAL 140 9.709 3.815 -0.204 1039 HA VAL 140 HA VAL 140 7.203 4.137 1.303 1040 HB VAL 140 HB VAL 140 7.366 5.934 -0.295 1041 HG11 VAL 140 1HG1 VAL 140 7.602 5.542 -2.703 1042 HG12 VAL 140 2HG1 VAL 140 7.824 3.819 -2.396 1043 HG13 VAL 140 3HG1 VAL 140 9.013 4.980 -1.805 1044 HG21 VAL 140 3HG2 VAL 140 5.485 3.802 -1.309 1045 HG22 VAL 140 1HG2 VAL 140 5.376 5.526 -1.671 1046 HG23 VAL 140 2HG2 VAL 140 5.155 4.956 -0.017 1047 H VAL 141 H VAL 141 5.855 2.474 1.324 1048 HA VAL 141 HA VAL 141 6.281 0.280 -0.603 1049 HB VAL 141 HB VAL 141 4.989 0.062 2.129 1050 HG11 VAL 141 1HG1 VAL 141 5.851 -2.053 0.158 1051 HG12 VAL 141 2HG1 VAL 141 4.192 -1.590 0.528 1052 HG13 VAL 141 3HG1 VAL 141 5.189 -2.355 1.765 1053 HG21 VAL 141 3HG2 VAL 141 7.374 0.562 2.352 1054 HG22 VAL 141 1HG2 VAL 141 7.758 -0.788 1.286 1055 HG23 VAL 141 2HG2 VAL 141 7.014 -1.089 2.856 1056 H VAL 142 H VAL 142 4.552 -0.287 -1.858 1057 HA VAL 142 HA VAL 142 2.041 1.139 -1.293 1058 HB VAL 142 HB VAL 142 3.238 1.980 -3.311 1059 HG11 VAL 142 1HG1 VAL 142 2.655 -0.760 -4.417 1060 HG12 VAL 142 2HG1 VAL 142 4.247 -0.072 -4.098 1061 HG13 VAL 142 3HG1 VAL 142 3.222 0.622 -5.354 1062 HG21 VAL 142 3HG2 VAL 142 0.569 0.678 -3.814 1063 HG22 VAL 142 1HG2 VAL 142 1.278 1.970 -4.782 1064 HG23 VAL 142 2HG2 VAL 142 0.841 2.267 -3.100 1065 H ALA 143 H ALA 143 0.262 -0.022 -1.083 1066 HA ALA 143 HA ALA 143 0.331 -2.866 -1.862 1067 HB1 ALA 143 3HB ALA 143 -1.319 -1.536 0.291 1068 HB2 ALA 143 1HB ALA 143 0.113 -2.533 0.553 1069 HB3 ALA 143 2HB ALA 143 -1.350 -3.250 -0.122 1070 H LEU 144 H LEU 144 -0.687 -3.086 -3.757 1071 HA LEU 144 HA LEU 144 -2.930 -1.274 -4.346 1072 HG LEU 144 HG LEU 144 -0.005 -0.834 -5.248 1073 HB2 LEU 144 1HB LEU 144 -1.134 -2.815 -6.215 1074 HB3 LEU 144 2HB LEU 144 -2.463 -1.790 -6.719 1075 HD11 LEU 144 1HD1 LEU 144 0.528 -1.567 -7.506 1076 HD12 LEU 144 2HD1 LEU 144 0.617 0.190 -7.377 1077 HD13 LEU 144 3HD1 LEU 144 -0.775 -0.570 -8.151 1078 HD21 LEU 144 3HD2 LEU 144 -1.973 0.523 -4.783 1079 HD22 LEU 144 1HD2 LEU 144 -2.284 0.686 -6.512 1080 HD23 LEU 144 2HD2 LEU 144 -0.833 1.399 -5.804 1081 H LEU 145 H LEU 145 -4.902 -2.047 -4.510 1082 HA LEU 145 HA LEU 145 -5.397 -4.913 -4.567 1083 HG LEU 145 HG LEU 145 -5.989 -3.023 -2.335 1084 HB2 LEU 145 1HB LEU 145 -7.263 -2.534 -4.474 1085 HB3 LEU 145 2HB LEU 145 -7.792 -4.205 -4.445 1086 HD11 LEU 145 1HD1 LEU 145 -8.988 -3.346 -2.286 1087 HD12 LEU 145 2HD1 LEU 145 -8.120 -1.814 -2.378 1088 HD13 LEU 145 3HD1 LEU 145 -7.975 -2.824 -0.939 1089 HD21 LEU 145 3HD2 LEU 145 -5.947 -5.462 -2.538 1090 HD22 LEU 145 1HD2 LEU 145 -7.705 -5.506 -2.394 1091 HD23 LEU 145 2HD2 LEU 145 -6.721 -4.955 -1.037 1092 HA PRO 146 HA PRO 146 -6.074 -5.229 -8.948 1093 HB2 PRO 146 1HB PRO 146 -8.405 -6.947 -8.338 1094 HB3 PRO 146 2HB PRO 146 -6.945 -7.319 -9.260 1095 HG2 PRO 146 1HG PRO 146 -7.339 -8.337 -6.817 1096 HG3 PRO 146 2HG PRO 146 -5.725 -7.851 -7.366 1097 HD2 PRO 146 1HD PRO 146 -7.618 -6.420 -5.540 1098 HD3 PRO 146 2HD PRO 146 -5.853 -6.592 -5.426 1099 H ASP 147 H ASP 147 -7.606 -4.730 -10.607 1100 HA ASP 147 HA ASP 147 -8.871 -2.321 -10.226 1101 HB2 ASP 147 1HB ASP 147 -9.416 -4.350 -12.391 1102 HB3 ASP 147 2HB ASP 147 -9.852 -2.646 -12.460 1103 H GLY 148 H GLY 148 -10.359 -5.520 -10.187 1104 HA2 GLY 148 1HA GLY 148 -12.450 -4.953 -8.525 1105 HA3 GLY 148 2HA GLY 148 -13.026 -4.459 -10.109 1106 H ASP 149 H ASP 149 -11.024 -6.819 -10.882 1107 HA ASP 149 HA ASP 149 -11.132 -9.032 -11.393 1108 HB2 ASP 149 1HB ASP 149 -13.291 -9.432 -9.330 1109 HB3 ASP 149 2HB ASP 149 -12.080 -10.578 -9.883 1110 H SER 150 H SER 150 -12.958 -7.022 -12.576 1111 HA SER 150 HA SER 150 -15.551 -8.143 -12.828 1112 HG SER 150 HG SER 150 -13.346 -5.612 -14.627 1113 HB2 SER 150 1HB SER 150 -15.330 -6.397 -14.929 1114 HB3 SER 150 2HB SER 150 -15.785 -5.955 -13.282 1115 H LEU 151 H LEU 151 -12.609 -8.822 -14.443 1116 HA LEU 151 HA LEU 151 -13.843 -9.947 -16.795 1117 HG LEU 151 HG LEU 151 -11.530 -7.955 -16.633 1118 HB2 LEU 151 1HB LEU 151 -11.050 -10.168 -15.681 1119 HB3 LEU 151 2HB LEU 151 -11.562 -10.925 -17.178 1120 HD11 LEU 151 1HD1 LEU 151 -9.711 -7.915 -18.256 1121 HD12 LEU 151 2HD1 LEU 151 -9.774 -9.673 -18.379 1122 HD13 LEU 151 3HD1 LEU 151 -9.298 -8.910 -16.862 1123 HD21 LEU 151 3HD2 LEU 151 -12.179 -9.486 -19.150 1124 HD22 LEU 151 1HD2 LEU 151 -12.066 -7.732 -19.005 1125 HD23 LEU 151 2HD2 LEU 151 -13.335 -8.609 -18.148 1126 H GLU 152 H GLU 152 -13.446 -10.871 -13.603 1127 HA GLU 152 HA GLU 152 -13.819 -13.716 -14.252 1128 HB2 GLU 152 1HB GLU 152 -12.720 -12.388 -11.767 1129 HB3 GLU 152 2HB GLU 152 -13.112 -14.098 -11.863 1130 HG2 GLU 152 1HG GLU 152 -11.096 -12.689 -13.597 1131 HG3 GLU 152 2HG GLU 152 -10.718 -13.641 -12.161 1132 H HIS 153 H HIS 153 -15.173 -14.846 -12.531 1133 HA HIS 153 HA HIS 153 -17.397 -13.090 -11.741 1134 HD1 HIS 153 HD1 HIS 153 -17.272 -15.833 -14.972 1135 HD2 HIS 153 HD2 HIS 153 -19.945 -13.132 -13.285 1136 HE1 HIS 153 HE1 HIS 153 -18.490 -14.784 -16.906 1137 HE2 HIS 153 HE2 HIS 153 -19.926 -12.991 -15.868 1138 HB2 HIS 153 1HB HIS 153 -17.375 -16.016 -12.485 1139 HB3 HIS 153 2HB HIS 153 -18.739 -15.246 -11.682 1140 H HIS 154 H HIS 154 -17.239 -12.579 -9.689 1141 HA HIS 154 HA HIS 154 -15.775 -13.926 -7.722 1142 HD1 HIS 154 HD1 HIS 154 -16.993 -10.409 -9.128 1143 HD2 HIS 154 HD2 HIS 154 -14.762 -11.342 -5.741 1144 HE1 HIS 154 HE1 HIS 154 -15.191 -8.665 -8.999 1145 HE2 HIS 154 HE2 HIS 154 -13.704 -9.414 -7.106 1146 HB2 HIS 154 1HB HIS 154 -18.153 -12.071 -7.455 1147 HB3 HIS 154 2HB HIS 154 -17.193 -12.629 -6.090 1148 H HIS 155 H HIS 155 -19.204 -14.056 -8.549 1149 HA HIS 155 HA HIS 155 -19.288 -16.734 -7.317 1150 HD1 HIS 155 HD1 HIS 155 -21.898 -17.174 -5.024 1151 HD2 HIS 155 HD2 HIS 155 -19.931 -13.521 -5.347 1152 HE1 HIS 155 HE1 HIS 155 -21.447 -16.434 -2.664 1153 HE2 HIS 155 HE2 HIS 155 -20.270 -14.215 -2.872 1154 HB2 HIS 155 1HB HIS 155 -21.445 -14.641 -7.592 1155 HB3 HIS 155 2HB HIS 155 -21.837 -16.340 -7.364 1156 H HIS 156 H HIS 156 -20.522 -18.328 -8.542 1157 HA HIS 156 HA HIS 156 -20.083 -18.021 -11.371 1158 HD1 HIS 156 HD1 HIS 156 -19.509 -22.055 -11.984 1159 HD2 HIS 156 HD2 HIS 156 -18.018 -19.036 -9.544 1160 HE1 HIS 156 HE1 HIS 156 -17.021 -22.401 -11.921 1161 HE2 HIS 156 HE2 HIS 156 -16.126 -20.444 -10.606 1162 HB2 HIS 156 1HB HIS 156 -21.058 -20.253 -9.628 1163 HB3 HIS 156 2HB HIS 156 -21.258 -20.353 -11.376 1164 H HIS 157 H HIS 157 -21.766 -16.120 -10.526 1165 HA HIS 157 HA HIS 157 -24.119 -16.619 -12.168 1166 HD1 HIS 157 HD1 HIS 157 -26.776 -17.802 -10.739 1167 HD2 HIS 157 HD2 HIS 157 -23.624 -17.715 -8.032 1168 HE1 HIS 157 HE1 HIS 157 -26.968 -19.925 -9.406 1169 HE2 HIS 157 HE2 HIS 157 -24.912 -19.952 -7.943 1170 HB2 HIS 157 1HB HIS 157 -24.294 -15.366 -9.406 1171 HB3 HIS 157 2HB HIS 157 -25.619 -15.513 -10.551 1172 H HIS 158 H HIS 158 -22.141 -14.417 -10.266 1173 HA HIS 158 HA HIS 158 -21.980 -12.553 -12.456 1174 HD1 HIS 158 HD1 HIS 158 -23.865 -10.095 -13.058 1175 HD2 HIS 158 HD2 HIS 158 -21.399 -9.335 -9.793 1176 HE1 HIS 158 HE1 HIS 158 -23.072 -7.724 -13.340 1177 HE2 HIS 158 HE2 HIS 158 -21.790 -7.215 -11.232 1178 HB2 HIS 158 1HB HIS 158 -24.027 -11.852 -11.193 1179 HB3 HIS 158 2HB HIS 158 -23.022 -11.631 -9.765 Start of MODEL 8 1 HA MET 1 HA MET 1 34.929 8.151 -1.475 2 H1 MET 1 1H MET 1 37.235 8.519 -2.111 3 H2 MET 1 2H MET 1 36.922 7.866 -3.646 4 H3 MET 1 3H MET 1 36.791 6.890 -2.265 5 HB2 MET 1 1HB MET 1 35.345 9.728 -4.027 6 HB3 MET 1 2HB MET 1 33.921 9.855 -3.004 7 HG2 MET 1 1HG MET 1 35.300 10.654 -1.165 8 HG3 MET 1 2HG MET 1 36.740 10.500 -2.168 9 HE1 MET 1 3HE MET 1 37.319 12.049 -4.198 10 HE2 MET 1 1HE MET 1 36.215 13.250 -4.872 11 HE3 MET 1 2HE MET 1 35.831 11.533 -4.991 12 H LYS 2 H LYS 2 32.798 7.516 -2.093 13 HA LYS 2 HA LYS 2 32.810 5.597 -4.320 14 HB2 LYS 2 1HB LYS 2 32.259 4.673 -2.093 15 HB3 LYS 2 2HB LYS 2 30.895 5.778 -1.984 16 HG2 LYS 2 1HG LYS 2 29.707 4.662 -3.658 17 HG3 LYS 2 2HG LYS 2 31.143 3.820 -4.238 18 HD2 LYS 2 1HD LYS 2 29.685 2.296 -3.024 19 HD3 LYS 2 2HD LYS 2 31.208 2.510 -2.166 20 HE2 LYS 2 1HE LYS 2 28.951 4.286 -1.423 21 HE3 LYS 2 2HE LYS 2 28.848 2.596 -0.940 22 HZ1 LYS 2 3HZ LYS 2 31.054 2.863 0.114 23 HZ2 LYS 2 1HZ LYS 2 29.858 3.842 0.809 24 HZ3 LYS 2 2HZ LYS 2 31.005 4.516 -0.238 25 H LEU 3 H LEU 3 31.516 5.870 -6.034 26 HA LEU 3 HA LEU 3 30.412 8.478 -6.425 27 HG LEU 3 HG LEU 3 32.639 6.759 -7.824 28 HB2 LEU 3 1HB LEU 3 30.307 6.042 -8.206 29 HB3 LEU 3 2HB LEU 3 29.894 7.677 -8.685 30 HD11 LEU 3 1HD1 LEU 3 31.980 5.834 -9.985 31 HD12 LEU 3 2HD1 LEU 3 33.245 7.049 -10.165 32 HD13 LEU 3 3HD1 LEU 3 31.573 7.452 -10.556 33 HD21 LEU 3 3HD2 LEU 3 31.689 9.405 -8.919 34 HD22 LEU 3 1HD2 LEU 3 33.368 8.961 -8.609 35 HD23 LEU 3 2HD2 LEU 3 32.229 9.095 -7.269 36 H HIS 4 H HIS 4 28.227 8.669 -7.549 37 HA HIS 4 HA HIS 4 26.233 7.429 -5.841 38 HD1 HIS 4 HD1 HIS 4 26.241 11.895 -7.009 39 HD2 HIS 4 HD2 HIS 4 25.773 9.011 -4.048 40 HE1 HIS 4 HE1 HIS 4 26.539 13.107 -4.821 41 HE2 HIS 4 HE2 HIS 4 26.001 11.382 -3.055 42 HB2 HIS 4 1HB HIS 4 26.053 9.593 -7.941 43 HB3 HIS 4 2HB HIS 4 24.650 8.953 -7.093 44 H THR 5 H THR 5 25.735 5.412 -6.424 45 HA THR 5 HA THR 5 25.203 4.897 -9.266 46 HB THR 5 HB THR 5 25.463 2.467 -8.613 47 HG1 THR 5 HG1 THR 5 25.290 2.484 -6.414 48 HG21 THR 5 3HG2 THR 5 27.249 3.751 -9.736 49 HG22 THR 5 1HG2 THR 5 27.896 2.536 -8.634 50 HG23 THR 5 2HG2 THR 5 27.871 4.233 -8.158 51 H ASP 6 H ASP 6 23.074 5.275 -9.562 52 HA ASP 6 HA ASP 6 21.095 4.568 -7.613 53 HB2 ASP 6 1HB ASP 6 19.471 5.177 -9.444 54 HB3 ASP 6 2HB ASP 6 20.599 6.451 -8.999 55 HA PRO 7 HA PRO 7 21.137 0.347 -8.869 56 HB2 PRO 7 1HB PRO 7 19.187 -0.234 -6.842 57 HB3 PRO 7 2HB PRO 7 20.926 -0.526 -6.804 58 HG2 PRO 7 1HG PRO 7 19.608 1.301 -5.215 59 HG3 PRO 7 2HG PRO 7 21.334 1.371 -5.611 60 HD2 PRO 7 1HD PRO 7 19.051 2.895 -6.794 61 HD3 PRO 7 2HD PRO 7 20.708 3.433 -6.445 62 H ALA 8 H ALA 8 20.015 0.838 -10.890 63 HA ALA 8 HA ALA 8 17.211 0.795 -11.136 64 HB1 ALA 8 3HB ALA 8 19.279 -0.159 -13.119 65 HB2 ALA 8 1HB ALA 8 18.702 1.500 -12.949 66 HB3 ALA 8 2HB ALA 8 17.596 0.232 -13.478 67 H THR 9 H THR 9 19.492 -1.645 -10.431 68 HA THR 9 HA THR 9 17.969 -3.912 -11.251 69 HB THR 9 HB THR 9 19.646 -5.035 -9.574 70 HG1 THR 9 HG1 THR 9 20.676 -3.491 -8.503 71 HG21 THR 9 3HG2 THR 9 19.795 -5.204 -12.016 72 HG22 THR 9 1HG2 THR 9 21.391 -5.001 -11.294 73 HG23 THR 9 2HG2 THR 9 20.597 -3.634 -12.079 74 H ALA 10 H ALA 10 17.556 -1.726 -8.743 75 HA ALA 10 HA ALA 10 16.076 -3.718 -7.150 76 HB1 ALA 10 3HB ALA 10 16.664 -2.502 -5.131 77 HB2 ALA 10 1HB ALA 10 17.581 -1.333 -6.079 78 HB3 ALA 10 2HB ALA 10 18.119 -3.009 -5.987 79 H LEU 11 H LEU 11 15.458 -1.555 -9.301 80 HA LEU 11 HA LEU 11 13.664 0.187 -7.834 81 HG LEU 11 HG LEU 11 16.079 0.982 -9.659 82 HB2 LEU 11 1HB LEU 11 14.198 -0.084 -10.791 83 HB3 LEU 11 2HB LEU 11 13.092 1.081 -10.091 84 HD11 LEU 11 1HD1 LEU 11 16.077 3.094 -10.878 85 HD12 LEU 11 2HD1 LEU 11 14.336 2.956 -11.125 86 HD13 LEU 11 3HD1 LEU 11 15.428 1.785 -11.865 87 HD21 LEU 11 3HD2 LEU 11 15.767 3.086 -8.435 88 HD22 LEU 11 1HD2 LEU 11 14.940 1.742 -7.645 89 HD23 LEU 11 2HD2 LEU 11 14.019 2.911 -8.590 90 H ASN 12 H ASN 12 12.143 -1.185 -6.969 91 HA ASN 12 HA ASN 12 10.648 -3.008 -8.606 92 HB2 ASN 12 1HB ASN 12 10.247 -2.040 -5.768 93 HB3 ASN 12 2HB ASN 12 9.195 -3.218 -6.548 94 HD21 ASN 12 2HD2 ASN 12 10.925 -3.473 -4.193 95 HD22 ASN 12 1HD2 ASN 12 11.984 -4.793 -4.539 96 H THR 13 H THR 13 9.816 -1.728 -10.255 97 HA THR 13 HA THR 13 7.779 0.244 -9.447 98 HB THR 13 HB THR 13 9.236 0.155 -12.097 99 HG1 THR 13 HG1 THR 13 10.290 0.765 -9.798 100 HG21 THR 13 3HG2 THR 13 7.087 1.345 -12.098 101 HG22 THR 13 1HG2 THR 13 8.437 2.458 -12.313 102 HG23 THR 13 2HG2 THR 13 7.637 2.337 -10.747 103 H VAL 14 H VAL 14 5.729 0.027 -10.256 104 HA VAL 14 HA VAL 14 4.837 -2.341 -11.468 105 HB VAL 14 HB VAL 14 3.510 0.375 -11.609 106 HG11 VAL 14 1HG1 VAL 14 1.439 -0.889 -11.894 107 HG12 VAL 14 2HG1 VAL 14 2.349 -2.399 -11.866 108 HG13 VAL 14 3HG1 VAL 14 2.588 -1.251 -13.182 109 HG21 VAL 14 3HG2 VAL 14 3.221 -1.798 -9.533 110 HG22 VAL 14 1HG2 VAL 14 2.254 -0.326 -9.621 111 HG23 VAL 14 2HG2 VAL 14 3.984 -0.226 -9.296 112 H THR 15 H THR 15 5.293 -3.037 -13.453 113 HA THR 15 HA THR 15 6.662 -1.308 -15.267 114 HB THR 15 HB THR 15 5.757 -4.112 -15.895 115 HG1 THR 15 HG1 THR 15 7.551 -3.209 -13.970 116 HG21 THR 15 3HG2 THR 15 8.195 -2.494 -16.656 117 HG22 THR 15 1HG2 THR 15 6.812 -2.829 -17.700 118 HG23 THR 15 2HG2 THR 15 7.858 -4.149 -17.170 119 H ALA 16 H ALA 16 3.623 -3.181 -15.498 120 HA ALA 16 HA ALA 16 2.640 -1.173 -17.394 121 HB1 ALA 16 3HB ALA 16 1.824 -2.892 -18.925 122 HB2 ALA 16 1HB ALA 16 2.560 -4.142 -17.920 123 HB3 ALA 16 2HB ALA 16 3.579 -2.970 -18.755 124 H TYR 17 H TYR 17 0.344 -1.181 -17.659 125 HA TYR 17 HA TYR 17 -1.082 -2.373 -15.374 126 HD1 TYR 17 HD2 TYR 17 -1.539 -0.523 -13.380 127 HD2 TYR 17 HD1 TYR 17 -0.140 1.603 -16.789 128 HE1 TYR 17 HE2 TYR 17 -0.208 0.936 -11.916 129 HE2 TYR 17 HE1 TYR 17 1.197 3.067 -15.335 130 HH TYR 17 HH TYR 17 1.143 3.826 -12.930 131 HB2 TYR 17 1HB TYR 17 -1.862 0.037 -17.039 132 HB3 TYR 17 2HB TYR 17 -2.731 -0.579 -15.639 133 H GLY 18 H GLY 18 -2.357 -4.036 -15.883 134 HA2 GLY 18 1HA GLY 18 -3.206 -4.289 -18.693 135 HA3 GLY 18 2HA GLY 18 -2.960 -5.636 -17.591 136 H ASP 19 H ASP 19 -5.276 -5.139 -19.156 137 HA ASP 19 HA ASP 19 -7.352 -4.032 -17.566 138 HB2 ASP 19 1HB ASP 19 -7.634 -4.187 -19.956 139 HB3 ASP 19 2HB ASP 19 -7.408 -5.931 -19.919 140 H GLY 20 H GLY 20 -7.280 -4.902 -15.527 141 HA2 GLY 20 1HA GLY 20 -8.463 -6.338 -14.069 142 HA3 GLY 20 2HA GLY 20 -8.473 -7.565 -15.325 143 H TYR 21 H TYR 21 -5.407 -6.146 -14.970 144 HA TYR 21 HA TYR 21 -4.512 -7.763 -12.775 145 HD1 TYR 21 HD1 TYR 21 -5.350 -8.612 -16.802 146 HD2 TYR 21 HD2 TYR 21 -1.309 -8.468 -15.470 147 HE1 TYR 21 HE1 TYR 21 -4.601 -8.275 -19.119 148 HE2 TYR 21 HE2 TYR 21 -0.553 -8.128 -17.783 149 HH TYR 21 HH TYR 21 -1.343 -8.557 -20.058 150 HB2 TYR 21 1HB TYR 21 -3.021 -9.235 -14.000 151 HB3 TYR 21 2HB TYR 21 -4.669 -9.475 -14.559 152 H ILE 22 H ILE 22 -2.406 -7.282 -12.113 153 HA ILE 22 HA ILE 22 -1.265 -4.856 -13.300 154 HB ILE 22 HB ILE 22 -0.534 -6.257 -10.712 155 HG12 ILE 22 1HG1 ILE 22 -2.216 -3.776 -11.152 156 HG13 ILE 22 2HG1 ILE 22 -2.846 -5.359 -10.706 157 HG21 ILE 22 1HG2 ILE 22 1.288 -4.924 -11.632 158 HG22 ILE 22 2HG2 ILE 22 0.641 -4.177 -10.172 159 HG23 ILE 22 3HG2 ILE 22 0.219 -3.528 -11.757 160 HD11 ILE 22 3HD1 ILE 22 -2.713 -3.895 -8.782 161 HD12 ILE 22 1HD1 ILE 22 -0.985 -3.666 -9.055 162 HD13 ILE 22 2HD1 ILE 22 -1.605 -5.256 -8.608 163 H GLU 23 H GLU 23 0.784 -4.841 -14.225 164 HA GLU 23 HA GLU 23 2.100 -7.471 -14.413 165 HB2 GLU 23 1HB GLU 23 1.006 -6.612 -16.529 166 HB3 GLU 23 2HB GLU 23 2.176 -5.303 -16.517 167 HG2 GLU 23 1HG GLU 23 3.155 -8.112 -16.412 168 HG3 GLU 23 2HG GLU 23 2.561 -7.466 -17.939 169 H VAL 24 H VAL 24 3.889 -7.492 -13.276 170 HA VAL 24 HA VAL 24 5.696 -5.175 -13.460 171 HB VAL 24 HB VAL 24 5.357 -6.882 -10.988 172 HG11 VAL 24 1HG1 VAL 24 6.773 -5.180 -9.920 173 HG12 VAL 24 2HG1 VAL 24 6.964 -4.380 -11.480 174 HG13 VAL 24 3HG1 VAL 24 7.600 -6.007 -11.239 175 HG21 VAL 24 3HG2 VAL 24 3.380 -5.519 -11.262 176 HG22 VAL 24 1HG2 VAL 24 4.372 -4.084 -11.519 177 HG23 VAL 24 2HG2 VAL 24 4.364 -4.880 -9.945 178 H ASN 25 H ASN 25 7.385 -5.833 -14.614 179 HA ASN 25 HA ASN 25 9.131 -7.062 -15.405 180 HB2 ASN 25 1HB ASN 25 9.735 -7.045 -12.967 181 HB3 ASN 25 2HB ASN 25 8.923 -8.597 -12.800 182 HD21 ASN 25 2HD2 ASN 25 10.815 -9.613 -12.150 183 HD22 ASN 25 1HD2 ASN 25 12.101 -9.975 -13.253 184 H GLN 26 H GLN 26 6.529 -7.787 -16.156 185 HA GLN 26 HA GLN 26 5.501 -9.336 -17.447 186 HB2 GLN 26 1HB GLN 26 8.020 -10.974 -17.118 187 HB3 GLN 26 2HB GLN 26 6.721 -11.315 -18.249 188 HG2 GLN 26 1HG GLN 26 7.168 -9.167 -19.366 189 HG3 GLN 26 2HG GLN 26 8.521 -8.907 -18.266 190 HE21 GLN 26 2HE2 GLN 26 8.555 -9.124 -21.149 191 HE22 GLN 26 1HE2 GLN 26 9.592 -10.457 -21.537 192 H VAL 27 H VAL 27 5.704 -9.441 -14.377 193 HA VAL 27 HA VAL 27 4.671 -12.165 -14.027 194 HB VAL 27 HB VAL 27 5.293 -10.130 -11.876 195 HG11 VAL 27 1HG1 VAL 27 3.635 -11.804 -11.225 196 HG12 VAL 27 2HG1 VAL 27 5.150 -12.037 -10.355 197 HG13 VAL 27 3HG1 VAL 27 4.740 -13.092 -11.707 198 HG21 VAL 27 3HG2 VAL 27 6.948 -12.473 -12.819 199 HG22 VAL 27 1HG2 VAL 27 7.310 -11.444 -11.433 200 HG23 VAL 27 2HG2 VAL 27 7.330 -10.767 -13.062 201 H ARG 28 H ARG 28 2.577 -12.349 -14.336 202 HA ARG 28 HA ARG 28 0.775 -10.148 -14.219 203 HE ARG 28 HE ARG 28 -3.947 -12.986 -14.250 204 HB2 ARG 28 1HB ARG 28 0.326 -11.927 -15.773 205 HB3 ARG 28 2HB ARG 28 0.322 -13.120 -14.483 206 HG2 ARG 28 1HG ARG 28 -1.683 -12.067 -13.536 207 HG3 ARG 28 2HG ARG 28 -1.690 -10.918 -14.873 208 HD2 ARG 28 1HD ARG 28 -2.013 -12.709 -16.461 209 HD3 ARG 28 2HD ARG 28 -1.875 -13.910 -15.177 210 HH11 ARG 28 1HH1 ARG 28 -3.170 -12.274 -17.593 211 HH12 ARG 28 2HH1 ARG 28 -4.828 -11.988 -18.047 212 HH21 ARG 28 1HH2 ARG 28 -6.118 -12.637 -14.842 213 HH22 ARG 28 2HH2 ARG 28 -6.502 -12.170 -16.469 214 H PHE 29 H PHE 29 0.253 -9.240 -12.351 215 HA PHE 29 HA PHE 29 -0.327 -10.972 -10.055 216 HD1 PHE 29 HD2 PHE 29 1.099 -10.851 -8.029 217 HD2 PHE 29 HD1 PHE 29 2.432 -7.684 -10.538 218 HE1 PHE 29 HE2 PHE 29 3.427 -11.348 -7.412 219 HE2 PHE 29 HE1 PHE 29 4.763 -8.177 -9.924 220 HZ PHE 29 HZ PHE 29 5.263 -10.010 -8.358 221 HB2 PHE 29 1HB PHE 29 0.177 -7.999 -10.245 222 HB3 PHE 29 2HB PHE 29 -0.374 -8.793 -8.774 223 H SER 30 H SER 30 -2.339 -11.722 -10.463 224 HA SER 30 HA SER 30 -4.508 -9.777 -10.821 225 HG SER 30 HG SER 30 -4.524 -10.855 -12.946 226 HB2 SER 30 1HB SER 30 -4.557 -12.811 -10.892 227 HB3 SER 30 2HB SER 30 -5.919 -11.751 -11.256 228 H HIS 31 H HIS 31 -2.948 -10.027 -8.396 229 HA HIS 31 HA HIS 31 -5.113 -10.415 -6.508 230 HD1 HIS 31 HD1 HIS 31 -1.906 -12.898 -8.104 231 HD2 HIS 31 HD2 HIS 31 -1.174 -11.336 -4.316 232 HE1 HIS 31 HE1 HIS 31 0.577 -13.061 -7.773 233 HE2 HIS 31 HE2 HIS 31 0.967 -12.291 -5.408 234 HB2 HIS 31 1HB HIS 31 -3.810 -11.867 -5.026 235 HB3 HIS 31 2HB HIS 31 -4.035 -12.635 -6.592 236 H ALA 32 H ALA 32 -4.622 -9.449 -4.422 237 HA ALA 32 HA ALA 32 -3.419 -6.936 -4.680 238 HB1 ALA 32 3HB ALA 32 -4.092 -8.432 -2.153 239 HB2 ALA 32 1HB ALA 32 -5.194 -7.406 -3.073 240 HB3 ALA 32 2HB ALA 32 -3.783 -6.701 -2.282 241 H ILE 33 H ILE 33 -1.464 -6.118 -4.140 242 HA ILE 33 HA ILE 33 0.543 -7.922 -2.988 243 HB ILE 33 HB ILE 33 2.211 -7.091 -4.677 244 HG12 ILE 33 1HG1 ILE 33 -0.278 -6.265 -6.190 245 HG13 ILE 33 2HG1 ILE 33 0.884 -5.157 -5.471 246 HG21 ILE 33 1HG2 ILE 33 1.321 -9.339 -4.788 247 HG22 ILE 33 2HG2 ILE 33 1.537 -8.688 -6.413 248 HG23 ILE 33 3HG2 ILE 33 -0.075 -8.764 -5.701 249 HD11 ILE 33 3HD1 ILE 33 1.228 -5.365 -7.860 250 HD12 ILE 33 1HD1 ILE 33 1.443 -7.108 -7.691 251 HD13 ILE 33 2HD1 ILE 33 2.612 -6.002 -6.972 252 H ALA 34 H ALA 34 2.259 -6.910 -1.963 253 HA ALA 34 HA ALA 34 2.225 -3.974 -1.827 254 HB1 ALA 34 3HB ALA 34 2.456 -5.808 0.561 255 HB2 ALA 34 1HB ALA 34 1.049 -4.826 0.154 256 HB3 ALA 34 2HB ALA 34 2.572 -4.049 0.588 257 H PHE 35 H PHE 35 4.220 -3.148 -2.173 258 HA PHE 35 HA PHE 35 6.558 -4.706 -1.441 259 HD1 PHE 35 HD1 PHE 35 4.034 -4.908 -4.645 260 HD2 PHE 35 HD2 PHE 35 7.534 -2.519 -5.027 261 HE1 PHE 35 HE1 PHE 35 2.997 -3.698 -6.518 262 HE2 PHE 35 HE2 PHE 35 6.500 -1.300 -6.899 263 HZ PHE 35 HZ PHE 35 4.231 -1.889 -7.646 264 HB2 PHE 35 1HB PHE 35 7.561 -4.506 -3.715 265 HB3 PHE 35 2HB PHE 35 6.173 -5.581 -3.641 266 H ALA 36 H ALA 36 8.557 -3.547 -1.621 267 HA ALA 36 HA ALA 36 8.261 -0.622 -1.670 268 HB1 ALA 36 3HB ALA 36 9.658 -0.437 0.322 269 HB2 ALA 36 1HB ALA 36 9.753 -2.195 0.433 270 HB3 ALA 36 2HB ALA 36 8.208 -1.380 0.667 271 HA PRO 37 HA PRO 37 11.908 -0.647 -4.176 272 HB2 PRO 37 1HB PRO 37 13.228 1.577 -3.279 273 HB3 PRO 37 2HB PRO 37 11.828 1.631 -4.353 274 HG2 PRO 37 1HG PRO 37 11.962 2.030 -1.392 275 HG3 PRO 37 2HG PRO 37 11.024 2.924 -2.603 276 HD2 PRO 37 1HD PRO 37 9.911 1.042 -1.028 277 HD3 PRO 37 2HD PRO 37 9.378 1.308 -2.701 278 H GLU 38 H GLU 38 12.249 -0.545 -0.715 279 HA GLU 38 HA GLU 38 14.932 -1.738 -0.971 280 HB2 GLU 38 1HB GLU 38 14.740 0.510 0.233 281 HB3 GLU 38 2HB GLU 38 13.856 -0.344 1.488 282 HG2 GLU 38 1HG GLU 38 15.799 -1.781 1.872 283 HG3 GLU 38 2HG GLU 38 16.683 -0.909 0.621 284 H GLY 39 H GLY 39 12.196 -2.929 -1.077 285 HA2 GLY 39 1HA GLY 39 12.623 -4.957 0.994 286 HA3 GLY 39 2HA GLY 39 11.053 -4.170 0.913 287 HA PRO 40 HA PRO 40 11.015 -7.685 -2.114 288 HB2 PRO 40 1HB PRO 40 9.694 -9.557 -0.762 289 HB3 PRO 40 2HB PRO 40 11.413 -9.276 -0.457 290 HG2 PRO 40 1HG PRO 40 9.041 -8.444 1.148 291 HG3 PRO 40 2HG PRO 40 10.636 -8.982 1.698 292 HD2 PRO 40 1HD PRO 40 9.768 -6.319 1.471 293 HD3 PRO 40 2HD PRO 40 11.445 -6.859 1.679 294 H VAL 41 H VAL 41 8.872 -9.078 -2.645 295 HA VAL 41 HA VAL 41 6.609 -7.193 -2.634 296 HB VAL 41 HB VAL 41 7.098 -9.464 -4.576 297 HG11 VAL 41 1HG1 VAL 41 5.321 -8.416 -5.890 298 HG12 VAL 41 2HG1 VAL 41 5.104 -7.201 -4.630 299 HG13 VAL 41 3HG1 VAL 41 4.747 -8.895 -4.294 300 HG21 VAL 41 3HG2 VAL 41 7.561 -6.507 -4.955 301 HG22 VAL 41 1HG2 VAL 41 7.669 -7.733 -6.218 302 HG23 VAL 41 2HG2 VAL 41 8.803 -7.754 -4.868 303 H ALA 42 H ALA 42 5.076 -7.759 -1.227 304 HA ALA 42 HA ALA 42 4.833 -10.592 -0.484 305 HB1 ALA 42 3HB ALA 42 3.840 -8.141 0.967 306 HB2 ALA 42 1HB ALA 42 5.313 -9.037 1.344 307 HB3 ALA 42 2HB ALA 42 3.738 -9.805 1.545 308 H SER 43 H SER 43 2.788 -11.567 -0.324 309 HA SER 43 HA SER 43 0.799 -10.480 -2.143 310 HG SER 43 HG SER 43 0.748 -13.993 -0.275 311 HB2 SER 43 1HB SER 43 -0.278 -12.787 -1.640 312 HB3 SER 43 2HB SER 43 1.206 -12.749 -2.592 313 H TRP 44 H TRP 44 -1.020 -9.523 -1.481 314 HA TRP 44 HA TRP 44 -1.491 -9.414 1.413 315 HD1 TRP 44 HD1 TRP 44 -1.137 -8.130 2.902 316 HE1 TRP 44 HE1 TRP 44 -1.834 -6.266 4.540 317 HE3 TRP 44 HE3 TRP 44 -3.760 -5.154 -0.325 318 HZ2 TRP 44 HZ2 TRP 44 -3.301 -3.859 4.467 319 HZ3 TRP 44 HZ3 TRP 44 -4.777 -3.087 0.541 320 HH2 TRP 44 HH2 TRP 44 -4.553 -2.455 2.887 321 HB2 TRP 44 1HB TRP 44 -1.191 -7.370 -0.323 322 HB3 TRP 44 2HB TRP 44 -2.934 -7.582 -0.426 323 HA PRO 45 HA PRO 45 -4.971 -12.061 0.538 324 HB2 PRO 45 1HB PRO 45 -5.531 -12.070 3.373 325 HB3 PRO 45 2HB PRO 45 -4.829 -13.351 2.385 326 HG2 PRO 45 1HG PRO 45 -3.443 -11.986 4.306 327 HG3 PRO 45 2HG PRO 45 -2.685 -12.741 2.893 328 HD2 PRO 45 1HD PRO 45 -3.407 -9.870 3.351 329 HD3 PRO 45 2HD PRO 45 -1.952 -10.562 2.600 330 H VAL 46 H VAL 46 -5.250 -8.994 0.773 331 HA VAL 46 HA VAL 46 -7.893 -8.780 1.987 332 HB VAL 46 HB VAL 46 -6.137 -6.647 0.751 333 HG11 VAL 46 1HG1 VAL 46 -8.487 -6.040 0.601 334 HG12 VAL 46 2HG1 VAL 46 -7.667 -5.049 1.808 335 HG13 VAL 46 3HG1 VAL 46 -8.701 -6.384 2.317 336 HG21 VAL 46 3HG2 VAL 46 -6.706 -7.308 3.638 337 HG22 VAL 46 1HG2 VAL 46 -5.755 -5.938 3.063 338 HG23 VAL 46 2HG2 VAL 46 -5.186 -7.584 2.786 339 H GLN 47 H GLN 47 -9.741 -8.640 0.866 340 HA GLN 47 HA GLN 47 -9.557 -8.828 -2.065 341 HB2 GLN 47 1HB GLN 47 -11.605 -9.792 -0.083 342 HB3 GLN 47 2HB GLN 47 -11.960 -9.687 -1.801 343 HG2 GLN 47 1HG GLN 47 -10.203 -11.259 -2.301 344 HG3 GLN 47 2HG GLN 47 -9.720 -11.300 -0.605 345 HE21 GLN 47 2HE2 GLN 47 -10.695 -13.399 -2.460 346 HE22 GLN 47 1HE2 GLN 47 -12.041 -14.123 -1.645 347 H ARG 48 H ARG 48 -11.533 -7.410 0.511 348 HA ARG 48 HA ARG 48 -12.382 -5.338 -1.398 349 HE ARG 48 HE ARG 48 -15.544 -7.185 3.661 350 HB2 ARG 48 1HB ARG 48 -14.453 -5.133 -0.050 351 HB3 ARG 48 2HB ARG 48 -14.271 -6.727 -0.771 352 HG2 ARG 48 1HG ARG 48 -13.340 -7.507 1.414 353 HG3 ARG 48 2HG ARG 48 -13.800 -5.944 2.088 354 HD2 ARG 48 1HD ARG 48 -16.131 -6.371 1.482 355 HD3 ARG 48 2HD ARG 48 -15.668 -7.937 0.811 356 HH11 ARG 48 1HH1 ARG 48 -15.687 -9.622 1.143 357 HH12 ARG 48 2HH1 ARG 48 -15.746 -10.955 2.257 358 HH21 ARG 48 1HH2 ARG 48 -15.651 -8.925 5.120 359 HH22 ARG 48 2HH2 ARG 48 -15.741 -10.557 4.524 360 HA PRO 49 HA PRO 49 -10.229 -2.496 1.129 361 HB2 PRO 49 1HB PRO 49 -11.525 -0.204 0.438 362 HB3 PRO 49 2HB PRO 49 -10.370 -1.023 -0.620 363 HG2 PRO 49 1HG PRO 49 -13.363 -1.128 -0.638 364 HG3 PRO 49 2HG PRO 49 -12.238 -0.982 -2.002 365 HD2 PRO 49 1HD PRO 49 -13.386 -3.329 -1.338 366 HD3 PRO 49 2HD PRO 49 -11.742 -3.236 -1.999 367 H ALA 50 H ALA 50 -13.568 -3.115 1.549 368 HA ALA 50 HA ALA 50 -13.982 -1.344 3.769 369 HB1 ALA 50 3HB ALA 50 -15.844 -2.099 2.367 370 HB2 ALA 50 1HB ALA 50 -16.094 -2.520 4.061 371 HB3 ALA 50 2HB ALA 50 -15.581 -3.755 2.912 372 H ASP 51 H ASP 51 -12.396 -4.309 3.370 373 HA ASP 51 HA ASP 51 -12.528 -4.830 6.263 374 HB2 ASP 51 1HB ASP 51 -12.550 -6.747 3.957 375 HB3 ASP 51 2HB ASP 51 -11.880 -7.248 5.506 376 H ILE 52 H ILE 52 -10.751 -3.130 5.890 377 HA ILE 52 HA ILE 52 -8.204 -4.592 5.661 378 HB ILE 52 HB ILE 52 -8.628 -1.622 5.266 379 HG12 ILE 52 1HG1 ILE 52 -8.034 -3.784 3.231 380 HG13 ILE 52 2HG1 ILE 52 -9.574 -2.951 3.413 381 HG21 ILE 52 1HG2 ILE 52 -6.178 -3.348 4.910 382 HG22 ILE 52 2HG2 ILE 52 -6.439 -2.155 6.183 383 HG23 ILE 52 3HG2 ILE 52 -6.293 -1.636 4.503 384 HD11 ILE 52 3HD1 ILE 52 -8.338 -2.045 1.549 385 HD12 ILE 52 1HD1 ILE 52 -6.959 -1.706 2.594 386 HD13 ILE 52 2HD1 ILE 52 -8.476 -0.835 2.827 387 H THR 53 H THR 53 -7.848 -5.176 7.742 388 HA THR 53 HA THR 53 -8.306 -3.292 9.900 389 HB THR 53 HB THR 53 -7.038 -5.998 10.234 390 HG1 THR 53 HG1 THR 53 -9.795 -5.391 9.754 391 HG21 THR 53 3HG2 THR 53 -8.941 -4.373 11.931 392 HG22 THR 53 1HG2 THR 53 -7.206 -4.534 12.192 393 HG23 THR 53 2HG2 THR 53 -8.257 -5.940 12.366 394 H ALA 54 H ALA 54 -6.621 -2.849 11.490 395 HA ALA 54 HA ALA 54 -4.345 -1.693 10.434 396 HB1 ALA 54 3HB ALA 54 -5.318 -1.139 12.620 397 HB2 ALA 54 1HB ALA 54 -3.583 -1.438 12.720 398 HB3 ALA 54 2HB ALA 54 -4.721 -2.670 13.262 399 H SER 55 H SER 55 -4.704 -4.890 11.903 400 HA SER 55 HA SER 55 -2.011 -5.609 11.988 401 HG SER 55 HG SER 55 -4.200 -7.532 13.926 402 HB2 SER 55 1HB SER 55 -4.339 -7.475 11.504 403 HB3 SER 55 2HB SER 55 -2.796 -7.864 12.266 404 H LEU 56 H LEU 56 -4.364 -5.804 9.367 405 HA LEU 56 HA LEU 56 -2.757 -7.348 7.611 406 HG LEU 56 HG LEU 56 -5.866 -7.165 8.379 407 HB2 LEU 56 1HB LEU 56 -4.968 -5.401 6.947 408 HB3 LEU 56 2HB LEU 56 -4.302 -6.600 5.857 409 HD11 LEU 56 1HD1 LEU 56 -7.582 -7.989 6.889 410 HD12 LEU 56 2HD1 LEU 56 -6.583 -7.615 5.485 411 HD13 LEU 56 3HD1 LEU 56 -7.206 -6.312 6.495 412 HD21 LEU 56 3HD2 LEU 56 -4.147 -8.857 7.987 413 HD22 LEU 56 1HD2 LEU 56 -4.728 -9.070 6.336 414 HD23 LEU 56 2HD2 LEU 56 -5.762 -9.504 7.696 415 H LEU 57 H LEU 57 -3.132 -3.914 8.215 416 HA LEU 57 HA LEU 57 -1.534 -3.009 6.055 417 HG LEU 57 HG LEU 57 -4.166 -2.036 7.146 418 HB2 LEU 57 1HB LEU 57 -2.234 -1.723 8.693 419 HB3 LEU 57 2HB LEU 57 -1.379 -0.903 7.401 420 HD11 LEU 57 1HD1 LEU 57 -3.244 0.804 7.554 421 HD12 LEU 57 2HD1 LEU 57 -4.131 -0.183 8.717 422 HD13 LEU 57 3HD1 LEU 57 -4.898 0.300 7.204 423 HD21 LEU 57 3HD2 LEU 57 -2.970 -1.940 5.029 424 HD22 LEU 57 1HD2 LEU 57 -2.535 -0.259 5.336 425 HD23 LEU 57 2HD2 LEU 57 -4.223 -0.700 5.085 426 H GLN 58 H GLN 58 -0.820 -3.876 9.411 427 HA GLN 58 HA GLN 58 1.880 -3.102 9.452 428 HB2 GLN 58 1HB GLN 58 0.498 -5.362 10.905 429 HB3 GLN 58 2HB GLN 58 2.128 -4.807 11.259 430 HG2 GLN 58 1HG GLN 58 1.235 -2.598 11.834 431 HG3 GLN 58 2HG GLN 58 -0.396 -3.189 11.517 432 HE21 GLN 58 2HE2 GLN 58 0.800 -2.145 13.972 433 HE22 GLN 58 1HE2 GLN 58 0.600 -3.379 15.170 434 H GLN 59 H GLN 59 0.321 -6.073 8.388 435 HA GLN 59 HA GLN 59 2.661 -7.532 7.808 436 HB2 GLN 59 1HB GLN 59 -0.118 -7.703 6.639 437 HB3 GLN 59 2HB GLN 59 1.153 -8.880 6.333 438 HG2 GLN 59 1HG GLN 59 1.219 -9.492 8.653 439 HG3 GLN 59 2HG GLN 59 0.078 -8.211 9.062 440 HE21 GLN 59 2HE2 GLN 59 0.476 -11.323 7.558 441 HE22 GLN 59 1HE2 GLN 59 -1.202 -11.733 7.509 442 H ALA 60 H ALA 60 0.696 -5.322 5.888 443 HA ALA 60 HA ALA 60 2.090 -5.709 3.442 444 HB1 ALA 60 3HB ALA 60 0.420 -3.359 4.329 445 HB2 ALA 60 1HB ALA 60 -0.189 -4.817 3.542 446 HB3 ALA 60 2HB ALA 60 0.898 -3.734 2.672 447 H ALA 61 H ALA 61 2.761 -3.888 6.275 448 HA ALA 61 HA ALA 61 4.564 -2.035 5.002 449 HB1 ALA 61 3HB ALA 61 3.319 -1.377 6.998 450 HB2 ALA 61 1HB ALA 61 5.059 -1.283 7.273 451 HB3 ALA 61 2HB ALA 61 4.135 -2.636 7.927 452 H GLY 62 H GLY 62 4.749 -5.261 5.770 453 HA2 GLY 62 1HA GLY 62 6.543 -6.701 5.537 454 HA3 GLY 62 2HA GLY 62 7.588 -5.307 5.313 455 H LEU 63 H LEU 63 5.625 -5.204 8.099 456 HA LEU 63 HA LEU 63 7.917 -5.151 9.798 457 HG LEU 63 HG LEU 63 5.593 -3.188 9.173 458 HB2 LEU 63 1HB LEU 63 4.978 -5.196 10.484 459 HB3 LEU 63 2HB LEU 63 6.274 -4.839 11.610 460 HD11 LEU 63 1HD1 LEU 63 5.058 -2.687 12.098 461 HD12 LEU 63 2HD1 LEU 63 3.850 -3.051 10.865 462 HD13 LEU 63 3HD1 LEU 63 4.764 -1.545 10.786 463 HD21 LEU 63 3HD2 LEU 63 7.523 -2.687 11.438 464 HD22 LEU 63 1HD2 LEU 63 7.136 -1.557 10.140 465 HD23 LEU 63 2HD2 LEU 63 7.958 -3.074 9.772 466 H ALA 64 H ALA 64 6.345 -7.704 8.474 467 HA ALA 64 HA ALA 64 6.155 -9.429 10.763 468 HB1 ALA 64 3HB ALA 64 4.637 -9.668 8.855 469 HB2 ALA 64 1HB ALA 64 5.532 -11.154 9.170 470 HB3 ALA 64 2HB ALA 64 6.004 -10.110 7.829 471 H GLU 65 H GLU 65 8.734 -8.403 8.834 472 HA GLU 65 HA GLU 65 10.194 -10.813 8.596 473 HB2 GLU 65 1HB GLU 65 10.682 -8.787 7.258 474 HB3 GLU 65 2HB GLU 65 11.285 -7.998 8.710 475 HG2 GLU 65 1HG GLU 65 13.007 -9.742 8.917 476 HG3 GLU 65 2HG GLU 65 12.428 -10.465 7.419 477 H VAL 66 H VAL 66 10.136 -8.309 11.095 478 HA VAL 66 HA VAL 66 12.332 -9.409 12.558 479 HB VAL 66 HB VAL 66 11.707 -7.847 14.348 480 HG11 VAL 66 1HG1 VAL 66 13.088 -7.033 12.533 481 HG12 VAL 66 2HG1 VAL 66 11.994 -5.760 13.077 482 HG13 VAL 66 3HG1 VAL 66 11.654 -6.638 11.585 483 HG21 VAL 66 3HG2 VAL 66 9.279 -7.991 14.161 484 HG22 VAL 66 1HG2 VAL 66 9.338 -7.178 12.597 485 HG23 VAL 66 2HG2 VAL 66 9.818 -6.316 14.058 486 H VAL 67 H VAL 67 9.127 -10.344 12.215 487 HA VAL 67 HA VAL 67 8.836 -11.488 14.865 488 HB VAL 67 HB VAL 67 7.071 -11.888 12.439 489 HG11 VAL 67 1HG1 VAL 67 6.524 -12.283 15.380 490 HG12 VAL 67 2HG1 VAL 67 6.723 -13.557 14.177 491 HG13 VAL 67 3HG1 VAL 67 5.345 -12.462 14.081 492 HG21 VAL 67 3HG2 VAL 67 7.268 -9.515 12.975 493 HG22 VAL 67 1HG2 VAL 67 6.815 -9.847 14.647 494 HG23 VAL 67 2HG2 VAL 67 5.654 -10.119 13.347 495 H ARG 68 H ARG 68 10.060 -12.369 11.793 496 HA ARG 68 HA ARG 68 9.710 -15.175 11.887 497 HE ARG 68 HE ARG 68 10.961 -15.663 7.715 498 HB2 ARG 68 1HB ARG 68 11.840 -13.541 10.490 499 HB3 ARG 68 2HB ARG 68 11.514 -15.243 10.193 500 HG2 ARG 68 1HG ARG 68 9.348 -14.742 9.309 501 HG3 ARG 68 2HG ARG 68 9.499 -13.048 9.777 502 HD2 ARG 68 1HD ARG 68 9.919 -13.255 7.419 503 HD3 ARG 68 2HD ARG 68 11.420 -12.832 8.237 504 HH11 ARG 68 1HH1 ARG 68 12.539 -12.690 6.737 505 HH12 ARG 68 2HH1 ARG 68 13.690 -13.489 5.712 506 HH21 ARG 68 1HH2 ARG 68 12.468 -16.707 6.358 507 HH22 ARG 68 2HH2 ARG 68 13.664 -15.767 5.514 508 H ASP 69 H ASP 69 12.362 -13.056 12.881 509 HA ASP 69 HA ASP 69 13.223 -15.044 14.810 510 HB2 ASP 69 1HB ASP 69 14.550 -15.680 12.883 511 HB3 ASP 69 2HB ASP 69 15.043 -14.013 12.622 512 HA PRO 70 HA PRO 70 13.424 -11.061 16.831 513 HB2 PRO 70 1HB PRO 70 13.808 -12.021 19.335 514 HB3 PRO 70 2HB PRO 70 12.232 -12.032 18.535 515 HG2 PRO 70 1HG PRO 70 14.219 -14.249 18.837 516 HG3 PRO 70 2HG PRO 70 12.457 -14.293 19.024 517 HD2 PRO 70 1HD PRO 70 13.715 -15.144 16.778 518 HD3 PRO 70 2HD PRO 70 12.094 -14.425 16.755 519 H LEU 71 H LEU 71 15.933 -13.057 16.066 520 HA LEU 71 HA LEU 71 17.955 -11.862 17.729 521 HG LEU 71 HG LEU 71 20.353 -12.160 15.779 522 HB2 LEU 71 1HB LEU 71 18.211 -14.105 16.661 523 HB3 LEU 71 2HB LEU 71 18.293 -13.313 15.100 524 HD11 LEU 71 1HD1 LEU 71 21.482 -12.778 17.855 525 HD12 LEU 71 2HD1 LEU 71 20.094 -13.762 18.322 526 HD13 LEU 71 3HD1 LEU 71 19.925 -12.013 18.174 527 HD21 LEU 71 3HD2 LEU 71 21.815 -14.117 15.811 528 HD22 LEU 71 1HD2 LEU 71 20.503 -14.315 14.651 529 HD23 LEU 71 2HD2 LEU 71 20.437 -15.145 16.205 530 H ALA 72 H ALA 72 16.332 -11.140 14.777 531 HA ALA 72 HA ALA 72 18.126 -8.932 14.155 532 HB1 ALA 72 3HB ALA 72 17.206 -10.229 12.295 533 HB2 ALA 72 1HB ALA 72 16.660 -8.554 12.228 534 HB3 ALA 72 2HB ALA 72 15.570 -9.815 12.807 535 H PHE 73 H PHE 73 17.891 -7.546 15.858 536 HA PHE 73 HA PHE 73 15.343 -6.925 16.995 537 HD1 PHE 73 HD2 PHE 73 15.634 -6.935 19.830 538 HD2 PHE 73 HD1 PHE 73 19.341 -7.581 17.846 539 HE1 PHE 73 HE2 PHE 73 16.156 -8.751 21.404 540 HE2 PHE 73 HE1 PHE 73 19.870 -9.398 19.417 541 HZ PHE 73 HZ PHE 73 18.279 -9.985 21.198 542 HB2 PHE 73 1HB PHE 73 18.057 -5.644 17.380 543 HB3 PHE 73 2HB PHE 73 16.624 -5.246 18.321 544 H LEU 74 H LEU 74 14.078 -5.174 16.713 545 HA LEU 74 HA LEU 74 14.461 -3.577 14.345 546 HG LEU 74 HG LEU 74 12.379 -1.404 14.993 547 HB2 LEU 74 1HB LEU 74 12.234 -4.418 15.111 548 HB3 LEU 74 2HB LEU 74 12.354 -3.359 16.503 549 HD11 LEU 74 1HD1 LEU 74 11.774 -1.703 12.640 550 HD12 LEU 74 2HD1 LEU 74 11.880 -3.452 12.839 551 HD13 LEU 74 3HD1 LEU 74 13.324 -2.456 13.016 552 HD21 LEU 74 3HD2 LEU 74 10.020 -1.540 14.340 553 HD22 LEU 74 1HD2 LEU 74 10.288 -2.149 15.973 554 HD23 LEU 74 2HD2 LEU 74 10.044 -3.278 14.640 555 H ASP 75 H ASP 75 14.663 -3.222 17.812 556 HA ASP 75 HA ASP 75 15.666 -0.479 17.516 557 HB2 ASP 75 1HB ASP 75 13.919 -0.818 19.220 558 HB3 ASP 75 2HB ASP 75 14.912 -2.040 20.003 559 H GLU 76 H GLU 76 17.774 -0.116 17.597 560 HA GLU 76 HA GLU 76 20.004 -0.500 17.539 561 HB2 GLU 76 1HB GLU 76 19.722 -0.727 19.983 562 HB3 GLU 76 2HB GLU 76 19.429 -2.448 19.784 563 HG2 GLU 76 1HG GLU 76 21.714 -1.899 20.542 564 HG3 GLU 76 2HG GLU 76 21.667 -2.813 19.037 565 HA PRO 77 HA PRO 77 19.433 -4.407 15.157 566 HB2 PRO 77 1HB PRO 77 19.164 -3.412 12.696 567 HB3 PRO 77 2HB PRO 77 17.808 -3.428 13.827 568 HG2 PRO 77 1HG PRO 77 19.526 -1.165 12.959 569 HG3 PRO 77 2HG PRO 77 17.816 -1.169 13.415 570 HD2 PRO 77 1HD PRO 77 20.003 -0.430 15.045 571 HD3 PRO 77 2HD PRO 77 18.325 -0.672 15.565 572 H GLU 78 H GLU 78 20.929 -5.495 13.871 573 HA GLU 78 HA GLU 78 23.555 -4.307 13.614 574 HB2 GLU 78 1HB GLU 78 22.559 -7.004 12.664 575 HB3 GLU 78 2HB GLU 78 24.240 -6.498 12.780 576 HG2 GLU 78 1HG GLU 78 24.018 -6.307 15.203 577 HG3 GLU 78 2HG GLU 78 22.333 -6.816 15.087 578 H ALA 79 H ALA 79 20.758 -4.370 11.816 579 HA ALA 79 HA ALA 79 22.200 -3.832 9.308 580 HB1 ALA 79 3HB ALA 79 20.108 -4.348 8.149 581 HB2 ALA 79 1HB ALA 79 19.323 -4.657 9.698 582 HB3 ALA 79 2HB ALA 79 20.632 -5.704 9.150 583 H GLY 80 H GLY 80 22.587 -1.684 9.378 584 HA2 GLY 80 1HA GLY 80 21.394 0.391 8.648 585 HA3 GLY 80 2HA GLY 80 20.303 0.080 9.992 586 H ALA 81 H ALA 81 21.493 2.491 9.887 587 HA ALA 81 HA ALA 81 23.894 2.379 11.552 588 HB1 ALA 81 3HB ALA 81 23.968 3.819 9.584 589 HB2 ALA 81 1HB ALA 81 24.128 4.758 11.068 590 HB3 ALA 81 2HB ALA 81 22.594 4.738 10.200 591 H GLY 82 H GLY 82 22.932 1.740 13.503 592 HA2 GLY 82 1HA GLY 82 22.276 2.241 15.646 593 HA3 GLY 82 2HA GLY 82 22.185 3.929 15.168 594 H ALA 83 H ALA 83 20.284 4.282 16.304 595 HA ALA 83 HA ALA 83 17.915 2.750 15.588 596 HB1 ALA 83 3HB ALA 83 18.270 3.385 17.933 597 HB2 ALA 83 1HB ALA 83 16.779 4.072 17.286 598 HB3 ALA 83 2HB ALA 83 18.209 5.087 17.472 599 H ARG 84 H ARG 84 16.143 3.597 14.492 600 HA ARG 84 HA ARG 84 16.803 5.973 12.874 601 HE ARG 84 HE ARG 84 14.898 1.698 11.114 602 HB2 ARG 84 1HB ARG 84 14.859 3.805 12.104 603 HB3 ARG 84 2HB ARG 84 15.604 5.010 11.067 604 HG2 ARG 84 1HG ARG 84 17.797 3.914 11.460 605 HG3 ARG 84 2HG ARG 84 16.952 2.651 12.354 606 HD2 ARG 84 1HD ARG 84 16.623 3.366 9.450 607 HD3 ARG 84 2HD ARG 84 17.311 1.886 10.113 608 HH11 ARG 84 1HH1 ARG 84 15.827 2.816 7.939 609 HH12 ARG 84 2HH1 ARG 84 14.364 2.283 7.173 610 HH21 ARG 84 1HH2 ARG 84 12.932 1.020 10.119 611 HH22 ARG 84 2HH2 ARG 84 12.712 1.282 8.418 612 HA PRO 85 HA PRO 85 13.207 7.977 14.708 613 HB2 PRO 85 1HB PRO 85 13.480 9.675 12.294 614 HB3 PRO 85 2HB PRO 85 13.435 10.142 13.996 615 HG2 PRO 85 1HG PRO 85 15.715 10.221 12.614 616 HG3 PRO 85 2HG PRO 85 15.686 9.715 14.314 617 HD2 PRO 85 1HD PRO 85 15.897 8.040 11.839 618 HD3 PRO 85 2HD PRO 85 16.730 7.860 13.398 619 H ALA 86 H ALA 86 13.540 7.285 11.252 620 HA ALA 86 HA ALA 86 10.674 6.814 11.016 621 HB1 ALA 86 3HB ALA 86 11.116 6.444 8.642 622 HB2 ALA 86 1HB ALA 86 12.850 6.578 8.930 623 HB3 ALA 86 2HB ALA 86 11.806 7.978 9.170 624 H ASN 87 H ASN 87 11.103 5.188 12.745 625 HA ASN 87 HA ASN 87 12.554 2.851 12.453 626 HB2 ASN 87 1HB ASN 87 11.441 3.645 14.536 627 HB3 ASN 87 2HB ASN 87 9.895 3.145 13.858 628 HD21 ASN 87 2HD2 ASN 87 9.434 1.624 15.361 629 HD22 ASN 87 1HD2 ASN 87 10.341 0.158 15.540 630 H ALA 88 H ALA 88 9.232 3.513 11.500 631 HA ALA 88 HA ALA 88 9.146 0.942 10.075 632 HB1 ALA 88 3HB ALA 88 6.872 2.704 10.998 633 HB2 ALA 88 1HB ALA 88 7.424 1.232 11.797 634 HB3 ALA 88 2HB ALA 88 6.710 1.147 10.187 635 HA PRO 89 HA PRO 89 8.689 2.748 5.975 636 HB2 PRO 89 1HB PRO 89 5.781 2.051 6.100 637 HB3 PRO 89 2HB PRO 89 6.943 1.787 4.793 638 HG2 PRO 89 1HG PRO 89 6.227 -0.222 6.373 639 HG3 PRO 89 2HG PRO 89 7.910 -0.044 5.846 640 HD2 PRO 89 1HD PRO 89 6.689 0.505 8.505 641 HD3 PRO 89 2HD PRO 89 8.323 -0.056 8.105 642 H GLU 90 H GLU 90 8.609 4.855 5.569 643 HA GLU 90 HA GLU 90 7.405 6.644 7.389 644 HB2 GLU 90 1HB GLU 90 8.564 7.215 4.658 645 HB3 GLU 90 2HB GLU 90 8.247 8.405 5.915 646 HG2 GLU 90 1HG GLU 90 9.872 7.278 7.366 647 HG3 GLU 90 2HG GLU 90 10.214 6.132 6.071 648 H VAL 91 H VAL 91 6.605 5.774 4.032 649 HA VAL 91 HA VAL 91 3.899 6.765 4.587 650 HB VAL 91 HB VAL 91 4.877 8.545 3.330 651 HG11 VAL 91 1HG1 VAL 91 5.698 6.484 1.295 652 HG12 VAL 91 2HG1 VAL 91 6.771 7.384 2.369 653 HG13 VAL 91 3HG1 VAL 91 5.864 8.231 1.116 654 HG21 VAL 91 3HG2 VAL 91 3.149 6.861 1.524 655 HG22 VAL 91 1HG2 VAL 91 3.467 8.584 1.322 656 HG23 VAL 91 2HG2 VAL 91 2.586 8.009 2.739 657 H LEU 92 H LEU 92 2.303 5.490 3.954 658 HA LEU 92 HA LEU 92 2.954 3.159 2.270 659 HG LEU 92 HG LEU 92 0.180 1.794 2.787 660 HB2 LEU 92 1HB LEU 92 2.490 2.531 4.592 661 HB3 LEU 92 2HB LEU 92 0.966 3.394 4.535 662 HD11 LEU 92 1HD1 LEU 92 2.358 1.105 1.942 663 HD12 LEU 92 2HD1 LEU 92 1.403 -0.284 2.463 664 HD13 LEU 92 3HD1 LEU 92 2.714 0.318 3.480 665 HD21 LEU 92 3HD2 LEU 92 -0.194 -0.062 4.333 666 HD22 LEU 92 1HD2 LEU 92 -0.426 1.494 5.127 667 HD23 LEU 92 2HD2 LEU 92 1.055 0.575 5.403 668 H LEU 93 H LEU 93 1.931 3.137 0.385 669 HA LEU 93 HA LEU 93 -0.450 4.839 0.073 670 HG LEU 93 HG LEU 93 2.458 5.627 -0.771 671 HB2 LEU 93 1HB LEU 93 1.452 3.761 -2.014 672 HB3 LEU 93 2HB LEU 93 0.040 4.747 -2.349 673 HD11 LEU 93 1HD1 LEU 93 1.527 6.354 -3.544 674 HD12 LEU 93 2HD1 LEU 93 2.939 5.378 -3.143 675 HD13 LEU 93 3HD1 LEU 93 2.888 7.082 -2.691 676 HD21 LEU 93 3HD2 LEU 93 0.422 6.712 0.014 677 HD22 LEU 93 1HD2 LEU 93 0.005 7.155 -1.642 678 HD23 LEU 93 2HD2 LEU 93 1.431 7.853 -0.874 679 H VAL 94 H VAL 94 -2.253 3.717 0.305 680 HA VAL 94 HA VAL 94 -2.375 0.938 -0.601 681 HB VAL 94 HB VAL 94 -4.439 2.569 0.899 682 HG11 VAL 94 1HG1 VAL 94 -5.517 0.415 1.346 683 HG12 VAL 94 2HG1 VAL 94 -4.317 -0.393 0.336 684 HG13 VAL 94 3HG1 VAL 94 -5.446 0.757 -0.383 685 HG21 VAL 94 3HG2 VAL 94 -2.479 0.502 1.898 686 HG22 VAL 94 1HG2 VAL 94 -3.760 1.246 2.856 687 HG23 VAL 94 2HG2 VAL 94 -2.437 2.233 2.235 688 H GLY 95 H GLY 95 -3.120 0.464 -2.532 689 HA2 GLY 95 1HA GLY 95 -4.611 2.467 -4.055 690 HA3 GLY 95 2HA GLY 95 -3.884 0.998 -4.696 691 H THR 96 H THR 96 -6.715 2.469 -3.689 692 HA THR 96 HA THR 96 -8.180 0.387 -2.539 693 HB THR 96 HB THR 96 -10.184 1.729 -3.306 694 HG1 THR 96 HG1 THR 96 -9.875 3.291 -4.713 695 HG21 THR 96 3HG2 THR 96 -9.676 3.627 -1.829 696 HG22 THR 96 1HG2 THR 96 -7.967 3.195 -1.871 697 HG23 THR 96 2HG2 THR 96 -9.136 2.099 -1.133 698 H GLY 97 H GLY 97 -8.139 1.498 -5.922 699 HA2 GLY 97 1HA GLY 97 -8.371 0.302 -7.873 700 HA3 GLY 97 2HA GLY 97 -8.286 -1.169 -6.918 701 H ARG 98 H ARG 98 -10.273 -1.801 -5.768 702 HA ARG 98 HA ARG 98 -12.401 -1.908 -7.649 703 HE ARG 98 HE ARG 98 -12.438 -6.633 -7.510 704 HB2 ARG 98 1HB ARG 98 -12.037 -2.967 -4.865 705 HB3 ARG 98 2HB ARG 98 -13.582 -3.106 -5.690 706 HG2 ARG 98 1HG ARG 98 -12.522 -4.355 -7.494 707 HG3 ARG 98 2HG ARG 98 -10.959 -4.189 -6.693 708 HD2 ARG 98 1HD ARG 98 -11.583 -5.594 -4.929 709 HD3 ARG 98 2HD ARG 98 -13.300 -5.444 -5.299 710 HH11 ARG 98 1HH1 ARG 98 -11.601 -7.332 -4.164 711 HH12 ARG 98 2HH1 ARG 98 -11.436 -9.037 -4.445 712 HH21 ARG 98 1HH2 ARG 98 -12.216 -8.885 -7.848 713 HH22 ARG 98 2HH2 ARG 98 -11.766 -9.917 -6.507 714 H ARG 99 H ARG 99 -11.944 -0.156 -4.616 715 HA ARG 99 HA ARG 99 -13.868 1.801 -5.354 716 HE ARG 99 HE ARG 99 -18.046 0.305 -4.396 717 HB2 ARG 99 1HB ARG 99 -15.531 0.240 -4.660 718 HB3 ARG 99 2HB ARG 99 -14.623 -0.194 -3.218 719 HG2 ARG 99 1HG ARG 99 -15.128 1.843 -2.158 720 HG3 ARG 99 2HG ARG 99 -15.688 2.577 -3.660 721 HD2 ARG 99 1HD ARG 99 -17.034 0.232 -2.333 722 HD3 ARG 99 2HD ARG 99 -17.499 1.911 -2.060 723 HH11 ARG 99 1HH1 ARG 99 -17.766 3.552 -3.128 724 HH12 ARG 99 2HH1 ARG 99 -18.788 4.259 -4.340 725 HH21 ARG 99 1HH2 ARG 99 -19.405 1.207 -5.977 726 HH22 ARG 99 2HH2 ARG 99 -19.733 2.919 -5.963 727 H GLN 100 H GLN 100 -13.606 3.672 -4.226 728 HA GLN 100 HA GLN 100 -11.279 3.945 -2.617 729 HB2 GLN 100 1HB GLN 100 -13.557 5.876 -3.075 730 HB3 GLN 100 2HB GLN 100 -12.003 6.275 -2.378 731 HG2 GLN 100 1HG GLN 100 -10.920 5.679 -4.500 732 HG3 GLN 100 2HG GLN 100 -12.511 5.356 -5.191 733 HE21 GLN 100 2HE2 GLN 100 -10.540 7.294 -6.051 734 HE22 GLN 100 1HE2 GLN 100 -11.303 8.853 -5.928 735 H HIS 101 H HIS 101 -11.326 2.953 -0.657 736 HA HIS 101 HA HIS 101 -13.437 3.866 1.184 737 HD1 HIS 101 HD1 HIS 101 -11.100 1.418 3.791 738 HD2 HIS 101 HD2 HIS 101 -15.171 2.002 3.192 739 HE1 HIS 101 HE1 HIS 101 -12.138 1.316 6.079 740 HE2 HIS 101 HE2 HIS 101 -14.619 1.555 5.684 741 HB2 HIS 101 1HB HIS 101 -13.499 1.431 0.958 742 HB3 HIS 101 2HB HIS 101 -11.783 1.338 1.333 743 H LEU 102 H LEU 102 -12.681 5.485 2.337 744 HA LEU 102 HA LEU 102 -9.895 5.902 2.813 745 HG LEU 102 HG LEU 102 -12.276 7.639 1.689 746 HB2 LEU 102 1HB LEU 102 -12.299 7.197 4.109 747 HB3 LEU 102 2HB LEU 102 -10.646 7.769 4.227 748 HD11 LEU 102 1HD1 LEU 102 -12.260 10.079 1.819 749 HD12 LEU 102 2HD1 LEU 102 -11.439 9.990 3.377 750 HD13 LEU 102 3HD1 LEU 102 -13.076 9.358 3.206 751 HD21 LEU 102 3HD2 LEU 102 -9.905 7.311 1.253 752 HD22 LEU 102 1HD2 LEU 102 -9.516 8.746 2.203 753 HD23 LEU 102 2HD2 LEU 102 -10.422 8.903 0.699 754 H LEU 103 H LEU 103 -8.687 5.214 4.481 755 HA LEU 103 HA LEU 103 -9.787 3.281 6.278 756 HG LEU 103 HG LEU 103 -7.433 3.215 4.203 757 HB2 LEU 103 1HB LEU 103 -7.054 4.565 6.215 758 HB3 LEU 103 2HB LEU 103 -7.501 3.201 7.222 759 HD11 LEU 103 1HD1 LEU 103 -5.656 1.863 6.227 760 HD12 LEU 103 2HD1 LEU 103 -5.214 3.230 5.204 761 HD13 LEU 103 3HD1 LEU 103 -5.565 1.662 4.477 762 HD21 LEU 103 3HD2 LEU 103 -8.061 0.987 6.139 763 HD22 LEU 103 1HD2 LEU 103 -7.862 0.809 4.395 764 HD23 LEU 103 2HD2 LEU 103 -9.199 1.763 5.037 765 H GLY 104 H GLY 104 -9.786 3.409 8.595 766 HA2 GLY 104 1HA GLY 104 -10.388 6.163 9.453 767 HA3 GLY 104 2HA GLY 104 -11.095 4.712 10.147 768 HA PRO 105 HA PRO 105 -7.301 6.525 12.496 769 HB2 PRO 105 1HB PRO 105 -8.741 6.898 14.841 770 HB3 PRO 105 2HB PRO 105 -8.342 8.162 13.675 771 HG2 PRO 105 1HG PRO 105 -10.869 6.603 13.993 772 HG3 PRO 105 2HG PRO 105 -10.648 8.319 13.599 773 HD2 PRO 105 1HD PRO 105 -11.287 6.534 11.711 774 HD3 PRO 105 2HD PRO 105 -10.167 7.871 11.371 775 H GLU 106 H GLU 106 -9.893 4.304 13.323 776 HA GLU 106 HA GLU 106 -8.562 2.933 15.409 777 HB2 GLU 106 1HB GLU 106 -11.028 2.890 14.941 778 HB3 GLU 106 2HB GLU 106 -10.697 1.876 13.546 779 HG2 GLU 106 1HG GLU 106 -11.446 0.555 15.435 780 HG3 GLU 106 2HG GLU 106 -9.787 0.150 14.994 781 H GLN 107 H GLN 107 -8.334 2.808 11.969 782 HA GLN 107 HA GLN 107 -7.102 0.159 11.983 783 HB2 GLN 107 1HB GLN 107 -8.009 1.951 9.727 784 HB3 GLN 107 2HB GLN 107 -7.256 0.376 9.498 785 HG2 GLN 107 1HG GLN 107 -9.072 -0.756 10.445 786 HG3 GLN 107 2HG GLN 107 -9.728 0.717 11.155 787 HE21 GLN 107 2HE2 GLN 107 -10.959 -1.268 9.402 788 HE22 GLN 107 1HE2 GLN 107 -11.548 -0.392 8.032 789 H VAL 108 H VAL 108 -6.241 3.496 11.729 790 HA VAL 108 HA VAL 108 -3.587 2.752 10.709 791 HB VAL 108 HB VAL 108 -3.261 5.140 10.199 792 HG11 VAL 108 1HG1 VAL 108 -4.119 3.634 8.488 793 HG12 VAL 108 2HG1 VAL 108 -4.803 5.248 8.307 794 HG13 VAL 108 3HG1 VAL 108 -5.769 3.955 9.019 795 HG21 VAL 108 3HG2 VAL 108 -4.736 6.093 11.902 796 HG22 VAL 108 1HG2 VAL 108 -6.139 5.450 11.051 797 HG23 VAL 108 2HG2 VAL 108 -5.143 6.692 10.294 798 H ARG 109 H ARG 109 -5.113 3.409 13.577 799 HA ARG 109 HA ARG 109 -3.527 5.234 14.915 800 HE ARG 109 HE ARG 109 -4.152 2.091 18.995 801 HB2 ARG 109 1HB ARG 109 -5.646 4.303 15.783 802 HB3 ARG 109 2HB ARG 109 -4.820 2.788 16.121 803 HG2 ARG 109 1HG ARG 109 -3.284 4.070 17.631 804 HG3 ARG 109 2HG ARG 109 -4.350 5.461 17.415 805 HD2 ARG 109 1HD ARG 109 -4.987 4.351 19.433 806 HD3 ARG 109 2HD ARG 109 -6.237 4.045 18.226 807 HH11 ARG 109 1HH1 ARG 109 -7.392 2.860 17.918 808 HH12 ARG 109 2HH1 ARG 109 -7.931 1.202 17.914 809 HH21 ARG 109 1HH2 ARG 109 -4.854 -0.074 19.045 810 HH22 ARG 109 2HH2 ARG 109 -6.487 -0.466 18.600 811 HA PRO 110 HA PRO 110 -0.721 1.595 16.618 812 HB2 PRO 110 1HB PRO 110 -0.977 -0.332 14.373 813 HB3 PRO 110 2HB PRO 110 -0.853 -0.636 16.108 814 HG2 PRO 110 1HG PRO 110 -3.174 -0.929 14.841 815 HG3 PRO 110 2HG PRO 110 -3.108 -0.234 16.473 816 HD2 PRO 110 1HD PRO 110 -3.455 1.139 13.837 817 HD3 PRO 110 2HD PRO 110 -4.243 1.471 15.394 818 H LEU 111 H LEU 111 -1.078 2.181 13.161 819 HA LEU 111 HA LEU 111 1.739 1.969 12.639 820 HG LEU 111 HG LEU 111 -0.691 0.593 11.277 821 HB2 LEU 111 1HB LEU 111 -0.525 3.006 10.939 822 HB3 LEU 111 2HB LEU 111 1.130 2.828 10.385 823 HD11 LEU 111 1HD1 LEU 111 -0.563 -0.100 8.932 824 HD12 LEU 111 2HD1 LEU 111 0.378 1.346 8.564 825 HD13 LEU 111 3HD1 LEU 111 -1.292 1.497 9.107 826 HD21 LEU 111 3HD2 LEU 111 1.115 -0.891 10.526 827 HD22 LEU 111 1HD2 LEU 111 1.618 0.122 11.878 828 HD23 LEU 111 2HD2 LEU 111 2.142 0.514 10.241 829 H LEU 112 H LEU 112 -0.561 4.569 13.234 830 HA LEU 112 HA LEU 112 1.123 6.740 12.641 831 HG LEU 112 HG LEU 112 -1.959 6.234 12.461 832 HB2 LEU 112 1HB LEU 112 -1.058 6.515 14.723 833 HB3 LEU 112 2HB LEU 112 -0.296 8.019 14.242 834 HD11 LEU 112 1HD1 LEU 112 -3.565 8.076 12.516 835 HD12 LEU 112 2HD1 LEU 112 -2.534 8.943 13.653 836 HD13 LEU 112 3HD1 LEU 112 -3.284 7.420 14.129 837 HD21 LEU 112 3HD2 LEU 112 -0.678 8.908 11.905 838 HD22 LEU 112 1HD2 LEU 112 -1.768 8.039 10.825 839 HD23 LEU 112 2HD2 LEU 112 -0.189 7.361 11.215 840 H ALA 113 H ALA 113 0.751 4.754 15.515 841 HA ALA 113 HA ALA 113 2.485 6.235 17.198 842 HB1 ALA 113 3HB ALA 113 2.445 4.275 18.640 843 HB2 ALA 113 1HB ALA 113 1.737 3.318 17.340 844 HB3 ALA 113 2HB ALA 113 0.825 4.650 18.051 845 H MET 114 H MET 114 3.034 3.989 14.654 846 HA MET 114 HA MET 114 5.774 3.436 15.456 847 HB2 MET 114 1HB MET 114 4.146 2.576 13.062 848 HB3 MET 114 2HB MET 114 5.827 2.127 13.313 849 HG2 MET 114 1HG MET 114 5.246 0.946 15.336 850 HG3 MET 114 2HG MET 114 3.568 1.465 15.184 851 HE1 MET 114 3HE MET 114 4.580 -1.581 15.552 852 HE2 MET 114 1HE MET 114 3.485 -2.408 14.444 853 HE3 MET 114 2HE MET 114 2.880 -1.119 15.486 854 H GLY 115 H GLY 115 3.991 5.378 13.163 855 HA2 GLY 115 1HA GLY 115 5.059 7.515 12.549 856 HA3 GLY 115 2HA GLY 115 6.540 6.600 12.302 857 H VAL 116 H VAL 116 3.614 5.113 11.296 858 HA VAL 116 HA VAL 116 4.507 5.305 8.527 859 HB VAL 116 HB VAL 116 2.258 3.628 9.649 860 HG11 VAL 116 1HG1 VAL 116 3.793 3.432 7.059 861 HG12 VAL 116 2HG1 VAL 116 2.126 3.978 7.246 862 HG13 VAL 116 3HG1 VAL 116 2.552 2.305 7.609 863 HG21 VAL 116 3HG2 VAL 116 4.340 3.025 10.749 864 HG22 VAL 116 1HG2 VAL 116 5.138 2.859 9.184 865 HG23 VAL 116 2HG2 VAL 116 3.836 1.755 9.633 866 H GLY 117 H GLY 117 3.726 6.949 7.366 867 HA2 GLY 117 1HA GLY 117 1.079 8.038 7.889 868 HA3 GLY 117 2HA GLY 117 2.230 8.612 6.685 869 H VAL 118 H VAL 118 -0.540 6.735 7.248 870 HA VAL 118 HA VAL 118 -0.266 5.225 4.764 871 HB VAL 118 HB VAL 118 -2.469 5.048 6.824 872 HG11 VAL 118 1HG1 VAL 118 -1.660 3.186 4.591 873 HG12 VAL 118 2HG1 VAL 118 -3.103 4.199 4.631 874 HG13 VAL 118 3HG1 VAL 118 -2.923 2.874 5.782 875 HG21 VAL 118 3HG2 VAL 118 0.002 3.342 6.526 876 HG22 VAL 118 1HG2 VAL 118 -1.323 3.055 7.655 877 HG23 VAL 118 2HG2 VAL 118 -0.312 4.491 7.827 878 H GLU 119 H GLU 119 -1.133 5.922 2.950 879 HA GLU 119 HA GLU 119 -3.513 7.658 3.075 880 HB2 GLU 119 1HB GLU 119 -1.203 7.710 1.129 881 HB3 GLU 119 2HB GLU 119 -2.714 8.565 0.857 882 HG2 GLU 119 1HG GLU 119 -0.833 9.010 3.167 883 HG3 GLU 119 2HG GLU 119 -0.982 10.034 1.739 884 H ALA 120 H ALA 120 -5.140 7.274 1.555 885 HA ALA 120 HA ALA 120 -4.914 4.710 0.115 886 HB1 ALA 120 3HB ALA 120 -6.369 4.462 2.051 887 HB2 ALA 120 1HB ALA 120 -7.301 4.343 0.557 888 HB3 ALA 120 2HB ALA 120 -7.346 5.827 1.509 889 H MET 121 H MET 121 -5.063 4.926 -1.988 890 HA MET 121 HA MET 121 -6.885 6.891 -3.162 891 HB2 MET 121 1HB MET 121 -3.948 6.684 -3.887 892 HB3 MET 121 2HB MET 121 -5.141 7.608 -4.788 893 HG2 MET 121 1HG MET 121 -5.495 9.057 -2.873 894 HG3 MET 121 2HG MET 121 -4.350 8.108 -1.927 895 HE1 MET 121 3HE MET 121 -2.100 7.483 -4.109 896 HE2 MET 121 1HE MET 121 -1.739 7.985 -2.458 897 HE3 MET 121 2HE MET 121 -0.980 8.815 -3.817 898 H ASP 122 H ASP 122 -6.854 6.475 -5.691 899 HA ASP 122 HA ASP 122 -7.440 3.721 -6.072 900 HB2 ASP 122 1HB ASP 122 -7.275 6.050 -7.971 901 HB3 ASP 122 2HB ASP 122 -7.563 4.412 -8.549 902 H THR 123 H THR 123 -6.501 2.436 -7.884 903 HA THR 123 HA THR 123 -3.964 1.655 -7.202 904 HB THR 123 HB THR 123 -5.154 1.250 -9.941 905 HG1 THR 123 HG1 THR 123 -5.650 -0.663 -8.022 906 HG21 THR 123 3HG2 THR 123 -3.371 -0.481 -8.220 907 HG22 THR 123 1HG2 THR 123 -2.871 0.409 -9.658 908 HG23 THR 123 2HG2 THR 123 -4.016 -0.925 -9.800 909 H GLN 124 H GLN 124 -4.838 3.574 -10.093 910 HA GLN 124 HA GLN 124 -2.199 3.849 -11.038 911 HB2 GLN 124 1HB GLN 124 -4.665 5.515 -11.519 912 HB3 GLN 124 2HB GLN 124 -3.136 5.800 -12.340 913 HG2 GLN 124 1HG GLN 124 -3.240 3.507 -13.248 914 HG3 GLN 124 2HG GLN 124 -4.823 3.312 -12.493 915 HE21 GLN 124 2HE2 GLN 124 -4.028 3.264 -15.323 916 HE22 GLN 124 1HE2 GLN 124 -4.976 4.480 -16.106 917 H ALA 125 H ALA 125 -4.184 5.935 -8.983 918 HA ALA 125 HA ALA 125 -2.419 8.117 -8.885 919 HB1 ALA 125 3HB ALA 125 -3.679 8.822 -6.912 920 HB2 ALA 125 1HB ALA 125 -4.428 7.229 -6.817 921 HB3 ALA 125 2HB ALA 125 -4.757 8.278 -8.198 922 H ALA 126 H ALA 126 -2.744 5.264 -6.815 923 HA ALA 126 HA ALA 126 -0.755 6.035 -4.947 924 HB1 ALA 126 3HB ALA 126 -0.855 3.727 -4.173 925 HB2 ALA 126 1HB ALA 126 -1.770 3.272 -5.613 926 HB3 ALA 126 2HB ALA 126 -2.475 4.375 -4.429 927 H ALA 127 H ALA 127 -0.687 3.952 -7.822 928 HA ALA 127 HA ALA 127 1.990 3.105 -7.504 929 HB1 ALA 127 3HB ALA 127 1.819 2.297 -9.793 930 HB2 ALA 127 1HB ALA 127 0.338 3.225 -10.023 931 HB3 ALA 127 2HB ALA 127 0.372 1.890 -8.871 932 H ARG 128 H ARG 128 0.550 5.797 -9.298 933 HA ARG 128 HA ARG 128 2.933 6.561 -10.626 934 HE ARG 128 HE ARG 128 -0.183 10.943 -11.158 935 HB2 ARG 128 1HB ARG 128 0.674 7.227 -11.364 936 HB3 ARG 128 2HB ARG 128 0.518 8.242 -9.938 937 HG2 ARG 128 1HG ARG 128 2.159 9.745 -10.700 938 HG3 ARG 128 2HG ARG 128 2.712 8.624 -11.947 939 HD2 ARG 128 1HD ARG 128 1.374 10.397 -12.928 940 HD3 ARG 128 2HD ARG 128 0.565 8.841 -13.094 941 HH11 ARG 128 1HH1 ARG 128 -0.982 8.101 -13.067 942 HH12 ARG 128 2HH1 ARG 128 -2.697 8.249 -12.785 943 HH21 ARG 128 1HH2 ARG 128 -2.440 11.102 -10.769 944 HH22 ARG 128 2HH2 ARG 128 -3.510 9.928 -11.481 945 H THR 129 H THR 129 1.361 7.743 -7.665 946 HA THR 129 HA THR 129 3.334 9.667 -7.039 947 HB THR 129 HB THR 129 1.555 8.207 -5.073 948 HG1 THR 129 HG1 THR 129 0.124 9.060 -6.482 949 HG21 THR 129 3HG2 THR 129 1.712 10.287 -3.783 950 HG22 THR 129 1HG2 THR 129 2.787 10.967 -5.004 951 HG23 THR 129 2HG2 THR 129 3.308 9.582 -4.045 952 H TYR 130 H TYR 130 3.019 6.246 -6.429 953 HA TYR 130 HA TYR 130 5.025 5.855 -4.529 954 HD1 TYR 130 HD1 TYR 130 4.894 3.650 -3.156 955 HD2 TYR 130 HD2 TYR 130 5.797 2.409 -7.124 956 HE1 TYR 130 HE1 TYR 130 6.327 1.862 -2.266 957 HE2 TYR 130 HE2 TYR 130 7.236 0.621 -6.244 958 HH TYR 130 HH TYR 130 7.149 -0.388 -3.067 959 HB2 TYR 130 1HB TYR 130 3.389 4.144 -5.247 960 HB3 TYR 130 2HB TYR 130 4.196 4.037 -6.805 961 H ASN 131 H ASN 131 5.197 5.882 -8.077 962 HA ASN 131 HA ASN 131 7.969 5.407 -8.275 963 HB2 ASN 131 1HB ASN 131 6.470 5.145 -10.194 964 HB3 ASN 131 2HB ASN 131 6.124 6.872 -10.179 965 HD21 ASN 131 2HD2 ASN 131 6.858 7.167 -12.260 966 HD22 ASN 131 1HD2 ASN 131 8.542 7.127 -12.666 967 H ILE 132 H ILE 132 6.078 8.389 -8.072 968 HA ILE 132 HA ILE 132 8.164 10.222 -8.427 969 HB ILE 132 HB ILE 132 5.682 10.534 -6.727 970 HG12 ILE 132 1HG1 ILE 132 6.218 11.337 -9.597 971 HG13 ILE 132 2HG1 ILE 132 5.225 9.975 -9.093 972 HG21 ILE 132 1HG2 ILE 132 7.527 12.631 -7.871 973 HG22 ILE 132 2HG2 ILE 132 7.391 12.187 -6.169 974 HG23 ILE 132 3HG2 ILE 132 6.028 12.940 -6.996 975 HD11 ILE 132 3HD1 ILE 132 3.666 11.508 -8.017 976 HD12 ILE 132 1HD1 ILE 132 3.864 11.882 -9.729 977 HD13 ILE 132 2HD1 ILE 132 4.666 12.872 -8.512 978 H LEU 133 H LEU 133 6.878 8.763 -5.446 979 HA LEU 133 HA LEU 133 8.705 10.089 -3.724 980 HG LEU 133 HG LEU 133 5.678 9.570 -3.608 981 HB2 LEU 133 1HB LEU 133 7.100 7.567 -3.309 982 HB3 LEU 133 2HB LEU 133 7.986 8.402 -2.047 983 HD11 LEU 133 1HD1 LEU 133 4.449 9.377 -1.496 984 HD12 LEU 133 2HD1 LEU 133 5.821 8.526 -0.785 985 HD13 LEU 133 3HD1 LEU 133 4.934 7.805 -2.127 986 HD21 LEU 133 3HD2 LEU 133 7.297 11.254 -2.881 987 HD22 LEU 133 1HD2 LEU 133 7.194 10.644 -1.230 988 HD23 LEU 133 2HD2 LEU 133 5.784 11.387 -1.984 989 H MET 134 H MET 134 8.853 7.140 -5.577 990 HA MET 134 HA MET 134 11.138 6.021 -4.329 991 HB2 MET 134 1HB MET 134 9.686 4.708 -5.807 992 HB3 MET 134 2HB MET 134 10.142 5.720 -7.171 993 HG2 MET 134 1HG MET 134 12.460 4.958 -6.950 994 HG3 MET 134 2HG MET 134 11.979 3.921 -5.608 995 HE1 MET 134 3HE MET 134 9.118 2.921 -6.614 996 HE2 MET 134 1HE MET 134 10.313 1.865 -5.861 997 HE3 MET 134 2HE MET 134 9.562 1.398 -7.387 998 H ALA 135 H ALA 135 10.743 8.079 -7.205 999 HA ALA 135 HA ALA 135 13.510 8.390 -7.728 1000 HB1 ALA 135 3HB ALA 135 11.794 8.850 -9.408 1001 HB2 ALA 135 1HB ALA 135 12.832 10.253 -9.161 1002 HB3 ALA 135 2HB ALA 135 11.217 10.217 -8.454 1003 H GLU 136 H GLU 136 11.321 9.908 -5.521 1004 HA GLU 136 HA GLU 136 13.005 12.133 -4.871 1005 HB2 GLU 136 1HB GLU 136 10.546 12.140 -4.554 1006 HB3 GLU 136 2HB GLU 136 10.719 10.912 -3.312 1007 HG2 GLU 136 1HG GLU 136 11.960 12.438 -1.917 1008 HG3 GLU 136 2HG GLU 136 11.918 13.667 -3.182 1009 H GLY 137 H GLY 137 13.090 8.833 -4.189 1010 HA2 GLY 137 1HA GLY 137 14.612 7.609 -2.975 1011 HA3 GLY 137 2HA GLY 137 15.386 9.117 -2.510 1012 H ARG 138 H ARG 138 12.008 8.296 -1.968 1013 HA ARG 138 HA ARG 138 12.538 8.554 0.912 1014 HE ARG 138 HE ARG 138 11.066 9.671 4.291 1015 HB2 ARG 138 1HB ARG 138 10.894 10.110 -0.353 1016 HB3 ARG 138 2HB ARG 138 9.811 8.723 -0.340 1017 HG2 ARG 138 1HG ARG 138 9.315 10.182 1.517 1018 HG3 ARG 138 2HG ARG 138 9.966 8.651 2.113 1019 HD2 ARG 138 1HD ARG 138 12.215 9.759 2.206 1020 HD3 ARG 138 2HD ARG 138 11.406 11.285 1.854 1021 HH11 ARG 138 1HH1 ARG 138 10.733 12.700 2.560 1022 HH12 ARG 138 2HH1 ARG 138 10.264 13.603 3.975 1023 HH21 ARG 138 1HH2 ARG 138 10.473 10.830 6.136 1024 HH22 ARG 138 2HH2 ARG 138 10.109 12.535 6.019 1025 H ARG 139 H ARG 139 11.457 7.126 2.381 1026 HA ARG 139 HA ARG 139 11.299 4.443 1.338 1027 HE ARG 139 HE ARG 139 12.872 6.729 5.102 1028 HB2 ARG 139 1HB ARG 139 11.229 5.614 4.107 1029 HB3 ARG 139 2HB ARG 139 10.928 3.904 3.814 1030 HG2 ARG 139 1HG ARG 139 13.091 3.499 3.127 1031 HG3 ARG 139 2HG ARG 139 13.380 5.182 2.694 1032 HD2 ARG 139 1HD ARG 139 12.950 4.300 5.532 1033 HD3 ARG 139 2HD ARG 139 14.543 4.304 4.777 1034 HH11 ARG 139 1HH1 ARG 139 15.989 5.128 4.961 1035 HH12 ARG 139 2HH1 ARG 139 16.890 6.540 5.429 1036 HH21 ARG 139 1HH2 ARG 139 14.054 8.601 5.722 1037 HH22 ARG 139 2HH2 ARG 139 15.781 8.513 5.867 1038 H VAL 140 H VAL 140 9.507 4.342 0.123 1039 HA VAL 140 HA VAL 140 6.921 4.668 1.482 1040 HB VAL 140 HB VAL 140 7.157 6.306 -0.295 1041 HG11 VAL 140 1HG1 VAL 140 8.850 5.196 -1.639 1042 HG12 VAL 140 2HG1 VAL 140 7.468 5.650 -2.635 1043 HG13 VAL 140 3HG1 VAL 140 7.680 3.973 -2.133 1044 HG21 VAL 140 3HG2 VAL 140 4.942 5.336 0.030 1045 HG22 VAL 140 1HG2 VAL 140 5.314 4.073 -1.143 1046 HG23 VAL 140 2HG2 VAL 140 5.206 5.754 -1.663 1047 H VAL 141 H VAL 141 5.447 3.035 1.330 1048 HA VAL 141 HA VAL 141 6.198 0.660 -0.253 1049 HB VAL 141 HB VAL 141 4.640 0.640 2.344 1050 HG11 VAL 141 1HG1 VAL 141 5.782 -1.618 0.702 1051 HG12 VAL 141 2HG1 VAL 141 4.076 -1.185 0.824 1052 HG13 VAL 141 3HG1 VAL 141 4.938 -1.783 2.242 1053 HG21 VAL 141 3HG2 VAL 141 6.629 -0.369 3.360 1054 HG22 VAL 141 1HG2 VAL 141 6.955 1.262 2.772 1055 HG23 VAL 141 2HG2 VAL 141 7.514 -0.134 1.852 1056 H VAL 142 H VAL 142 4.540 -0.266 -1.473 1057 HA VAL 142 HA VAL 142 1.993 1.211 -1.422 1058 HB VAL 142 HB VAL 142 3.363 1.725 -3.433 1059 HG11 VAL 142 1HG1 VAL 142 2.942 -1.183 -4.090 1060 HG12 VAL 142 2HG1 VAL 142 4.481 -0.399 -3.731 1061 HG13 VAL 142 3HG1 VAL 142 3.590 0.032 -5.193 1062 HG21 VAL 142 3HG2 VAL 142 0.940 1.945 -3.506 1063 HG22 VAL 142 1HG2 VAL 142 0.790 0.255 -3.989 1064 HG23 VAL 142 2HG2 VAL 142 1.570 1.413 -5.065 1065 H ALA 143 H ALA 143 0.146 0.072 -1.423 1066 HA ALA 143 HA ALA 143 0.297 -2.846 -1.812 1067 HB1 ALA 143 3HB ALA 143 -1.364 -1.409 0.267 1068 HB2 ALA 143 1HB ALA 143 0.093 -2.352 0.586 1069 HB3 ALA 143 2HB ALA 143 -1.352 -3.148 -0.034 1070 H LEU 144 H LEU 144 -0.783 -3.239 -3.650 1071 HA LEU 144 HA LEU 144 -2.954 -1.399 -4.384 1072 HG LEU 144 HG LEU 144 -0.060 -1.155 -5.387 1073 HB2 LEU 144 1HB LEU 144 -1.252 -3.199 -6.105 1074 HB3 LEU 144 2HB LEU 144 -2.568 -2.207 -6.700 1075 HD11 LEU 144 1HD1 LEU 144 0.530 -0.368 -7.621 1076 HD12 LEU 144 2HD1 LEU 144 -0.902 -1.155 -8.283 1077 HD13 LEU 144 3HD1 LEU 144 0.391 -2.125 -7.580 1078 HD21 LEU 144 3HD2 LEU 144 -0.860 1.030 -6.132 1079 HD22 LEU 144 1HD2 LEU 144 -2.003 0.279 -5.017 1080 HD23 LEU 144 2HD2 LEU 144 -2.335 0.283 -6.749 1081 H LEU 145 H LEU 145 -4.976 -2.077 -4.492 1082 HA LEU 145 HA LEU 145 -5.540 -4.956 -4.404 1083 HG LEU 145 HG LEU 145 -5.767 -2.967 -2.044 1084 HB2 LEU 145 1HB LEU 145 -7.339 -2.573 -3.930 1085 HB3 LEU 145 2HB LEU 145 -7.844 -4.246 -3.822 1086 HD11 LEU 145 1HD1 LEU 145 -7.978 -2.023 -1.646 1087 HD12 LEU 145 2HD1 LEU 145 -7.489 -3.066 -0.310 1088 HD13 LEU 145 3HD1 LEU 145 -8.654 -3.645 -1.500 1089 HD21 LEU 145 3HD2 LEU 145 -6.021 -4.999 -0.711 1090 HD22 LEU 145 1HD2 LEU 145 -5.452 -5.367 -2.338 1091 HD23 LEU 145 2HD2 LEU 145 -7.139 -5.649 -1.909 1092 HA PRO 146 HA PRO 146 -6.971 -4.330 -8.651 1093 HB2 PRO 146 1HB PRO 146 -6.064 -6.767 -9.523 1094 HB3 PRO 146 2HB PRO 146 -5.076 -5.305 -9.489 1095 HG2 PRO 146 1HG PRO 146 -4.822 -7.692 -7.882 1096 HG3 PRO 146 2HG PRO 146 -3.748 -6.287 -7.953 1097 HD2 PRO 146 1HD PRO 146 -5.831 -6.950 -5.988 1098 HD3 PRO 146 2HD PRO 146 -4.483 -5.803 -5.857 1099 H ASP 147 H ASP 147 -7.774 -6.734 -9.972 1100 HA ASP 147 HA ASP 147 -9.858 -7.774 -8.179 1101 HB2 ASP 147 1HB ASP 147 -10.528 -6.094 -10.134 1102 HB3 ASP 147 2HB ASP 147 -10.426 -7.558 -11.108 1103 H GLY 148 H GLY 148 -10.916 -9.740 -9.664 1104 HA2 GLY 148 1HA GLY 148 -9.467 -11.415 -11.210 1105 HA3 GLY 148 2HA GLY 148 -8.747 -11.661 -9.624 1106 H ASP 149 H ASP 149 -11.293 -11.161 -8.254 1107 HA ASP 149 HA ASP 149 -12.270 -13.826 -8.185 1108 HB2 ASP 149 1HB ASP 149 -13.517 -11.323 -7.024 1109 HB3 ASP 149 2HB ASP 149 -13.934 -12.977 -6.595 1110 H SER 150 H SER 150 -13.069 -11.066 -10.036 1111 HA SER 150 HA SER 150 -15.741 -11.766 -10.712 1112 HG SER 150 HG SER 150 -13.082 -9.224 -11.161 1113 HB2 SER 150 1HB SER 150 -15.242 -10.130 -12.653 1114 HB3 SER 150 2HB SER 150 -15.186 -9.494 -11.008 1115 H LEU 151 H LEU 151 -12.578 -12.477 -12.040 1116 HA LEU 151 HA LEU 151 -13.725 -13.835 -14.342 1117 HG LEU 151 HG LEU 151 -11.833 -11.321 -14.127 1118 HB2 LEU 151 1HB LEU 151 -10.840 -13.497 -13.520 1119 HB3 LEU 151 2HB LEU 151 -11.399 -14.167 -15.040 1120 HD11 LEU 151 1HD1 LEU 151 -9.958 -12.471 -16.185 1121 HD12 LEU 151 2HD1 LEU 151 -9.500 -11.764 -14.635 1122 HD13 LEU 151 3HD1 LEU 151 -10.229 -10.756 -15.885 1123 HD21 LEU 151 3HD2 LEU 151 -13.626 -12.135 -15.571 1124 HD22 LEU 151 1HD2 LEU 151 -12.436 -12.671 -16.757 1125 HD23 LEU 151 2HD2 LEU 151 -12.623 -10.952 -16.409 1126 H GLU 152 H GLU 152 -14.759 -15.580 -13.401 1127 HA GLU 152 HA GLU 152 -13.331 -17.330 -11.606 1128 HB2 GLU 152 1HB GLU 152 -16.063 -17.540 -12.880 1129 HB3 GLU 152 2HB GLU 152 -15.424 -18.689 -11.710 1130 HG2 GLU 152 1HG GLU 152 -15.325 -16.998 -10.016 1131 HG3 GLU 152 2HG GLU 152 -15.770 -15.750 -11.176 1132 H HIS 153 H HIS 153 -11.839 -18.625 -12.358 1133 HA HIS 153 HA HIS 153 -12.026 -19.673 -15.087 1134 HD1 HIS 153 HD1 HIS 153 -9.626 -18.440 -16.580 1135 HD2 HIS 153 HD2 HIS 153 -9.359 -17.173 -12.625 1136 HE1 HIS 153 HE1 HIS 153 -8.790 -16.073 -16.678 1137 HE2 HIS 153 HE2 HIS 153 -8.472 -15.386 -14.274 1138 HB2 HIS 153 1HB HIS 153 -9.755 -19.867 -13.090 1139 HB3 HIS 153 2HB HIS 153 -9.691 -20.371 -14.774 1140 H HIS 154 H HIS 154 -11.546 -21.988 -15.448 1141 HA HIS 154 HA HIS 154 -13.327 -23.533 -13.849 1142 HD1 HIS 154 HD1 HIS 154 -15.124 -25.244 -15.598 1143 HD2 HIS 154 HD2 HIS 154 -11.442 -27.159 -15.239 1144 HE1 HIS 154 HE1 HIS 154 -15.647 -27.691 -15.314 1145 HE2 HIS 154 HE2 HIS 154 -13.410 -28.844 -15.199 1146 HB2 HIS 154 1HB HIS 154 -13.056 -23.804 -16.311 1147 HB3 HIS 154 2HB HIS 154 -11.461 -24.492 -16.028 1148 H HIS 155 H HIS 155 -9.950 -22.957 -13.696 1149 HA HIS 155 HA HIS 155 -9.164 -25.349 -12.391 1150 HD1 HIS 155 HD1 HIS 155 -6.488 -26.054 -12.750 1151 HD2 HIS 155 HD2 HIS 155 -6.308 -23.039 -9.889 1152 HE1 HIS 155 HE1 HIS 155 -4.679 -26.744 -11.149 1153 HE2 HIS 155 HE2 HIS 155 -4.667 -24.969 -9.358 1154 HB2 HIS 155 1HB HIS 155 -7.606 -23.653 -13.410 1155 HB3 HIS 155 2HB HIS 155 -7.935 -22.609 -12.033 1156 H HIS 156 H HIS 156 -11.102 -22.756 -11.416 1157 HA HIS 156 HA HIS 156 -10.774 -23.388 -8.564 1158 HD1 HIS 156 HD1 HIS 156 -10.659 -20.263 -6.840 1159 HD2 HIS 156 HD2 HIS 156 -9.462 -20.519 -10.817 1160 HE1 HIS 156 HE1 HIS 156 -8.554 -18.892 -7.008 1161 HE2 HIS 156 HE2 HIS 156 -7.993 -18.869 -9.467 1162 HB2 HIS 156 1HB HIS 156 -12.220 -21.136 -9.976 1163 HB3 HIS 156 2HB HIS 156 -12.333 -21.420 -8.246 1164 H HIS 157 H HIS 157 -12.978 -23.372 -7.371 1165 HA HIS 157 HA HIS 157 -15.166 -24.377 -9.030 1166 HD1 HIS 157 HD1 HIS 157 -16.065 -27.401 -9.237 1167 HD2 HIS 157 HD2 HIS 157 -17.015 -25.793 -5.519 1168 HE1 HIS 157 HE1 HIS 157 -18.394 -28.199 -8.724 1169 HE2 HIS 157 HE2 HIS 157 -19.004 -27.097 -6.542 1170 HB2 HIS 157 1HB HIS 157 -14.059 -26.358 -8.009 1171 HB3 HIS 157 2HB HIS 157 -14.342 -25.667 -6.415 1172 H HIS 158 H HIS 158 -16.679 -22.901 -8.784 1173 HA HIS 158 HA HIS 158 -17.409 -21.990 -6.119 1174 HD1 HIS 158 HD1 HIS 158 -17.905 -18.037 -8.196 1175 HD2 HIS 158 HD2 HIS 158 -17.288 -19.679 -4.419 1176 HE1 HIS 158 HE1 HIS 158 -18.983 -16.442 -6.569 1177 HE2 HIS 158 HE2 HIS 158 -18.743 -17.536 -4.312 1178 HB2 HIS 158 1HB HIS 158 -15.643 -20.419 -6.827 1179 HB3 HIS 158 2HB HIS 158 -16.542 -20.074 -8.299 Start of MODEL 9 1 HA MET 1 HA MET 1 34.765 3.433 -4.558 2 H1 MET 1 1H MET 1 35.316 1.469 -6.703 3 H2 MET 1 2H MET 1 35.619 1.236 -5.052 4 H3 MET 1 3H MET 1 36.464 2.433 -5.904 5 HB2 MET 1 1HB MET 1 34.121 3.451 -7.515 6 HB3 MET 1 2HB MET 1 33.504 4.615 -6.352 7 HG2 MET 1 1HG MET 1 35.775 5.364 -5.887 8 HG3 MET 1 2HG MET 1 36.402 4.184 -7.037 9 HE1 MET 1 3HE MET 1 34.268 7.447 -6.574 10 HE2 MET 1 1HE MET 1 33.132 6.360 -7.372 11 HE3 MET 1 2HE MET 1 33.750 7.772 -8.228 12 H LYS 2 H LYS 2 33.627 1.884 -3.335 13 HA LYS 2 HA LYS 2 30.942 1.360 -4.365 14 HB2 LYS 2 1HB LYS 2 32.796 -0.761 -3.283 15 HB3 LYS 2 2HB LYS 2 31.052 -0.965 -3.341 16 HG2 LYS 2 1HG LYS 2 31.106 -0.698 -5.772 17 HG3 LYS 2 2HG LYS 2 32.859 -0.506 -5.705 18 HD2 LYS 2 1HD LYS 2 33.094 -2.745 -4.801 19 HD3 LYS 2 2HD LYS 2 31.341 -2.941 -4.772 20 HE2 LYS 2 1HE LYS 2 33.015 -2.500 -7.242 21 HE3 LYS 2 2HE LYS 2 32.383 -4.054 -6.704 22 HZ1 LYS 2 3HZ LYS 2 30.947 -3.199 -8.378 23 HZ2 LYS 2 1HZ LYS 2 30.808 -1.697 -7.598 24 HZ3 LYS 2 2HZ LYS 2 30.122 -3.083 -6.900 25 H LEU 3 H LEU 3 29.412 0.843 -2.674 26 HA LEU 3 HA LEU 3 30.175 2.043 -0.112 27 HG LEU 3 HG LEU 3 28.519 3.392 -2.401 28 HB2 LEU 3 1HB LEU 3 27.444 1.481 -1.280 29 HB3 LEU 3 2HB LEU 3 27.738 2.233 0.277 30 HD11 LEU 3 1HD1 LEU 3 26.327 4.170 -0.481 31 HD12 LEU 3 2HD1 LEU 3 26.108 3.396 -2.050 32 HD13 LEU 3 3HD1 LEU 3 26.765 5.030 -1.957 33 HD21 LEU 3 3HD2 LEU 3 29.059 5.408 -1.117 34 HD22 LEU 3 1HD2 LEU 3 30.065 4.043 -0.634 35 HD23 LEU 3 2HD2 LEU 3 28.714 4.545 0.381 36 H HIS 4 H HIS 4 29.343 1.048 1.863 37 HA HIS 4 HA HIS 4 29.834 -1.780 1.865 38 HD1 HIS 4 HD1 HIS 4 31.751 -1.533 5.212 39 HD2 HIS 4 HD2 HIS 4 27.991 -3.170 4.510 40 HE1 HIS 4 HE1 HIS 4 31.703 -3.701 6.486 41 HE2 HIS 4 HE2 HIS 4 29.495 -4.758 5.895 42 HB2 HIS 4 1HB HIS 4 30.414 -0.110 3.725 43 HB3 HIS 4 2HB HIS 4 28.711 -0.167 4.162 44 H THR 5 H THR 5 27.022 0.296 1.981 45 HA THR 5 HA THR 5 25.299 -2.050 2.356 46 HB THR 5 HB THR 5 23.521 -0.391 2.930 47 HG1 THR 5 HG1 THR 5 25.523 1.567 3.264 48 HG21 THR 5 3HG2 THR 5 26.031 -0.233 4.604 49 HG22 THR 5 1HG2 THR 5 24.802 -1.494 4.698 50 HG23 THR 5 2HG2 THR 5 24.401 0.162 5.152 51 H ASP 6 H ASP 6 23.547 -2.395 1.006 52 HA ASP 6 HA ASP 6 23.483 -0.808 -1.471 53 HB2 ASP 6 1HB ASP 6 22.723 -3.679 -0.926 54 HB3 ASP 6 2HB ASP 6 22.173 -2.827 -2.364 55 HA PRO 7 HA PRO 7 19.774 0.772 0.623 56 HB2 PRO 7 1HB PRO 7 19.660 2.205 -1.986 57 HB3 PRO 7 2HB PRO 7 19.494 2.840 -0.345 58 HG2 PRO 7 1HG PRO 7 21.735 3.227 -1.734 59 HG3 PRO 7 2HG PRO 7 21.785 2.896 0.008 60 HD2 PRO 7 1HD PRO 7 22.403 1.089 -2.288 61 HD3 PRO 7 2HD PRO 7 23.168 1.186 -0.689 62 H ALA 8 H ALA 8 19.709 0.366 -2.913 63 HA ALA 8 HA ALA 8 17.301 -1.290 -2.576 64 HB1 ALA 8 3HB ALA 8 16.545 -0.504 -4.761 65 HB2 ALA 8 1HB ALA 8 17.980 0.512 -4.900 66 HB3 ALA 8 2HB ALA 8 16.781 0.845 -3.650 67 H THR 9 H THR 9 18.245 -3.284 -2.590 68 HA THR 9 HA THR 9 20.286 -4.106 -4.359 69 HB THR 9 HB THR 9 19.480 -6.435 -3.796 70 HG1 THR 9 HG1 THR 9 17.619 -6.666 -2.808 71 HG21 THR 9 3HG2 THR 9 20.141 -6.308 -1.435 72 HG22 THR 9 1HG2 THR 9 19.944 -4.557 -1.475 73 HG23 THR 9 2HG2 THR 9 21.194 -5.326 -2.452 74 H ALA 10 H ALA 10 16.794 -4.189 -4.478 75 HA ALA 10 HA ALA 10 16.925 -4.499 -7.390 76 HB1 ALA 10 3HB ALA 10 16.259 -6.672 -6.482 77 HB2 ALA 10 1HB ALA 10 14.914 -5.914 -7.335 78 HB3 ALA 10 2HB ALA 10 14.958 -5.904 -5.572 79 H LEU 11 H LEU 11 14.703 -3.799 -8.331 80 HA LEU 11 HA LEU 11 13.569 -1.665 -6.657 81 HG LEU 11 HG LEU 11 12.243 0.027 -8.742 82 HB2 LEU 11 1HB LEU 11 15.133 -0.787 -8.411 83 HB3 LEU 11 2HB LEU 11 14.051 -1.440 -9.626 84 HD11 LEU 11 1HD1 LEU 11 12.858 1.871 -7.257 85 HD12 LEU 11 2HD1 LEU 11 14.476 1.190 -7.083 86 HD13 LEU 11 3HD1 LEU 11 13.077 0.305 -6.475 87 HD21 LEU 11 3HD2 LEU 11 13.129 2.097 -9.691 88 HD22 LEU 11 1HD2 LEU 11 13.563 0.701 -10.677 89 HD23 LEU 11 2HD2 LEU 11 14.762 1.436 -9.613 90 H ASN 12 H ASN 12 11.693 -2.635 -6.132 91 HA ASN 12 HA ASN 12 10.106 -4.142 -7.943 92 HB2 ASN 12 1HB ASN 12 9.490 -2.870 -5.271 93 HB3 ASN 12 2HB ASN 12 8.316 -3.829 -6.168 94 HD21 ASN 12 2HD2 ASN 12 9.660 -4.246 -3.555 95 HD22 ASN 12 1HD2 ASN 12 10.378 -5.816 -3.667 96 H THR 13 H THR 13 9.262 -3.259 -9.697 97 HA THR 13 HA THR 13 7.904 -0.660 -9.447 98 HB THR 13 HB THR 13 9.619 -1.426 -11.816 99 HG1 THR 13 HG1 THR 13 10.391 -0.591 -9.392 100 HG21 THR 13 3HG2 THR 13 7.841 0.195 -12.287 101 HG22 THR 13 1HG2 THR 13 9.432 0.950 -12.380 102 HG23 THR 13 2HG2 THR 13 8.414 1.213 -10.965 103 H VAL 14 H VAL 14 5.958 -0.568 -10.405 104 HA VAL 14 HA VAL 14 4.815 -2.858 -11.678 105 HB VAL 14 HB VAL 14 3.753 -0.024 -11.589 106 HG11 VAL 14 1HG1 VAL 14 1.566 -1.063 -11.962 107 HG12 VAL 14 2HG1 VAL 14 2.343 -2.639 -12.105 108 HG13 VAL 14 3HG1 VAL 14 2.676 -1.381 -13.295 109 HG21 VAL 14 3HG2 VAL 14 2.410 -0.776 -9.676 110 HG22 VAL 14 1HG2 VAL 14 4.140 -0.851 -9.340 111 HG23 VAL 14 2HG2 VAL 14 3.249 -2.327 -9.709 112 H THR 15 H THR 15 5.123 -3.419 -13.732 113 HA THR 15 HA THR 15 6.238 -1.457 -15.577 114 HB THR 15 HB THR 15 6.417 -3.578 -17.067 115 HG1 THR 15 HG1 THR 15 5.665 -5.339 -16.178 116 HG21 THR 15 3HG2 THR 15 8.338 -2.472 -16.041 117 HG22 THR 15 1HG2 THR 15 8.513 -4.226 -15.962 118 HG23 THR 15 2HG2 THR 15 8.032 -3.323 -14.526 119 H ALA 16 H ALA 16 3.995 -4.157 -16.187 120 HA ALA 16 HA ALA 16 2.475 -2.412 -17.956 121 HB1 ALA 16 3HB ALA 16 2.181 -5.371 -17.452 122 HB2 ALA 16 1HB ALA 16 3.085 -4.633 -18.776 123 HB3 ALA 16 2HB ALA 16 1.334 -4.439 -18.686 124 H TYR 17 H TYR 17 1.262 -1.092 -16.694 125 HA TYR 17 HA TYR 17 -0.396 -2.198 -14.591 126 HD1 TYR 17 HD2 TYR 17 -1.212 -0.782 -12.409 127 HD2 TYR 17 HD1 TYR 17 -2.189 1.651 -15.761 128 HE1 TYR 17 HE2 TYR 17 -3.272 -0.054 -11.276 129 HE2 TYR 17 HE1 TYR 17 -4.249 2.384 -14.638 130 HH TYR 17 HH TYR 17 -5.774 1.593 -12.887 131 HB2 TYR 17 1HB TYR 17 0.520 -0.019 -14.159 132 HB3 TYR 17 2HB TYR 17 -0.098 0.607 -15.684 133 H GLY 18 H GLY 18 -2.211 -3.199 -15.073 134 HA2 GLY 18 1HA GLY 18 -3.866 -2.103 -17.254 135 HA3 GLY 18 2HA GLY 18 -3.668 -3.834 -17.017 136 H ASP 19 H ASP 19 -6.177 -2.809 -17.049 137 HA ASP 19 HA ASP 19 -7.078 -2.280 -14.369 138 HB2 ASP 19 1HB ASP 19 -8.595 -2.814 -16.931 139 HB3 ASP 19 2HB ASP 19 -9.325 -2.324 -15.414 140 H GLY 20 H GLY 20 -6.548 -4.996 -16.391 141 HA2 GLY 20 1HA GLY 20 -8.300 -6.737 -14.841 142 HA3 GLY 20 2HA GLY 20 -7.370 -7.193 -16.260 143 H TYR 21 H TYR 21 -4.849 -6.174 -15.314 144 HA TYR 21 HA TYR 21 -4.317 -7.848 -12.981 145 HD1 TYR 21 HD2 TYR 21 -0.766 -7.517 -15.155 146 HD2 TYR 21 HD1 TYR 21 -4.354 -8.595 -17.172 147 HE1 TYR 21 HE2 TYR 21 0.223 -6.794 -17.287 148 HE2 TYR 21 HE1 TYR 21 -3.373 -7.878 -19.308 149 HH TYR 21 HH TYR 21 -1.639 -6.415 -20.140 150 HB2 TYR 21 1HB TYR 21 -2.447 -8.983 -14.098 151 HB3 TYR 21 2HB TYR 21 -3.968 -9.324 -14.912 152 H ILE 22 H ILE 22 -2.300 -7.420 -11.963 153 HA ILE 22 HA ILE 22 -1.103 -4.835 -12.732 154 HB ILE 22 HB ILE 22 -1.201 -6.095 -9.979 155 HG12 ILE 22 1HG1 ILE 22 -2.660 -3.666 -11.048 156 HG13 ILE 22 2HG1 ILE 22 -3.396 -5.243 -10.790 157 HG21 ILE 22 1HG2 ILE 22 -0.290 -3.941 -9.213 158 HG22 ILE 22 2HG2 ILE 22 -0.152 -3.415 -10.890 159 HG23 ILE 22 3HG2 ILE 22 0.811 -4.774 -10.310 160 HD11 ILE 22 3HD1 ILE 22 -2.197 -3.489 -8.659 161 HD12 ILE 22 1HD1 ILE 22 -2.950 -5.062 -8.402 162 HD13 ILE 22 2HD1 ILE 22 -3.917 -3.707 -8.983 163 H GLU 23 H GLU 23 0.820 -5.114 -13.667 164 HA GLU 23 HA GLU 23 2.360 -7.518 -13.023 165 HB2 GLU 23 1HB GLU 23 1.856 -7.079 -15.398 166 HB3 GLU 23 2HB GLU 23 2.720 -5.550 -15.289 167 HG2 GLU 23 1HG GLU 23 4.776 -6.768 -14.742 168 HG3 GLU 23 2HG GLU 23 3.902 -8.289 -14.906 169 H VAL 24 H VAL 24 3.880 -7.338 -11.554 170 HA VAL 24 HA VAL 24 5.385 -4.807 -11.360 171 HB VAL 24 HB VAL 24 4.936 -6.860 -9.181 172 HG11 VAL 24 1HG1 VAL 24 7.082 -5.737 -8.966 173 HG12 VAL 24 2HG1 VAL 24 5.974 -5.195 -7.706 174 HG13 VAL 24 3HG1 VAL 24 6.293 -4.166 -9.104 175 HG21 VAL 24 3HG2 VAL 24 3.756 -4.105 -9.530 176 HG22 VAL 24 1HG2 VAL 24 3.549 -5.139 -8.116 177 HG23 VAL 24 2HG2 VAL 24 2.892 -5.636 -9.675 178 H ASN 25 H ASN 25 7.441 -4.934 -11.972 179 HA ASN 25 HA ASN 25 9.447 -5.759 -12.667 180 HB2 ASN 25 1HB ASN 25 8.905 -7.969 -10.668 181 HB3 ASN 25 2HB ASN 25 10.465 -7.587 -11.384 182 HD21 ASN 25 2HD2 ASN 25 9.767 -7.698 -8.615 183 HD22 ASN 25 1HD2 ASN 25 10.067 -6.121 -7.954 184 H GLN 26 H GLN 26 7.041 -6.524 -14.046 185 HA GLN 26 HA GLN 26 6.392 -7.781 -15.802 186 HB2 GLN 26 1HB GLN 26 9.110 -9.063 -15.523 187 HB3 GLN 26 2HB GLN 26 7.990 -9.383 -16.841 188 HG2 GLN 26 1HG GLN 26 8.072 -7.022 -17.475 189 HG3 GLN 26 2HG GLN 26 9.210 -6.717 -16.166 190 HE21 GLN 26 2HE2 GLN 26 9.496 -6.340 -19.030 191 HE22 GLN 26 1HE2 GLN 26 10.880 -7.265 -19.503 192 H VAL 27 H VAL 27 6.388 -8.716 -12.818 193 HA VAL 27 HA VAL 27 5.390 -11.424 -13.382 194 HB VAL 27 HB VAL 27 5.807 -10.128 -10.678 195 HG11 VAL 27 1HG1 VAL 27 4.159 -11.911 -10.657 196 HG12 VAL 27 2HG1 VAL 27 5.628 -12.425 -9.828 197 HG13 VAL 27 3HG1 VAL 27 5.293 -12.994 -11.463 198 HG21 VAL 27 3HG2 VAL 27 7.596 -12.059 -12.154 199 HG22 VAL 27 1HG2 VAL 27 7.818 -11.522 -10.488 200 HG23 VAL 27 2HG2 VAL 27 7.948 -10.365 -11.814 201 H ARG 28 H ARG 28 3.263 -11.598 -13.710 202 HA ARG 28 HA ARG 28 1.582 -9.301 -13.075 203 HE ARG 28 HE ARG 28 2.597 -8.982 -17.885 204 HB2 ARG 28 1HB ARG 28 1.032 -11.719 -14.806 205 HB3 ARG 28 2HB ARG 28 -0.044 -10.339 -14.612 206 HG2 ARG 28 1HG ARG 28 1.637 -8.875 -15.574 207 HG3 ARG 28 2HG ARG 28 2.741 -10.237 -15.742 208 HD2 ARG 28 1HD ARG 28 1.171 -11.313 -17.282 209 HD3 ARG 28 2HD ARG 28 0.072 -9.943 -17.113 210 HH11 ARG 28 1HH1 ARG 28 -0.047 -10.860 -19.204 211 HH12 ARG 28 2HH1 ARG 28 0.262 -10.386 -20.846 212 HH21 ARG 28 1HH2 ARG 28 3.010 -8.356 -20.021 213 HH22 ARG 28 2HH2 ARG 28 2.009 -8.951 -21.312 214 H PHE 29 H PHE 29 0.466 -9.295 -11.272 215 HA PHE 29 HA PHE 29 -0.361 -11.849 -10.084 216 HD1 PHE 29 HD2 PHE 29 0.702 -12.316 -7.427 217 HD2 PHE 29 HD1 PHE 29 2.150 -8.726 -9.198 218 HE1 PHE 29 HE2 PHE 29 2.980 -12.871 -6.681 219 HE2 PHE 29 HE1 PHE 29 4.430 -9.274 -8.454 220 HZ PHE 29 HZ PHE 29 4.846 -11.348 -7.194 221 HB2 PHE 29 1HB PHE 29 -0.187 -9.069 -8.901 222 HB3 PHE 29 2HB PHE 29 -0.807 -10.474 -8.041 223 H SER 30 H SER 30 -2.482 -12.298 -9.640 224 HA SER 30 HA SER 30 -4.447 -10.486 -10.859 225 HG SER 30 HG SER 30 -5.065 -14.487 -10.404 226 HB2 SER 30 1HB SER 30 -5.929 -12.531 -10.862 227 HB3 SER 30 2HB SER 30 -4.501 -12.649 -11.888 228 H HIS 31 H HIS 31 -3.175 -11.089 -7.940 229 HA HIS 31 HA HIS 31 -5.689 -10.400 -6.592 230 HD1 HIS 31 HD1 HIS 31 -2.479 -13.358 -6.823 231 HD2 HIS 31 HD2 HIS 31 -3.038 -11.641 -3.073 232 HE1 HIS 31 HE1 HIS 31 -0.358 -13.800 -5.547 233 HE2 HIS 31 HE2 HIS 31 -0.822 -12.966 -3.213 234 HB2 HIS 31 1HB HIS 31 -5.213 -11.792 -4.717 235 HB3 HIS 31 2HB HIS 31 -5.015 -12.794 -6.146 236 H ALA 32 H ALA 32 -5.165 -9.504 -4.315 237 HA ALA 32 HA ALA 32 -3.851 -7.070 -4.728 238 HB1 ALA 32 3HB ALA 32 -4.260 -6.641 -2.380 239 HB2 ALA 32 1HB ALA 32 -4.590 -8.352 -2.106 240 HB3 ALA 32 2HB ALA 32 -5.668 -7.398 -3.126 241 H ILE 33 H ILE 33 -1.944 -6.220 -4.058 242 HA ILE 33 HA ILE 33 0.005 -7.936 -2.713 243 HB ILE 33 HB ILE 33 1.757 -7.177 -4.386 244 HG12 ILE 33 1HG1 ILE 33 -0.702 -6.634 -6.067 245 HG13 ILE 33 2HG1 ILE 33 0.412 -5.415 -5.460 246 HG21 ILE 33 1HG2 ILE 33 1.258 -8.990 -5.962 247 HG22 ILE 33 2HG2 ILE 33 -0.385 -9.077 -5.327 248 HG23 ILE 33 3HG2 ILE 33 0.984 -9.472 -4.287 249 HD11 ILE 33 3HD1 ILE 33 0.820 -5.904 -7.799 250 HD12 ILE 33 1HD1 ILE 33 1.082 -7.604 -7.411 251 HD13 ILE 33 2HD1 ILE 33 2.200 -6.379 -6.807 252 H ALA 34 H ALA 34 1.505 -6.840 -1.530 253 HA ALA 34 HA ALA 34 1.484 -3.896 -1.675 254 HB1 ALA 34 3HB ALA 34 0.233 -4.609 0.304 255 HB2 ALA 34 1HB ALA 34 1.739 -3.812 0.761 256 HB3 ALA 34 2HB ALA 34 1.612 -5.571 0.837 257 H PHE 35 H PHE 35 3.476 -3.128 -2.122 258 HA PHE 35 HA PHE 35 5.799 -4.649 -1.230 259 HD1 PHE 35 HD2 PHE 35 3.216 -4.834 -4.368 260 HD2 PHE 35 HD1 PHE 35 6.900 -2.787 -4.969 261 HE1 PHE 35 HE2 PHE 35 2.234 -3.636 -6.279 262 HE2 PHE 35 HE1 PHE 35 5.924 -1.587 -6.881 263 HZ PHE 35 HZ PHE 35 3.590 -2.010 -7.538 264 HB2 PHE 35 1HB PHE 35 6.795 -4.643 -3.505 265 HB3 PHE 35 2HB PHE 35 5.350 -5.640 -3.388 266 H ALA 36 H ALA 36 7.824 -3.539 -1.587 267 HA ALA 36 HA ALA 36 7.622 -0.646 -2.008 268 HB1 ALA 36 3HB ALA 36 7.533 -1.019 0.417 269 HB2 ALA 36 1HB ALA 36 9.033 -0.220 -0.055 270 HB3 ALA 36 2HB ALA 36 9.033 -1.941 0.330 271 HA PRO 37 HA PRO 37 11.134 -1.176 -4.595 272 HB2 PRO 37 1HB PRO 37 12.701 0.977 -3.821 273 HB3 PRO 37 2HB PRO 37 11.374 1.048 -4.985 274 HG2 PRO 37 1HG PRO 37 11.396 1.763 -2.085 275 HG3 PRO 37 2HG PRO 37 10.576 2.569 -3.435 276 HD2 PRO 37 1HD PRO 37 9.238 1.000 -1.727 277 HD3 PRO 37 2HD PRO 37 8.835 1.035 -3.456 278 H GLU 38 H GLU 38 12.016 -0.269 -1.274 279 HA GLU 38 HA GLU 38 14.485 -1.818 -1.502 280 HB2 GLU 38 1HB GLU 38 13.532 0.078 0.652 281 HB3 GLU 38 2HB GLU 38 15.102 -0.710 0.617 282 HG2 GLU 38 1HG GLU 38 15.726 0.485 -1.363 283 HG3 GLU 38 2HG GLU 38 14.106 1.165 -1.513 284 H GLY 39 H GLY 39 11.731 -2.975 -1.199 285 HA2 GLY 39 1HA GLY 39 12.342 -4.645 1.140 286 HA3 GLY 39 2HA GLY 39 10.747 -3.919 1.002 287 HA PRO 40 HA PRO 40 10.545 -7.879 -1.350 288 HB2 PRO 40 1HB PRO 40 9.098 -9.375 0.316 289 HB3 PRO 40 2HB PRO 40 10.833 -9.154 0.570 290 HG2 PRO 40 1HG PRO 40 8.536 -7.908 1.997 291 HG3 PRO 40 2HG PRO 40 10.117 -8.400 2.626 292 HD2 PRO 40 1HD PRO 40 9.346 -5.794 1.883 293 HD3 PRO 40 2HD PRO 40 10.996 -6.349 2.220 294 H VAL 41 H VAL 41 8.294 -9.247 -1.560 295 HA VAL 41 HA VAL 41 6.159 -7.255 -1.967 296 HB VAL 41 HB VAL 41 6.556 -9.860 -3.459 297 HG11 VAL 41 1HG1 VAL 41 4.213 -9.218 -3.282 298 HG12 VAL 41 2HG1 VAL 41 4.788 -9.024 -4.938 299 HG13 VAL 41 3HG1 VAL 41 4.594 -7.611 -3.903 300 HG21 VAL 41 3HG2 VAL 41 7.052 -7.027 -4.367 301 HG22 VAL 41 1HG2 VAL 41 7.141 -8.461 -5.387 302 HG23 VAL 41 2HG2 VAL 41 8.282 -8.252 -4.059 303 H ALA 42 H ALA 42 4.531 -7.459 -0.584 304 HA ALA 42 HA ALA 42 4.199 -9.959 0.883 305 HB1 ALA 42 3HB ALA 42 2.728 -8.676 2.351 306 HB2 ALA 42 1HB ALA 42 2.875 -7.276 1.288 307 HB3 ALA 42 2HB ALA 42 4.286 -7.871 2.162 308 H SER 43 H SER 43 2.735 -11.390 0.324 309 HA SER 43 HA SER 43 0.852 -10.853 -1.771 310 HG SER 43 HG SER 43 0.223 -14.308 -1.949 311 HB2 SER 43 1HB SER 43 2.059 -13.050 -1.429 312 HB3 SER 43 2HB SER 43 1.027 -13.319 -0.026 313 H TRP 44 H TRP 44 -0.989 -9.816 -1.407 314 HA TRP 44 HA TRP 44 -2.158 -9.888 1.273 315 HD1 TRP 44 HD1 TRP 44 -0.514 -8.487 1.999 316 HE1 TRP 44 HE1 TRP 44 -0.401 -6.517 3.654 317 HE3 TRP 44 HE3 TRP 44 -4.312 -5.622 0.121 318 HZ2 TRP 44 HZ2 TRP 44 -1.740 -4.071 4.097 319 HZ3 TRP 44 HZ3 TRP 44 -4.829 -3.481 1.216 320 HH2 TRP 44 HH2 TRP 44 -3.569 -2.723 3.164 321 HB2 TRP 44 1HB TRP 44 -2.055 -7.918 -0.897 322 HB3 TRP 44 2HB TRP 44 -3.645 -8.077 -0.159 323 HA PRO 45 HA PRO 45 -5.359 -12.513 -0.480 324 HB2 PRO 45 1HB PRO 45 -6.357 -13.363 1.853 325 HB3 PRO 45 2HB PRO 45 -4.798 -13.949 1.260 326 HG2 PRO 45 1HG PRO 45 -5.382 -11.877 3.334 327 HG3 PRO 45 2HG PRO 45 -4.137 -13.139 3.330 328 HD2 PRO 45 1HD PRO 45 -3.703 -10.493 2.652 329 HD3 PRO 45 2HD PRO 45 -2.679 -11.848 2.141 330 H VAL 46 H VAL 46 -5.537 -9.558 0.098 331 HA VAL 46 HA VAL 46 -8.140 -9.202 1.322 332 HB VAL 46 HB VAL 46 -6.248 -7.184 0.098 333 HG11 VAL 46 1HG1 VAL 46 -8.686 -6.742 1.812 334 HG12 VAL 46 2HG1 VAL 46 -8.564 -6.397 0.088 335 HG13 VAL 46 3HG1 VAL 46 -7.580 -5.495 1.242 336 HG21 VAL 46 3HG2 VAL 46 -5.302 -8.283 2.052 337 HG22 VAL 46 1HG2 VAL 46 -6.756 -7.915 2.978 338 HG23 VAL 46 2HG2 VAL 46 -5.713 -6.608 2.419 339 H GLN 47 H GLN 47 -9.971 -9.199 0.222 340 HA GLN 47 HA GLN 47 -9.858 -9.267 -2.690 341 HB2 GLN 47 1HB GLN 47 -12.152 -9.810 -0.796 342 HB3 GLN 47 2HB GLN 47 -12.168 -10.081 -2.536 343 HG2 GLN 47 1HG GLN 47 -10.519 -11.791 -2.358 344 HG3 GLN 47 2HG GLN 47 -10.250 -11.428 -0.655 345 HE21 GLN 47 2HE2 GLN 47 -10.998 -13.916 -1.929 346 HE22 GLN 47 1HE2 GLN 47 -12.486 -14.403 -1.196 347 H ARG 48 H ARG 48 -11.331 -7.442 -0.062 348 HA ARG 48 HA ARG 48 -11.743 -5.222 -1.918 349 HE ARG 48 HE ARG 48 -15.748 -6.949 -4.122 350 HB2 ARG 48 1HB ARG 48 -13.849 -6.366 -0.075 351 HB3 ARG 48 2HB ARG 48 -13.964 -4.765 -0.795 352 HG2 ARG 48 1HG ARG 48 -13.918 -5.759 -3.024 353 HG3 ARG 48 2HG ARG 48 -13.792 -7.365 -2.305 354 HD2 ARG 48 1HD ARG 48 -15.963 -7.062 -1.236 355 HD3 ARG 48 2HD ARG 48 -16.085 -5.444 -1.927 356 HH11 ARG 48 1HH1 ARG 48 -17.885 -7.286 -1.370 357 HH12 ARG 48 2HH1 ARG 48 -19.121 -8.111 -2.263 358 HH21 ARG 48 1HH2 ARG 48 -17.393 -8.002 -5.324 359 HH22 ARG 48 2HH2 ARG 48 -18.855 -8.512 -4.511 360 HA PRO 49 HA PRO 49 -9.945 -2.662 1.141 361 HB2 PRO 49 1HB PRO 49 -11.715 -0.534 1.245 362 HB3 PRO 49 2HB PRO 49 -10.438 -0.738 0.044 363 HG2 PRO 49 1HG PRO 49 -13.350 -1.373 -0.156 364 HG3 PRO 49 2HG PRO 49 -12.268 -0.669 -1.372 365 HD2 PRO 49 1HD PRO 49 -13.001 -3.239 -1.481 366 HD3 PRO 49 2HD PRO 49 -11.362 -2.728 -1.935 367 H ALA 50 H ALA 50 -13.099 -3.876 1.650 368 HA ALA 50 HA ALA 50 -13.535 -2.808 4.260 369 HB1 ALA 50 3HB ALA 50 -15.381 -3.589 2.861 370 HB2 ALA 50 1HB ALA 50 -15.342 -4.444 4.403 371 HB3 ALA 50 2HB ALA 50 -14.751 -5.233 2.941 372 H ASP 51 H ASP 51 -11.635 -5.376 2.993 373 HA ASP 51 HA ASP 51 -11.566 -6.886 5.472 374 HB2 ASP 51 1HB ASP 51 -10.007 -7.250 2.908 375 HB3 ASP 51 2HB ASP 51 -9.971 -8.352 4.275 376 H ILE 52 H ILE 52 -10.128 -4.113 4.442 377 HA ILE 52 HA ILE 52 -7.410 -4.624 5.183 378 HB ILE 52 HB ILE 52 -8.844 -2.005 4.711 379 HG12 ILE 52 1HG1 ILE 52 -6.998 -3.622 2.935 380 HG13 ILE 52 2HG1 ILE 52 -8.743 -3.485 2.742 381 HG21 ILE 52 1HG2 ILE 52 -6.609 -1.021 4.511 382 HG22 ILE 52 2HG2 ILE 52 -5.890 -2.566 4.967 383 HG23 ILE 52 3HG2 ILE 52 -6.886 -1.682 6.123 384 HD11 ILE 52 3HD1 ILE 52 -7.557 -2.056 1.178 385 HD12 ILE 52 1HD1 ILE 52 -6.764 -1.230 2.519 386 HD13 ILE 52 2HD1 ILE 52 -8.511 -1.099 2.310 387 H THR 53 H THR 53 -6.561 -4.616 7.139 388 HA THR 53 HA THR 53 -7.727 -2.943 9.223 389 HB THR 53 HB THR 53 -8.704 -5.231 9.481 390 HG1 THR 53 HG1 THR 53 -8.585 -4.065 11.354 391 HG21 THR 53 3HG2 THR 53 -7.263 -7.043 10.302 392 HG22 THR 53 1HG2 THR 53 -5.845 -6.028 10.046 393 HG23 THR 53 2HG2 THR 53 -6.814 -6.550 8.668 394 H ALA 54 H ALA 54 -6.196 -3.232 11.277 395 HA ALA 54 HA ALA 54 -3.849 -1.908 10.577 396 HB1 ALA 54 3HB ALA 54 -3.231 -2.111 12.921 397 HB2 ALA 54 1HB ALA 54 -4.478 -3.335 13.153 398 HB3 ALA 54 2HB ALA 54 -4.932 -1.680 12.746 399 H SER 55 H SER 55 -4.298 -5.292 11.550 400 HA SER 55 HA SER 55 -1.637 -6.038 11.757 401 HG SER 55 HG SER 55 -4.314 -8.161 12.954 402 HB2 SER 55 1HB SER 55 -3.875 -7.800 10.745 403 HB3 SER 55 2HB SER 55 -2.421 -8.304 11.609 404 H LEU 56 H LEU 56 -3.749 -6.068 8.912 405 HA LEU 56 HA LEU 56 -1.866 -7.259 7.162 406 HG LEU 56 HG LEU 56 -4.872 -7.650 7.684 407 HB2 LEU 56 1HB LEU 56 -4.261 -5.522 6.564 408 HB3 LEU 56 2HB LEU 56 -3.365 -6.436 5.366 409 HD11 LEU 56 1HD1 LEU 56 -6.478 -8.378 6.000 410 HD12 LEU 56 2HD1 LEU 56 -5.584 -7.498 4.760 411 HD13 LEU 56 3HD1 LEU 56 -6.376 -6.619 6.067 412 HD21 LEU 56 3HD2 LEU 56 -4.499 -9.762 6.503 413 HD22 LEU 56 1HD2 LEU 56 -2.976 -9.000 6.963 414 HD23 LEU 56 2HD2 LEU 56 -3.535 -8.912 5.293 415 H LEU 57 H LEU 57 -2.672 -3.930 7.970 416 HA LEU 57 HA LEU 57 -1.123 -2.704 5.951 417 HG LEU 57 HG LEU 57 -3.897 -2.179 7.091 418 HB2 LEU 57 1HB LEU 57 -2.019 -1.662 8.637 419 HB3 LEU 57 2HB LEU 57 -1.293 -0.680 7.380 420 HD11 LEU 57 1HD1 LEU 57 -3.378 0.753 7.562 421 HD12 LEU 57 2HD1 LEU 57 -4.096 -0.375 8.713 422 HD13 LEU 57 3HD1 LEU 57 -4.948 0.024 7.221 423 HD21 LEU 57 3HD2 LEU 57 -4.152 -0.838 5.059 424 HD22 LEU 57 1HD2 LEU 57 -2.723 -1.869 4.979 425 HD23 LEU 57 2HD2 LEU 57 -2.549 -0.146 5.315 426 H GLN 58 H GLN 58 -0.405 -3.620 9.294 427 HA GLN 58 HA GLN 58 2.175 -2.514 9.433 428 HB2 GLN 58 1HB GLN 58 0.922 -4.874 10.827 429 HB3 GLN 58 2HB GLN 58 2.565 -4.346 11.163 430 HG2 GLN 58 1HG GLN 58 1.731 -2.162 11.850 431 HG3 GLN 58 2HG GLN 58 0.082 -2.681 11.502 432 HE21 GLN 58 2HE2 GLN 58 1.372 -1.802 14.006 433 HE22 GLN 58 1HE2 GLN 58 1.086 -3.072 15.142 434 H GLN 59 H GLN 59 1.084 -5.744 8.449 435 HA GLN 59 HA GLN 59 3.634 -6.781 7.874 436 HB2 GLN 59 1HB GLN 59 0.912 -7.512 6.795 437 HB3 GLN 59 2HB GLN 59 2.373 -8.431 6.459 438 HG2 GLN 59 1HG GLN 59 2.653 -8.862 8.845 439 HG3 GLN 59 2HG GLN 59 1.185 -7.944 9.181 440 HE21 GLN 59 2HE2 GLN 59 1.843 -10.750 9.711 441 HE22 GLN 59 1HE2 GLN 59 0.613 -11.681 8.919 442 H ALA 60 H ALA 60 1.338 -4.946 5.948 443 HA ALA 60 HA ALA 60 2.600 -5.214 3.444 444 HB1 ALA 60 3HB ALA 60 0.310 -4.381 3.714 445 HB2 ALA 60 1HB ALA 60 1.303 -3.262 2.780 446 HB3 ALA 60 2HB ALA 60 0.935 -2.916 4.469 447 H ALA 61 H ALA 61 3.184 -3.103 6.169 448 HA ALA 61 HA ALA 61 4.933 -1.320 4.755 449 HB1 ALA 61 3HB ALA 61 3.641 -0.568 6.694 450 HB2 ALA 61 1HB ALA 61 5.371 -0.336 6.940 451 HB3 ALA 61 2HB ALA 61 4.541 -1.679 7.725 452 H GLY 62 H GLY 62 5.358 -4.437 5.424 453 HA2 GLY 62 1HA GLY 62 7.444 -5.478 4.903 454 HA3 GLY 62 2HA GLY 62 8.272 -4.090 5.594 455 H LEU 63 H LEU 63 5.923 -4.588 7.730 456 HA LEU 63 HA LEU 63 7.746 -5.863 9.575 457 HG LEU 63 HG LEU 63 6.464 -3.015 9.370 458 HB2 LEU 63 1HB LEU 63 4.929 -4.862 10.006 459 HB3 LEU 63 2HB LEU 63 6.058 -5.332 11.263 460 HD11 LEU 63 1HD1 LEU 63 5.993 -1.603 11.306 461 HD12 LEU 63 2HD1 LEU 63 5.620 -3.037 12.263 462 HD13 LEU 63 3HD1 LEU 63 4.604 -2.606 10.887 463 HD21 LEU 63 3HD2 LEU 63 7.994 -3.867 11.826 464 HD22 LEU 63 1HD2 LEU 63 8.286 -2.408 10.878 465 HD23 LEU 63 2HD2 LEU 63 8.555 -3.996 10.158 466 H ALA 64 H ALA 64 6.500 -7.412 7.360 467 HA ALA 64 HA ALA 64 4.762 -9.302 8.709 468 HB1 ALA 64 3HB ALA 64 4.623 -10.414 6.547 469 HB2 ALA 64 1HB ALA 64 5.884 -9.360 5.908 470 HB3 ALA 64 2HB ALA 64 4.323 -8.685 6.374 471 H GLU 65 H GLU 65 7.910 -9.426 7.041 472 HA GLU 65 HA GLU 65 8.422 -12.015 8.290 473 HB2 GLU 65 1HB GLU 65 9.883 -10.563 6.082 474 HB3 GLU 65 2HB GLU 65 10.330 -12.145 6.708 475 HG2 GLU 65 1HG GLU 65 8.117 -12.999 6.026 476 HG3 GLU 65 2HG GLU 65 7.763 -11.426 5.314 477 H VAL 66 H VAL 66 9.071 -8.792 8.844 478 HA VAL 66 HA VAL 66 11.679 -9.171 10.037 479 HB VAL 66 HB VAL 66 9.820 -6.781 10.141 480 HG11 VAL 66 1HG1 VAL 66 11.788 -5.517 10.866 481 HG12 VAL 66 2HG1 VAL 66 12.731 -7.006 10.903 482 HG13 VAL 66 3HG1 VAL 66 11.380 -6.791 12.016 483 HG21 VAL 66 3HG2 VAL 66 11.328 -5.803 8.471 484 HG22 VAL 66 1HG2 VAL 66 10.551 -7.269 7.873 485 HG23 VAL 66 2HG2 VAL 66 12.231 -7.316 8.409 486 H VAL 67 H VAL 67 12.107 -9.290 12.224 487 HA VAL 67 HA VAL 67 10.237 -10.528 13.879 488 HB VAL 67 HB VAL 67 11.821 -10.081 15.744 489 HG11 VAL 67 1HG1 VAL 67 13.672 -11.388 14.811 490 HG12 VAL 67 2HG1 VAL 67 13.075 -11.068 13.183 491 HG13 VAL 67 3HG1 VAL 67 12.108 -12.024 14.306 492 HG21 VAL 67 3HG2 VAL 67 13.963 -8.986 15.253 493 HG22 VAL 67 1HG2 VAL 67 12.608 -7.872 15.074 494 HG23 VAL 67 2HG2 VAL 67 13.375 -8.565 13.645 495 H ARG 68 H ARG 68 8.784 -9.840 15.327 496 HA ARG 68 HA ARG 68 8.080 -7.024 15.213 497 HE ARG 68 HE ARG 68 3.166 -6.806 17.523 498 HB2 ARG 68 1HB ARG 68 6.377 -8.800 14.858 499 HB3 ARG 68 2HB ARG 68 6.617 -9.326 16.518 500 HG2 ARG 68 1HG ARG 68 5.764 -7.255 17.363 501 HG3 ARG 68 2HG ARG 68 5.689 -6.572 15.737 502 HD2 ARG 68 1HD ARG 68 4.035 -8.275 15.114 503 HD3 ARG 68 2HD ARG 68 4.097 -8.923 16.753 504 HH11 ARG 68 1HH1 ARG 68 2.947 -7.479 14.086 505 HH12 ARG 68 2HH1 ARG 68 1.579 -6.433 13.853 506 HH21 ARG 68 1HH2 ARG 68 1.374 -5.441 17.208 507 HH22 ARG 68 2HH2 ARG 68 0.676 -5.291 15.623 508 H ASP 69 H ASP 69 9.575 -9.252 17.354 509 HA ASP 69 HA ASP 69 9.522 -7.205 19.471 510 HB2 ASP 69 1HB ASP 69 9.722 -10.204 19.666 511 HB3 ASP 69 2HB ASP 69 10.233 -9.156 20.986 512 HA PRO 70 HA PRO 70 13.777 -7.094 17.902 513 HB2 PRO 70 1HB PRO 70 13.793 -4.366 18.902 514 HB3 PRO 70 2HB PRO 70 13.925 -4.939 17.238 515 HG2 PRO 70 1HG PRO 70 11.756 -3.600 18.173 516 HG3 PRO 70 2HG PRO 70 11.665 -4.802 16.873 517 HD2 PRO 70 1HD PRO 70 10.999 -5.097 19.779 518 HD3 PRO 70 2HD PRO 70 10.138 -5.721 18.354 519 H LEU 71 H LEU 71 12.456 -6.474 21.025 520 HA LEU 71 HA LEU 71 15.090 -6.315 22.264 521 HG LEU 71 HG LEU 71 12.964 -4.071 22.261 522 HB2 LEU 71 1HB LEU 71 12.311 -6.118 23.415 523 HB3 LEU 71 2HB LEU 71 13.772 -6.061 24.383 524 HD11 LEU 71 1HD1 LEU 71 12.784 -2.520 24.143 525 HD12 LEU 71 2HD1 LEU 71 13.151 -3.836 25.259 526 HD13 LEU 71 3HD1 LEU 71 11.667 -3.877 24.307 527 HD21 LEU 71 3HD2 LEU 71 15.383 -4.377 22.308 528 HD22 LEU 71 1HD2 LEU 71 15.390 -4.124 24.053 529 HD23 LEU 71 2HD2 LEU 71 14.932 -2.806 22.972 530 H ALA 72 H ALA 72 13.532 -8.725 21.001 531 HA ALA 72 HA ALA 72 13.786 -10.617 23.203 532 HB1 ALA 72 3HB ALA 72 12.897 -12.260 21.617 533 HB2 ALA 72 1HB ALA 72 12.924 -11.043 20.341 534 HB3 ALA 72 2HB ALA 72 11.853 -10.843 21.728 535 H PHE 73 H PHE 73 15.048 -12.626 22.806 536 HA PHE 73 HA PHE 73 17.683 -11.878 21.875 537 HD1 PHE 73 HD2 PHE 73 19.226 -11.927 23.992 538 HD2 PHE 73 HD1 PHE 73 15.674 -14.007 25.071 539 HE1 PHE 73 HE2 PHE 73 19.293 -10.881 26.216 540 HE2 PHE 73 HE1 PHE 73 15.733 -12.963 27.296 541 HZ PHE 73 HZ PHE 73 17.546 -11.398 27.872 542 HB2 PHE 73 1HB PHE 73 16.704 -14.489 23.054 543 HB3 PHE 73 2HB PHE 73 18.387 -14.043 22.793 544 H LEU 74 H LEU 74 14.997 -13.779 20.820 545 HA LEU 74 HA LEU 74 14.458 -14.714 18.826 546 HG LEU 74 HG LEU 74 15.192 -11.661 18.873 547 HB2 LEU 74 1HB LEU 74 16.838 -13.173 17.792 548 HB3 LEU 74 2HB LEU 74 15.544 -13.848 16.820 549 HD11 LEU 74 1HD1 LEU 74 15.284 -11.506 15.865 550 HD12 LEU 74 2HD1 LEU 74 16.513 -10.899 16.975 551 HD13 LEU 74 3HD1 LEU 74 14.903 -10.177 16.960 552 HD21 LEU 74 3HD2 LEU 74 12.974 -11.408 17.872 553 HD22 LEU 74 1HD2 LEU 74 13.189 -13.015 18.567 554 HD23 LEU 74 2HD2 LEU 74 13.290 -12.790 16.821 555 H ASP 75 H ASP 75 16.669 -15.848 20.610 556 HA ASP 75 HA ASP 75 17.983 -17.691 20.713 557 HB2 ASP 75 1HB ASP 75 16.014 -18.706 19.526 558 HB3 ASP 75 2HB ASP 75 16.839 -18.408 18.003 559 H GLU 76 H GLU 76 18.748 -15.158 19.164 560 HA GLU 76 HA GLU 76 20.932 -16.272 17.545 561 HB2 GLU 76 1HB GLU 76 19.947 -13.416 17.689 562 HB3 GLU 76 2HB GLU 76 21.149 -14.047 16.572 563 HG2 GLU 76 1HG GLU 76 19.362 -15.586 15.696 564 HG3 GLU 76 2HG GLU 76 18.211 -14.662 16.659 565 HA PRO 77 HA PRO 77 23.688 -15.332 20.840 566 HB2 PRO 77 1HB PRO 77 26.041 -15.631 19.554 567 HB3 PRO 77 2HB PRO 77 24.989 -16.999 19.935 568 HG2 PRO 77 1HG PRO 77 25.337 -15.538 17.352 569 HG3 PRO 77 2HG PRO 77 25.169 -17.278 17.640 570 HD2 PRO 77 1HD PRO 77 23.119 -15.667 16.804 571 HD3 PRO 77 2HD PRO 77 22.884 -17.165 17.724 572 H GLU 78 H GLU 78 23.954 -13.548 17.816 573 HA GLU 78 HA GLU 78 25.527 -11.481 19.169 574 HB2 GLU 78 1HB GLU 78 24.915 -11.900 16.242 575 HB3 GLU 78 2HB GLU 78 25.822 -10.535 16.879 576 HG2 GLU 78 1HG GLU 78 27.503 -12.090 17.764 577 HG3 GLU 78 2HG GLU 78 26.604 -13.435 17.060 578 H ALA 79 H ALA 79 24.677 -9.626 19.768 579 HA ALA 79 HA ALA 79 22.034 -8.878 18.690 580 HB1 ALA 79 3HB ALA 79 21.856 -9.637 21.012 581 HB2 ALA 79 1HB ALA 79 21.490 -7.918 20.868 582 HB3 ALA 79 2HB ALA 79 23.054 -8.437 21.496 583 H GLY 80 H GLY 80 21.655 -6.639 18.417 584 HA2 GLY 80 1HA GLY 80 23.397 -4.577 19.089 585 HA3 GLY 80 2HA GLY 80 23.896 -5.173 17.512 586 H ALA 81 H ALA 81 23.168 -3.894 15.967 587 HA ALA 81 HA ALA 81 20.868 -2.226 16.305 588 HB1 ALA 81 3HB ALA 81 22.458 -2.832 13.813 589 HB2 ALA 81 1HB ALA 81 22.776 -1.520 14.946 590 HB3 ALA 81 2HB ALA 81 21.287 -1.527 14.003 591 H GLY 82 H GLY 82 18.957 -3.242 16.474 592 HA2 GLY 82 1HA GLY 82 18.315 -5.287 14.450 593 HA3 GLY 82 2HA GLY 82 17.618 -5.235 16.063 594 H ALA 83 H ALA 83 15.513 -5.161 15.397 595 HA ALA 83 HA ALA 83 14.589 -3.392 13.368 596 HB1 ALA 83 3HB ALA 83 12.364 -4.164 13.987 597 HB2 ALA 83 1HB ALA 83 13.015 -4.912 15.445 598 HB3 ALA 83 2HB ALA 83 13.481 -5.524 13.858 599 H ARG 84 H ARG 84 14.287 -1.288 13.564 600 HA ARG 84 HA ARG 84 13.306 -0.236 16.125 601 HE ARG 84 HE ARG 84 17.838 1.197 13.213 602 HB2 ARG 84 1HB ARG 84 14.790 1.563 16.121 603 HB3 ARG 84 2HB ARG 84 15.806 0.239 15.569 604 HG2 ARG 84 1HG ARG 84 15.492 0.980 13.254 605 HG3 ARG 84 2HG ARG 84 14.502 2.323 13.828 606 HD2 ARG 84 1HD ARG 84 16.554 3.334 13.597 607 HD3 ARG 84 2HD ARG 84 16.585 2.863 15.295 608 HH11 ARG 84 1HH1 ARG 84 18.002 2.897 16.270 609 HH12 ARG 84 2HH1 ARG 84 19.629 2.385 16.608 610 HH21 ARG 84 1HH2 ARG 84 19.957 0.542 13.631 611 HH22 ARG 84 2HH2 ARG 84 20.756 1.059 15.091 612 HA PRO 85 HA PRO 85 10.016 1.660 13.843 613 HB2 PRO 85 1HB PRO 85 10.722 4.196 15.234 614 HB3 PRO 85 2HB PRO 85 9.166 3.363 15.133 615 HG2 PRO 85 1HG PRO 85 10.607 3.274 17.368 616 HG3 PRO 85 2HG PRO 85 9.720 1.848 16.800 617 HD2 PRO 85 1HD PRO 85 12.642 2.445 16.662 618 HD3 PRO 85 2HD PRO 85 11.817 0.898 16.942 619 H ALA 86 H ALA 86 13.085 3.399 14.040 620 HA ALA 86 HA ALA 86 12.543 5.163 11.869 621 HB1 ALA 86 3HB ALA 86 14.165 5.694 13.623 622 HB2 ALA 86 1HB ALA 86 14.884 5.780 12.015 623 HB3 ALA 86 2HB ALA 86 15.204 4.389 13.050 624 H ASN 87 H ASN 87 13.339 1.850 11.900 625 HA ASN 87 HA ASN 87 14.764 1.874 9.376 626 HB2 ASN 87 1HB ASN 87 13.562 -0.440 10.916 627 HB3 ASN 87 2HB ASN 87 14.507 -0.604 9.445 628 HD21 ASN 87 2HD2 ASN 87 15.036 -1.808 11.928 629 HD22 ASN 87 1HD2 ASN 87 16.570 -1.222 12.489 630 H ALA 88 H ALA 88 11.538 1.904 10.439 631 HA ALA 88 HA ALA 88 10.342 0.494 8.270 632 HB1 ALA 88 3HB ALA 88 9.111 2.449 10.210 633 HB2 ALA 88 1HB ALA 88 9.241 0.706 10.446 634 HB3 ALA 88 2HB ALA 88 8.233 1.349 9.149 635 HA PRO 89 HA PRO 89 10.341 3.474 5.020 636 HB2 PRO 89 1HB PRO 89 7.506 2.675 4.597 637 HB3 PRO 89 2HB PRO 89 8.854 2.688 3.455 638 HG2 PRO 89 1HG PRO 89 7.972 0.396 4.458 639 HG3 PRO 89 2HG PRO 89 9.710 0.675 4.240 640 HD2 PRO 89 1HD PRO 89 8.073 0.775 6.743 641 HD3 PRO 89 2HD PRO 89 9.709 0.131 6.489 642 H GLU 90 H GLU 90 9.233 5.406 4.246 643 HA GLU 90 HA GLU 90 8.498 7.035 6.473 644 HB2 GLU 90 1HB GLU 90 8.335 7.786 3.554 645 HB3 GLU 90 2HB GLU 90 8.517 8.864 4.931 646 HG2 GLU 90 1HG GLU 90 10.566 6.891 3.946 647 HG3 GLU 90 2HG GLU 90 10.593 8.634 3.689 648 H VAL 91 H VAL 91 6.808 5.922 3.541 649 HA VAL 91 HA VAL 91 4.265 6.227 4.932 650 HB VAL 91 HB VAL 91 4.632 8.438 3.907 651 HG11 VAL 91 1HG1 VAL 91 4.699 6.935 1.297 652 HG12 VAL 91 2HG1 VAL 91 6.030 7.827 2.034 653 HG13 VAL 91 3HG1 VAL 91 4.600 8.689 1.462 654 HG21 VAL 91 3HG2 VAL 91 2.508 8.605 2.687 655 HG22 VAL 91 1HG2 VAL 91 2.353 7.646 4.160 656 HG23 VAL 91 2HG2 VAL 91 2.436 6.846 2.591 657 H LEU 92 H LEU 92 2.650 4.889 4.162 658 HA LEU 92 HA LEU 92 3.297 3.335 1.748 659 HG LEU 92 HG LEU 92 0.454 2.780 4.063 660 HB2 LEU 92 1HB LEU 92 2.149 1.427 2.611 661 HB3 LEU 92 2HB LEU 92 3.326 1.942 3.800 662 HD11 LEU 92 1HD1 LEU 92 0.427 0.357 3.756 663 HD12 LEU 92 2HD1 LEU 92 0.048 0.791 5.423 664 HD13 LEU 92 3HD1 LEU 92 1.650 0.179 5.013 665 HD21 LEU 92 3HD2 LEU 92 2.663 2.257 6.052 666 HD22 LEU 92 1HD2 LEU 92 1.028 2.788 6.445 667 HD23 LEU 92 2HD2 LEU 92 2.098 3.840 5.521 668 H LEU 93 H LEU 93 1.880 3.331 0.154 669 HA LEU 93 HA LEU 93 -0.542 4.947 0.470 670 HG LEU 93 HG LEU 93 2.234 5.594 -0.938 671 HB2 LEU 93 1HB LEU 93 0.790 3.923 -2.041 672 HB3 LEU 93 2HB LEU 93 -0.551 5.049 -1.970 673 HD11 LEU 93 1HD1 LEU 93 2.406 7.116 -2.840 674 HD12 LEU 93 2HD1 LEU 93 0.820 6.590 -3.406 675 HD13 LEU 93 3HD1 LEU 93 2.165 5.450 -3.366 676 HD21 LEU 93 3HD2 LEU 93 0.518 6.795 0.312 677 HD22 LEU 93 1HD2 LEU 93 -0.169 7.401 -1.195 678 HD23 LEU 93 2HD2 LEU 93 1.450 7.898 -0.701 679 H VAL 94 H VAL 94 -2.456 4.000 0.619 680 HA VAL 94 HA VAL 94 -2.664 1.157 -0.089 681 HB VAL 94 HB VAL 94 -4.564 2.830 1.568 682 HG11 VAL 94 1HG1 VAL 94 -4.408 -0.152 1.135 683 HG12 VAL 94 2HG1 VAL 94 -5.651 0.931 0.507 684 HG13 VAL 94 3HG1 VAL 94 -5.506 0.668 2.245 685 HG21 VAL 94 3HG2 VAL 94 -3.630 1.649 3.504 686 HG22 VAL 94 1HG2 VAL 94 -2.409 2.619 2.680 687 HG23 VAL 94 2HG2 VAL 94 -2.447 0.871 2.453 688 H GLY 95 H GLY 95 -3.314 0.884 -2.114 689 HA2 GLY 95 1HA GLY 95 -5.206 2.698 -3.366 690 HA3 GLY 95 2HA GLY 95 -4.439 1.297 -4.110 691 H THR 96 H THR 96 -7.272 2.511 -2.845 692 HA THR 96 HA THR 96 -8.310 0.228 -1.536 693 HB THR 96 HB THR 96 -10.534 1.537 -1.977 694 HG1 THR 96 HG1 THR 96 -9.945 3.033 -3.460 695 HG21 THR 96 3HG2 THR 96 -10.012 3.002 -0.079 696 HG22 THR 96 1HG2 THR 96 -8.294 2.657 -0.284 697 HG23 THR 96 2HG2 THR 96 -9.403 1.369 0.190 698 H GLY 97 H GLY 97 -7.991 0.932 -4.856 699 HA2 GLY 97 1HA GLY 97 -8.313 -0.518 -6.610 700 HA3 GLY 97 2HA GLY 97 -8.979 -1.675 -5.474 701 H ARG 98 H ARG 98 -11.225 -1.481 -4.904 702 HA ARG 98 HA ARG 98 -12.801 -1.306 -7.226 703 HE ARG 98 HE ARG 98 -14.504 -5.613 -6.265 704 HB2 ARG 98 1HB ARG 98 -13.742 -1.396 -4.353 705 HB3 ARG 98 2HB ARG 98 -14.689 -1.825 -5.773 706 HG2 ARG 98 1HG ARG 98 -12.185 -3.243 -4.879 707 HG3 ARG 98 2HG ARG 98 -13.831 -3.787 -4.551 708 HD2 ARG 98 1HD ARG 98 -13.185 -3.219 -7.375 709 HD3 ARG 98 2HD ARG 98 -12.374 -4.610 -6.662 710 HH11 ARG 98 1HH1 ARG 98 -14.605 -2.701 -8.227 711 HH12 ARG 98 2HH1 ARG 98 -16.185 -3.040 -8.868 712 HH21 ARG 98 1HH2 ARG 98 -16.546 -6.091 -7.163 713 HH22 ARG 98 2HH2 ARG 98 -17.286 -4.960 -8.266 714 H ARG 99 H ARG 99 -12.553 0.831 -4.417 715 HA ARG 99 HA ARG 99 -12.700 3.131 -6.022 716 HE ARG 99 HE ARG 99 -17.846 2.979 -2.241 717 HB2 ARG 99 1HB ARG 99 -14.767 4.099 -5.523 718 HB3 ARG 99 2HB ARG 99 -15.180 2.430 -5.875 719 HG2 ARG 99 1HG ARG 99 -15.546 1.932 -3.606 720 HG3 ARG 99 2HG ARG 99 -14.756 3.420 -3.074 721 HD2 ARG 99 1HD ARG 99 -16.561 4.698 -4.241 722 HD3 ARG 99 2HD ARG 99 -17.379 3.165 -4.539 723 HH11 ARG 99 1HH1 ARG 99 -16.127 5.922 -3.038 724 HH12 ARG 99 2HH1 ARG 99 -16.559 6.745 -1.569 725 HH21 ARG 99 1HH2 ARG 99 -18.451 4.070 -0.304 726 HH22 ARG 99 2HH2 ARG 99 -17.894 5.691 -0.016 727 H GLN 100 H GLN 100 -12.488 5.106 -4.699 728 HA GLN 100 HA GLN 100 -10.618 4.675 -2.650 729 HB2 GLN 100 1HB GLN 100 -10.625 6.697 -4.030 730 HB3 GLN 100 2HB GLN 100 -12.149 7.196 -3.308 731 HG2 GLN 100 1HG GLN 100 -11.056 7.339 -1.121 732 HG3 GLN 100 2HG GLN 100 -9.528 6.867 -1.862 733 HE21 GLN 100 2HE2 GLN 100 -10.276 9.292 -0.420 734 HE22 GLN 100 1HE2 GLN 100 -9.935 10.607 -1.491 735 H HIS 101 H HIS 101 -10.718 4.642 -0.504 736 HA HIS 101 HA HIS 101 -13.217 5.361 0.851 737 HD1 HIS 101 HD1 HIS 101 -12.617 1.361 -0.544 738 HD2 HIS 101 HD2 HIS 101 -15.523 3.596 1.393 739 HE1 HIS 101 HE1 HIS 101 -14.814 0.508 -1.422 740 HE2 HIS 101 HE2 HIS 101 -16.546 1.688 -0.021 741 HB2 HIS 101 1HB HIS 101 -11.660 2.797 1.219 742 HB3 HIS 101 2HB HIS 101 -12.784 3.405 2.429 743 H LEU 102 H LEU 102 -12.844 5.673 3.220 744 HA LEU 102 HA LEU 102 -10.159 6.809 3.624 745 HG LEU 102 HG LEU 102 -10.754 7.888 6.459 746 HB2 LEU 102 1HB LEU 102 -12.008 8.421 3.762 747 HB3 LEU 102 2HB LEU 102 -12.750 7.464 5.031 748 HD11 LEU 102 1HD1 LEU 102 -9.988 9.793 4.252 749 HD12 LEU 102 2HD1 LEU 102 -9.135 8.312 4.685 750 HD13 LEU 102 3HD1 LEU 102 -9.202 9.656 5.825 751 HD21 LEU 102 3HD2 LEU 102 -12.760 9.238 6.702 752 HD22 LEU 102 1HD2 LEU 102 -12.193 10.334 5.441 753 HD23 LEU 102 2HD2 LEU 102 -11.316 10.216 6.966 754 H LEU 103 H LEU 103 -8.911 5.410 4.662 755 HA LEU 103 HA LEU 103 -9.920 3.591 6.645 756 HG LEU 103 HG LEU 103 -7.889 3.592 3.987 757 HB2 LEU 103 1HB LEU 103 -7.041 4.343 6.131 758 HB3 LEU 103 2HB LEU 103 -7.635 2.892 6.914 759 HD11 LEU 103 1HD1 LEU 103 -5.672 2.852 4.630 760 HD12 LEU 103 2HD1 LEU 103 -6.483 1.616 3.667 761 HD13 LEU 103 3HD1 LEU 103 -6.357 1.428 5.417 762 HD21 LEU 103 3HD2 LEU 103 -8.897 1.144 5.437 763 HD22 LEU 103 1HD2 LEU 103 -8.949 1.421 3.695 764 HD23 LEU 103 2HD2 LEU 103 -9.904 2.434 4.778 765 H GLY 104 H GLY 104 -9.893 3.870 8.860 766 HA2 GLY 104 1HA GLY 104 -9.530 6.700 9.591 767 HA3 GLY 104 2HA GLY 104 -10.716 5.622 10.301 768 HA PRO 105 HA PRO 105 -6.928 6.199 13.000 769 HB2 PRO 105 1HB PRO 105 -8.207 7.112 15.197 770 HB3 PRO 105 2HB PRO 105 -7.741 8.168 13.859 771 HG2 PRO 105 1HG PRO 105 -10.405 6.938 14.461 772 HG3 PRO 105 2HG PRO 105 -10.027 8.596 13.953 773 HD2 PRO 105 1HD PRO 105 -10.922 6.705 12.232 774 HD3 PRO 105 2HD PRO 105 -9.817 8.004 11.739 775 H GLU 106 H GLU 106 -9.525 4.138 12.942 776 HA GLU 106 HA GLU 106 -8.706 2.717 15.365 777 HB2 GLU 106 1HB GLU 106 -11.139 3.013 14.809 778 HB3 GLU 106 2HB GLU 106 -10.886 1.999 13.396 779 HG2 GLU 106 1HG GLU 106 -11.858 0.728 15.212 780 HG3 GLU 106 2HG GLU 106 -10.239 0.141 14.834 781 H GLN 107 H GLN 107 -8.383 2.721 11.944 782 HA GLN 107 HA GLN 107 -7.431 -0.040 11.864 783 HB2 GLN 107 1HB GLN 107 -8.026 1.942 9.662 784 HB3 GLN 107 2HB GLN 107 -7.468 0.294 9.398 785 HG2 GLN 107 1HG GLN 107 -9.465 -0.623 10.266 786 HG3 GLN 107 2HG GLN 107 -9.981 0.932 10.914 787 HE21 GLN 107 2HE2 GLN 107 -11.327 -0.909 9.076 788 HE22 GLN 107 1HE2 GLN 107 -11.667 0.020 7.656 789 H VAL 108 H VAL 108 -6.344 3.223 10.928 790 HA VAL 108 HA VAL 108 -3.704 2.151 10.312 791 HB VAL 108 HB VAL 108 -3.189 4.368 9.425 792 HG11 VAL 108 1HG1 VAL 108 -5.843 3.290 8.483 793 HG12 VAL 108 2HG1 VAL 108 -4.248 2.741 7.964 794 HG13 VAL 108 3HG1 VAL 108 -4.792 4.372 7.570 795 HG21 VAL 108 3HG2 VAL 108 -4.919 6.105 9.315 796 HG22 VAL 108 1HG2 VAL 108 -4.476 5.730 10.980 797 HG23 VAL 108 2HG2 VAL 108 -5.981 5.105 10.306 798 H ARG 109 H ARG 109 -5.049 2.920 13.096 799 HA ARG 109 HA ARG 109 -3.498 4.960 14.215 800 HE ARG 109 HE ARG 109 -4.713 2.409 18.757 801 HB2 ARG 109 1HB ARG 109 -5.596 4.084 15.197 802 HB3 ARG 109 2HB ARG 109 -4.733 2.631 15.681 803 HG2 ARG 109 1HG ARG 109 -3.305 3.920 17.143 804 HG3 ARG 109 2HG ARG 109 -4.057 5.421 16.597 805 HD2 ARG 109 1HD ARG 109 -5.002 4.813 18.716 806 HD3 ARG 109 2HD ARG 109 -6.224 4.596 17.466 807 HH11 ARG 109 1HH1 ARG 109 -7.521 3.600 17.035 808 HH12 ARG 109 2HH1 ARG 109 -8.438 2.139 17.261 809 HH21 ARG 109 1HH2 ARG 109 -5.939 0.484 19.064 810 HH22 ARG 109 2HH2 ARG 109 -7.540 0.382 18.393 811 HA PRO 110 HA PRO 110 -0.623 1.407 16.082 812 HB2 PRO 110 1HB PRO 110 -0.918 -0.490 13.794 813 HB3 PRO 110 2HB PRO 110 -0.635 -0.825 15.507 814 HG2 PRO 110 1HG PRO 110 -3.044 -1.189 14.500 815 HG3 PRO 110 2HG PRO 110 -2.862 -0.411 16.084 816 HD2 PRO 110 1HD PRO 110 -3.430 0.832 13.416 817 HD3 PRO 110 2HD PRO 110 -4.135 1.203 15.005 818 H LEU 111 H LEU 111 -0.967 2.069 12.629 819 HA LEU 111 HA LEU 111 1.817 1.949 12.024 820 HG LEU 111 HG LEU 111 -0.960 1.131 10.680 821 HB2 LEU 111 1HB LEU 111 -0.324 3.528 10.597 822 HB3 LEU 111 2HB LEU 111 1.239 3.065 9.954 823 HD11 LEU 111 1HD1 LEU 111 -1.287 0.892 8.292 824 HD12 LEU 111 2HD1 LEU 111 -0.039 2.095 7.976 825 HD13 LEU 111 3HD1 LEU 111 -1.540 2.567 8.774 826 HD21 LEU 111 3HD2 LEU 111 1.655 0.724 9.229 827 HD22 LEU 111 1HD2 LEU 111 0.413 -0.500 9.487 828 HD23 LEU 111 2HD2 LEU 111 1.285 0.176 10.864 829 H LEU 112 H LEU 112 -0.442 4.587 12.681 830 HA LEU 112 HA LEU 112 1.427 6.692 12.552 831 HG LEU 112 HG LEU 112 -1.612 6.037 11.807 832 HB2 LEU 112 1HB LEU 112 -1.121 6.576 14.168 833 HB3 LEU 112 2HB LEU 112 -0.280 8.025 13.651 834 HD11 LEU 112 1HD1 LEU 112 -3.243 7.259 13.126 835 HD12 LEU 112 2HD1 LEU 112 -3.270 7.800 11.447 836 HD13 LEU 112 3HD1 LEU 112 -2.484 8.786 12.681 837 HD21 LEU 112 3HD2 LEU 112 -1.232 7.721 10.077 838 HD22 LEU 112 1HD2 LEU 112 0.288 7.149 10.763 839 HD23 LEU 112 2HD2 LEU 112 -0.357 8.720 11.237 840 H ALA 113 H ALA 113 0.437 4.531 15.109 841 HA ALA 113 HA ALA 113 1.649 5.882 17.275 842 HB1 ALA 113 3HB ALA 113 -0.068 4.159 17.559 843 HB2 ALA 113 1HB ALA 113 1.388 3.786 18.482 844 HB3 ALA 113 2HB ALA 113 1.061 2.940 16.969 845 H MET 114 H MET 114 2.906 3.777 14.806 846 HA MET 114 HA MET 114 5.407 3.367 16.224 847 HB2 MET 114 1HB MET 114 4.516 2.541 13.458 848 HB3 MET 114 2HB MET 114 6.092 2.165 14.140 849 HG2 MET 114 1HG MET 114 5.022 0.896 15.926 850 HG3 MET 114 2HG MET 114 3.439 1.278 15.251 851 HE1 MET 114 3HE MET 114 2.648 0.458 12.823 852 HE2 MET 114 1HE MET 114 3.628 -0.567 11.775 853 HE3 MET 114 2HE MET 114 4.126 1.093 12.102 854 H GLY 115 H GLY 115 4.114 5.337 13.633 855 HA2 GLY 115 1HA GLY 115 5.221 7.560 13.464 856 HA3 GLY 115 2HA GLY 115 6.743 6.682 13.454 857 H VAL 116 H VAL 116 4.506 4.922 11.760 858 HA VAL 116 HA VAL 116 5.728 5.689 9.237 859 HB VAL 116 HB VAL 116 3.704 3.500 9.742 860 HG11 VAL 116 1HG1 VAL 116 3.894 4.148 7.405 861 HG12 VAL 116 2HG1 VAL 116 4.591 2.549 7.661 862 HG13 VAL 116 3HG1 VAL 116 5.645 3.950 7.476 863 HG21 VAL 116 3HG2 VAL 116 5.611 1.959 9.820 864 HG22 VAL 116 1HG2 VAL 116 5.662 3.131 11.137 865 HG23 VAL 116 2HG2 VAL 116 6.715 3.332 9.737 866 H GLY 117 H GLY 117 4.746 6.874 7.701 867 HA2 GLY 117 1HA GLY 117 2.130 7.982 8.263 868 HA3 GLY 117 2HA GLY 117 3.177 8.396 6.911 869 H VAL 118 H VAL 118 0.257 7.621 7.158 870 HA VAL 118 HA VAL 118 0.332 5.531 5.086 871 HB VAL 118 HB VAL 118 -0.471 4.565 7.204 872 HG11 VAL 118 1HG1 VAL 118 -1.396 6.555 8.232 873 HG12 VAL 118 2HG1 VAL 118 -2.612 5.279 8.161 874 HG13 VAL 118 3HG1 VAL 118 -2.670 6.618 7.014 875 HG21 VAL 118 3HG2 VAL 118 -2.567 3.606 6.366 876 HG22 VAL 118 1HG2 VAL 118 -1.323 3.662 5.117 877 HG23 VAL 118 2HG2 VAL 118 -2.629 4.848 5.115 878 H GLU 119 H GLU 119 -1.129 5.766 3.386 879 HA GLU 119 HA GLU 119 -2.968 8.030 3.480 880 HB2 GLU 119 1HB GLU 119 -0.786 8.818 2.511 881 HB3 GLU 119 2HB GLU 119 -1.019 7.669 1.200 882 HG2 GLU 119 1HG GLU 119 -1.687 9.951 0.601 883 HG3 GLU 119 2HG GLU 119 -3.022 8.802 0.499 884 H ALA 120 H ALA 120 -4.818 7.680 2.403 885 HA ALA 120 HA ALA 120 -5.089 5.131 0.969 886 HB1 ALA 120 3HB ALA 120 -7.497 5.400 1.301 887 HB2 ALA 120 1HB ALA 120 -7.223 6.963 2.070 888 HB3 ALA 120 2HB ALA 120 -6.634 5.488 2.837 889 H MET 121 H MET 121 -5.411 5.101 -1.184 890 HA MET 121 HA MET 121 -6.242 7.535 -2.562 891 HB2 MET 121 1HB MET 121 -3.684 7.472 -2.187 892 HB3 MET 121 2HB MET 121 -3.678 6.178 -3.374 893 HG2 MET 121 1HG MET 121 -4.575 7.651 -5.051 894 HG3 MET 121 2HG MET 121 -4.749 8.946 -3.867 895 HE1 MET 121 3HE MET 121 -0.950 9.604 -2.960 896 HE2 MET 121 1HE MET 121 -2.021 8.436 -2.186 897 HE3 MET 121 2HE MET 121 -2.619 10.043 -2.595 898 H ASP 122 H ASP 122 -6.650 7.119 -4.890 899 HA ASP 122 HA ASP 122 -7.871 4.553 -5.268 900 HB2 ASP 122 1HB ASP 122 -8.726 6.755 -6.202 901 HB3 ASP 122 2HB ASP 122 -7.423 6.668 -7.381 902 H THR 123 H THR 123 -7.399 3.222 -7.242 903 HA THR 123 HA THR 123 -4.963 2.013 -6.877 904 HB THR 123 HB THR 123 -6.402 1.849 -9.510 905 HG1 THR 123 HG1 THR 123 -8.123 1.114 -8.520 906 HG21 THR 123 3HG2 THR 123 -5.044 -0.206 -7.758 907 HG22 THR 123 1HG2 THR 123 -4.379 0.499 -9.231 908 HG23 THR 123 2HG2 THR 123 -5.810 -0.527 -9.313 909 H GLN 124 H GLN 124 -5.823 3.834 -9.833 910 HA GLN 124 HA GLN 124 -3.237 3.717 -10.933 911 HB2 GLN 124 1HB GLN 124 -5.180 4.051 -12.315 912 HB3 GLN 124 2HB GLN 124 -5.558 5.558 -11.497 913 HG2 GLN 124 1HG GLN 124 -3.658 6.635 -12.452 914 HG3 GLN 124 2HG GLN 124 -3.061 5.111 -13.111 915 HE21 GLN 124 2HE2 GLN 124 -3.056 6.028 -15.194 916 HE22 GLN 124 1HE2 GLN 124 -4.522 6.228 -16.092 917 H ALA 125 H ALA 125 -4.875 6.298 -9.130 918 HA ALA 125 HA ALA 125 -2.853 8.226 -9.332 919 HB1 ALA 125 3HB ALA 125 -4.822 7.832 -7.080 920 HB2 ALA 125 1HB ALA 125 -5.121 8.731 -8.568 921 HB3 ALA 125 2HB ALA 125 -3.911 9.303 -7.421 922 H ALA 126 H ALA 126 -3.331 5.621 -6.983 923 HA ALA 126 HA ALA 126 -1.233 6.332 -5.239 924 HB1 ALA 126 3HB ALA 126 -2.981 4.730 -4.629 925 HB2 ALA 126 1HB ALA 126 -1.370 4.049 -4.406 926 HB3 ALA 126 2HB ALA 126 -2.339 3.583 -5.804 927 H ALA 127 H ALA 127 -1.337 4.193 -8.064 928 HA ALA 127 HA ALA 127 1.324 3.314 -7.980 929 HB1 ALA 127 3HB ALA 127 -0.392 2.294 -9.403 930 HB2 ALA 127 1HB ALA 127 1.039 2.742 -10.331 931 HB3 ALA 127 2HB ALA 127 -0.414 3.740 -10.411 932 H ARG 128 H ARG 128 -0.147 6.169 -9.444 933 HA ARG 128 HA ARG 128 2.106 7.192 -10.760 934 HE ARG 128 HE ARG 128 0.332 11.309 -8.879 935 HB2 ARG 128 1HB ARG 128 -0.194 8.063 -11.052 936 HB3 ARG 128 2HB ARG 128 -0.136 8.726 -9.425 937 HG2 ARG 128 1HG ARG 128 1.863 10.074 -10.189 938 HG3 ARG 128 2HG ARG 128 1.450 9.573 -11.829 939 HD2 ARG 128 1HD ARG 128 0.440 11.689 -11.501 940 HD3 ARG 128 2HD ARG 128 -0.854 10.496 -11.408 941 HH11 ARG 128 1HH1 ARG 128 -2.304 11.682 -11.168 942 HH12 ARG 128 2HH1 ARG 128 -3.330 12.499 -10.027 943 HH21 ARG 128 1HH2 ARG 128 -1.015 12.373 -7.391 944 HH22 ARG 128 2HH2 ARG 128 -2.599 12.905 -7.886 945 H THR 129 H THR 129 0.813 7.986 -7.548 946 HA THR 129 HA THR 129 2.849 9.751 -6.788 947 HB THR 129 HB THR 129 1.214 8.033 -4.913 948 HG1 THR 129 HG1 THR 129 -0.373 8.995 -6.013 949 HG21 THR 129 3HG2 THR 129 1.413 9.962 -3.409 950 HG22 THR 129 1HG2 THR 129 2.397 10.799 -4.610 951 HG23 THR 129 2HG2 THR 129 3.000 9.328 -3.846 952 H TYR 130 H TYR 130 2.530 6.257 -6.403 953 HA TYR 130 HA TYR 130 4.724 5.799 -4.726 954 HD1 TYR 130 HD1 TYR 130 5.273 3.522 -3.620 955 HD2 TYR 130 HD2 TYR 130 4.803 2.428 -7.706 956 HE1 TYR 130 HE1 TYR 130 6.944 1.741 -3.332 957 HE2 TYR 130 HE2 TYR 130 6.474 0.647 -7.429 958 HH TYR 130 HH TYR 130 8.264 -0.005 -6.012 959 HB2 TYR 130 1HB TYR 130 3.123 4.051 -5.107 960 HB3 TYR 130 2HB TYR 130 3.435 4.067 -6.838 961 H ASN 131 H ASN 131 4.530 5.773 -8.286 962 HA ASN 131 HA ASN 131 7.220 5.101 -8.737 963 HB2 ASN 131 1HB ASN 131 5.430 4.987 -10.462 964 HB3 ASN 131 2HB ASN 131 5.417 6.746 -10.529 965 HD21 ASN 131 2HD2 ASN 131 7.014 7.813 -11.643 966 HD22 ASN 131 1HD2 ASN 131 8.215 6.994 -12.583 967 H ILE 132 H ILE 132 5.618 8.229 -8.388 968 HA ILE 132 HA ILE 132 7.804 9.875 -8.992 969 HB ILE 132 HB ILE 132 5.527 10.409 -7.073 970 HG12 ILE 132 1HG1 ILE 132 5.867 11.193 -9.978 971 HG13 ILE 132 2HG1 ILE 132 4.839 9.885 -9.403 972 HG21 ILE 132 1HG2 ILE 132 7.447 12.333 -8.384 973 HG22 ILE 132 2HG2 ILE 132 7.396 11.917 -6.671 974 HG23 ILE 132 3HG2 ILE 132 6.047 12.780 -7.409 975 HD11 ILE 132 3HD1 ILE 132 4.514 12.804 -8.747 976 HD12 ILE 132 1HD1 ILE 132 3.481 11.496 -8.172 977 HD13 ILE 132 2HD1 ILE 132 3.544 11.878 -9.892 978 H LEU 133 H LEU 133 6.613 8.817 -5.793 979 HA LEU 133 HA LEU 133 8.699 10.030 -4.335 980 HG LEU 133 HG LEU 133 5.625 9.774 -3.944 981 HB2 LEU 133 1HB LEU 133 6.911 7.717 -3.594 982 HB3 LEU 133 2HB LEU 133 7.965 8.556 -2.472 983 HD11 LEU 133 1HD1 LEU 133 4.597 9.906 -1.735 984 HD12 LEU 133 2HD1 LEU 133 5.990 9.085 -1.032 985 HD13 LEU 133 3HD1 LEU 133 4.951 8.234 -2.175 986 HD21 LEU 133 3HD2 LEU 133 7.418 11.392 -3.597 987 HD22 LEU 133 1HD2 LEU 133 7.480 10.970 -1.886 988 HD23 LEU 133 2HD2 LEU 133 6.041 11.741 -2.553 989 H MET 134 H MET 134 8.410 6.883 -5.840 990 HA MET 134 HA MET 134 10.652 5.674 -4.612 991 HB2 MET 134 1HB MET 134 8.899 4.433 -5.856 992 HB3 MET 134 2HB MET 134 9.491 5.139 -7.354 993 HG2 MET 134 1HG MET 134 11.632 4.025 -7.048 994 HG3 MET 134 2HG MET 134 11.065 3.339 -5.526 995 HE1 MET 134 3HE MET 134 10.717 3.332 -9.430 996 HE2 MET 134 1HE MET 134 9.103 3.822 -8.911 997 HE3 MET 134 2HE MET 134 9.346 2.248 -9.669 998 H ALA 135 H ALA 135 10.261 7.594 -7.557 999 HA ALA 135 HA ALA 135 12.986 7.430 -8.365 1000 HB1 ALA 135 3HB ALA 135 12.430 9.226 -9.917 1001 HB2 ALA 135 1HB ALA 135 10.906 9.497 -9.075 1002 HB3 ALA 135 2HB ALA 135 11.182 7.981 -9.930 1003 H GLU 136 H GLU 136 11.127 9.652 -6.379 1004 HA GLU 136 HA GLU 136 13.057 11.652 -6.004 1005 HB2 GLU 136 1HB GLU 136 10.881 10.662 -4.154 1006 HB3 GLU 136 2HB GLU 136 11.814 12.127 -3.883 1007 HG2 GLU 136 1HG GLU 136 10.133 11.634 -6.325 1008 HG3 GLU 136 2HG GLU 136 9.567 12.482 -4.886 1009 H GLY 137 H GLY 137 12.710 8.481 -4.621 1010 HA2 GLY 137 1HA GLY 137 14.474 7.297 -3.588 1011 HA3 GLY 137 2HA GLY 137 15.264 8.829 -3.238 1012 H ARG 138 H ARG 138 11.888 8.193 -2.596 1013 HA ARG 138 HA ARG 138 12.472 8.380 0.279 1014 HE ARG 138 HE ARG 138 9.838 11.773 0.369 1015 HB2 ARG 138 1HB ARG 138 11.028 10.167 -0.494 1016 HB3 ARG 138 2HB ARG 138 9.947 9.013 -1.263 1017 HG2 ARG 138 1HG ARG 138 9.374 8.095 0.932 1018 HG3 ARG 138 2HG ARG 138 10.443 9.271 1.695 1019 HD2 ARG 138 1HD ARG 138 8.099 10.011 -0.043 1020 HD3 ARG 138 2HD ARG 138 8.012 9.874 1.712 1021 HH11 ARG 138 1HH1 ARG 138 7.436 11.005 2.798 1022 HH12 ARG 138 2HH1 ARG 138 7.436 12.592 3.497 1023 HH21 ARG 138 1HH2 ARG 138 9.817 13.884 1.252 1024 HH22 ARG 138 2HH2 ARG 138 8.789 14.236 2.614 1025 H ARG 139 H ARG 139 11.902 6.768 1.620 1026 HA ARG 139 HA ARG 139 11.225 4.232 0.554 1027 HE ARG 139 HE ARG 139 12.450 5.350 5.007 1028 HB2 ARG 139 1HB ARG 139 11.240 5.230 3.405 1029 HB3 ARG 139 2HB ARG 139 11.026 3.546 2.947 1030 HG2 ARG 139 1HG ARG 139 13.232 3.550 1.896 1031 HG3 ARG 139 2HG ARG 139 13.445 5.240 2.357 1032 HD2 ARG 139 1HD ARG 139 13.038 2.945 4.271 1033 HD3 ARG 139 2HD ARG 139 14.591 3.685 3.886 1034 HH11 ARG 139 1HH1 ARG 139 15.592 3.851 5.329 1035 HH12 ARG 139 2HH1 ARG 139 16.032 4.780 6.723 1036 HH21 ARG 139 1HH2 ARG 139 13.007 6.565 6.833 1037 HH22 ARG 139 2HH2 ARG 139 14.558 6.314 7.596 1038 H VAL 140 H VAL 140 9.334 4.144 -0.480 1039 HA VAL 140 HA VAL 140 6.908 4.699 1.087 1040 HB VAL 140 HB VAL 140 7.123 6.375 -0.668 1041 HG11 VAL 140 1HG1 VAL 140 7.232 4.063 -2.601 1042 HG12 VAL 140 2HG1 VAL 140 8.555 5.163 -2.211 1043 HG13 VAL 140 3HG1 VAL 140 7.119 5.768 -3.040 1044 HG21 VAL 140 3HG2 VAL 140 4.998 4.339 -1.329 1045 HG22 VAL 140 1HG2 VAL 140 4.994 6.029 -1.833 1046 HG23 VAL 140 2HG2 VAL 140 4.877 5.619 -0.121 1047 H VAL 141 H VAL 141 5.365 3.153 1.103 1048 HA VAL 141 HA VAL 141 5.894 0.681 -0.422 1049 HB VAL 141 HB VAL 141 4.148 0.987 2.034 1050 HG11 VAL 141 1HG1 VAL 141 4.282 -1.456 2.143 1051 HG12 VAL 141 2HG1 VAL 141 5.222 -1.467 0.652 1052 HG13 VAL 141 3HG1 VAL 141 3.551 -0.905 0.636 1053 HG21 VAL 141 3HG2 VAL 141 6.443 1.472 2.645 1054 HG22 VAL 141 1HG2 VAL 141 6.987 -0.010 1.859 1055 HG23 VAL 141 2HG2 VAL 141 5.958 -0.097 3.288 1056 H VAL 142 H VAL 142 4.103 -0.291 -1.532 1057 HA VAL 142 HA VAL 142 1.663 1.339 -1.590 1058 HB VAL 142 HB VAL 142 3.001 1.941 -3.563 1059 HG11 VAL 142 1HG1 VAL 142 4.217 -0.133 -3.885 1060 HG12 VAL 142 2HG1 VAL 142 3.364 0.324 -5.360 1061 HG13 VAL 142 3HG1 VAL 142 2.724 -0.958 -4.333 1062 HG21 VAL 142 3HG2 VAL 142 0.581 2.059 -3.691 1063 HG22 VAL 142 1HG2 VAL 142 0.509 0.373 -4.204 1064 HG23 VAL 142 2HG2 VAL 142 1.258 1.581 -5.247 1065 H ALA 143 H ALA 143 -0.135 0.231 -1.388 1066 HA ALA 143 HA ALA 143 -0.083 -2.678 -1.885 1067 HB1 ALA 143 3HB ALA 143 -0.415 -2.152 0.484 1068 HB2 ALA 143 1HB ALA 143 -1.865 -2.878 -0.210 1069 HB3 ALA 143 2HB ALA 143 -1.798 -1.138 0.072 1070 H LEU 144 H LEU 144 -1.316 -3.309 -3.556 1071 HA LEU 144 HA LEU 144 -3.362 -1.409 -4.500 1072 HG LEU 144 HG LEU 144 -0.481 -1.053 -5.423 1073 HB2 LEU 144 1HB LEU 144 -1.536 -3.187 -6.110 1074 HB3 LEU 144 2HB LEU 144 -2.877 -2.286 -6.789 1075 HD11 LEU 144 1HD1 LEU 144 0.160 -0.324 -7.666 1076 HD12 LEU 144 2HD1 LEU 144 -1.193 -1.226 -8.347 1077 HD13 LEU 144 3HD1 LEU 144 0.124 -2.084 -7.546 1078 HD21 LEU 144 3HD2 LEU 144 -2.513 0.286 -5.196 1079 HD22 LEU 144 1HD2 LEU 144 -2.764 0.208 -6.941 1080 HD23 LEU 144 2HD2 LEU 144 -1.361 1.054 -6.289 1081 H LEU 145 H LEU 145 -5.354 -2.122 -4.585 1082 HA LEU 145 HA LEU 145 -5.883 -5.002 -4.503 1083 HG LEU 145 HG LEU 145 -6.255 -2.674 -2.285 1084 HB2 LEU 145 1HB LEU 145 -7.811 -2.695 -4.183 1085 HB3 LEU 145 2HB LEU 145 -8.157 -4.387 -3.888 1086 HD11 LEU 145 1HD1 LEU 145 -7.911 -2.903 -0.506 1087 HD12 LEU 145 2HD1 LEU 145 -8.975 -3.779 -1.606 1088 HD13 LEU 145 3HD1 LEU 145 -8.586 -2.086 -1.915 1089 HD21 LEU 145 3HD2 LEU 145 -7.139 -5.526 -1.866 1090 HD22 LEU 145 1HD2 LEU 145 -6.130 -4.581 -0.770 1091 HD23 LEU 145 2HD2 LEU 145 -5.533 -5.003 -2.375 1092 HA PRO 146 HA PRO 146 -6.684 -4.512 -8.888 1093 HB2 PRO 146 1HB PRO 146 -6.920 -7.121 -9.487 1094 HB3 PRO 146 2HB PRO 146 -5.354 -6.387 -9.117 1095 HG2 PRO 146 1HG PRO 146 -7.138 -8.028 -7.365 1096 HG3 PRO 146 2HG PRO 146 -5.375 -8.084 -7.533 1097 HD2 PRO 146 1HD PRO 146 -6.685 -6.792 -5.496 1098 HD3 PRO 146 2HD PRO 146 -5.064 -6.353 -6.069 1099 H ASP 147 H ASP 147 -8.453 -4.593 -10.251 1100 HA ASP 147 HA ASP 147 -11.028 -4.892 -9.023 1101 HB2 ASP 147 1HB ASP 147 -10.803 -3.151 -10.656 1102 HB3 ASP 147 2HB ASP 147 -10.183 -4.278 -11.859 1103 H GLY 148 H GLY 148 -12.234 -6.665 -8.945 1104 HA2 GLY 148 1HA GLY 148 -12.859 -8.429 -10.884 1105 HA3 GLY 148 2HA GLY 148 -11.341 -9.069 -10.275 1106 H ASP 149 H ASP 149 -12.113 -7.949 -7.553 1107 HA ASP 149 HA ASP 149 -12.788 -8.891 -5.606 1108 HB2 ASP 149 1HB ASP 149 -15.154 -9.714 -7.305 1109 HB3 ASP 149 2HB ASP 149 -15.067 -9.976 -5.568 1110 H SER 150 H SER 150 -10.960 -10.247 -5.727 1111 HA SER 150 HA SER 150 -11.091 -12.701 -7.201 1112 HG SER 150 HG SER 150 -8.936 -11.692 -4.445 1113 HB2 SER 150 1HB SER 150 -8.737 -12.966 -6.296 1114 HB3 SER 150 2HB SER 150 -9.029 -11.527 -7.277 1115 H LEU 151 H LEU 151 -12.810 -13.758 -6.007 1116 HA LEU 151 HA LEU 151 -11.659 -15.204 -3.716 1117 HG LEU 151 HG LEU 151 -14.172 -17.252 -3.694 1118 HB2 LEU 151 1HB LEU 151 -13.850 -14.286 -3.188 1119 HB3 LEU 151 2HB LEU 151 -14.538 -15.018 -4.625 1120 HD11 LEU 151 1HD1 LEU 151 -13.426 -17.545 -1.391 1121 HD12 LEU 151 2HD1 LEU 151 -13.131 -15.812 -1.258 1122 HD13 LEU 151 3HD1 LEU 151 -12.174 -16.786 -2.374 1123 HD21 LEU 151 3HD2 LEU 151 -16.283 -16.134 -3.239 1124 HD22 LEU 151 1HD2 LEU 151 -15.596 -15.397 -1.792 1125 HD23 LEU 151 2HD2 LEU 151 -15.803 -17.146 -1.877 1126 H GLU 152 H GLU 152 -10.340 -16.559 -4.850 1127 HA GLU 152 HA GLU 152 -11.209 -17.890 -7.220 1128 HB2 GLU 152 1HB GLU 152 -8.833 -17.271 -6.761 1129 HB3 GLU 152 2HB GLU 152 -8.800 -18.493 -5.498 1130 HG2 GLU 152 1HG GLU 152 -7.782 -19.278 -7.574 1131 HG3 GLU 152 2HG GLU 152 -9.194 -20.235 -7.122 1132 H HIS 153 H HIS 153 -12.253 -19.737 -7.399 1133 HA HIS 153 HA HIS 153 -13.191 -21.099 -5.067 1134 HD1 HIS 153 HD1 HIS 153 -16.583 -22.224 -6.458 1135 HD2 HIS 153 HD2 HIS 153 -14.429 -18.791 -7.410 1136 HE1 HIS 153 HE1 HIS 153 -18.261 -20.354 -6.502 1137 HE2 HIS 153 HE2 HIS 153 -16.908 -18.264 -6.880 1138 HB2 HIS 153 1HB HIS 153 -13.488 -21.672 -8.018 1139 HB3 HIS 153 2HB HIS 153 -14.181 -22.707 -6.773 1140 H HIS 154 H HIS 154 -12.449 -22.888 -4.128 1141 HA HIS 154 HA HIS 154 -9.760 -23.615 -4.566 1142 HD1 HIS 154 HD1 HIS 154 -10.569 -26.923 -1.558 1143 HD2 HIS 154 HD2 HIS 154 -8.010 -23.933 -2.911 1144 HE1 HIS 154 HE1 HIS 154 -8.275 -27.570 -0.750 1145 HE2 HIS 154 HE2 HIS 154 -6.796 -25.624 -1.375 1146 HB2 HIS 154 1HB HIS 154 -11.168 -23.711 -2.407 1147 HB3 HIS 154 2HB HIS 154 -11.731 -25.268 -3.000 1148 H HIS 155 H HIS 155 -12.827 -25.127 -5.419 1149 HA HIS 155 HA HIS 155 -11.321 -27.033 -7.092 1150 HD1 HIS 155 HD1 HIS 155 -12.254 -30.430 -6.404 1151 HD2 HIS 155 HD2 HIS 155 -11.993 -27.498 -3.462 1152 HE1 HIS 155 HE1 HIS 155 -11.008 -31.489 -4.492 1153 HE2 HIS 155 HE2 HIS 155 -10.704 -29.644 -2.804 1154 HB2 HIS 155 1HB HIS 155 -13.962 -27.343 -5.675 1155 HB3 HIS 155 2HB HIS 155 -13.502 -28.384 -7.017 1156 H HIS 156 H HIS 156 -11.340 -26.435 -9.133 1157 HA HIS 156 HA HIS 156 -13.509 -24.780 -10.156 1158 HD1 HIS 156 HD1 HIS 156 -9.027 -24.242 -10.691 1159 HD2 HIS 156 HD2 HIS 156 -12.689 -22.295 -10.322 1160 HE1 HIS 156 HE1 HIS 156 -8.501 -21.979 -9.730 1161 HE2 HIS 156 HE2 HIS 156 -10.716 -20.778 -9.592 1162 HB2 HIS 156 1HB HIS 156 -10.897 -25.673 -11.383 1163 HB3 HIS 156 2HB HIS 156 -12.091 -24.698 -12.232 1164 H HIS 157 H HIS 157 -14.710 -25.289 -11.994 1165 HA HIS 157 HA HIS 157 -14.946 -28.152 -12.584 1166 HD1 HIS 157 HD1 HIS 157 -18.665 -25.338 -11.907 1167 HD2 HIS 157 HD2 HIS 157 -16.562 -28.736 -10.746 1168 HE1 HIS 157 HE1 HIS 157 -19.615 -25.997 -9.674 1169 HE2 HIS 157 HE2 HIS 157 -18.228 -27.959 -8.921 1170 HB2 HIS 157 1HB HIS 157 -16.709 -25.822 -13.398 1171 HB3 HIS 157 2HB HIS 157 -17.023 -27.511 -13.775 1172 H HIS 158 H HIS 158 -14.544 -25.005 -14.126 1173 HA HIS 158 HA HIS 158 -12.853 -26.229 -16.159 1174 HD1 HIS 158 HD1 HIS 158 -13.313 -27.455 -18.301 1175 HD2 HIS 158 HD2 HIS 158 -17.221 -26.416 -17.341 1176 HE1 HIS 158 HE1 HIS 158 -14.735 -29.388 -19.060 1177 HE2 HIS 158 HE2 HIS 158 -17.108 -28.615 -18.697 1178 HB2 HIS 158 1HB HIS 158 -15.324 -24.608 -16.764 1179 HB3 HIS 158 2HB HIS 158 -13.987 -24.719 -17.902 Start of MODEL 10 1 HA MET 1 HA MET 1 18.773 4.240 -14.931 2 H1 MET 1 1H MET 1 21.491 4.426 -16.085 3 H2 MET 1 2H MET 1 21.163 4.151 -14.448 4 H3 MET 1 3H MET 1 20.677 5.604 -15.171 5 HB2 MET 1 1HB MET 1 19.762 4.211 -17.790 6 HB3 MET 1 2HB MET 1 18.096 3.943 -17.302 7 HG2 MET 1 1HG MET 1 19.675 6.471 -16.884 8 HG3 MET 1 2HG MET 1 18.444 6.208 -18.115 9 HE1 MET 1 3HE MET 1 15.856 5.911 -17.587 10 HE2 MET 1 1HE MET 1 15.195 5.848 -15.953 11 HE3 MET 1 2HE MET 1 16.245 4.554 -16.530 12 H LYS 2 H LYS 2 20.708 2.489 -17.374 13 HA LYS 2 HA LYS 2 20.319 0.025 -15.844 14 HB2 LYS 2 1HB LYS 2 19.598 0.375 -18.759 15 HB3 LYS 2 2HB LYS 2 19.772 -1.188 -17.976 16 HG2 LYS 2 1HG LYS 2 17.963 -0.559 -16.412 17 HG3 LYS 2 2HG LYS 2 17.747 0.940 -17.319 18 HD2 LYS 2 1HD LYS 2 17.262 -0.374 -19.340 19 HD3 LYS 2 2HD LYS 2 17.438 -1.860 -18.405 20 HE2 LYS 2 1HE LYS 2 15.584 -1.133 -16.952 21 HE3 LYS 2 2HE LYS 2 15.392 0.308 -17.948 22 HZ1 LYS 2 3HZ LYS 2 14.932 -1.162 -19.851 23 HZ2 LYS 2 1HZ LYS 2 13.800 -1.345 -18.601 24 HZ3 LYS 2 2HZ LYS 2 15.014 -2.508 -18.823 25 H LEU 3 H LEU 3 21.895 -1.522 -16.152 26 HA LEU 3 HA LEU 3 24.385 -0.487 -17.232 27 HG LEU 3 HG LEU 3 25.260 -1.934 -13.926 28 HB2 LEU 3 1HB LEU 3 23.802 -3.026 -15.694 29 HB3 LEU 3 2HB LEU 3 25.397 -2.494 -16.185 30 HD11 LEU 3 1HD1 LEU 3 24.498 0.552 -15.438 31 HD12 LEU 3 2HD1 LEU 3 26.123 -0.113 -15.274 32 HD13 LEU 3 3HD1 LEU 3 25.272 0.499 -13.854 33 HD21 LEU 3 3HD2 LEU 3 22.876 -2.292 -13.601 34 HD22 LEU 3 1HD2 LEU 3 22.524 -0.773 -14.426 35 HD23 LEU 3 2HD2 LEU 3 23.386 -0.761 -12.888 36 H HIS 4 H HIS 4 25.815 -2.315 -18.264 37 HA HIS 4 HA HIS 4 24.440 -3.241 -20.627 38 HD1 HIS 4 HD1 HIS 4 27.128 -2.705 -23.097 39 HD2 HIS 4 HD2 HIS 4 26.993 -0.682 -19.465 40 HE1 HIS 4 HE1 HIS 4 27.736 -0.325 -23.620 41 HE2 HIS 4 HE2 HIS 4 27.880 0.814 -21.378 42 HB2 HIS 4 1HB HIS 4 27.277 -3.667 -19.658 43 HB3 HIS 4 2HB HIS 4 26.672 -4.234 -21.208 44 H THR 5 H THR 5 25.907 -4.671 -17.765 45 HA THR 5 HA THR 5 24.502 -7.192 -18.359 46 HB THR 5 HB THR 5 26.850 -6.884 -16.480 47 HG1 THR 5 HG1 THR 5 27.162 -6.368 -18.890 48 HG21 THR 5 3HG2 THR 5 25.478 -8.901 -16.208 49 HG22 THR 5 1HG2 THR 5 27.084 -9.295 -16.825 50 HG23 THR 5 2HG2 THR 5 25.699 -9.279 -17.917 51 H ASP 6 H ASP 6 23.499 -8.253 -16.534 52 HA ASP 6 HA ASP 6 22.301 -8.399 -14.612 53 HB2 ASP 6 1HB ASP 6 23.990 -6.052 -13.721 54 HB3 ASP 6 2HB ASP 6 22.825 -6.870 -12.689 55 HA PRO 7 HA PRO 7 19.401 -5.238 -16.163 56 HB2 PRO 7 1HB PRO 7 17.278 -6.891 -16.367 57 HB3 PRO 7 2HB PRO 7 18.533 -6.812 -17.608 58 HG2 PRO 7 1HG PRO 7 18.146 -8.819 -15.427 59 HG3 PRO 7 2HG PRO 7 18.617 -9.076 -17.117 60 HD2 PRO 7 1HD PRO 7 20.390 -9.046 -15.030 61 HD3 PRO 7 2HD PRO 7 20.822 -8.620 -16.698 62 H ALA 8 H ALA 8 19.570 -7.197 -13.395 63 HA ALA 8 HA ALA 8 17.170 -6.303 -12.115 64 HB1 ALA 8 3HB ALA 8 18.185 -8.443 -11.524 65 HB2 ALA 8 1HB ALA 8 18.084 -7.383 -10.119 66 HB3 ALA 8 2HB ALA 8 19.626 -7.607 -10.945 67 H THR 9 H THR 9 16.882 -4.315 -11.378 68 HA THR 9 HA THR 9 19.234 -2.733 -10.596 69 HB THR 9 HB THR 9 16.475 -1.657 -11.200 70 HG1 THR 9 HG1 THR 9 18.065 -2.850 -12.924 71 HG21 THR 9 3HG2 THR 9 17.990 -0.147 -10.000 72 HG22 THR 9 1HG2 THR 9 17.695 0.427 -11.642 73 HG23 THR 9 2HG2 THR 9 19.215 -0.376 -11.248 74 H ALA 10 H ALA 10 19.048 -1.379 -8.695 75 HA ALA 10 HA ALA 10 17.830 -2.687 -6.481 76 HB1 ALA 10 3HB ALA 10 19.948 -1.483 -6.286 77 HB2 ALA 10 1HB ALA 10 18.749 -0.863 -5.152 78 HB3 ALA 10 2HB ALA 10 19.117 0.036 -6.624 79 H LEU 11 H LEU 11 16.427 -0.866 -8.783 80 HA LEU 11 HA LEU 11 14.489 0.402 -6.995 81 HG LEU 11 HG LEU 11 16.610 1.855 -8.776 82 HB2 LEU 11 1HB LEU 11 14.847 0.631 -9.988 83 HB3 LEU 11 2HB LEU 11 13.627 1.476 -9.057 84 HD11 LEU 11 1HD1 LEU 11 16.191 4.049 -9.777 85 HD12 LEU 11 2HD1 LEU 11 14.500 3.611 -10.024 86 HD13 LEU 11 3HD1 LEU 11 15.772 2.738 -10.879 87 HD21 LEU 11 3HD2 LEU 11 16.006 3.746 -7.345 88 HD22 LEU 11 1HD2 LEU 11 15.425 2.222 -6.675 89 HD23 LEU 11 2HD2 LEU 11 14.302 3.313 -7.487 90 H ASN 12 H ASN 12 12.369 -0.215 -6.959 91 HA ASN 12 HA ASN 12 11.679 -2.634 -8.488 92 HB2 ASN 12 1HB ASN 12 11.788 -3.000 -6.051 93 HB3 ASN 12 2HB ASN 12 10.615 -1.712 -5.806 94 HD21 ASN 12 2HD2 ASN 12 9.154 -3.045 -4.815 95 HD22 ASN 12 1HD2 ASN 12 8.251 -4.246 -5.675 96 H THR 13 H THR 13 10.327 -2.191 -10.104 97 HA THR 13 HA THR 13 8.361 -0.032 -9.726 98 HB THR 13 HB THR 13 9.880 -0.474 -12.300 99 HG1 THR 13 HG1 THR 13 10.568 0.912 -9.987 100 HG21 THR 13 3HG2 THR 13 9.060 1.767 -12.847 101 HG22 THR 13 1HG2 THR 13 8.224 1.847 -11.296 102 HG23 THR 13 2HG2 THR 13 7.719 0.671 -12.510 103 H VAL 14 H VAL 14 6.380 -0.337 -10.637 104 HA VAL 14 HA VAL 14 5.572 -2.925 -11.500 105 HB VAL 14 HB VAL 14 4.013 -1.446 -10.338 106 HG11 VAL 14 1HG1 VAL 14 3.083 0.547 -11.415 107 HG12 VAL 14 2HG1 VAL 14 4.210 0.343 -12.756 108 HG13 VAL 14 3HG1 VAL 14 4.818 0.700 -11.140 109 HG21 VAL 14 3HG2 VAL 14 2.067 -1.645 -11.811 110 HG22 VAL 14 1HG2 VAL 14 3.054 -3.105 -11.837 111 HG23 VAL 14 2HG2 VAL 14 3.137 -1.963 -13.177 112 H THR 15 H THR 15 5.171 -3.678 -13.585 113 HA THR 15 HA THR 15 6.432 -2.068 -15.680 114 HB THR 15 HB THR 15 6.305 -4.297 -16.969 115 HG1 THR 15 HG1 THR 15 5.356 -5.853 -15.910 116 HG21 THR 15 3HG2 THR 15 8.368 -5.096 -15.901 117 HG22 THR 15 1HG2 THR 15 8.060 -4.039 -14.524 118 HG23 THR 15 2HG2 THR 15 8.383 -3.346 -16.112 119 H ALA 16 H ALA 16 3.438 -3.824 -14.974 120 HA ALA 16 HA ALA 16 2.168 -2.268 -17.103 121 HB1 ALA 16 3HB ALA 16 2.759 -4.459 -18.064 122 HB2 ALA 16 1HB ALA 16 1.018 -4.180 -18.014 123 HB3 ALA 16 2HB ALA 16 1.775 -5.243 -16.828 124 H TYR 17 H TYR 17 0.629 -1.168 -16.185 125 HA TYR 17 HA TYR 17 -1.034 -2.435 -14.114 126 HD1 TYR 17 HD1 TYR 17 -1.441 -1.121 -11.627 127 HD2 TYR 17 HD2 TYR 17 -3.034 1.247 -14.783 128 HE1 TYR 17 HE1 TYR 17 -3.402 -0.600 -10.238 129 HE2 TYR 17 HE2 TYR 17 -5.002 1.771 -13.404 130 HH TYR 17 HH TYR 17 -6.219 0.795 -11.487 131 HB2 TYR 17 1HB TYR 17 -0.017 -0.257 -13.506 132 HB3 TYR 17 2HB TYR 17 -0.791 0.486 -14.899 133 H GLY 18 H GLY 18 -2.691 -3.479 -15.071 134 HA2 GLY 18 1HA GLY 18 -3.859 -2.216 -17.472 135 HA3 GLY 18 2HA GLY 18 -3.641 -3.951 -17.311 136 H ASP 19 H ASP 19 -5.946 -3.813 -17.926 137 HA ASP 19 HA ASP 19 -7.831 -2.795 -16.024 138 HB2 ASP 19 1HB ASP 19 -8.273 -2.869 -18.466 139 HB3 ASP 19 2HB ASP 19 -8.279 -4.627 -18.391 140 H GLY 20 H GLY 20 -7.467 -3.842 -14.084 141 HA2 GLY 20 1HA GLY 20 -8.564 -5.381 -12.651 142 HA3 GLY 20 2HA GLY 20 -8.689 -6.502 -13.995 143 H TYR 21 H TYR 21 -5.677 -5.730 -14.449 144 HA TYR 21 HA TYR 21 -4.642 -7.594 -12.419 145 HD1 TYR 21 HD1 TYR 21 -1.755 -7.151 -15.450 146 HD2 TYR 21 HD2 TYR 21 -5.857 -7.660 -16.455 147 HE1 TYR 21 HE1 TYR 21 -1.335 -6.150 -17.655 148 HE2 TYR 21 HE2 TYR 21 -5.446 -6.662 -18.661 149 HH TYR 21 HH TYR 21 -3.862 -5.167 -19.735 150 HB2 TYR 21 1HB TYR 21 -3.206 -8.620 -14.135 151 HB3 TYR 21 2HB TYR 21 -4.910 -8.796 -14.537 152 H ILE 22 H ILE 22 -2.447 -7.366 -11.857 153 HA ILE 22 HA ILE 22 -1.164 -4.859 -12.718 154 HB ILE 22 HB ILE 22 -1.185 -5.935 -9.889 155 HG12 ILE 22 1HG1 ILE 22 -2.529 -3.462 -10.998 156 HG13 ILE 22 2HG1 ILE 22 -3.365 -4.971 -10.648 157 HG21 ILE 22 1HG2 ILE 22 0.883 -4.782 -10.444 158 HG22 ILE 22 2HG2 ILE 22 -0.079 -3.813 -9.328 159 HG23 ILE 22 3HG2 ILE 22 -0.031 -3.396 -11.041 160 HD11 ILE 22 3HD1 ILE 22 -3.682 -3.345 -8.878 161 HD12 ILE 22 1HD1 ILE 22 -1.937 -3.239 -8.645 162 HD13 ILE 22 2HD1 ILE 22 -2.785 -4.746 -8.293 163 H GLU 23 H GLU 23 0.841 -5.172 -13.470 164 HA GLU 23 HA GLU 23 2.138 -7.748 -12.886 165 HB2 GLU 23 1HB GLU 23 1.458 -7.408 -15.244 166 HB3 GLU 23 2HB GLU 23 2.480 -5.978 -15.306 167 HG2 GLU 23 1HG GLU 23 4.435 -7.422 -14.806 168 HG3 GLU 23 2HG GLU 23 3.372 -8.824 -14.923 169 H VAL 24 H VAL 24 3.904 -7.702 -11.717 170 HA VAL 24 HA VAL 24 5.487 -5.217 -11.633 171 HB VAL 24 HB VAL 24 5.396 -7.445 -9.584 172 HG11 VAL 24 1HG1 VAL 24 7.568 -6.340 -9.674 173 HG12 VAL 24 2HG1 VAL 24 6.715 -5.927 -8.186 174 HG13 VAL 24 3HG1 VAL 24 6.786 -4.768 -9.514 175 HG21 VAL 24 3HG2 VAL 24 3.322 -6.179 -9.593 176 HG22 VAL 24 1HG2 VAL 24 4.222 -4.666 -9.497 177 HG23 VAL 24 2HG2 VAL 24 4.262 -5.804 -8.150 178 H ASN 25 H ASN 25 7.227 -5.314 -12.839 179 HA ASN 25 HA ASN 25 9.170 -5.964 -13.785 180 HB2 ASN 25 1HB ASN 25 8.997 -7.985 -11.585 181 HB3 ASN 25 2HB ASN 25 10.224 -8.168 -12.831 182 HD21 ASN 25 2HD2 ASN 25 9.076 -5.065 -11.655 183 HD22 ASN 25 1HD2 ASN 25 10.553 -4.609 -10.877 184 H GLN 26 H GLN 26 7.925 -9.227 -13.120 185 HA GLN 26 HA GLN 26 7.379 -9.539 -15.986 186 HB2 GLN 26 1HB GLN 26 9.019 -11.490 -14.362 187 HB3 GLN 26 2HB GLN 26 8.528 -11.704 -16.034 188 HG2 GLN 26 1HG GLN 26 9.856 -9.695 -16.625 189 HG3 GLN 26 2HG GLN 26 10.427 -9.638 -14.956 190 HE21 GLN 26 2HE2 GLN 26 10.581 -11.302 -17.986 191 HE22 GLN 26 1HE2 GLN 26 11.932 -12.313 -17.600 192 H VAL 27 H VAL 27 6.212 -9.761 -12.942 193 HA VAL 27 HA VAL 27 4.589 -12.148 -13.548 194 HB VAL 27 HB VAL 27 5.357 -11.152 -10.798 195 HG11 VAL 27 1HG1 VAL 27 3.926 -13.658 -11.677 196 HG12 VAL 27 2HG1 VAL 27 3.207 -12.285 -10.835 197 HG13 VAL 27 3HG1 VAL 27 4.416 -13.281 -10.025 198 HG21 VAL 27 3HG2 VAL 27 6.789 -13.138 -10.667 199 HG22 VAL 27 1HG2 VAL 27 7.302 -12.054 -11.960 200 HG23 VAL 27 2HG2 VAL 27 6.406 -13.522 -12.344 201 H ARG 28 H ARG 28 2.525 -11.719 -13.890 202 HA ARG 28 HA ARG 28 1.364 -9.294 -12.736 203 HE ARG 28 HE ARG 28 1.549 -10.163 -17.057 204 HB2 ARG 28 1HB ARG 28 -0.566 -9.784 -14.259 205 HB3 ARG 28 2HB ARG 28 0.952 -9.442 -15.073 206 HG2 ARG 28 1HG ARG 28 1.274 -11.918 -15.302 207 HG3 ARG 28 2HG ARG 28 -0.376 -12.113 -14.706 208 HD2 ARG 28 1HD ARG 28 -0.268 -12.141 -17.161 209 HD3 ARG 28 2HD ARG 28 -1.227 -10.793 -16.550 210 HH11 ARG 28 1HH1 ARG 28 -1.688 -10.277 -18.405 211 HH12 ARG 28 2HH1 ARG 28 -1.339 -9.105 -19.645 212 HH21 ARG 28 1HH2 ARG 28 2.002 -8.627 -18.642 213 HH22 ARG 28 2HH2 ARG 28 0.765 -8.163 -19.785 214 H PHE 29 H PHE 29 0.091 -9.337 -11.053 215 HA PHE 29 HA PHE 29 -0.546 -11.969 -9.939 216 HD1 PHE 29 HD2 PHE 29 0.886 -12.394 -7.364 217 HD2 PHE 29 HD1 PHE 29 1.799 -8.713 -9.292 218 HE1 PHE 29 HE2 PHE 29 3.277 -12.760 -6.921 219 HE2 PHE 29 HE1 PHE 29 4.191 -9.072 -8.851 220 HZ PHE 29 HZ PHE 29 4.934 -11.097 -7.665 221 HB2 PHE 29 1HB PHE 29 -0.458 -9.241 -8.638 222 HB3 PHE 29 2HB PHE 29 -0.839 -10.743 -7.806 223 H SER 30 H SER 30 -2.548 -12.640 -9.549 224 HA SER 30 HA SER 30 -4.783 -10.993 -10.432 225 HG SER 30 HG SER 30 -4.814 -14.953 -9.575 226 HB2 SER 30 1HB SER 30 -6.012 -13.230 -10.011 227 HB3 SER 30 2HB SER 30 -4.860 -13.166 -11.347 228 H HIS 31 H HIS 31 -3.206 -10.775 -7.824 229 HA HIS 31 HA HIS 31 -5.509 -10.445 -6.098 230 HD1 HIS 31 HD1 HIS 31 -3.109 -14.349 -6.066 231 HD2 HIS 31 HD2 HIS 31 -1.488 -10.881 -4.426 232 HE1 HIS 31 HE1 HIS 31 -0.634 -14.767 -5.891 233 HE2 HIS 31 HE2 HIS 31 0.268 -12.770 -4.643 234 HB2 HIS 31 1HB HIS 31 -4.406 -11.608 -4.189 235 HB3 HIS 31 2HB HIS 31 -4.858 -12.694 -5.493 236 H ALA 32 H ALA 32 -4.812 -9.338 -4.005 237 HA ALA 32 HA ALA 32 -3.519 -6.941 -4.676 238 HB1 ALA 32 3HB ALA 32 -3.731 -6.362 -2.327 239 HB2 ALA 32 1HB ALA 32 -4.070 -8.046 -1.926 240 HB3 ALA 32 2HB ALA 32 -5.208 -7.127 -2.910 241 H ILE 33 H ILE 33 -1.549 -6.065 -4.068 242 HA ILE 33 HA ILE 33 0.460 -7.860 -2.924 243 HB ILE 33 HB ILE 33 2.089 -7.054 -4.711 244 HG12 ILE 33 1HG1 ILE 33 -0.508 -6.472 -6.156 245 HG13 ILE 33 2HG1 ILE 33 0.669 -5.271 -5.638 246 HG21 ILE 33 1HG2 ILE 33 1.455 -8.842 -6.265 247 HG22 ILE 33 2HG2 ILE 33 -0.129 -8.935 -5.495 248 HG23 ILE 33 3HG2 ILE 33 1.321 -9.347 -4.580 249 HD11 ILE 33 3HD1 ILE 33 1.140 -7.436 -7.673 250 HD12 ILE 33 1HD1 ILE 33 2.310 -6.216 -7.167 251 HD13 ILE 33 2HD1 ILE 33 0.842 -5.731 -8.016 252 H ALA 34 H ALA 34 2.157 -6.835 -1.918 253 HA ALA 34 HA ALA 34 2.060 -3.890 -1.822 254 HB1 ALA 34 3HB ALA 34 2.628 -3.983 0.554 255 HB2 ALA 34 1HB ALA 34 2.575 -5.746 0.504 256 HB3 ALA 34 2HB ALA 34 1.103 -4.811 0.237 257 H PHE 35 H PHE 35 3.947 -2.963 -2.339 258 HA PHE 35 HA PHE 35 6.432 -4.384 -1.847 259 HD1 PHE 35 HD1 PHE 35 3.597 -4.694 -4.731 260 HD2 PHE 35 HD2 PHE 35 6.919 -2.159 -5.539 261 HE1 PHE 35 HE1 PHE 35 2.294 -3.550 -6.474 262 HE2 PHE 35 HE2 PHE 35 5.618 -1.006 -7.281 263 HZ PHE 35 HZ PHE 35 3.303 -1.701 -7.752 264 HB2 PHE 35 1HB PHE 35 7.192 -4.101 -4.206 265 HB3 PHE 35 2HB PHE 35 5.893 -5.268 -4.007 266 H ALA 36 H ALA 36 8.337 -3.087 -2.328 267 HA ALA 36 HA ALA 36 7.868 -0.192 -2.302 268 HB1 ALA 36 3HB ALA 36 9.614 -1.692 -0.341 269 HB2 ALA 36 1HB ALA 36 8.075 -0.914 0.031 270 HB3 ALA 36 2HB ALA 36 9.462 0.062 -0.453 271 HA PRO 37 HA PRO 37 11.309 0.113 -5.097 272 HB2 PRO 37 1HB PRO 37 12.898 2.012 -3.825 273 HB3 PRO 37 2HB PRO 37 11.560 2.363 -4.920 274 HG2 PRO 37 1HG PRO 37 11.616 2.346 -1.937 275 HG3 PRO 37 2HG PRO 37 10.752 3.434 -3.041 276 HD2 PRO 37 1HD PRO 37 9.480 1.469 -1.735 277 HD3 PRO 37 2HD PRO 37 9.039 1.910 -3.398 278 H GLU 38 H GLU 38 12.432 0.305 -1.724 279 HA GLU 38 HA GLU 38 14.459 -1.722 -2.376 280 HB2 GLU 38 1HB GLU 38 15.435 0.388 -1.578 281 HB3 GLU 38 2HB GLU 38 14.447 0.308 -0.127 282 HG2 GLU 38 1HG GLU 38 15.617 -1.649 0.629 283 HG3 GLU 38 2HG GLU 38 16.523 -1.735 -0.881 284 H GLY 39 H GLY 39 13.034 -3.446 -2.135 285 HA2 GLY 39 1HA GLY 39 12.865 -4.671 0.333 286 HA3 GLY 39 2HA GLY 39 11.362 -3.781 0.138 287 HA PRO 40 HA PRO 40 11.005 -7.799 -2.161 288 HB2 PRO 40 1HB PRO 40 9.705 -9.335 -0.400 289 HB3 PRO 40 2HB PRO 40 11.454 -9.113 -0.310 290 HG2 PRO 40 1HG PRO 40 9.310 -7.943 1.376 291 HG3 PRO 40 2HG PRO 40 10.971 -8.377 1.808 292 HD2 PRO 40 1HD PRO 40 9.997 -5.797 1.172 293 HD3 PRO 40 2HD PRO 40 11.692 -6.275 1.381 294 H VAL 41 H VAL 41 9.311 -8.211 -3.476 295 HA VAL 41 HA VAL 41 6.782 -6.886 -3.064 296 HB VAL 41 HB VAL 41 7.520 -8.951 -5.155 297 HG11 VAL 41 1HG1 VAL 41 5.115 -8.741 -4.850 298 HG12 VAL 41 2HG1 VAL 41 5.606 -8.053 -6.398 299 HG13 VAL 41 3HG1 VAL 41 5.230 -6.991 -5.040 300 HG21 VAL 41 3HG2 VAL 41 7.556 -5.939 -5.322 301 HG22 VAL 41 1HG2 VAL 41 7.827 -7.046 -6.669 302 HG23 VAL 41 2HG2 VAL 41 8.964 -7.001 -5.321 303 H ALA 42 H ALA 42 5.310 -7.669 -1.701 304 HA ALA 42 HA ALA 42 5.154 -10.593 -1.354 305 HB1 ALA 42 3HB ALA 42 5.950 -9.455 0.659 306 HB2 ALA 42 1HB ALA 42 4.368 -10.191 0.918 307 HB3 ALA 42 2HB ALA 42 4.500 -8.450 0.664 308 H SER 43 H SER 43 3.058 -11.490 -1.019 309 HA SER 43 HA SER 43 0.996 -10.061 -2.478 310 HG SER 43 HG SER 43 2.435 -12.474 -3.205 311 HB2 SER 43 1HB SER 43 1.114 -12.872 -1.364 312 HB3 SER 43 2HB SER 43 -0.250 -12.222 -2.275 313 H TRP 44 H TRP 44 -0.969 -9.456 -1.654 314 HA TRP 44 HA TRP 44 -1.125 -9.366 1.286 315 HD1 TRP 44 HD1 TRP 44 -1.150 -8.091 2.963 316 HE1 TRP 44 HE1 TRP 44 -2.228 -6.412 4.591 317 HE3 TRP 44 HE3 TRP 44 -3.719 -5.230 -0.407 318 HZ2 TRP 44 HZ2 TRP 44 -3.941 -4.176 4.460 319 HZ3 TRP 44 HZ3 TRP 44 -5.049 -3.338 0.425 320 HH2 TRP 44 HH2 TRP 44 -5.158 -2.822 2.809 321 HB2 TRP 44 1HB TRP 44 -0.891 -7.208 -0.168 322 HB3 TRP 44 2HB TRP 44 -2.587 -7.481 -0.549 323 HA PRO 45 HA PRO 45 -4.562 -12.118 0.597 324 HB2 PRO 45 1HB PRO 45 -5.068 -11.879 3.465 325 HB3 PRO 45 2HB PRO 45 -4.516 -13.278 2.541 326 HG2 PRO 45 1HG PRO 45 -2.912 -11.962 4.270 327 HG3 PRO 45 2HG PRO 45 -2.295 -12.740 2.800 328 HD2 PRO 45 1HD PRO 45 -2.899 -9.846 3.301 329 HD3 PRO 45 2HD PRO 45 -1.509 -10.579 2.470 330 H VAL 46 H VAL 46 -5.181 -9.454 -0.017 331 HA VAL 46 HA VAL 46 -7.844 -9.196 1.222 332 HB VAL 46 HB VAL 46 -6.075 -6.957 0.213 333 HG11 VAL 46 1HG1 VAL 46 -7.835 -5.457 1.014 334 HG12 VAL 46 2HG1 VAL 46 -8.838 -6.849 1.419 335 HG13 VAL 46 3HG1 VAL 46 -8.425 -6.518 -0.264 336 HG21 VAL 46 3HG2 VAL 46 -6.061 -6.219 2.548 337 HG22 VAL 46 1HG2 VAL 46 -5.364 -7.830 2.374 338 HG23 VAL 46 2HG2 VAL 46 -7.001 -7.640 3.002 339 H GLN 47 H GLN 47 -9.370 -9.732 -0.179 340 HA GLN 47 HA GLN 47 -8.828 -9.792 -3.016 341 HB2 GLN 47 1HB GLN 47 -10.122 -11.550 -1.686 342 HB3 GLN 47 2HB GLN 47 -11.452 -10.405 -1.655 343 HG2 GLN 47 1HG GLN 47 -10.238 -11.168 -4.269 344 HG3 GLN 47 2HG GLN 47 -11.341 -12.279 -3.463 345 HE21 GLN 47 2HE2 GLN 47 -11.648 -10.854 -5.982 346 HE22 GLN 47 1HE2 GLN 47 -13.113 -9.938 -5.833 347 H ARG 48 H ARG 48 -10.673 -7.871 -0.752 348 HA ARG 48 HA ARG 48 -10.749 -5.699 -2.602 349 HE ARG 48 HE ARG 48 -15.865 -8.381 -0.654 350 HB2 ARG 48 1HB ARG 48 -13.220 -5.386 -2.518 351 HB3 ARG 48 2HB ARG 48 -12.713 -6.794 -3.435 352 HG2 ARG 48 1HG ARG 48 -13.258 -8.208 -1.475 353 HG3 ARG 48 2HG ARG 48 -13.883 -6.768 -0.661 354 HD2 ARG 48 1HD ARG 48 -15.513 -6.445 -2.426 355 HD3 ARG 48 2HD ARG 48 -14.852 -7.810 -3.319 356 HH11 ARG 48 1HH1 ARG 48 -16.413 -8.422 -4.111 357 HH12 ARG 48 2HH1 ARG 48 -17.767 -9.504 -4.010 358 HH21 ARG 48 1HH2 ARG 48 -17.641 -9.816 -0.525 359 HH22 ARG 48 2HH2 ARG 48 -18.461 -10.292 -1.991 360 HA PRO 49 HA PRO 49 -10.394 -3.306 0.998 361 HB2 PRO 49 1HB PRO 49 -12.285 -1.285 0.004 362 HB3 PRO 49 2HB PRO 49 -10.544 -1.162 0.269 363 HG2 PRO 49 1HG PRO 49 -11.584 -1.226 -2.198 364 HG3 PRO 49 2HG PRO 49 -10.034 -2.000 -1.821 365 HD2 PRO 49 1HD PRO 49 -12.746 -3.242 -2.124 366 HD3 PRO 49 2HD PRO 49 -11.178 -3.800 -2.747 367 H ALA 50 H ALA 50 -12.676 -5.203 1.157 368 HA ALA 50 HA ALA 50 -14.599 -3.714 2.779 369 HB1 ALA 50 3HB ALA 50 -15.469 -5.298 1.122 370 HB2 ALA 50 1HB ALA 50 -15.922 -5.758 2.763 371 HB3 ALA 50 2HB ALA 50 -14.620 -6.611 1.936 372 H ASP 51 H ASP 51 -11.928 -5.916 3.079 373 HA ASP 51 HA ASP 51 -12.572 -6.356 5.921 374 HB2 ASP 51 1HB ASP 51 -10.916 -8.030 4.024 375 HB3 ASP 51 2HB ASP 51 -11.057 -8.342 5.750 376 H ILE 52 H ILE 52 -10.799 -4.285 4.262 377 HA ILE 52 HA ILE 52 -8.150 -4.651 5.142 378 HB ILE 52 HB ILE 52 -9.547 -2.069 4.419 379 HG12 ILE 52 1HG1 ILE 52 -7.801 -3.945 2.806 380 HG13 ILE 52 2HG1 ILE 52 -9.527 -3.679 2.583 381 HG21 ILE 52 1HG2 ILE 52 -7.287 -1.166 4.085 382 HG22 ILE 52 2HG2 ILE 52 -6.603 -2.672 4.698 383 HG23 ILE 52 3HG2 ILE 52 -7.561 -1.641 5.761 384 HD11 ILE 52 3HD1 ILE 52 -9.088 -1.369 1.935 385 HD12 ILE 52 1HD1 ILE 52 -8.225 -2.507 0.902 386 HD13 ILE 52 2HD1 ILE 52 -7.359 -1.632 2.165 387 H THR 53 H THR 53 -7.564 -4.809 7.172 388 HA THR 53 HA THR 53 -8.652 -2.907 9.126 389 HB THR 53 HB THR 53 -8.231 -4.891 10.784 390 HG1 THR 53 HG1 THR 53 -8.820 -6.333 8.396 391 HG21 THR 53 3HG2 THR 53 -10.596 -4.865 8.904 392 HG22 THR 53 1HG2 THR 53 -10.422 -3.887 10.361 393 HG23 THR 53 2HG2 THR 53 -10.549 -5.642 10.487 394 H ALA 54 H ALA 54 -7.195 -3.139 11.238 395 HA ALA 54 HA ALA 54 -4.777 -1.910 10.557 396 HB1 ALA 54 3HB ALA 54 -5.944 -1.519 12.670 397 HB2 ALA 54 1HB ALA 54 -4.263 -1.979 12.934 398 HB3 ALA 54 2HB ALA 54 -5.549 -3.156 13.191 399 H SER 55 H SER 55 -5.429 -5.226 11.657 400 HA SER 55 HA SER 55 -2.789 -6.090 11.921 401 HG SER 55 HG SER 55 -6.067 -7.409 12.670 402 HB2 SER 55 1HB SER 55 -5.033 -7.839 10.912 403 HB3 SER 55 2HB SER 55 -3.652 -8.303 11.909 404 H LEU 56 H LEU 56 -4.903 -6.060 9.086 405 HA LEU 56 HA LEU 56 -3.087 -7.369 7.349 406 HG LEU 56 HG LEU 56 -6.135 -7.627 7.821 407 HB2 LEU 56 1HB LEU 56 -5.407 -5.537 6.744 408 HB3 LEU 56 2HB LEU 56 -4.534 -6.463 5.538 409 HD11 LEU 56 1HD1 LEU 56 -7.547 -6.620 6.116 410 HD12 LEU 56 2HD1 LEU 56 -7.658 -8.380 6.064 411 HD13 LEU 56 3HD1 LEU 56 -6.695 -7.520 4.862 412 HD21 LEU 56 3HD2 LEU 56 -5.739 -9.774 6.730 413 HD22 LEU 56 1HD2 LEU 56 -4.221 -9.024 7.225 414 HD23 LEU 56 2HD2 LEU 56 -4.715 -8.982 5.533 415 H LEU 57 H LEU 57 -3.684 -3.996 8.156 416 HA LEU 57 HA LEU 57 -1.987 -2.867 6.198 417 HG LEU 57 HG LEU 57 -4.728 -2.049 7.335 418 HB2 LEU 57 1HB LEU 57 -2.837 -1.821 8.900 419 HB3 LEU 57 2HB LEU 57 -1.971 -0.875 7.705 420 HD11 LEU 57 1HD1 LEU 57 -5.489 0.272 7.435 421 HD12 LEU 57 2HD1 LEU 57 -3.843 0.797 7.793 422 HD13 LEU 57 3HD1 LEU 57 -4.715 -0.220 8.941 423 HD21 LEU 57 3HD2 LEU 57 -3.499 -1.917 5.240 424 HD22 LEU 57 1HD2 LEU 57 -3.095 -0.231 5.564 425 HD23 LEU 57 2HD2 LEU 57 -4.774 -0.700 5.290 426 H GLN 58 H GLN 58 -1.440 -4.027 9.485 427 HA GLN 58 HA GLN 58 1.211 -3.217 9.820 428 HB2 GLN 58 1HB GLN 58 -0.169 -5.718 10.808 429 HB3 GLN 58 2HB GLN 58 1.409 -5.176 11.358 430 HG2 GLN 58 1HG GLN 58 0.447 -3.181 12.298 431 HG3 GLN 58 2HG GLN 58 -1.136 -3.598 11.643 432 HE21 GLN 58 2HE2 GLN 58 -0.301 -3.146 14.410 433 HE22 GLN 58 1HE2 GLN 58 -0.710 -4.584 15.275 434 H GLN 59 H GLN 59 -0.135 -6.091 8.274 435 HA GLN 59 HA GLN 59 2.347 -7.330 7.701 436 HB2 GLN 59 1HB GLN 59 -0.341 -7.653 6.354 437 HB3 GLN 59 2HB GLN 59 1.039 -8.717 6.120 438 HG2 GLN 59 1HG GLN 59 0.973 -9.334 8.478 439 HG3 GLN 59 2HG GLN 59 -0.401 -8.258 8.724 440 HE21 GLN 59 2HE2 GLN 59 -0.175 -11.148 9.118 441 HE22 GLN 59 1HE2 GLN 59 -1.404 -11.858 8.129 442 H ALA 60 H ALA 60 0.311 -5.081 5.906 443 HA ALA 60 HA ALA 60 1.835 -5.334 3.478 444 HB1 ALA 60 3HB ALA 60 0.356 -3.618 2.601 445 HB2 ALA 60 1HB ALA 60 -0.281 -3.321 4.219 446 HB3 ALA 60 2HB ALA 60 -0.566 -4.872 3.430 447 H ALA 61 H ALA 61 2.130 -3.461 6.320 448 HA ALA 61 HA ALA 61 3.263 -1.116 5.196 449 HB1 ALA 61 3HB ALA 61 3.535 -2.211 7.989 450 HB2 ALA 61 1HB ALA 61 2.254 -1.144 7.414 451 HB3 ALA 61 2HB ALA 61 3.920 -0.568 7.474 452 H GLY 62 H GLY 62 4.551 -4.240 5.808 453 HA2 GLY 62 1HA GLY 62 6.637 -5.099 5.318 454 HA3 GLY 62 2HA GLY 62 7.081 -3.520 4.683 455 H LEU 63 H LEU 63 6.023 -4.525 7.905 456 HA LEU 63 HA LEU 63 8.098 -2.912 9.113 457 HG LEU 63 HG LEU 63 4.965 -2.810 9.153 458 HB2 LEU 63 1HB LEU 63 6.013 -4.686 10.391 459 HB3 LEU 63 2HB LEU 63 7.033 -3.534 11.231 460 HD11 LEU 63 1HD1 LEU 63 3.679 -1.934 11.040 461 HD12 LEU 63 2HD1 LEU 63 4.888 -2.571 12.156 462 HD13 LEU 63 3HD1 LEU 63 3.926 -3.677 11.174 463 HD21 LEU 63 3HD2 LEU 63 5.354 -0.520 9.903 464 HD22 LEU 63 1HD2 LEU 63 6.829 -1.237 9.252 465 HD23 LEU 63 2HD2 LEU 63 6.616 -1.087 10.996 466 H ALA 64 H ALA 64 7.573 -6.190 8.279 467 HA ALA 64 HA ALA 64 9.732 -7.125 10.021 468 HB1 ALA 64 3HB ALA 64 7.833 -8.700 8.280 469 HB2 ALA 64 1HB ALA 64 7.663 -8.435 10.015 470 HB3 ALA 64 2HB ALA 64 9.021 -9.374 9.395 471 H GLU 65 H GLU 65 11.696 -6.870 9.176 472 HA GLU 65 HA GLU 65 12.076 -6.831 6.308 473 HB2 GLU 65 1HB GLU 65 13.263 -5.273 7.870 474 HB3 GLU 65 2HB GLU 65 14.163 -6.652 8.487 475 HG2 GLU 65 1HG GLU 65 15.209 -7.005 6.375 476 HG3 GLU 65 2HG GLU 65 14.174 -5.802 5.603 477 H VAL 66 H VAL 66 12.094 -8.691 5.287 478 HA VAL 66 HA VAL 66 12.739 -11.148 6.631 479 HB VAL 66 HB VAL 66 12.057 -10.723 3.718 480 HG11 VAL 66 1HG1 VAL 66 13.089 -12.881 4.170 481 HG12 VAL 66 2HG1 VAL 66 11.382 -13.075 3.776 482 HG13 VAL 66 3HG1 VAL 66 11.919 -13.187 5.453 483 HG21 VAL 66 3HG2 VAL 66 9.760 -11.313 4.349 484 HG22 VAL 66 1HG2 VAL 66 10.293 -9.825 5.134 485 HG23 VAL 66 2HG2 VAL 66 10.237 -11.333 6.047 486 H VAL 67 H VAL 67 14.798 -11.677 6.926 487 HA VAL 67 HA VAL 67 16.794 -11.232 4.858 488 HB VAL 67 HB VAL 67 18.357 -12.344 6.437 489 HG11 VAL 67 1HG1 VAL 67 16.719 -10.114 7.638 490 HG12 VAL 67 2HG1 VAL 67 18.075 -9.932 6.525 491 HG13 VAL 67 3HG1 VAL 67 18.344 -10.580 8.143 492 HG21 VAL 67 3HG2 VAL 67 17.606 -12.845 8.722 493 HG22 VAL 67 1HG2 VAL 67 16.793 -13.858 7.529 494 HG23 VAL 67 2HG2 VAL 67 15.945 -12.489 8.249 495 H ARG 68 H ARG 68 18.319 -13.483 4.827 496 HA ARG 68 HA ARG 68 16.461 -15.389 3.602 497 HE ARG 68 HE ARG 68 21.188 -15.879 1.509 498 HB2 ARG 68 1HB ARG 68 18.459 -14.482 2.333 499 HB3 ARG 68 2HB ARG 68 19.476 -15.424 3.416 500 HG2 ARG 68 1HG ARG 68 18.457 -17.472 2.662 501 HG3 ARG 68 2HG ARG 68 17.317 -16.574 1.663 502 HD2 ARG 68 1HD ARG 68 19.085 -17.462 0.285 503 HD3 ARG 68 2HD ARG 68 19.201 -15.705 0.340 504 HH11 ARG 68 1HH1 ARG 68 19.718 -19.027 1.098 505 HH12 ARG 68 2HH1 ARG 68 21.153 -19.907 1.541 506 HH21 ARG 68 1HH2 ARG 68 23.089 -17.016 2.090 507 HH22 ARG 68 2HH2 ARG 68 23.078 -18.758 2.113 508 H ASP 69 H ASP 69 17.944 -14.925 6.492 509 HA ASP 69 HA ASP 69 18.002 -16.156 8.393 510 HB2 ASP 69 1HB ASP 69 15.915 -17.181 7.849 511 HB3 ASP 69 2HB ASP 69 16.667 -18.236 6.660 512 HA PRO 70 HA PRO 70 21.861 -18.289 7.474 513 HB2 PRO 70 1HB PRO 70 23.374 -16.906 9.213 514 HB3 PRO 70 2HB PRO 70 22.933 -16.250 7.633 515 HG2 PRO 70 1HG PRO 70 21.942 -15.521 10.317 516 HG3 PRO 70 2HG PRO 70 21.992 -14.555 8.835 517 HD2 PRO 70 1HD PRO 70 19.761 -15.971 9.943 518 HD3 PRO 70 2HD PRO 70 19.819 -15.036 8.436 519 H LEU 71 H LEU 71 22.746 -20.006 8.555 520 HA LEU 71 HA LEU 71 21.453 -20.898 10.956 521 HG LEU 71 HG LEU 71 22.184 -23.992 9.075 522 HB2 LEU 71 1HB LEU 71 23.586 -21.999 9.170 523 HB3 LEU 71 2HB LEU 71 23.361 -22.694 10.762 524 HD11 LEU 71 1HD1 LEU 71 21.242 -23.905 11.308 525 HD12 LEU 71 2HD1 LEU 71 19.964 -24.009 10.098 526 HD13 LEU 71 3HD1 LEU 71 20.314 -22.468 10.880 527 HD21 LEU 71 3HD2 LEU 71 21.773 -22.248 7.433 528 HD22 LEU 71 1HD2 LEU 71 20.635 -21.463 8.527 529 HD23 LEU 71 2HD2 LEU 71 20.269 -23.057 7.868 530 H ALA 72 H ALA 72 24.582 -19.554 10.094 531 HA ALA 72 HA ALA 72 25.436 -19.577 12.876 532 HB1 ALA 72 3HB ALA 72 27.517 -18.610 12.049 533 HB2 ALA 72 1HB ALA 72 26.819 -18.459 10.436 534 HB3 ALA 72 2HB ALA 72 27.091 -20.056 11.134 535 H PHE 73 H PHE 73 23.873 -18.227 13.795 536 HA PHE 73 HA PHE 73 23.357 -15.594 12.860 537 HD1 PHE 73 HD1 PHE 73 20.771 -14.767 13.349 538 HD2 PHE 73 HD2 PHE 73 21.478 -18.723 14.751 539 HE1 PHE 73 HE1 PHE 73 18.650 -15.498 12.342 540 HE2 PHE 73 HE2 PHE 73 19.358 -19.461 13.744 541 HZ PHE 73 HZ PHE 73 17.940 -17.849 12.539 542 HB2 PHE 73 1HB PHE 73 22.831 -16.960 15.498 543 HB3 PHE 73 2HB PHE 73 22.389 -15.282 15.199 544 H LEU 74 H LEU 74 24.742 -14.000 12.871 545 HA LEU 74 HA LEU 74 26.883 -13.984 14.874 546 HG LEU 74 HG LEU 74 27.234 -14.978 11.992 547 HB2 LEU 74 1HB LEU 74 26.663 -12.582 12.211 548 HB3 LEU 74 2HB LEU 74 27.998 -12.381 13.328 549 HD11 LEU 74 1HD1 LEU 74 29.493 -13.063 11.433 550 HD12 LEU 74 2HD1 LEU 74 28.102 -13.372 10.392 551 HD13 LEU 74 3HD1 LEU 74 29.282 -14.648 10.691 552 HD21 LEU 74 3HD2 LEU 74 28.285 -15.305 14.171 553 HD22 LEU 74 1HD2 LEU 74 29.615 -14.248 13.696 554 HD23 LEU 74 2HD2 LEU 74 29.370 -15.786 12.867 555 H ASP 75 H ASP 75 27.492 -11.999 15.836 556 HA ASP 75 HA ASP 75 25.283 -10.308 16.553 557 HB2 ASP 75 1HB ASP 75 27.001 -9.133 17.939 558 HB3 ASP 75 2HB ASP 75 26.912 -10.861 18.254 559 H GLU 76 H GLU 76 28.214 -10.081 14.652 560 HA GLU 76 HA GLU 76 28.822 -8.796 12.898 561 HB2 GLU 76 1HB GLU 76 26.464 -9.216 12.158 562 HB3 GLU 76 2HB GLU 76 26.008 -7.699 12.916 563 HG2 GLU 76 1HG GLU 76 26.271 -7.180 10.660 564 HG3 GLU 76 2HG GLU 76 27.755 -6.611 11.421 565 HA PRO 77 HA PRO 77 30.166 -5.176 15.201 566 HB2 PRO 77 1HB PRO 77 31.683 -4.279 13.035 567 HB3 PRO 77 2HB PRO 77 32.265 -5.316 14.339 568 HG2 PRO 77 1HG PRO 77 31.350 -6.044 11.600 569 HG3 PRO 77 2HG PRO 77 32.643 -6.759 12.583 570 HD2 PRO 77 1HD PRO 77 30.274 -7.979 12.271 571 HD3 PRO 77 2HD PRO 77 31.165 -8.058 13.804 572 H GLU 78 H GLU 78 28.929 -3.436 15.368 573 HA GLU 78 HA GLU 78 27.169 -2.710 13.207 574 HB2 GLU 78 1HB GLU 78 27.524 -1.585 15.989 575 HB3 GLU 78 2HB GLU 78 26.281 -1.060 14.858 576 HG2 GLU 78 1HG GLU 78 25.229 -3.180 14.889 577 HG3 GLU 78 2HG GLU 78 26.584 -3.913 15.746 578 H ALA 79 H ALA 79 28.067 -1.663 11.585 579 HA ALA 79 HA ALA 79 30.233 0.186 11.910 580 HB1 ALA 79 3HB ALA 79 30.068 -1.250 9.938 581 HB2 ALA 79 1HB ALA 79 30.082 0.456 9.489 582 HB3 ALA 79 2HB ALA 79 28.567 -0.447 9.476 583 H GLY 80 H GLY 80 30.221 2.398 11.362 584 HA2 GLY 80 1HA GLY 80 27.922 3.799 12.353 585 HA3 GLY 80 2HA GLY 80 29.406 4.523 11.753 586 H ALA 81 H ALA 81 28.658 2.585 9.337 587 HA ALA 81 HA ALA 81 27.597 4.611 7.660 588 HB1 ALA 81 3HB ALA 81 29.062 2.843 6.817 589 HB2 ALA 81 1HB ALA 81 27.530 2.874 5.944 590 HB3 ALA 81 2HB ALA 81 27.823 1.641 7.171 591 H GLY 82 H GLY 82 26.191 2.082 9.583 592 HA2 GLY 82 1HA GLY 82 23.979 1.904 10.264 593 HA3 GLY 82 2HA GLY 82 23.556 3.179 9.133 594 H ALA 83 H ALA 83 24.650 1.979 6.815 595 HA ALA 83 HA ALA 83 24.192 0.548 5.120 596 HB1 ALA 83 3HB ALA 83 23.395 -1.710 5.540 597 HB2 ALA 83 1HB ALA 83 23.008 -1.279 7.206 598 HB3 ALA 83 2HB ALA 83 24.687 -1.287 6.666 599 H ARG 84 H ARG 84 21.399 0.036 7.279 600 HA ARG 84 HA ARG 84 19.752 1.422 5.291 601 HE ARG 84 HE ARG 84 19.819 -2.806 4.696 602 HB2 ARG 84 1HB ARG 84 17.928 -0.236 5.726 603 HB3 ARG 84 2HB ARG 84 19.320 -0.899 4.888 604 HG2 ARG 84 1HG ARG 84 20.113 -1.723 7.149 605 HG3 ARG 84 2HG ARG 84 18.508 -1.302 7.749 606 HD2 ARG 84 1HD ARG 84 18.522 -3.631 7.170 607 HD3 ARG 84 2HD ARG 84 17.528 -2.766 5.999 608 HH11 ARG 84 1HH1 ARG 84 18.212 -5.378 6.464 609 HH12 ARG 84 2HH1 ARG 84 19.007 -6.641 5.567 610 HH21 ARG 84 1HH2 ARG 84 20.826 -4.461 3.504 611 HH22 ARG 84 2HH2 ARG 84 20.491 -6.132 3.889 612 HA PRO 85 HA PRO 85 18.822 3.424 9.190 613 HB2 PRO 85 1HB PRO 85 18.158 5.795 7.797 614 HB3 PRO 85 2HB PRO 85 19.694 5.414 8.571 615 HG2 PRO 85 1HG PRO 85 19.276 5.721 5.825 616 HG3 PRO 85 2HG PRO 85 20.693 4.978 6.584 617 HD2 PRO 85 1HD PRO 85 18.300 3.686 5.354 618 HD3 PRO 85 2HD PRO 85 19.994 3.149 5.372 619 H ALA 86 H ALA 86 16.957 3.115 10.180 620 HA ALA 86 HA ALA 86 14.757 3.058 10.699 621 HB1 ALA 86 3HB ALA 86 14.432 5.062 8.469 622 HB2 ALA 86 1HB ALA 86 14.821 5.445 10.146 623 HB3 ALA 86 2HB ALA 86 13.264 4.719 9.746 624 H ASN 87 H ASN 87 14.342 0.953 10.191 625 HA ASN 87 HA ASN 87 13.966 -0.027 7.564 626 HB2 ASN 87 1HB ASN 87 12.867 -1.221 10.122 627 HB3 ASN 87 2HB ASN 87 13.149 -2.061 8.602 628 HD21 ASN 87 2HD2 ASN 87 15.264 -2.627 8.020 629 HD22 ASN 87 1HD2 ASN 87 16.565 -2.579 9.171 630 H ALA 88 H ALA 88 11.798 1.242 10.015 631 HA ALA 88 HA ALA 88 9.369 0.608 8.697 632 HB1 ALA 88 3HB ALA 88 9.482 1.157 11.087 633 HB2 ALA 88 1HB ALA 88 8.337 2.195 10.233 634 HB3 ALA 88 2HB ALA 88 9.927 2.815 10.679 635 HA PRO 89 HA PRO 89 9.728 3.525 5.363 636 HB2 PRO 89 1HB PRO 89 7.183 3.276 4.432 637 HB3 PRO 89 2HB PRO 89 8.446 2.079 4.124 638 HG2 PRO 89 1HG PRO 89 6.268 2.050 6.178 639 HG3 PRO 89 2HG PRO 89 6.844 0.732 5.139 640 HD2 PRO 89 1HD PRO 89 7.589 0.948 7.722 641 HD3 PRO 89 2HD PRO 89 8.682 0.312 6.476 642 H GLU 90 H GLU 90 9.000 5.599 4.805 643 HA GLU 90 HA GLU 90 7.912 7.127 6.966 644 HB2 GLU 90 1HB GLU 90 9.562 8.221 5.642 645 HB3 GLU 90 2HB GLU 90 8.723 7.832 4.146 646 HG2 GLU 90 1HG GLU 90 6.929 9.353 4.721 647 HG3 GLU 90 2HG GLU 90 7.689 9.696 6.272 648 H VAL 91 H VAL 91 6.752 5.998 3.822 649 HA VAL 91 HA VAL 91 4.056 6.835 4.629 650 HB VAL 91 HB VAL 91 4.780 8.629 3.236 651 HG11 VAL 91 1HG1 VAL 91 6.651 7.571 2.130 652 HG12 VAL 91 2HG1 VAL 91 5.576 8.309 0.942 653 HG13 VAL 91 3HG1 VAL 91 5.554 6.562 1.187 654 HG21 VAL 91 3HG2 VAL 91 3.004 6.785 1.644 655 HG22 VAL 91 1HG2 VAL 91 3.190 8.516 1.369 656 HG23 VAL 91 2HG2 VAL 91 2.485 7.933 2.877 657 H LEU 92 H LEU 92 2.429 5.538 4.060 658 HA LEU 92 HA LEU 92 3.057 3.161 2.428 659 HG LEU 92 HG LEU 92 0.365 1.760 3.042 660 HB2 LEU 92 1HB LEU 92 2.683 2.596 4.785 661 HB3 LEU 92 2HB LEU 92 1.144 3.433 4.755 662 HD11 LEU 92 1HD1 LEU 92 2.897 0.340 3.844 663 HD12 LEU 92 2HD1 LEU 92 2.550 1.024 2.257 664 HD13 LEU 92 3HD1 LEU 92 1.600 -0.334 2.859 665 HD21 LEU 92 3HD2 LEU 92 -0.268 1.585 5.387 666 HD22 LEU 92 1HD2 LEU 92 1.212 0.689 5.730 667 HD23 LEU 92 2HD2 LEU 92 -0.021 -0.013 4.682 668 H LEU 93 H LEU 93 1.936 3.049 0.584 669 HA LEU 93 HA LEU 93 -0.421 4.787 0.298 670 HG LEU 93 HG LEU 93 2.431 5.499 -0.684 671 HB2 LEU 93 1HB LEU 93 1.377 3.564 -1.797 672 HB3 LEU 93 2HB LEU 93 -0.034 4.544 -2.143 673 HD11 LEU 93 1HD1 LEU 93 1.465 6.038 -3.489 674 HD12 LEU 93 2HD1 LEU 93 2.870 5.073 -3.037 675 HD13 LEU 93 3HD1 LEU 93 2.849 6.805 -2.710 676 HD21 LEU 93 3HD2 LEU 93 1.430 7.718 -0.907 677 HD22 LEU 93 1HD2 LEU 93 0.404 6.647 0.046 678 HD23 LEU 93 2HD2 LEU 93 -0.009 7.001 -1.631 679 H VAL 94 H VAL 94 -2.351 3.861 0.278 680 HA VAL 94 HA VAL 94 -2.520 0.999 -0.402 681 HB VAL 94 HB VAL 94 -4.485 2.670 1.182 682 HG11 VAL 94 1HG1 VAL 94 -5.561 0.843 -0.030 683 HG12 VAL 94 2HG1 VAL 94 -5.559 0.535 1.706 684 HG13 VAL 94 3HG1 VAL 94 -4.411 -0.301 0.662 685 HG21 VAL 94 3HG2 VAL 94 -2.496 0.599 2.106 686 HG22 VAL 94 1HG2 VAL 94 -3.716 1.369 3.119 687 HG23 VAL 94 2HG2 VAL 94 -2.419 2.334 2.417 688 H GLY 95 H GLY 95 -3.188 0.646 -2.408 689 HA2 GLY 95 1HA GLY 95 -4.574 2.654 -3.935 690 HA3 GLY 95 2HA GLY 95 -4.128 1.045 -4.482 691 H THR 96 H THR 96 -6.551 2.985 -2.945 692 HA THR 96 HA THR 96 -8.374 0.684 -2.771 693 HB THR 96 HB THR 96 -9.640 2.854 -1.588 694 HG1 THR 96 HG1 THR 96 -6.831 2.924 -1.119 695 HG21 THR 96 3HG2 THR 96 -7.934 0.723 -0.291 696 HG22 THR 96 1HG2 THR 96 -9.631 0.562 -0.744 697 HG23 THR 96 2HG2 THR 96 -9.160 1.693 0.524 698 H GLY 97 H GLY 97 -7.772 1.956 -5.307 699 HA2 GLY 97 1HA GLY 97 -9.778 3.900 -5.929 700 HA3 GLY 97 2HA GLY 97 -8.736 3.079 -7.078 701 H ARG 98 H ARG 98 -9.856 0.500 -5.726 702 HA ARG 98 HA ARG 98 -11.991 0.151 -7.644 703 HE ARG 98 HE ARG 98 -13.441 -4.618 -7.932 704 HB2 ARG 98 1HB ARG 98 -10.311 -1.624 -7.232 705 HB3 ARG 98 2HB ARG 98 -10.901 -1.778 -5.583 706 HG2 ARG 98 1HG ARG 98 -13.086 -2.464 -6.428 707 HG3 ARG 98 2HG ARG 98 -12.487 -2.318 -8.081 708 HD2 ARG 98 1HD ARG 98 -10.865 -4.065 -7.684 709 HD3 ARG 98 2HD ARG 98 -11.341 -4.160 -5.988 710 HH11 ARG 98 1HH1 ARG 98 -10.970 -6.095 -5.945 711 HH12 ARG 98 2HH1 ARG 98 -11.813 -7.601 -5.790 712 HH21 ARG 98 1HH2 ARG 98 -14.549 -6.584 -7.745 713 HH22 ARG 98 2HH2 ARG 98 -13.871 -7.890 -6.815 714 H ARG 99 H ARG 99 -11.649 0.895 -4.329 715 HA ARG 99 HA ARG 99 -14.393 1.486 -3.989 716 HE ARG 99 HE ARG 99 -17.434 0.959 -0.765 717 HB2 ARG 99 1HB ARG 99 -14.520 -0.990 -3.694 718 HB3 ARG 99 2HB ARG 99 -13.360 -0.868 -2.379 719 HG2 ARG 99 1HG ARG 99 -15.561 -1.070 -1.457 720 HG3 ARG 99 2HG ARG 99 -14.969 0.564 -1.151 721 HD2 ARG 99 1HD ARG 99 -16.270 1.398 -3.038 722 HD3 ARG 99 2HD ARG 99 -16.834 -0.234 -3.384 723 HH11 ARG 99 1HH1 ARG 99 -18.524 -0.226 -3.876 724 HH12 ARG 99 2HH1 ARG 99 -20.210 -0.194 -3.449 725 HH21 ARG 99 1HH2 ARG 99 -19.644 0.990 -0.185 726 HH22 ARG 99 2HH2 ARG 99 -20.849 0.479 -1.331 727 H GLN 100 H GLN 100 -13.564 3.453 -3.393 728 HA GLN 100 HA GLN 100 -11.387 3.909 -1.740 729 HB2 GLN 100 1HB GLN 100 -13.824 5.646 -2.143 730 HB3 GLN 100 2HB GLN 100 -12.284 6.179 -1.497 731 HG2 GLN 100 1HG GLN 100 -11.200 5.630 -3.617 732 HG3 GLN 100 2HG GLN 100 -12.755 5.112 -4.266 733 HE21 GLN 100 2HE2 GLN 100 -10.981 7.205 -5.219 734 HE22 GLN 100 1HE2 GLN 100 -11.893 8.676 -5.165 735 H HIS 101 H HIS 101 -11.174 3.075 0.211 736 HA HIS 101 HA HIS 101 -13.419 3.311 2.101 737 HD1 HIS 101 HD1 HIS 101 -11.717 0.306 4.737 738 HD2 HIS 101 HD2 HIS 101 -15.133 1.370 2.609 739 HE1 HIS 101 HE1 HIS 101 -13.657 -0.482 6.125 740 HE2 HIS 101 HE2 HIS 101 -15.711 0.066 4.768 741 HB2 HIS 101 1HB HIS 101 -12.342 0.987 1.348 742 HB3 HIS 101 2HB HIS 101 -11.163 1.410 2.585 743 H LEU 102 H LEU 102 -12.999 5.194 3.110 744 HA LEU 102 HA LEU 102 -10.466 6.313 3.514 745 HG LEU 102 HG LEU 102 -13.246 7.363 2.604 746 HB2 LEU 102 1HB LEU 102 -13.042 6.830 4.999 747 HB3 LEU 102 2HB LEU 102 -11.611 7.838 5.099 748 HD11 LEU 102 1HD1 LEU 102 -13.022 9.775 4.396 749 HD12 LEU 102 2HD1 LEU 102 -14.429 8.726 4.230 750 HD13 LEU 102 3HD1 LEU 102 -13.895 9.707 2.866 751 HD21 LEU 102 3HD2 LEU 102 -10.889 9.180 3.100 752 HD22 LEU 102 1HD2 LEU 102 -11.857 9.126 1.626 753 HD23 LEU 102 2HD2 LEU 102 -10.890 7.728 2.099 754 H LEU 103 H LEU 103 -8.912 5.465 4.691 755 HA LEU 103 HA LEU 103 -9.332 3.705 6.865 756 HG LEU 103 HG LEU 103 -7.601 3.591 4.330 757 HB2 LEU 103 1HB LEU 103 -6.866 5.234 6.030 758 HB3 LEU 103 2HB LEU 103 -6.891 3.967 7.242 759 HD11 LEU 103 1HD1 LEU 103 -5.496 2.365 4.184 760 HD12 LEU 103 2HD1 LEU 103 -5.132 2.782 5.859 761 HD13 LEU 103 3HD1 LEU 103 -5.226 4.048 4.635 762 HD21 LEU 103 3HD2 LEU 103 -7.569 1.208 4.865 763 HD22 LEU 103 1HD2 LEU 103 -8.793 2.057 5.810 764 HD23 LEU 103 2HD2 LEU 103 -7.268 1.588 6.561 765 H GLY 104 H GLY 104 -9.448 4.061 9.002 766 HA2 GLY 104 1HA GLY 104 -9.684 6.888 9.792 767 HA3 GLY 104 2HA GLY 104 -10.542 5.550 10.543 768 HA PRO 105 HA PRO 105 -6.710 7.120 12.897 769 HB2 PRO 105 1HB PRO 105 -8.063 7.119 15.324 770 HB3 PRO 105 2HB PRO 105 -7.820 8.529 14.290 771 HG2 PRO 105 1HG PRO 105 -10.195 6.730 14.516 772 HG3 PRO 105 2HG PRO 105 -10.136 8.493 14.328 773 HD2 PRO 105 1HD PRO 105 -10.713 6.915 12.257 774 HD3 PRO 105 2HD PRO 105 -9.695 8.356 12.046 775 H GLU 106 H GLU 106 -9.150 4.783 14.040 776 HA GLU 106 HA GLU 106 -7.318 3.390 15.712 777 HB2 GLU 106 1HB GLU 106 -9.982 2.470 14.628 778 HB3 GLU 106 2HB GLU 106 -9.113 1.757 15.980 779 HG2 GLU 106 1HG GLU 106 -9.361 3.811 17.248 780 HG3 GLU 106 2HG GLU 106 -10.193 4.561 15.886 781 H GLN 107 H GLN 107 -8.124 3.169 12.366 782 HA GLN 107 HA GLN 107 -7.312 0.431 12.050 783 HB2 GLN 107 1HB GLN 107 -7.895 2.587 10.015 784 HB3 GLN 107 2HB GLN 107 -7.572 0.904 9.620 785 HG2 GLN 107 1HG GLN 107 -9.553 0.201 10.798 786 HG3 GLN 107 2HG GLN 107 -9.848 1.849 11.349 787 HE21 GLN 107 2HE2 GLN 107 -11.545 0.073 9.765 788 HE22 GLN 107 1HE2 GLN 107 -11.876 0.928 8.296 789 H VAL 108 H VAL 108 -5.879 3.608 11.423 790 HA VAL 108 HA VAL 108 -3.411 2.280 10.552 791 HB VAL 108 HB VAL 108 -2.680 4.527 9.801 792 HG11 VAL 108 1HG1 VAL 108 -4.217 4.688 7.897 793 HG12 VAL 108 2HG1 VAL 108 -5.353 3.628 8.732 794 HG13 VAL 108 3HG1 VAL 108 -3.773 3.016 8.241 795 HG21 VAL 108 3HG2 VAL 108 -5.462 5.369 10.608 796 HG22 VAL 108 1HG2 VAL 108 -4.313 6.351 9.700 797 HG23 VAL 108 2HG2 VAL 108 -3.957 5.892 11.365 798 H ARG 109 H ARG 109 -4.658 3.128 13.372 799 HA ARG 109 HA ARG 109 -2.931 4.878 14.631 800 HE ARG 109 HE ARG 109 -5.435 2.353 18.014 801 HB2 ARG 109 1HB ARG 109 -5.023 4.160 15.635 802 HB3 ARG 109 2HB ARG 109 -4.398 2.530 15.836 803 HG2 ARG 109 1HG ARG 109 -3.049 3.114 17.595 804 HG3 ARG 109 2HG ARG 109 -2.928 4.797 17.084 805 HD2 ARG 109 1HD ARG 109 -4.272 4.586 19.106 806 HD3 ARG 109 2HD ARG 109 -5.232 5.186 17.759 807 HH11 ARG 109 1HH1 ARG 109 -6.536 5.369 19.412 808 HH12 ARG 109 2HH1 ARG 109 -8.041 4.709 19.990 809 HH21 ARG 109 1HH2 ARG 109 -7.428 1.472 18.763 810 HH22 ARG 109 2HH2 ARG 109 -8.534 2.498 19.625 811 HA PRO 110 HA PRO 110 -0.235 0.960 16.036 812 HB2 PRO 110 1HB PRO 110 -0.540 -0.525 13.472 813 HB3 PRO 110 2HB PRO 110 -0.331 -1.144 15.114 814 HG2 PRO 110 1HG PRO 110 -2.711 -1.222 13.925 815 HG3 PRO 110 2HG PRO 110 -2.565 -0.848 15.653 816 HD2 PRO 110 1HD PRO 110 -3.116 0.972 13.356 817 HD3 PRO 110 2HD PRO 110 -3.729 1.035 15.021 818 H LEU 111 H LEU 111 -0.570 2.105 12.721 819 HA LEU 111 HA LEU 111 2.293 1.988 12.270 820 HG LEU 111 HG LEU 111 -0.133 0.569 10.839 821 HB2 LEU 111 1HB LEU 111 0.068 2.986 10.491 822 HB3 LEU 111 2HB LEU 111 1.742 2.786 10.010 823 HD11 LEU 111 1HD1 LEU 111 0.037 -0.142 8.515 824 HD12 LEU 111 2HD1 LEU 111 1.032 1.269 8.152 825 HD13 LEU 111 3HD1 LEU 111 -0.649 1.478 8.641 826 HD21 LEU 111 3HD2 LEU 111 1.677 -0.934 10.169 827 HD22 LEU 111 1HD2 LEU 111 2.154 0.097 11.518 828 HD23 LEU 111 2HD2 LEU 111 2.725 0.456 9.890 829 H LEU 112 H LEU 112 -0.213 4.402 12.838 830 HA LEU 112 HA LEU 112 1.380 6.691 12.418 831 HG LEU 112 HG LEU 112 -1.692 5.985 12.006 832 HB2 LEU 112 1HB LEU 112 -0.954 6.298 14.295 833 HB3 LEU 112 2HB LEU 112 -0.252 7.851 13.889 834 HD11 LEU 112 1HD1 LEU 112 -3.329 7.792 11.881 835 HD12 LEU 112 2HD1 LEU 112 -2.404 8.714 13.066 836 HD13 LEU 112 3HD1 LEU 112 -3.160 7.189 13.531 837 HD21 LEU 112 3HD2 LEU 112 0.147 7.102 10.858 838 HD22 LEU 112 1HD2 LEU 112 -0.417 8.662 11.458 839 HD23 LEU 112 2HD2 LEU 112 -1.408 7.740 10.328 840 H ALA 113 H ALA 113 0.965 4.543 15.151 841 HA ALA 113 HA ALA 113 2.393 6.101 17.045 842 HB1 ALA 113 3HB ALA 113 0.847 4.307 17.686 843 HB2 ALA 113 1HB ALA 113 2.448 4.074 18.388 844 HB3 ALA 113 2HB ALA 113 1.950 3.117 16.993 845 H MET 114 H MET 114 3.409 4.336 14.340 846 HA MET 114 HA MET 114 6.137 4.041 15.375 847 HB2 MET 114 1HB MET 114 4.882 3.024 12.818 848 HB3 MET 114 2HB MET 114 6.555 2.760 13.289 849 HG2 MET 114 1HG MET 114 5.794 1.532 15.267 850 HG3 MET 114 2HG MET 114 4.122 1.775 14.762 851 HE1 MET 114 3HE MET 114 4.659 -2.038 14.092 852 HE2 MET 114 1HE MET 114 3.638 -0.824 14.863 853 HE3 MET 114 2HE MET 114 5.289 -1.077 15.430 854 H GLY 115 H GLY 115 4.189 5.913 13.225 855 HA2 GLY 115 1HA GLY 115 4.948 8.117 12.591 856 HA3 GLY 115 2HA GLY 115 6.578 7.469 12.479 857 H VAL 116 H VAL 116 4.081 5.499 11.228 858 HA VAL 116 HA VAL 116 5.035 5.994 8.510 859 HB VAL 116 HB VAL 116 3.168 3.827 9.497 860 HG11 VAL 116 1HG1 VAL 116 4.700 4.095 6.913 861 HG12 VAL 116 2HG1 VAL 116 2.959 4.283 7.114 862 HG13 VAL 116 3HG1 VAL 116 3.714 2.713 7.387 863 HG21 VAL 116 3HG2 VAL 116 5.107 2.331 9.391 864 HG22 VAL 116 1HG2 VAL 116 5.338 3.617 10.576 865 HG23 VAL 116 2HG2 VAL 116 6.144 3.706 9.008 866 H GLY 117 H GLY 117 3.940 7.353 7.256 867 HA2 GLY 117 1HA GLY 117 1.219 8.114 7.957 868 HA3 GLY 117 2HA GLY 117 2.224 8.851 6.716 869 H VAL 118 H VAL 118 -0.392 6.866 7.276 870 HA VAL 118 HA VAL 118 -0.075 5.357 4.791 871 HB VAL 118 HB VAL 118 -2.307 5.138 6.814 872 HG11 VAL 118 1HG1 VAL 118 -2.868 4.255 4.625 873 HG12 VAL 118 2HG1 VAL 118 -2.665 2.939 5.783 874 HG13 VAL 118 3HG1 VAL 118 -1.391 3.291 4.614 875 HG21 VAL 118 3HG2 VAL 118 0.228 3.518 6.605 876 HG22 VAL 118 1HG2 VAL 118 -1.126 3.173 7.681 877 HG23 VAL 118 2HG2 VAL 118 -0.184 4.649 7.895 878 H GLU 119 H GLU 119 -0.896 6.122 2.983 879 HA GLU 119 HA GLU 119 -3.092 8.075 3.129 880 HB2 GLU 119 1HB GLU 119 -0.875 7.675 1.135 881 HB3 GLU 119 2HB GLU 119 -2.304 8.623 0.747 882 HG2 GLU 119 1HG GLU 119 -0.536 9.188 3.110 883 HG3 GLU 119 2HG GLU 119 -0.311 9.926 1.524 884 H ALA 120 H ALA 120 -5.012 7.308 2.612 885 HA ALA 120 HA ALA 120 -5.307 4.960 0.936 886 HB1 ALA 120 3HB ALA 120 -7.693 5.167 1.416 887 HB2 ALA 120 1HB ALA 120 -7.409 6.718 2.208 888 HB3 ALA 120 2HB ALA 120 -6.746 5.238 2.902 889 H MET 121 H MET 121 -5.113 5.237 -1.196 890 HA MET 121 HA MET 121 -6.322 7.617 -2.431 891 HB2 MET 121 1HB MET 121 -3.829 7.885 -2.006 892 HB3 MET 121 2HB MET 121 -3.576 6.575 -3.149 893 HG2 MET 121 1HG MET 121 -4.731 7.932 -4.873 894 HG3 MET 121 2HG MET 121 -4.812 9.258 -3.715 895 HE1 MET 121 3HE MET 121 -1.980 8.805 -2.211 896 HE2 MET 121 1HE MET 121 -2.595 10.399 -2.647 897 HE3 MET 121 2HE MET 121 -0.958 9.929 -3.108 898 H ASP 122 H ASP 122 -6.576 7.351 -4.810 899 HA ASP 122 HA ASP 122 -7.732 4.914 -5.539 900 HB2 ASP 122 1HB ASP 122 -6.599 7.077 -7.329 901 HB3 ASP 122 2HB ASP 122 -7.670 5.783 -7.856 902 H THR 123 H THR 123 -7.015 3.295 -7.036 903 HA THR 123 HA THR 123 -4.520 2.268 -6.282 904 HB THR 123 HB THR 123 -6.094 1.410 -8.712 905 HG1 THR 123 HG1 THR 123 -6.872 -0.121 -6.844 906 HG21 THR 123 3HG2 THR 123 -4.316 -0.117 -6.799 907 HG22 THR 123 1HG2 THR 123 -3.890 0.362 -8.443 908 HG23 THR 123 2HG2 THR 123 -5.186 -0.803 -8.172 909 H GLN 124 H GLN 124 -5.566 3.747 -9.348 910 HA GLN 124 HA GLN 124 -3.030 3.494 -10.611 911 HB2 GLN 124 1HB GLN 124 -5.187 3.780 -11.825 912 HB3 GLN 124 2HB GLN 124 -5.255 5.439 -11.247 913 HG2 GLN 124 1HG GLN 124 -3.080 5.847 -12.406 914 HG3 GLN 124 2HG GLN 124 -3.224 4.237 -13.112 915 HE21 GLN 124 2HE2 GLN 124 -3.142 6.807 -14.450 916 HE22 GLN 124 1HE2 GLN 124 -4.630 6.957 -15.329 917 H ALA 125 H ALA 125 -4.624 6.065 -8.800 918 HA ALA 125 HA ALA 125 -2.714 8.083 -9.276 919 HB1 ALA 125 3HB ALA 125 -4.977 8.544 -8.460 920 HB2 ALA 125 1HB ALA 125 -3.748 9.252 -7.410 921 HB3 ALA 125 2HB ALA 125 -4.577 7.772 -6.925 922 H ALA 126 H ALA 126 -3.035 5.659 -6.715 923 HA ALA 126 HA ALA 126 -0.880 6.532 -5.126 924 HB1 ALA 126 3HB ALA 126 -2.591 4.963 -4.334 925 HB2 ALA 126 1HB ALA 126 -0.961 4.331 -4.101 926 HB3 ALA 126 2HB ALA 126 -1.958 3.731 -5.426 927 H ALA 127 H ALA 127 -1.060 4.391 -7.914 928 HA ALA 127 HA ALA 127 1.575 3.407 -7.824 929 HB1 ALA 127 3HB ALA 127 -0.184 2.407 -9.208 930 HB2 ALA 127 1HB ALA 127 1.248 2.802 -10.160 931 HB3 ALA 127 2HB ALA 127 -0.179 3.836 -10.242 932 H ARG 128 H ARG 128 0.180 6.215 -9.514 933 HA ARG 128 HA ARG 128 2.594 7.077 -10.689 934 HE ARG 128 HE ARG 128 1.499 12.429 -11.448 935 HB2 ARG 128 1HB ARG 128 0.470 7.912 -11.495 936 HB3 ARG 128 2HB ARG 128 0.124 8.645 -9.935 937 HG2 ARG 128 1HG ARG 128 1.925 10.222 -10.224 938 HG3 ARG 128 2HG ARG 128 2.412 9.435 -11.726 939 HD2 ARG 128 1HD ARG 128 0.334 10.063 -12.779 940 HD3 ARG 128 2HD ARG 128 -0.270 10.730 -11.262 941 HH11 ARG 128 1HH1 ARG 128 0.550 10.679 -14.323 942 HH12 ARG 128 2HH1 ARG 128 1.083 11.916 -15.416 943 HH21 ARG 128 1HH2 ARG 128 2.202 14.065 -12.869 944 HH22 ARG 128 2HH2 ARG 128 2.027 13.847 -14.592 945 H THR 129 H THR 129 1.054 7.857 -7.607 946 HA THR 129 HA THR 129 2.918 9.787 -6.752 947 HB THR 129 HB THR 129 1.352 7.893 -4.986 948 HG1 THR 129 HG1 THR 129 -0.192 8.855 -6.210 949 HG21 THR 129 3HG2 THR 129 2.385 10.693 -4.507 950 HG22 THR 129 1HG2 THR 129 3.058 9.217 -3.817 951 HG23 THR 129 2HG2 THR 129 1.431 9.737 -3.373 952 H TYR 130 H TYR 130 2.740 6.283 -6.276 953 HA TYR 130 HA TYR 130 5.031 5.898 -4.741 954 HD1 TYR 130 HD2 TYR 130 5.531 3.401 -3.661 955 HD2 TYR 130 HD1 TYR 130 5.229 2.765 -7.855 956 HE1 TYR 130 HE2 TYR 130 7.253 1.651 -3.514 957 HE2 TYR 130 HE1 TYR 130 6.947 1.014 -7.722 958 HH TYR 130 HH TYR 130 8.712 0.265 -6.332 959 HB2 TYR 130 1HB TYR 130 3.484 4.098 -5.065 960 HB3 TYR 130 2HB TYR 130 3.687 4.155 -6.810 961 H ASN 131 H ASN 131 4.653 6.108 -8.252 962 HA ASN 131 HA ASN 131 7.280 5.540 -9.017 963 HB2 ASN 131 1HB ASN 131 5.302 5.783 -10.553 964 HB3 ASN 131 2HB ASN 131 5.426 7.527 -10.351 965 HD21 ASN 131 2HD2 ASN 131 6.697 4.729 -11.875 966 HD22 ASN 131 1HD2 ASN 131 7.863 5.532 -12.874 967 H ILE 132 H ILE 132 5.757 8.639 -8.210 968 HA ILE 132 HA ILE 132 8.046 10.241 -8.645 969 HB ILE 132 HB ILE 132 5.646 10.775 -6.883 970 HG12 ILE 132 1HG1 ILE 132 6.230 11.640 -9.726 971 HG13 ILE 132 2HG1 ILE 132 5.112 10.359 -9.270 972 HG21 ILE 132 1HG2 ILE 132 7.722 12.679 -7.967 973 HG22 ILE 132 2HG2 ILE 132 7.520 12.205 -6.281 974 HG23 ILE 132 3HG2 ILE 132 6.263 13.141 -7.089 975 HD11 ILE 132 3HD1 ILE 132 4.853 13.268 -8.541 976 HD12 ILE 132 1HD1 ILE 132 3.727 11.986 -8.097 977 HD13 ILE 132 2HD1 ILE 132 3.942 12.422 -9.792 978 H LEU 133 H LEU 133 6.679 8.784 -5.703 979 HA LEU 133 HA LEU 133 8.559 9.889 -3.912 980 HG LEU 133 HG LEU 133 5.468 9.253 -3.894 981 HB2 LEU 133 1HB LEU 133 6.972 7.333 -3.668 982 HB3 LEU 133 2HB LEU 133 7.811 8.134 -2.353 983 HD11 LEU 133 1HD1 LEU 133 4.260 8.995 -1.792 984 HD12 LEU 133 2HD1 LEU 133 5.682 8.250 -1.061 985 HD13 LEU 133 3HD1 LEU 133 4.847 7.443 -2.390 986 HD21 LEU 133 3HD2 LEU 133 7.005 11.011 -3.195 987 HD22 LEU 133 1HD2 LEU 133 6.978 10.389 -1.544 988 HD23 LEU 133 2HD2 LEU 133 5.512 11.065 -2.257 989 H MET 134 H MET 134 8.573 6.954 -5.850 990 HA MET 134 HA MET 134 10.931 5.829 -4.750 991 HB2 MET 134 1HB MET 134 9.384 4.500 -6.094 992 HB3 MET 134 2HB MET 134 9.712 5.502 -7.500 993 HG2 MET 134 1HG MET 134 12.056 4.745 -7.460 994 HG3 MET 134 2HG MET 134 11.670 3.696 -6.098 995 HE1 MET 134 3HE MET 134 9.763 3.205 -10.270 996 HE2 MET 134 1HE MET 134 10.933 4.468 -9.888 997 HE3 MET 134 2HE MET 134 9.337 4.489 -9.138 998 H ALA 135 H ALA 135 10.317 8.185 -7.276 999 HA ALA 135 HA ALA 135 12.965 8.302 -8.284 1000 HB1 ALA 135 3HB ALA 135 10.808 10.412 -8.369 1001 HB2 ALA 135 1HB ALA 135 11.038 9.124 -9.553 1002 HB3 ALA 135 2HB ALA 135 12.267 10.375 -9.360 1003 H GLU 136 H GLU 136 11.242 10.051 -5.743 1004 HA GLU 136 HA GLU 136 13.394 11.823 -5.137 1005 HB2 GLU 136 1HB GLU 136 11.109 10.946 -3.363 1006 HB3 GLU 136 2HB GLU 136 12.167 12.319 -3.077 1007 HG2 GLU 136 1HG GLU 136 11.328 13.225 -5.295 1008 HG3 GLU 136 2HG GLU 136 10.077 11.985 -5.197 1009 H GLY 137 H GLY 137 12.665 8.558 -4.367 1010 HA2 GLY 137 1HA GLY 137 14.155 7.003 -3.464 1011 HA3 GLY 137 2HA GLY 137 15.170 8.329 -2.912 1012 H ARG 138 H ARG 138 11.726 8.147 -2.272 1013 HA ARG 138 HA ARG 138 12.243 8.264 0.562 1014 HE ARG 138 HE ARG 138 9.217 12.442 -1.240 1015 HB2 ARG 138 1HB ARG 138 9.680 8.217 -1.028 1016 HB3 ARG 138 2HB ARG 138 9.759 8.367 0.713 1017 HG2 ARG 138 1HG ARG 138 11.142 10.455 0.332 1018 HG3 ARG 138 2HG ARG 138 10.648 10.332 -1.361 1019 HD2 ARG 138 1HD ARG 138 8.279 10.256 -0.578 1020 HD3 ARG 138 2HD ARG 138 8.863 10.600 1.048 1021 HH11 ARG 138 1HH1 ARG 138 8.669 11.826 2.178 1022 HH12 ARG 138 2HH1 ARG 138 8.306 13.488 2.537 1023 HH21 ARG 138 1HH2 ARG 138 8.759 14.617 -0.754 1024 HH22 ARG 138 2HH2 ARG 138 8.342 15.075 0.869 1025 H ARG 139 H ARG 139 11.517 6.752 2.090 1026 HA ARG 139 HA ARG 139 11.223 4.047 1.111 1027 HE ARG 139 HE ARG 139 12.286 2.382 5.377 1028 HB2 ARG 139 1HB ARG 139 11.234 5.171 3.917 1029 HB3 ARG 139 2HB ARG 139 11.058 3.459 3.549 1030 HG2 ARG 139 1HG ARG 139 13.244 3.537 2.382 1031 HG3 ARG 139 2HG ARG 139 13.422 5.210 2.905 1032 HD2 ARG 139 1HD ARG 139 14.655 3.745 4.380 1033 HD3 ARG 139 2HD ARG 139 13.302 4.467 5.247 1034 HH11 ARG 139 1HH1 ARG 139 15.205 2.190 3.442 1035 HH12 ARG 139 2HH1 ARG 139 15.332 0.464 3.589 1036 HH21 ARG 139 1HH2 ARG 139 12.466 0.108 5.574 1037 HH22 ARG 139 2HH2 ARG 139 13.795 -0.719 4.806 1038 H VAL 140 H VAL 140 9.385 3.938 0.031 1039 HA VAL 140 HA VAL 140 6.889 4.352 1.526 1040 HB VAL 140 HB VAL 140 7.015 6.110 -0.113 1041 HG11 VAL 140 1HG1 VAL 140 7.278 5.671 -2.511 1042 HG12 VAL 140 2HG1 VAL 140 7.539 3.961 -2.164 1043 HG13 VAL 140 3HG1 VAL 140 8.695 5.164 -1.592 1044 HG21 VAL 140 3HG2 VAL 140 5.188 3.917 -1.091 1045 HG22 VAL 140 1HG2 VAL 140 5.050 5.625 -1.506 1046 HG23 VAL 140 2HG2 VAL 140 4.821 5.102 0.163 1047 H VAL 141 H VAL 141 5.542 2.657 1.563 1048 HA VAL 141 HA VAL 141 6.078 0.434 -0.297 1049 HB VAL 141 HB VAL 141 4.610 0.272 2.344 1050 HG11 VAL 141 1HG1 VAL 141 5.653 -1.872 0.497 1051 HG12 VAL 141 2HG1 VAL 141 3.961 -1.436 0.739 1052 HG13 VAL 141 3HG1 VAL 141 4.886 -2.146 2.062 1053 HG21 VAL 141 3HG2 VAL 141 6.952 0.827 2.739 1054 HG22 VAL 141 1HG2 VAL 141 7.453 -0.514 1.711 1055 HG23 VAL 141 2HG2 VAL 141 6.610 -0.833 3.227 1056 H VAL 142 H VAL 142 4.462 -0.173 -1.661 1057 HA VAL 142 HA VAL 142 1.903 1.243 -1.320 1058 HB VAL 142 HB VAL 142 3.161 2.070 -3.260 1059 HG11 VAL 142 1HG1 VAL 142 2.927 -0.740 -4.320 1060 HG12 VAL 142 2HG1 VAL 142 4.413 0.070 -3.823 1061 HG13 VAL 142 3HG1 VAL 142 3.514 0.658 -5.220 1062 HG21 VAL 142 3HG2 VAL 142 1.380 1.831 -4.930 1063 HG22 VAL 142 1HG2 VAL 142 0.743 2.151 -3.317 1064 HG23 VAL 142 2HG2 VAL 142 0.680 0.519 -3.982 1065 H ALA 143 H ALA 143 0.140 0.077 -1.152 1066 HA ALA 143 HA ALA 143 0.246 -2.781 -1.857 1067 HB1 ALA 143 3HB ALA 143 -1.593 -3.088 -0.268 1068 HB2 ALA 143 1HB ALA 143 -1.582 -1.359 0.083 1069 HB3 ALA 143 2HB ALA 143 -0.193 -2.356 0.514 1070 H LEU 144 H LEU 144 -0.640 -3.130 -3.779 1071 HA LEU 144 HA LEU 144 -2.715 -1.284 -4.720 1072 HG LEU 144 HG LEU 144 0.233 -1.127 -5.566 1073 HB2 LEU 144 1HB LEU 144 -0.930 -3.195 -6.221 1074 HB3 LEU 144 2HB LEU 144 -2.197 -2.243 -6.968 1075 HD11 LEU 144 1HD1 LEU 144 0.920 -0.434 -7.810 1076 HD12 LEU 144 2HD1 LEU 144 -0.470 -1.277 -8.493 1077 HD13 LEU 144 3HD1 LEU 144 0.801 -2.189 -7.677 1078 HD21 LEU 144 3HD2 LEU 144 -0.515 1.025 -6.459 1079 HD22 LEU 144 1HD2 LEU 144 -1.705 0.337 -5.351 1080 HD23 LEU 144 2HD2 LEU 144 -1.970 0.256 -7.093 1081 H LEU 145 H LEU 145 -4.732 -1.908 -5.004 1082 HA LEU 145 HA LEU 145 -5.396 -4.742 -4.649 1083 HG LEU 145 HG LEU 145 -5.563 -2.582 -2.484 1084 HB2 LEU 145 1HB LEU 145 -7.123 -2.274 -4.415 1085 HB3 LEU 145 2HB LEU 145 -7.682 -3.916 -4.170 1086 HD11 LEU 145 1HD1 LEU 145 -7.713 -1.468 -2.210 1087 HD12 LEU 145 2HD1 LEU 145 -7.295 -2.403 -0.774 1088 HD13 LEU 145 3HD1 LEU 145 -8.488 -3.025 -1.915 1089 HD21 LEU 145 3HD2 LEU 145 -7.106 -5.147 -2.117 1090 HD22 LEU 145 1HD2 LEU 145 -5.950 -4.462 -0.973 1091 HD23 LEU 145 2HD2 LEU 145 -5.402 -5.015 -2.556 1092 HA PRO 146 HA PRO 146 -6.538 -4.563 -8.998 1093 HB2 PRO 146 1HB PRO 146 -6.467 -7.188 -9.452 1094 HB3 PRO 146 2HB PRO 146 -4.973 -6.277 -9.190 1095 HG2 PRO 146 1HG PRO 146 -6.471 -8.043 -7.305 1096 HG3 PRO 146 2HG PRO 146 -4.722 -7.871 -7.533 1097 HD2 PRO 146 1HD PRO 146 -6.217 -6.641 -5.530 1098 HD3 PRO 146 2HD PRO 146 -4.600 -6.142 -6.062 1099 H ASP 147 H ASP 147 -8.073 -6.680 -10.036 1100 HA ASP 147 HA ASP 147 -10.603 -6.279 -8.578 1101 HB2 ASP 147 1HB ASP 147 -10.224 -5.270 -10.966 1102 HB3 ASP 147 2HB ASP 147 -10.491 -6.922 -11.511 1103 H GLY 148 H GLY 148 -12.089 -8.147 -10.098 1104 HA2 GLY 148 1HA GLY 148 -11.233 -10.682 -10.445 1105 HA3 GLY 148 2HA GLY 148 -11.301 -10.553 -8.692 1106 H ASP 149 H ASP 149 -13.589 -8.487 -9.578 1107 HA ASP 149 HA ASP 149 -15.690 -10.555 -9.698 1108 HB2 ASP 149 1HB ASP 149 -15.756 -7.940 -8.171 1109 HB3 ASP 149 2HB ASP 149 -17.125 -9.029 -8.357 1110 H SER 150 H SER 150 -14.899 -7.164 -10.366 1111 HA SER 150 HA SER 150 -17.091 -6.730 -12.133 1112 HG SER 150 HG SER 150 -14.349 -4.833 -10.404 1113 HB2 SER 150 1HB SER 150 -14.605 -5.132 -12.452 1114 HB3 SER 150 2HB SER 150 -16.277 -4.592 -12.283 1115 H LEU 151 H LEU 151 -13.728 -7.696 -12.446 1116 HA LEU 151 HA LEU 151 -13.859 -7.990 -15.308 1117 HG LEU 151 HG LEU 151 -11.656 -10.203 -15.509 1118 HB2 LEU 151 1HB LEU 151 -11.735 -7.511 -14.139 1119 HB3 LEU 151 2HB LEU 151 -11.841 -9.060 -13.327 1120 HD11 LEU 151 1HD1 LEU 151 -11.003 -8.929 -17.490 1121 HD12 LEU 151 2HD1 LEU 151 -11.213 -7.425 -16.596 1122 HD13 LEU 151 3HD1 LEU 151 -12.604 -8.458 -16.923 1123 HD21 LEU 151 3HD2 LEU 151 -9.664 -9.791 -14.153 1124 HD22 LEU 151 1HD2 LEU 151 -9.445 -8.230 -14.945 1125 HD23 LEU 151 2HD2 LEU 151 -9.292 -9.721 -15.876 1126 H GLU 152 H GLU 152 -15.716 -9.274 -15.515 1127 HA GLU 152 HA GLU 152 -15.705 -11.925 -14.299 1128 HB2 GLU 152 1HB GLU 152 -17.749 -10.624 -14.105 1129 HB3 GLU 152 2HB GLU 152 -17.823 -10.425 -15.849 1130 HG2 GLU 152 1HG GLU 152 -18.193 -12.807 -16.126 1131 HG3 GLU 152 2HG GLU 152 -18.055 -13.044 -14.384 1132 H HIS 153 H HIS 153 -15.490 -13.778 -15.392 1133 HA HIS 153 HA HIS 153 -14.873 -13.596 -18.258 1134 HD1 HIS 153 HD1 HIS 153 -11.643 -15.800 -18.440 1135 HD2 HIS 153 HD2 HIS 153 -12.760 -13.028 -15.544 1136 HE1 HIS 153 HE1 HIS 153 -9.568 -14.466 -17.936 1137 HE2 HIS 153 HE2 HIS 153 -10.211 -13.012 -15.980 1138 HB2 HIS 153 1HB HIS 153 -14.248 -15.698 -16.179 1139 HB3 HIS 153 2HB HIS 153 -14.020 -15.972 -17.899 1140 H HIS 154 H HIS 154 -16.828 -13.683 -19.286 1141 HA HIS 154 HA HIS 154 -18.903 -15.470 -18.522 1142 HD1 HIS 154 HD1 HIS 154 -21.845 -14.330 -20.202 1143 HD2 HIS 154 HD2 HIS 154 -18.794 -11.872 -18.808 1144 HE1 HIS 154 HE1 HIS 154 -22.988 -12.473 -18.943 1145 HE2 HIS 154 HE2 HIS 154 -21.106 -11.160 -17.902 1146 HB2 HIS 154 1HB HIS 154 -18.351 -13.840 -20.979 1147 HB3 HIS 154 2HB HIS 154 -19.620 -15.061 -21.010 1148 H HIS 155 H HIS 155 -19.479 -17.467 -19.401 1149 HA HIS 155 HA HIS 155 -17.128 -19.047 -19.845 1150 HD1 HIS 155 HD1 HIS 155 -18.298 -22.188 -17.789 1151 HD2 HIS 155 HD2 HIS 155 -18.627 -18.094 -17.123 1152 HE1 HIS 155 HE1 HIS 155 -17.715 -21.842 -15.364 1153 HE2 HIS 155 HE2 HIS 155 -17.727 -19.343 -15.041 1154 HB2 HIS 155 1HB HIS 155 -20.030 -19.719 -19.457 1155 HB3 HIS 155 2HB HIS 155 -18.846 -20.958 -19.867 1156 H HIS 156 H HIS 156 -18.640 -17.273 -22.014 1157 HA HIS 156 HA HIS 156 -18.328 -19.170 -24.201 1158 HD1 HIS 156 HD1 HIS 156 -20.213 -18.875 -26.546 1159 HD2 HIS 156 HD2 HIS 156 -21.668 -16.898 -23.187 1160 HE1 HIS 156 HE1 HIS 156 -22.660 -19.449 -26.426 1161 HE2 HIS 156 HE2 HIS 156 -23.556 -18.089 -24.503 1162 HB2 HIS 156 1HB HIS 156 -19.115 -16.268 -24.065 1163 HB3 HIS 156 2HB HIS 156 -18.640 -16.999 -25.595 1164 H HIS 157 H HIS 157 -16.424 -17.422 -22.202 1165 HA HIS 157 HA HIS 157 -14.172 -17.408 -24.106 1166 HD1 HIS 157 HD1 HIS 157 -12.257 -14.917 -24.451 1167 HD2 HIS 157 HD2 HIS 157 -16.249 -13.976 -23.757 1168 HE1 HIS 157 HE1 HIS 157 -12.817 -13.083 -26.082 1169 HE2 HIS 157 HE2 HIS 157 -15.175 -12.400 -25.508 1170 HB2 HIS 157 1HB HIS 157 -14.894 -15.536 -21.882 1171 HB3 HIS 157 2HB HIS 157 -13.195 -15.823 -22.223 1172 H HIS 158 H HIS 158 -12.168 -17.125 -22.158 1173 HA HIS 158 HA HIS 158 -12.107 -19.797 -21.044 1174 HD1 HIS 158 HD1 HIS 158 -9.543 -21.306 -21.064 1175 HD2 HIS 158 HD2 HIS 158 -8.830 -18.061 -18.557 1176 HE1 HIS 158 HE1 HIS 158 -8.074 -22.180 -19.216 1177 HE2 HIS 158 HE2 HIS 158 -7.734 -20.230 -17.658 1178 HB2 HIS 158 1HB HIS 158 -10.083 -18.919 -22.096 1179 HB3 HIS 158 2HB HIS 158 -10.063 -17.563 -20.974 Start of MODEL 11 1 HA MET 1 HA MET 1 24.569 11.447 -9.617 2 H1 MET 1 1H MET 1 23.571 12.153 -7.603 3 H2 MET 1 2H MET 1 23.236 10.562 -7.131 4 H3 MET 1 3H MET 1 22.438 11.232 -8.466 5 HB2 MET 1 1HB MET 1 26.502 10.213 -8.747 6 HB3 MET 1 2HB MET 1 26.016 11.487 -7.639 7 HG2 MET 1 1HG MET 1 24.916 9.856 -6.216 8 HG3 MET 1 2HG MET 1 25.337 8.568 -7.343 9 HE1 MET 1 3HE MET 1 25.983 8.417 -4.241 10 HE2 MET 1 1HE MET 1 27.636 7.801 -4.266 11 HE3 MET 1 2HE MET 1 26.435 7.152 -5.384 12 H LYS 2 H LYS 2 24.717 10.032 -11.252 13 HA LYS 2 HA LYS 2 23.408 7.417 -10.869 14 HB2 LYS 2 1HB LYS 2 23.727 9.007 -13.424 15 HB3 LYS 2 2HB LYS 2 22.902 7.463 -13.269 16 HG2 LYS 2 1HG LYS 2 21.251 8.510 -11.784 17 HG3 LYS 2 2HG LYS 2 22.067 10.060 -11.993 18 HD2 LYS 2 1HD LYS 2 21.654 9.881 -14.438 19 HD3 LYS 2 2HD LYS 2 20.720 8.415 -14.133 20 HE2 LYS 2 1HE LYS 2 19.186 9.694 -12.715 21 HE3 LYS 2 2HE LYS 2 20.117 11.158 -13.030 22 HZ1 LYS 2 3HZ LYS 2 19.610 10.786 -15.441 23 HZ2 LYS 2 1HZ LYS 2 18.266 11.176 -14.480 24 HZ3 LYS 2 2HZ LYS 2 18.521 9.574 -14.968 25 H LEU 3 H LEU 3 25.055 6.066 -10.416 26 HA LEU 3 HA LEU 3 27.235 5.908 -12.383 27 HG LEU 3 HG LEU 3 29.258 4.333 -10.725 28 HB2 LEU 3 1HB LEU 3 27.959 7.019 -10.255 29 HB3 LEU 3 2HB LEU 3 27.552 5.544 -9.401 30 HD11 LEU 3 1HD1 LEU 3 29.939 7.077 -11.773 31 HD12 LEU 3 2HD1 LEU 3 29.252 5.750 -12.709 32 HD13 LEU 3 3HD1 LEU 3 30.877 5.607 -12.038 33 HD21 LEU 3 3HD2 LEU 3 30.275 6.768 -9.264 34 HD22 LEU 3 1HD2 LEU 3 31.196 5.302 -9.599 35 HD23 LEU 3 2HD2 LEU 3 29.800 5.240 -8.523 36 H HIS 4 H HIS 4 27.778 3.859 -13.016 37 HA HIS 4 HA HIS 4 25.878 1.801 -12.241 38 HD1 HIS 4 HD1 HIS 4 27.007 3.607 -15.989 39 HD2 HIS 4 HD2 HIS 4 24.096 1.049 -14.465 40 HE1 HIS 4 HE1 HIS 4 24.879 4.197 -17.197 41 HE2 HIS 4 HE2 HIS 4 23.156 2.560 -16.352 42 HB2 HIS 4 1HB HIS 4 27.957 1.922 -14.429 43 HB3 HIS 4 2HB HIS 4 26.970 0.500 -14.115 44 H THR 5 H THR 5 28.861 2.784 -11.181 45 HA THR 5 HA THR 5 30.032 0.274 -10.530 46 HB THR 5 HB THR 5 30.393 2.842 -8.978 47 HG1 THR 5 HG1 THR 5 31.447 2.047 -11.503 48 HG21 THR 5 3HG2 THR 5 32.663 1.965 -8.629 49 HG22 THR 5 1HG2 THR 5 32.244 0.521 -9.552 50 HG23 THR 5 2HG2 THR 5 31.441 0.851 -8.017 51 H ASP 6 H ASP 6 27.543 2.246 -9.179 52 HA ASP 6 HA ASP 6 27.461 1.013 -6.594 53 HB2 ASP 6 1HB ASP 6 26.652 3.260 -6.773 54 HB3 ASP 6 2HB ASP 6 25.576 2.834 -8.100 55 HA PRO 7 HA PRO 7 25.188 -2.639 -7.767 56 HB2 PRO 7 1HB PRO 7 24.059 -3.174 -5.327 57 HB3 PRO 7 2HB PRO 7 25.721 -3.590 -5.755 58 HG2 PRO 7 1HG PRO 7 24.692 -1.265 -4.187 59 HG3 PRO 7 2HG PRO 7 26.128 -2.265 -3.899 60 HD2 PRO 7 1HD PRO 7 26.281 0.186 -5.015 61 HD3 PRO 7 2HD PRO 7 27.387 -1.127 -5.466 62 H ALA 8 H ALA 8 23.287 -2.785 -8.752 63 HA ALA 8 HA ALA 8 21.469 -0.666 -8.807 64 HB1 ALA 8 3HB ALA 8 20.079 -2.106 -10.188 65 HB2 ALA 8 1HB ALA 8 21.020 -3.513 -9.694 66 HB3 ALA 8 2HB ALA 8 21.773 -2.243 -10.657 67 H THR 9 H THR 9 20.314 -0.055 -7.120 68 HA THR 9 HA THR 9 19.332 -1.681 -5.059 69 HB THR 9 HB THR 9 18.271 0.976 -6.052 70 HG1 THR 9 HG1 THR 9 20.393 1.222 -5.413 71 HG21 THR 9 3HG2 THR 9 17.351 1.231 -3.794 72 HG22 THR 9 1HG2 THR 9 17.895 -0.397 -3.388 73 HG23 THR 9 2HG2 THR 9 16.651 -0.163 -4.617 74 H ALA 10 H ALA 10 17.593 -2.960 -4.892 75 HA ALA 10 HA ALA 10 16.084 -3.629 -7.206 76 HB1 ALA 10 3HB ALA 10 14.880 -5.167 -5.755 77 HB2 ALA 10 1HB ALA 10 15.591 -4.402 -4.333 78 HB3 ALA 10 2HB ALA 10 16.617 -5.271 -5.473 79 H LEU 11 H LEU 11 15.072 -1.726 -7.871 80 HA LEU 11 HA LEU 11 13.019 -0.608 -6.122 81 HG LEU 11 HG LEU 11 15.687 0.695 -7.182 82 HB2 LEU 11 1HB LEU 11 13.938 0.259 -8.865 83 HB3 LEU 11 2HB LEU 11 12.774 1.108 -7.868 84 HD11 LEU 11 1HD1 LEU 11 15.893 3.097 -7.577 85 HD12 LEU 11 2HD1 LEU 11 14.206 3.160 -8.088 86 HD13 LEU 11 3HD1 LEU 11 15.381 2.248 -9.035 87 HD21 LEU 11 3HD2 LEU 11 14.270 0.794 -5.200 88 HD22 LEU 11 1HD2 LEU 11 13.539 2.287 -5.787 89 HD23 LEU 11 2HD2 LEU 11 15.248 2.254 -5.351 90 H ASN 12 H ASN 12 11.316 -1.960 -6.097 91 HA ASN 12 HA ASN 12 10.406 -3.470 -8.296 92 HB2 ASN 12 1HB ASN 12 8.948 -2.597 -5.792 93 HB3 ASN 12 2HB ASN 12 8.327 -3.771 -6.948 94 HD21 ASN 12 2HD2 ASN 12 8.996 -4.057 -4.117 95 HD22 ASN 12 1HD2 ASN 12 10.157 -5.336 -4.023 96 H THR 13 H THR 13 9.668 -2.654 -10.108 97 HA THR 13 HA THR 13 8.162 -0.125 -10.004 98 HB THR 13 HB THR 13 9.872 -1.080 -12.307 99 HG1 THR 13 HG1 THR 13 11.021 -0.542 -10.252 100 HG21 THR 13 3HG2 THR 13 9.703 1.255 -13.043 101 HG22 THR 13 1HG2 THR 13 8.671 1.617 -11.660 102 HG23 THR 13 2HG2 THR 13 8.110 0.510 -12.912 103 H VAL 14 H VAL 14 6.195 -0.104 -10.891 104 HA VAL 14 HA VAL 14 4.976 -2.408 -11.988 105 HB VAL 14 HB VAL 14 4.072 0.464 -12.282 106 HG11 VAL 14 1HG1 VAL 14 2.950 -1.069 -13.808 107 HG12 VAL 14 2HG1 VAL 14 1.842 -0.505 -12.558 108 HG13 VAL 14 3HG1 VAL 14 2.533 -2.125 -12.457 109 HG21 VAL 14 3HG2 VAL 14 4.400 -0.089 -9.933 110 HG22 VAL 14 1HG2 VAL 14 3.422 -1.544 -10.125 111 HG23 VAL 14 2HG2 VAL 14 2.681 0.047 -10.303 112 H THR 15 H THR 15 5.512 -3.258 -13.861 113 HA THR 15 HA THR 15 6.865 -1.702 -15.886 114 HB THR 15 HB THR 15 6.054 -4.598 -16.108 115 HG1 THR 15 HG1 THR 15 7.842 -3.387 -14.360 116 HG21 THR 15 3HG2 THR 15 8.097 -4.763 -17.432 117 HG22 THR 15 1HG2 THR 15 8.453 -3.063 -17.120 118 HG23 THR 15 2HG2 THR 15 7.044 -3.508 -18.085 119 H ALA 16 H ALA 16 3.860 -3.548 -15.566 120 HA ALA 16 HA ALA 16 2.674 -1.928 -17.692 121 HB1 ALA 16 3HB ALA 16 3.427 -3.970 -18.806 122 HB2 ALA 16 1HB ALA 16 1.666 -3.892 -18.754 123 HB3 ALA 16 2HB ALA 16 2.536 -4.945 -17.637 124 H TYR 17 H TYR 17 0.378 -1.794 -17.553 125 HA TYR 17 HA TYR 17 -0.729 -2.786 -15.014 126 HD1 TYR 17 HD1 TYR 17 -0.683 -1.180 -12.704 127 HD2 TYR 17 HD2 TYR 17 -3.622 0.097 -15.499 128 HE1 TYR 17 HE1 TYR 17 -2.315 -0.970 -10.878 129 HE2 TYR 17 HE2 TYR 17 -5.267 0.310 -13.681 130 HH TYR 17 HH TYR 17 -5.654 -0.558 -11.439 131 HB2 TYR 17 1HB TYR 17 -0.073 -0.325 -14.968 132 HB3 TYR 17 2HB TYR 17 -1.340 -0.057 -16.160 133 H GLY 18 H GLY 18 -2.613 -3.817 -15.236 134 HA2 GLY 18 1HA GLY 18 -4.163 -3.337 -17.703 135 HA3 GLY 18 2HA GLY 18 -3.875 -4.959 -17.089 136 H ASP 19 H ASP 19 -6.309 -4.905 -17.234 137 HA ASP 19 HA ASP 19 -7.774 -3.355 -15.359 138 HB2 ASP 19 1HB ASP 19 -8.552 -5.845 -16.884 139 HB3 ASP 19 2HB ASP 19 -9.659 -4.806 -16.005 140 H GLY 20 H GLY 20 -7.212 -6.852 -15.564 141 HA2 GLY 20 1HA GLY 20 -7.670 -6.982 -12.653 142 HA3 GLY 20 2HA GLY 20 -8.001 -8.293 -13.775 143 H TYR 21 H TYR 21 -5.085 -6.440 -14.097 144 HA TYR 21 HA TYR 21 -3.519 -8.262 -12.512 145 HD1 TYR 21 HD1 TYR 21 -5.147 -8.291 -16.314 146 HD2 TYR 21 HD2 TYR 21 -0.935 -7.838 -15.931 147 HE1 TYR 21 HE1 TYR 21 -5.049 -7.342 -18.580 148 HE2 TYR 21 HE2 TYR 21 -0.826 -6.885 -18.195 149 HH TYR 21 HH TYR 21 -2.176 -6.960 -20.297 150 HB2 TYR 21 1HB TYR 21 -2.126 -9.101 -14.328 151 HB3 TYR 21 2HB TYR 21 -3.802 -9.559 -14.592 152 H ILE 22 H ILE 22 -1.651 -7.378 -11.855 153 HA ILE 22 HA ILE 22 -0.794 -4.869 -13.150 154 HB ILE 22 HB ILE 22 -0.540 -5.593 -10.221 155 HG12 ILE 22 1HG1 ILE 22 -2.249 -3.495 -11.581 156 HG13 ILE 22 2HG1 ILE 22 -2.844 -5.003 -10.895 157 HG21 ILE 22 1HG2 ILE 22 0.243 -3.078 -11.694 158 HG22 ILE 22 2HG2 ILE 22 1.349 -4.275 -11.020 159 HG23 ILE 22 3HG2 ILE 22 0.328 -3.317 -9.948 160 HD11 ILE 22 3HD1 ILE 22 -3.255 -3.117 -9.419 161 HD12 ILE 22 1HD1 ILE 22 -1.526 -2.774 -9.363 162 HD13 ILE 22 2HD1 ILE 22 -2.150 -4.276 -8.680 163 H GLU 23 H GLU 23 1.153 -5.000 -14.054 164 HA GLU 23 HA GLU 23 2.777 -7.357 -13.456 165 HB2 GLU 23 1HB GLU 23 2.085 -6.805 -15.811 166 HB3 GLU 23 2HB GLU 23 3.097 -5.373 -15.711 167 HG2 GLU 23 1HG GLU 23 5.059 -6.762 -15.375 168 HG3 GLU 23 2HG GLU 23 4.055 -8.211 -15.422 169 H VAL 24 H VAL 24 4.057 -6.955 -11.763 170 HA VAL 24 HA VAL 24 5.639 -4.465 -11.770 171 HB VAL 24 HB VAL 24 5.061 -6.302 -9.433 172 HG11 VAL 24 1HG1 VAL 24 6.034 -4.520 -8.066 173 HG12 VAL 24 2HG1 VAL 24 6.414 -3.608 -9.526 174 HG13 VAL 24 3HG1 VAL 24 7.201 -5.157 -9.225 175 HG21 VAL 24 3HG2 VAL 24 3.915 -3.591 -10.089 176 HG22 VAL 24 1HG2 VAL 24 3.631 -4.496 -8.602 177 HG23 VAL 24 2HG2 VAL 24 3.052 -5.129 -10.144 178 H ASN 25 H ASN 25 7.784 -4.631 -12.061 179 HA ASN 25 HA ASN 25 9.830 -5.532 -12.502 180 HB2 ASN 25 1HB ASN 25 8.851 -7.548 -10.470 181 HB3 ASN 25 2HB ASN 25 10.474 -7.585 -11.149 182 HD21 ASN 25 2HD2 ASN 25 11.214 -7.332 -8.979 183 HD22 ASN 25 1HD2 ASN 25 11.226 -5.772 -8.228 184 H GLN 26 H GLN 26 7.567 -6.173 -14.146 185 HA GLN 26 HA GLN 26 7.018 -7.393 -15.961 186 HB2 GLN 26 1HB GLN 26 9.694 -8.691 -15.462 187 HB3 GLN 26 2HB GLN 26 8.672 -9.075 -16.841 188 HG2 GLN 26 1HG GLN 26 8.789 -6.747 -17.573 189 HG3 GLN 26 2HG GLN 26 9.825 -6.372 -16.197 190 HE21 GLN 26 2HE2 GLN 26 10.320 -6.167 -19.079 191 HE22 GLN 26 1HE2 GLN 26 11.737 -7.118 -19.383 192 H VAL 27 H VAL 27 6.672 -8.371 -13.030 193 HA VAL 27 HA VAL 27 5.756 -11.078 -13.747 194 HB VAL 27 HB VAL 27 6.085 -9.920 -10.970 195 HG11 VAL 27 1HG1 VAL 27 5.538 -12.735 -11.909 196 HG12 VAL 27 2HG1 VAL 27 4.402 -11.668 -11.082 197 HG13 VAL 27 3HG1 VAL 27 5.836 -12.254 -10.238 198 HG21 VAL 27 3HG2 VAL 27 7.877 -11.831 -12.464 199 HG22 VAL 27 1HG2 VAL 27 8.057 -11.355 -10.776 200 HG23 VAL 27 2HG2 VAL 27 8.253 -10.158 -12.055 201 H ARG 28 H ARG 28 3.640 -11.333 -14.053 202 HA ARG 28 HA ARG 28 1.891 -9.082 -13.522 203 HE ARG 28 HE ARG 28 2.096 -8.680 -18.354 204 HB2 ARG 28 1HB ARG 28 1.506 -11.648 -15.058 205 HB3 ARG 28 2HB ARG 28 0.224 -10.467 -14.820 206 HG2 ARG 28 1HG ARG 28 1.590 -8.773 -15.944 207 HG3 ARG 28 2HG ARG 28 2.850 -9.978 -16.207 208 HD2 ARG 28 1HD ARG 28 1.441 -11.252 -17.636 209 HD3 ARG 28 2HD ARG 28 0.029 -10.287 -17.206 210 HH11 ARG 28 1HH1 ARG 28 -0.438 -10.979 -19.159 211 HH12 ARG 28 2HH1 ARG 28 -0.728 -10.300 -20.738 212 HH21 ARG 28 1HH2 ARG 28 1.700 -7.782 -20.423 213 HH22 ARG 28 2HH2 ARG 28 0.481 -8.477 -21.445 214 H PHE 29 H PHE 29 0.989 -8.928 -11.608 215 HA PHE 29 HA PHE 29 0.138 -11.355 -10.195 216 HD1 PHE 29 HD1 PHE 29 1.665 -11.591 -7.762 217 HD2 PHE 29 HD2 PHE 29 2.527 -7.916 -9.728 218 HE1 PHE 29 HE1 PHE 29 4.056 -11.879 -7.250 219 HE2 PHE 29 HE2 PHE 29 4.915 -8.199 -9.225 220 HZ PHE 29 HZ PHE 29 5.685 -10.182 -7.984 221 HB2 PHE 29 1HB PHE 29 0.291 -8.496 -9.208 222 HB3 PHE 29 2HB PHE 29 -0.090 -9.907 -8.230 223 H SER 30 H SER 30 -1.944 -11.924 -10.230 224 HA SER 30 HA SER 30 -3.904 -10.017 -11.257 225 HG SER 30 HG SER 30 -4.283 -13.536 -10.061 226 HB2 SER 30 1HB SER 30 -5.340 -12.133 -11.390 227 HB3 SER 30 2HB SER 30 -3.934 -12.063 -12.454 228 H HIS 31 H HIS 31 -2.834 -10.054 -8.449 229 HA HIS 31 HA HIS 31 -5.389 -9.840 -7.111 230 HD1 HIS 31 HD1 HIS 31 -3.245 -13.736 -7.399 231 HD2 HIS 31 HD2 HIS 31 -1.708 -10.875 -4.792 232 HE1 HIS 31 HE1 HIS 31 -0.859 -14.417 -6.969 233 HE2 HIS 31 HE2 HIS 31 0.081 -12.633 -5.452 234 HB2 HIS 31 1HB HIS 31 -4.625 -11.251 -5.169 235 HB3 HIS 31 2HB HIS 31 -4.983 -12.153 -6.636 236 H ALA 32 H ALA 32 -4.989 -9.118 -4.749 237 HA ALA 32 HA ALA 32 -3.649 -6.678 -4.837 238 HB1 ALA 32 3HB ALA 32 -4.458 -8.235 -2.387 239 HB2 ALA 32 1HB ALA 32 -5.503 -7.156 -3.311 240 HB3 ALA 32 2HB ALA 32 -4.101 -6.510 -2.459 241 H ILE 33 H ILE 33 -1.696 -5.974 -4.235 242 HA ILE 33 HA ILE 33 0.206 -7.840 -3.019 243 HB ILE 33 HB ILE 33 1.950 -7.085 -4.685 244 HG12 ILE 33 1HG1 ILE 33 -0.495 -6.258 -6.269 245 HG13 ILE 33 2HG1 ILE 33 0.690 -5.157 -5.576 246 HG21 ILE 33 1HG2 ILE 33 1.017 -9.322 -4.741 247 HG22 ILE 33 2HG2 ILE 33 1.294 -8.732 -6.379 248 HG23 ILE 33 3HG2 ILE 33 -0.339 -8.753 -5.715 249 HD11 ILE 33 3HD1 ILE 33 2.408 -6.084 -7.029 250 HD12 ILE 33 1HD1 ILE 33 1.041 -5.469 -7.958 251 HD13 ILE 33 2HD1 ILE 33 1.231 -7.206 -7.711 252 H ALA 34 H ALA 34 1.798 -6.887 -1.829 253 HA ALA 34 HA ALA 34 1.862 -3.941 -1.756 254 HB1 ALA 34 3HB ALA 34 2.088 -5.813 0.606 255 HB2 ALA 34 1HB ALA 34 0.709 -4.779 0.232 256 HB3 ALA 34 2HB ALA 34 2.261 -4.059 0.660 257 H PHE 35 H PHE 35 3.829 -3.155 -2.214 258 HA PHE 35 HA PHE 35 6.181 -4.755 -1.578 259 HD1 PHE 35 HD1 PHE 35 3.488 -4.763 -4.621 260 HD2 PHE 35 HD2 PHE 35 7.032 -2.461 -5.150 261 HE1 PHE 35 HE1 PHE 35 2.377 -3.458 -6.385 262 HE2 PHE 35 HE2 PHE 35 5.922 -1.153 -6.910 263 HZ PHE 35 HZ PHE 35 3.592 -1.649 -7.532 264 HB2 PHE 35 1HB PHE 35 7.083 -4.474 -3.888 265 HB3 PHE 35 2HB PHE 35 5.685 -5.535 -3.790 266 H ALA 36 H ALA 36 8.145 -3.628 -1.619 267 HA ALA 36 HA ALA 36 8.017 -0.715 -1.905 268 HB1 ALA 36 3HB ALA 36 9.215 -0.402 0.203 269 HB2 ALA 36 1HB ALA 36 9.148 -2.137 0.508 270 HB3 ALA 36 2HB ALA 36 7.659 -1.191 0.474 271 HA PRO 37 HA PRO 37 12.069 -1.144 -3.751 272 HB2 PRO 37 1HB PRO 37 13.373 0.956 -2.491 273 HB3 PRO 37 2HB PRO 37 12.393 1.100 -3.953 274 HG2 PRO 37 1HG PRO 37 11.667 1.679 -1.117 275 HG3 PRO 37 2HG PRO 37 11.206 2.543 -2.595 276 HD2 PRO 37 1HD PRO 37 9.506 0.892 -1.333 277 HD3 PRO 37 2HD PRO 37 9.529 1.031 -3.103 278 H GLU 38 H GLU 38 13.768 -2.368 -3.286 279 HA GLU 38 HA GLU 38 15.322 -3.583 -2.185 280 HB2 GLU 38 1HB GLU 38 14.856 -1.775 0.190 281 HB3 GLU 38 2HB GLU 38 16.234 -2.836 -0.065 282 HG2 GLU 38 1HG GLU 38 16.769 -1.494 -2.108 283 HG3 GLU 38 2HG GLU 38 15.509 -0.365 -1.606 284 H GLY 39 H GLY 39 12.312 -3.887 -1.879 285 HA2 GLY 39 1HA GLY 39 12.488 -5.979 0.185 286 HA3 GLY 39 2HA GLY 39 11.114 -4.881 0.148 287 HA PRO 40 HA PRO 40 10.361 -8.486 -2.772 288 HB2 PRO 40 1HB PRO 40 8.884 -10.136 -1.267 289 HB3 PRO 40 2HB PRO 40 10.650 -10.172 -1.206 290 HG2 PRO 40 1HG PRO 40 8.715 -8.922 0.697 291 HG3 PRO 40 2HG PRO 40 10.200 -9.827 1.041 292 HD2 PRO 40 1HD PRO 40 10.009 -7.074 1.038 293 HD3 PRO 40 2HD PRO 40 11.516 -7.977 0.797 294 H VAL 41 H VAL 41 8.126 -9.361 -3.399 295 HA VAL 41 HA VAL 41 6.127 -7.236 -3.014 296 HB VAL 41 HB VAL 41 6.150 -9.420 -5.111 297 HG11 VAL 41 1HG1 VAL 41 4.423 -8.074 -6.202 298 HG12 VAL 41 2HG1 VAL 41 4.473 -6.923 -4.868 299 HG13 VAL 41 3HG1 VAL 41 3.920 -8.574 -4.587 300 HG21 VAL 41 3HG2 VAL 41 6.816 -7.668 -6.691 301 HG22 VAL 41 1HG2 VAL 41 8.034 -7.912 -5.439 302 HG23 VAL 41 2HG2 VAL 41 6.952 -6.522 -5.358 303 H ALA 42 H ALA 42 4.907 -7.724 -1.292 304 HA ALA 42 HA ALA 42 4.476 -10.477 -0.518 305 HB1 ALA 42 3HB ALA 42 3.422 -9.541 1.464 306 HB2 ALA 42 1HB ALA 42 3.480 -7.929 0.751 307 HB3 ALA 42 2HB ALA 42 4.976 -8.764 1.165 308 H SER 43 H SER 43 2.676 -11.637 -0.783 309 HA SER 43 HA SER 43 0.563 -10.615 -2.430 310 HG SER 43 HG SER 43 0.907 -13.331 -0.044 311 HB2 SER 43 1HB SER 43 -0.416 -12.956 -1.890 312 HB3 SER 43 2HB SER 43 1.063 -12.870 -2.847 313 H TRP 44 H TRP 44 -1.142 -9.542 -1.729 314 HA TRP 44 HA TRP 44 -1.669 -9.494 1.152 315 HD1 TRP 44 HD1 TRP 44 -1.316 -8.121 2.672 316 HE1 TRP 44 HE1 TRP 44 -2.141 -6.278 4.271 317 HE3 TRP 44 HE3 TRP 44 -3.999 -5.314 -0.653 318 HZ2 TRP 44 HZ2 TRP 44 -3.724 -3.940 4.133 319 HZ3 TRP 44 HZ3 TRP 44 -5.136 -3.289 0.157 320 HH2 TRP 44 HH2 TRP 44 -5.000 -2.616 2.501 321 HB2 TRP 44 1HB TRP 44 -1.287 -7.439 -0.526 322 HB3 TRP 44 2HB TRP 44 -3.022 -7.630 -0.739 323 HA PRO 45 HA PRO 45 -5.168 -12.098 0.196 324 HB2 PRO 45 1HB PRO 45 -5.816 -12.041 3.019 325 HB3 PRO 45 2HB PRO 45 -5.141 -13.364 2.068 326 HG2 PRO 45 1HG PRO 45 -3.744 -12.040 3.999 327 HG3 PRO 45 2HG PRO 45 -2.982 -12.816 2.600 328 HD2 PRO 45 1HD PRO 45 -3.634 -9.924 3.046 329 HD3 PRO 45 2HD PRO 45 -2.180 -10.655 2.328 330 H VAL 46 H VAL 46 -5.418 -9.083 0.242 331 HA VAL 46 HA VAL 46 -8.123 -8.811 1.344 332 HB VAL 46 HB VAL 46 -6.187 -6.660 0.462 333 HG11 VAL 46 1HG1 VAL 46 -8.493 -5.966 0.133 334 HG12 VAL 46 2HG1 VAL 46 -7.775 -5.096 1.489 335 HG13 VAL 46 3HG1 VAL 46 -8.886 -6.433 1.786 336 HG21 VAL 46 3HG2 VAL 46 -5.473 -7.784 2.498 337 HG22 VAL 46 1HG2 VAL 46 -7.061 -7.515 3.217 338 HG23 VAL 46 2HG2 VAL 46 -6.016 -6.143 2.845 339 H GLN 47 H GLN 47 -9.614 -9.322 -0.115 340 HA GLN 47 HA GLN 47 -9.337 -8.174 -2.821 341 HB2 GLN 47 1HB GLN 47 -11.047 -10.509 -1.923 342 HB3 GLN 47 2HB GLN 47 -10.957 -9.879 -3.563 343 HG2 GLN 47 1HG GLN 47 -8.572 -10.473 -3.638 344 HG3 GLN 47 2HG GLN 47 -8.709 -11.155 -2.020 345 HE21 GLN 47 2HE2 GLN 47 -11.407 -12.204 -2.587 346 HE22 GLN 47 1HE2 GLN 47 -11.161 -13.605 -3.575 347 H ARG 48 H ARG 48 -10.924 -7.982 0.122 348 HA ARG 48 HA ARG 48 -13.314 -6.703 -1.003 349 HE ARG 48 HE ARG 48 -16.277 -8.694 2.081 350 HB2 ARG 48 1HB ARG 48 -12.713 -7.516 1.846 351 HB3 ARG 48 2HB ARG 48 -14.239 -6.874 1.259 352 HG2 ARG 48 1HG ARG 48 -14.657 -8.842 -0.022 353 HG3 ARG 48 2HG ARG 48 -13.033 -9.456 0.298 354 HD2 ARG 48 1HD ARG 48 -14.725 -10.547 1.709 355 HD3 ARG 48 2HD ARG 48 -13.540 -9.655 2.661 356 HH11 ARG 48 1HH1 ARG 48 -13.470 -8.912 4.190 357 HH12 ARG 48 2HH1 ARG 48 -14.210 -7.981 5.467 358 HH21 ARG 48 1HH2 ARG 48 -17.235 -7.492 3.743 359 HH22 ARG 48 2HH2 ARG 48 -16.357 -7.165 5.208 360 HA PRO 49 HA PRO 49 -11.585 -2.691 -0.105 361 HB2 PRO 49 1HB PRO 49 -14.424 -1.884 0.181 362 HB3 PRO 49 2HB PRO 49 -13.172 -1.236 -0.883 363 HG2 PRO 49 1HG PRO 49 -15.137 -2.758 -1.851 364 HG3 PRO 49 2HG PRO 49 -13.481 -2.891 -2.475 365 HD2 PRO 49 1HD PRO 49 -14.941 -4.681 -0.570 366 HD3 PRO 49 2HD PRO 49 -13.838 -5.107 -1.896 367 H ALA 50 H ALA 50 -14.157 -4.093 1.854 368 HA ALA 50 HA ALA 50 -13.488 -2.365 4.112 369 HB1 ALA 50 3HB ALA 50 -15.488 -3.288 5.163 370 HB2 ALA 50 1HB ALA 50 -15.703 -4.390 3.803 371 HB3 ALA 50 2HB ALA 50 -15.847 -2.647 3.561 372 H ASP 51 H ASP 51 -12.057 -4.925 2.952 373 HA ASP 51 HA ASP 51 -12.074 -6.680 5.266 374 HB2 ASP 51 1HB ASP 51 -11.830 -7.296 2.720 375 HB3 ASP 51 2HB ASP 51 -10.133 -6.927 2.996 376 H ILE 52 H ILE 52 -10.231 -4.092 3.964 377 HA ILE 52 HA ILE 52 -7.692 -4.547 4.985 378 HB ILE 52 HB ILE 52 -9.054 -1.869 4.680 379 HG12 ILE 52 1HG1 ILE 52 -7.379 -3.431 2.701 380 HG13 ILE 52 2HG1 ILE 52 -9.128 -3.249 2.622 381 HG21 ILE 52 1HG2 ILE 52 -7.014 -1.733 5.992 382 HG22 ILE 52 2HG2 ILE 52 -6.770 -1.006 4.404 383 HG23 ILE 52 3HG2 ILE 52 -6.132 -2.614 4.746 384 HD11 ILE 52 3HD1 ILE 52 -7.115 -1.024 2.416 385 HD12 ILE 52 1HD1 ILE 52 -8.868 -0.844 2.330 386 HD13 ILE 52 2HD1 ILE 52 -8.010 -1.748 1.080 387 H THR 53 H THR 53 -7.245 -5.039 6.994 388 HA THR 53 HA THR 53 -8.489 -3.509 9.178 389 HB THR 53 HB THR 53 -7.121 -6.205 9.391 390 HG1 THR 53 HG1 THR 53 -9.225 -5.936 8.062 391 HG21 THR 53 3HG2 THR 53 -9.023 -4.754 11.237 392 HG22 THR 53 1HG2 THR 53 -7.289 -4.966 11.490 393 HG23 THR 53 2HG2 THR 53 -8.361 -6.367 11.503 394 H ALA 54 H ALA 54 -7.040 -2.893 10.954 395 HA ALA 54 HA ALA 54 -4.671 -1.687 10.119 396 HB1 ALA 54 3HB ALA 54 -4.220 -1.281 12.471 397 HB2 ALA 54 1HB ALA 54 -5.424 -2.485 12.927 398 HB3 ALA 54 2HB ALA 54 -5.923 -1.003 12.113 399 H SER 55 H SER 55 -5.206 -4.791 11.701 400 HA SER 55 HA SER 55 -2.585 -5.606 12.100 401 HG SER 55 HG SER 55 -2.860 -7.977 13.101 402 HB2 SER 55 1HB SER 55 -4.675 -6.777 12.872 403 HB3 SER 55 2HB SER 55 -4.883 -7.375 11.228 404 H LEU 56 H LEU 56 -4.598 -5.827 9.196 405 HA LEU 56 HA LEU 56 -2.722 -7.318 7.663 406 HG LEU 56 HG LEU 56 -5.875 -7.360 8.139 407 HB2 LEU 56 1HB LEU 56 -4.994 -5.563 6.722 408 HB3 LEU 56 2HB LEU 56 -4.140 -6.741 5.746 409 HD11 LEU 56 1HD1 LEU 56 -7.373 -8.369 6.500 410 HD12 LEU 56 2HD1 LEU 56 -6.312 -7.839 5.196 411 HD13 LEU 56 3HD1 LEU 56 -7.152 -6.648 6.188 412 HD21 LEU 56 3HD2 LEU 56 -4.014 -8.930 7.922 413 HD22 LEU 56 1HD2 LEU 56 -4.448 -9.214 6.236 414 HD23 LEU 56 2HD2 LEU 56 -5.552 -9.697 7.524 415 H LEU 57 H LEU 57 -3.216 -3.945 8.318 416 HA LEU 57 HA LEU 57 -1.587 -2.932 6.213 417 HG LEU 57 HG LEU 57 -4.308 -2.054 7.313 418 HB2 LEU 57 1HB LEU 57 -2.403 -1.716 8.854 419 HB3 LEU 57 2HB LEU 57 -1.554 -0.848 7.590 420 HD11 LEU 57 1HD1 LEU 57 -3.440 0.813 7.652 421 HD12 LEU 57 2HD1 LEU 57 -4.305 -0.161 8.841 422 HD13 LEU 57 3HD1 LEU 57 -5.083 0.268 7.318 423 HD21 LEU 57 3HD2 LEU 57 -2.715 -0.289 5.456 424 HD22 LEU 57 1HD2 LEU 57 -4.388 -0.796 5.216 425 HD23 LEU 57 2HD2 LEU 57 -3.093 -1.993 5.203 426 H GLN 58 H GLN 58 -1.007 -3.965 9.520 427 HA GLN 58 HA GLN 58 1.669 -3.107 9.747 428 HB2 GLN 58 1HB GLN 58 0.299 -5.483 11.029 429 HB3 GLN 58 2HB GLN 58 1.853 -4.828 11.522 430 HG2 GLN 58 1HG GLN 58 0.807 -2.742 12.161 431 HG3 GLN 58 2HG GLN 58 -0.755 -3.328 11.591 432 HE21 GLN 58 2HE2 GLN 58 0.061 -2.429 14.245 433 HE22 GLN 58 1HE2 GLN 58 -0.276 -3.738 15.318 434 H GLN 59 H GLN 59 0.215 -6.080 8.534 435 HA GLN 59 HA GLN 59 2.625 -7.439 7.946 436 HB2 GLN 59 1HB GLN 59 -0.092 -7.708 6.639 437 HB3 GLN 59 2HB GLN 59 1.225 -8.866 6.507 438 HG2 GLN 59 1HG GLN 59 1.077 -9.378 8.850 439 HG3 GLN 59 2HG GLN 59 -0.125 -8.110 9.088 440 HE21 GLN 59 2HE2 GLN 59 -0.301 -10.974 9.628 441 HE22 GLN 59 1HE2 GLN 59 -1.654 -11.544 8.708 442 H ALA 60 H ALA 60 0.523 -5.329 6.044 443 HA ALA 60 HA ALA 60 1.902 -5.621 3.589 444 HB1 ALA 60 3HB ALA 60 -0.422 -4.875 3.728 445 HB2 ALA 60 1HB ALA 60 0.576 -3.728 2.834 446 HB3 ALA 60 2HB ALA 60 0.105 -3.378 4.498 447 H ALA 61 H ALA 61 2.570 -3.761 6.399 448 HA ALA 61 HA ALA 61 4.141 -1.743 5.099 449 HB1 ALA 61 3HB ALA 61 3.065 -1.317 7.251 450 HB2 ALA 61 1HB ALA 61 4.812 -1.100 7.357 451 HB3 ALA 61 2HB ALA 61 4.065 -2.561 8.002 452 H GLY 62 H GLY 62 4.640 -4.983 5.620 453 HA2 GLY 62 1HA GLY 62 6.548 -6.166 4.941 454 HA3 GLY 62 2HA GLY 62 7.487 -4.687 5.075 455 H LEU 63 H LEU 63 5.744 -4.787 7.806 456 HA LEU 63 HA LEU 63 8.051 -5.591 9.353 457 HG LEU 63 HG LEU 63 6.593 -2.873 8.891 458 HB2 LEU 63 1HB LEU 63 5.359 -4.548 10.239 459 HB3 LEU 63 2HB LEU 63 6.773 -4.734 11.260 460 HD11 LEU 63 1HD1 LEU 63 5.129 -2.180 10.709 461 HD12 LEU 63 2HD1 LEU 63 6.509 -1.094 10.552 462 HD13 LEU 63 3HD1 LEU 63 6.472 -2.295 11.844 463 HD21 LEU 63 3HD2 LEU 63 8.686 -1.960 9.743 464 HD22 LEU 63 1HD2 LEU 63 8.862 -3.668 9.343 465 HD23 LEU 63 2HD2 LEU 63 8.703 -3.168 11.027 466 H ALA 64 H ALA 64 6.735 -7.662 7.920 467 HA ALA 64 HA ALA 64 5.514 -9.271 10.054 468 HB1 ALA 64 3HB ALA 64 4.697 -10.728 8.280 469 HB2 ALA 64 1HB ALA 64 5.539 -9.752 7.075 470 HB3 ALA 64 2HB ALA 64 4.206 -9.058 7.998 471 H GLU 65 H GLU 65 8.382 -8.869 8.250 472 HA GLU 65 HA GLU 65 9.294 -11.586 8.890 473 HB2 GLU 65 1HB GLU 65 10.312 -9.523 6.945 474 HB3 GLU 65 2HB GLU 65 11.268 -10.925 7.404 475 HG2 GLU 65 1HG GLU 65 9.442 -12.381 6.594 476 HG3 GLU 65 2HG GLU 65 8.587 -10.940 6.042 477 H VAL 66 H VAL 66 11.505 -11.820 9.690 478 HA VAL 66 HA VAL 66 12.411 -9.509 11.265 479 HB VAL 66 HB VAL 66 13.186 -11.084 13.029 480 HG11 VAL 66 1HG1 VAL 66 11.100 -9.881 13.320 481 HG12 VAL 66 2HG1 VAL 66 10.978 -11.497 14.017 482 HG13 VAL 66 3HG1 VAL 66 10.227 -11.149 12.460 483 HG21 VAL 66 3HG2 VAL 66 12.274 -13.360 13.096 484 HG22 VAL 66 1HG2 VAL 66 13.323 -13.122 11.698 485 HG23 VAL 66 2HG2 VAL 66 11.570 -13.122 11.496 486 H VAL 67 H VAL 67 14.581 -9.142 11.308 487 HA VAL 67 HA VAL 67 16.195 -10.578 9.366 488 HB VAL 67 HB VAL 67 17.001 -8.250 11.129 489 HG11 VAL 67 1HG1 VAL 67 18.887 -9.461 10.168 490 HG12 VAL 67 2HG1 VAL 67 18.729 -7.863 9.438 491 HG13 VAL 67 3HG1 VAL 67 18.187 -9.292 8.558 492 HG21 VAL 67 3HG2 VAL 67 15.065 -7.636 9.785 493 HG22 VAL 67 1HG2 VAL 67 15.883 -8.200 8.328 494 HG23 VAL 67 2HG2 VAL 67 16.512 -6.810 9.211 495 H ARG 68 H ARG 68 18.265 -11.513 9.929 496 HA ARG 68 HA ARG 68 18.203 -13.249 12.095 497 HE ARG 68 HE ARG 68 21.299 -12.621 8.269 498 HB2 ARG 68 1HB ARG 68 20.627 -12.233 10.599 499 HB3 ARG 68 2HB ARG 68 20.590 -13.659 11.629 500 HG2 ARG 68 1HG ARG 68 18.934 -14.679 10.127 501 HG3 ARG 68 2HG ARG 68 19.032 -13.262 9.082 502 HD2 ARG 68 1HD ARG 68 21.298 -15.134 9.753 503 HD3 ARG 68 2HD ARG 68 20.406 -15.092 8.233 504 HH11 ARG 68 1HH1 ARG 68 22.986 -15.558 9.170 505 HH12 ARG 68 2HH1 ARG 68 24.555 -14.930 8.749 506 HH21 ARG 68 1HH2 ARG 68 23.340 -11.811 7.686 507 HH22 ARG 68 2HH2 ARG 68 24.760 -12.807 7.881 508 H ASP 69 H ASP 69 18.857 -13.174 14.166 509 HA ASP 69 HA ASP 69 19.093 -10.594 15.360 510 HB2 ASP 69 1HB ASP 69 17.924 -12.577 16.385 511 HB3 ASP 69 2HB ASP 69 19.510 -13.276 16.693 512 HA PRO 70 HA PRO 70 23.554 -10.495 15.126 513 HB2 PRO 70 1HB PRO 70 23.402 -7.907 16.423 514 HB3 PRO 70 2HB PRO 70 23.831 -8.280 14.753 515 HG2 PRO 70 1HG PRO 70 21.535 -6.988 15.463 516 HG3 PRO 70 2HG PRO 70 21.691 -7.976 13.999 517 HD2 PRO 70 1HD PRO 70 20.457 -8.675 16.638 518 HD3 PRO 70 2HD PRO 70 19.898 -9.059 14.995 519 H LEU 71 H LEU 71 24.156 -12.004 16.664 520 HA LEU 71 HA LEU 71 23.859 -11.601 19.465 521 HG LEU 71 HG LEU 71 26.357 -13.238 20.382 522 HB2 LEU 71 1HB LEU 71 24.143 -13.828 18.413 523 HB3 LEU 71 2HB LEU 71 25.789 -13.401 17.989 524 HD11 LEU 71 1HD1 LEU 71 23.536 -14.208 20.818 525 HD12 LEU 71 2HD1 LEU 71 24.167 -12.619 21.246 526 HD13 LEU 71 3HD1 LEU 71 24.778 -14.058 22.062 527 HD21 LEU 71 3HD2 LEU 71 25.068 -15.847 19.590 528 HD22 LEU 71 1HD2 LEU 71 26.259 -15.631 20.871 529 HD23 LEU 71 2HD2 LEU 71 26.709 -15.337 19.192 530 H ALA 72 H ALA 72 26.460 -11.038 17.152 531 HA ALA 72 HA ALA 72 28.065 -9.724 19.205 532 HB1 ALA 72 3HB ALA 72 29.211 -11.215 17.633 533 HB2 ALA 72 1HB ALA 72 29.788 -9.555 17.483 534 HB3 ALA 72 2HB ALA 72 28.671 -10.210 16.287 535 H PHE 73 H PHE 73 26.119 -8.223 19.320 536 HA PHE 73 HA PHE 73 25.841 -6.354 17.129 537 HD1 PHE 73 HD1 PHE 73 24.344 -8.584 20.241 538 HD2 PHE 73 HD2 PHE 73 24.379 -4.344 20.618 539 HE1 PHE 73 HE1 PHE 73 24.197 -8.803 22.687 540 HE2 PHE 73 HE2 PHE 73 24.236 -4.557 23.065 541 HZ PHE 73 HZ PHE 73 24.146 -6.790 24.101 542 HB2 PHE 73 1HB PHE 73 24.060 -5.350 18.496 543 HB3 PHE 73 2HB PHE 73 23.838 -7.087 18.325 544 H LEU 74 H LEU 74 26.066 -4.079 17.357 545 HA LEU 74 HA LEU 74 28.407 -3.235 18.707 546 HG LEU 74 HG LEU 74 27.658 -0.197 18.923 547 HB2 LEU 74 1HB LEU 74 27.536 -2.181 16.647 548 HB3 LEU 74 2HB LEU 74 26.156 -1.584 17.547 549 HD11 LEU 74 1HD1 LEU 74 29.993 0.082 18.269 550 HD12 LEU 74 2HD1 LEU 74 29.810 -1.191 17.062 551 HD13 LEU 74 3HD1 LEU 74 29.664 -1.575 18.778 552 HD21 LEU 74 3HD2 LEU 74 26.622 0.751 16.938 553 HD22 LEU 74 1HD2 LEU 74 27.968 0.187 15.948 554 HD23 LEU 74 2HD2 LEU 74 28.236 1.421 17.180 555 H ASP 75 H ASP 75 28.689 -2.280 20.662 556 HA ASP 75 HA ASP 75 26.703 -2.697 22.639 557 HB2 ASP 75 1HB ASP 75 29.285 -1.129 22.784 558 HB3 ASP 75 2HB ASP 75 28.284 -1.545 24.172 559 H GLU 76 H GLU 76 27.288 -0.118 20.511 560 HA GLU 76 HA GLU 76 25.420 1.573 22.031 561 HB2 GLU 76 1HB GLU 76 27.468 2.402 19.964 562 HB3 GLU 76 2HB GLU 76 26.334 3.484 20.761 563 HG2 GLU 76 1HG GLU 76 27.371 3.007 22.912 564 HG3 GLU 76 2HG GLU 76 28.492 1.892 22.129 565 HA PRO 77 HA PRO 77 23.191 0.147 18.287 566 HB2 PRO 77 1HB PRO 77 20.846 -0.176 19.914 567 HB3 PRO 77 2HB PRO 77 21.846 -1.431 19.183 568 HG2 PRO 77 1HG PRO 77 21.645 -0.990 21.891 569 HG3 PRO 77 2HG PRO 77 23.021 -1.782 21.104 570 HD2 PRO 77 1HD PRO 77 22.743 1.049 22.039 571 HD3 PRO 77 2HD PRO 77 24.144 -0.042 22.142 572 H GLU 78 H GLU 78 23.084 2.843 20.140 573 HA GLU 78 HA GLU 78 20.629 3.908 18.949 574 HB2 GLU 78 1HB GLU 78 22.375 5.074 21.125 575 HB3 GLU 78 2HB GLU 78 20.835 5.722 20.575 576 HG2 GLU 78 1HG GLU 78 19.711 3.690 21.345 577 HG3 GLU 78 2HG GLU 78 21.256 3.061 21.916 578 H ALA 79 H ALA 79 21.114 4.559 16.938 579 HA ALA 79 HA ALA 79 23.570 5.967 16.353 580 HB1 ALA 79 3HB ALA 79 22.644 4.389 14.726 581 HB2 ALA 79 1HB ALA 79 22.754 6.015 14.053 582 HB3 ALA 79 2HB ALA 79 21.196 5.383 14.584 583 H GLY 80 H GLY 80 23.357 8.041 15.003 584 HA2 GLY 80 1HA GLY 80 21.972 9.952 16.665 585 HA3 GLY 80 2HA GLY 80 23.010 10.314 15.293 586 H ALA 81 H ALA 81 19.824 8.972 16.077 587 HA ALA 81 HA ALA 81 18.569 10.671 14.108 588 HB1 ALA 81 3HB ALA 81 17.510 8.851 12.864 589 HB2 ALA 81 1HB ALA 81 18.425 7.670 13.800 590 HB3 ALA 81 2HB ALA 81 19.266 8.780 12.716 591 H GLY 82 H GLY 82 16.700 11.336 14.943 592 HA2 GLY 82 1HA GLY 82 15.725 10.145 17.387 593 HA3 GLY 82 2HA GLY 82 15.092 11.581 16.598 594 H ALA 83 H ALA 83 15.411 8.134 15.796 595 HA ALA 83 HA ALA 83 12.576 7.760 15.625 596 HB1 ALA 83 3HB ALA 83 14.167 7.707 13.058 597 HB2 ALA 83 1HB ALA 83 12.958 8.914 13.493 598 HB3 ALA 83 2HB ALA 83 12.477 7.236 13.240 599 H ARG 84 H ARG 84 12.101 5.509 14.816 600 HA ARG 84 HA ARG 84 13.858 3.643 16.027 601 HE ARG 84 HE ARG 84 9.597 4.123 15.636 602 HB2 ARG 84 1HB ARG 84 12.316 1.917 15.248 603 HB3 ARG 84 2HB ARG 84 11.442 3.245 15.984 604 HG2 ARG 84 1HG ARG 84 11.749 2.875 13.011 605 HG3 ARG 84 2HG ARG 84 10.375 2.293 13.947 606 HD2 ARG 84 1HD ARG 84 11.233 5.147 13.503 607 HD3 ARG 84 2HD ARG 84 9.751 4.369 12.950 608 HH11 ARG 84 1HH1 ARG 84 10.133 6.859 13.515 609 HH12 ARG 84 2HH1 ARG 84 9.476 8.018 14.625 610 HH21 ARG 84 1HH2 ARG 84 8.693 5.647 17.088 611 HH22 ARG 84 2HH2 ARG 84 8.619 7.326 16.637 612 HA PRO 85 HA PRO 85 16.641 3.280 12.636 613 HB2 PRO 85 1HB PRO 85 18.197 1.319 13.622 614 HB3 PRO 85 2HB PRO 85 18.197 2.952 14.300 615 HG2 PRO 85 1HG PRO 85 16.783 0.497 15.276 616 HG3 PRO 85 2HG PRO 85 17.699 1.700 16.203 617 HD2 PRO 85 1HD PRO 85 14.984 1.707 16.042 618 HD3 PRO 85 2HD PRO 85 15.943 3.186 16.244 619 H ALA 86 H ALA 86 14.082 1.664 12.577 620 HA ALA 86 HA ALA 86 14.994 -0.787 11.270 621 HB1 ALA 86 3HB ALA 86 13.173 -0.980 12.890 622 HB2 ALA 86 1HB ALA 86 12.640 -1.441 11.273 623 HB3 ALA 86 2HB ALA 86 12.197 0.135 11.932 624 H ASN 87 H ASN 87 14.500 2.339 10.449 625 HA ASN 87 HA ASN 87 14.110 3.509 8.545 626 HB2 ASN 87 1HB ASN 87 15.024 0.868 7.436 627 HB3 ASN 87 2HB ASN 87 14.546 2.178 6.363 628 HD21 ASN 87 2HD2 ASN 87 15.550 4.270 8.110 629 HD22 ASN 87 1HD2 ASN 87 17.273 4.221 7.990 630 H ALA 88 H ALA 88 11.866 2.435 9.814 631 HA ALA 88 HA ALA 88 10.031 1.131 8.178 632 HB1 ALA 88 3HB ALA 88 8.311 2.021 9.667 633 HB2 ALA 88 1HB ALA 88 9.469 3.177 10.326 634 HB3 ALA 88 2HB ALA 88 9.703 1.448 10.585 635 HA PRO 89 HA PRO 89 9.065 3.893 4.932 636 HB2 PRO 89 1HB PRO 89 6.351 3.415 4.712 637 HB3 PRO 89 2HB PRO 89 7.618 2.412 4.001 638 HG2 PRO 89 1HG PRO 89 6.095 2.024 6.542 639 HG3 PRO 89 2HG PRO 89 6.588 0.823 5.334 640 HD2 PRO 89 1HD PRO 89 7.912 1.090 7.642 641 HD3 PRO 89 2HD PRO 89 8.768 0.737 6.126 642 H GLU 90 H GLU 90 8.702 6.008 4.825 643 HA GLU 90 HA GLU 90 7.505 7.468 6.942 644 HB2 GLU 90 1HB GLU 90 8.017 8.353 4.093 645 HB3 GLU 90 2HB GLU 90 7.635 9.411 5.439 646 HG2 GLU 90 1HG GLU 90 9.758 8.494 6.524 647 HG3 GLU 90 2HG GLU 90 10.148 7.877 4.917 648 H VAL 91 H VAL 91 6.405 6.204 3.865 649 HA VAL 91 HA VAL 91 3.669 6.930 4.614 650 HB VAL 91 HB VAL 91 4.344 8.749 3.201 651 HG11 VAL 91 1HG1 VAL 91 5.097 8.417 0.891 652 HG12 VAL 91 2HG1 VAL 91 5.130 6.675 1.164 653 HG13 VAL 91 3HG1 VAL 91 6.219 7.730 2.064 654 HG21 VAL 91 3HG2 VAL 91 2.709 8.566 1.385 655 HG22 VAL 91 1HG2 VAL 91 2.064 7.969 2.912 656 HG23 VAL 91 2HG2 VAL 91 2.592 6.831 1.673 657 H LEU 92 H LEU 92 2.197 5.461 4.185 658 HA LEU 92 HA LEU 92 2.895 3.174 2.458 659 HG LEU 92 HG LEU 92 0.124 1.793 3.016 660 HB2 LEU 92 1HB LEU 92 2.480 2.513 4.765 661 HB3 LEU 92 2HB LEU 92 0.955 3.377 4.770 662 HD11 LEU 92 1HD1 LEU 92 2.259 1.065 2.120 663 HD12 LEU 92 2HD1 LEU 92 1.332 -0.314 2.709 664 HD13 LEU 92 3HD1 LEU 92 2.672 0.320 3.663 665 HD21 LEU 92 3HD2 LEU 92 -0.252 -0.054 4.568 666 HD22 LEU 92 1HD2 LEU 92 -0.445 1.506 5.368 667 HD23 LEU 92 2HD2 LEU 92 1.023 0.563 5.617 668 H LEU 93 H LEU 93 1.847 3.106 0.577 669 HA LEU 93 HA LEU 93 -0.503 4.836 0.246 670 HG LEU 93 HG LEU 93 2.417 5.488 -0.612 671 HB2 LEU 93 1HB LEU 93 1.339 3.625 -1.815 672 HB3 LEU 93 2HB LEU 93 -0.032 4.658 -2.172 673 HD11 LEU 93 1HD1 LEU 93 2.917 5.136 -2.961 674 HD12 LEU 93 2HD1 LEU 93 2.917 6.858 -2.579 675 HD13 LEU 93 3HD1 LEU 93 1.543 6.142 -3.421 676 HD21 LEU 93 3HD2 LEU 93 1.494 7.737 -0.770 677 HD22 LEU 93 1HD2 LEU 93 0.392 6.665 0.094 678 HD23 LEU 93 2HD2 LEU 93 0.062 7.105 -1.582 679 H VAL 94 H VAL 94 -2.369 3.823 0.453 680 HA VAL 94 HA VAL 94 -2.602 1.024 -0.404 681 HB VAL 94 HB VAL 94 -4.573 2.695 1.174 682 HG11 VAL 94 1HG1 VAL 94 -5.629 0.538 1.692 683 HG12 VAL 94 2HG1 VAL 94 -4.485 -0.272 0.620 684 HG13 VAL 94 3HG1 VAL 94 -5.646 0.883 -0.037 685 HG21 VAL 94 3HG2 VAL 94 -2.590 0.630 2.129 686 HG22 VAL 94 1HG2 VAL 94 -3.832 1.393 3.122 687 HG23 VAL 94 2HG2 VAL 94 -2.526 2.364 2.442 688 H GLY 95 H GLY 95 -3.281 0.719 -2.424 689 HA2 GLY 95 1HA GLY 95 -4.843 2.835 -3.728 690 HA3 GLY 95 2HA GLY 95 -3.970 1.545 -4.541 691 H THR 96 H THR 96 -6.936 2.534 -3.125 692 HA THR 96 HA THR 96 -8.103 -0.129 -3.585 693 HB THR 96 HB THR 96 -10.066 0.876 -2.245 694 HG1 THR 96 HG1 THR 96 -7.973 2.698 -1.567 695 HG21 THR 96 3HG2 THR 96 -7.416 0.364 -0.890 696 HG22 THR 96 1HG2 THR 96 -8.591 -0.860 -1.370 697 HG23 THR 96 2HG2 THR 96 -8.997 0.306 -0.111 698 H GLY 97 H GLY 97 -7.739 0.911 -5.905 699 HA2 GLY 97 1HA GLY 97 -9.459 2.964 -6.793 700 HA3 GLY 97 2HA GLY 97 -8.629 1.809 -7.821 701 H ARG 98 H ARG 98 -9.978 -0.481 -6.475 702 HA ARG 98 HA ARG 98 -12.183 -0.719 -8.209 703 HE ARG 98 HE ARG 98 -14.650 -5.031 -7.501 704 HB2 ARG 98 1HB ARG 98 -10.971 -2.660 -7.301 705 HB3 ARG 98 2HB ARG 98 -11.580 -2.290 -5.693 706 HG2 ARG 98 1HG ARG 98 -13.886 -2.612 -6.556 707 HG3 ARG 98 2HG ARG 98 -13.191 -3.132 -8.091 708 HD2 ARG 98 1HD ARG 98 -12.047 -4.964 -6.962 709 HD3 ARG 98 2HD ARG 98 -12.712 -4.436 -5.415 710 HH11 ARG 98 1HH1 ARG 98 -12.869 -6.250 -4.734 711 HH12 ARG 98 2HH1 ARG 98 -14.014 -7.513 -4.393 712 HH21 ARG 98 1HH2 ARG 98 -16.145 -6.683 -7.059 713 HH22 ARG 98 2HH2 ARG 98 -15.879 -7.764 -5.725 714 H ARG 99 H ARG 99 -11.915 0.204 -4.839 715 HA ARG 99 HA ARG 99 -14.303 1.704 -4.843 716 HE ARG 99 HE ARG 99 -17.947 0.694 -1.308 717 HB2 ARG 99 1HB ARG 99 -15.300 -0.578 -4.735 718 HB3 ARG 99 2HB ARG 99 -14.397 -0.878 -3.259 719 HG2 ARG 99 1HG ARG 99 -15.629 0.834 -2.098 720 HG3 ARG 99 2HG ARG 99 -16.461 1.291 -3.588 721 HD2 ARG 99 1HD ARG 99 -17.512 -0.890 -3.702 722 HD3 ARG 99 2HD ARG 99 -16.622 -1.419 -2.277 723 HH11 ARG 99 1HH1 ARG 99 -19.047 -1.957 -3.323 724 HH12 ARG 99 2HH1 ARG 99 -20.647 -1.988 -2.650 725 HH21 ARG 99 1HH2 ARG 99 -20.058 0.658 -0.409 726 HH22 ARG 99 2HH2 ARG 99 -21.211 -0.523 -0.971 727 H GLN 100 H GLN 100 -13.174 3.309 -3.912 728 HA GLN 100 HA GLN 100 -10.962 2.902 -2.251 729 HB2 GLN 100 1HB GLN 100 -11.467 4.902 -3.721 730 HB3 GLN 100 2HB GLN 100 -12.531 5.463 -2.439 731 HG2 GLN 100 1HG GLN 100 -10.712 5.664 -0.916 732 HG3 GLN 100 2HG GLN 100 -9.614 4.863 -2.039 733 HE21 GLN 100 2HE2 GLN 100 -9.358 7.459 -0.812 734 HE22 GLN 100 1HE2 GLN 100 -9.259 8.609 -2.101 735 H HIS 101 H HIS 101 -10.723 2.636 -0.163 736 HA HIS 101 HA HIS 101 -13.071 2.999 1.574 737 HD1 HIS 101 HD1 HIS 101 -13.793 -0.036 3.232 738 HD2 HIS 101 HD2 HIS 101 -10.742 2.344 4.748 739 HE1 HIS 101 HE1 HIS 101 -14.090 -0.061 5.728 740 HE2 HIS 101 HE2 HIS 101 -12.420 1.625 6.577 741 HB2 HIS 101 1HB HIS 101 -12.193 0.683 1.460 742 HB3 HIS 101 2HB HIS 101 -10.625 1.260 2.010 743 H LEU 102 H LEU 102 -13.016 4.676 2.893 744 HA LEU 102 HA LEU 102 -10.562 6.143 3.312 745 HG LEU 102 HG LEU 102 -11.561 7.742 5.781 746 HB2 LEU 102 1HB LEU 102 -12.716 7.308 3.022 747 HB3 LEU 102 2HB LEU 102 -13.316 6.555 4.487 748 HD11 LEU 102 1HD1 LEU 102 -9.931 8.029 3.990 749 HD12 LEU 102 2HD1 LEU 102 -10.340 9.572 4.737 750 HD13 LEU 102 3HD1 LEU 102 -11.023 9.144 3.168 751 HD21 LEU 102 3HD2 LEU 102 -13.809 8.663 5.606 752 HD22 LEU 102 1HD2 LEU 102 -13.358 9.509 4.126 753 HD23 LEU 102 2HD2 LEU 102 -12.602 9.948 5.658 754 H LEU 103 H LEU 103 -9.147 5.136 4.609 755 HA LEU 103 HA LEU 103 -9.850 3.509 6.812 756 HG LEU 103 HG LEU 103 -7.843 3.231 4.468 757 HB2 LEU 103 1HB LEU 103 -7.249 4.905 6.173 758 HB3 LEU 103 2HB LEU 103 -7.449 3.696 7.426 759 HD11 LEU 103 1HD1 LEU 103 -5.820 1.879 4.633 760 HD12 LEU 103 2HD1 LEU 103 -5.644 2.340 6.326 761 HD13 LEU 103 3HD1 LEU 103 -5.501 3.560 5.060 762 HD21 LEU 103 3HD2 LEU 103 -9.304 1.828 5.828 763 HD22 LEU 103 1HD2 LEU 103 -7.920 1.306 6.788 764 HD23 LEU 103 2HD2 LEU 103 -8.022 0.874 5.082 765 H GLY 104 H GLY 104 -9.717 3.936 9.042 766 HA2 GLY 104 1HA GLY 104 -10.334 6.759 9.604 767 HA3 GLY 104 2HA GLY 104 -10.968 5.389 10.500 768 HA PRO 105 HA PRO 105 -7.317 7.705 12.552 769 HB2 PRO 105 1HB PRO 105 -9.236 7.407 14.811 770 HB3 PRO 105 2HB PRO 105 -8.200 8.774 14.384 771 HG2 PRO 105 1HG PRO 105 -10.810 8.849 13.888 772 HG3 PRO 105 2HG PRO 105 -9.645 9.522 12.732 773 HD2 PRO 105 1HD PRO 105 -11.174 6.962 12.615 774 HD3 PRO 105 2HD PRO 105 -10.718 8.067 11.303 775 H GLU 106 H GLU 106 -9.395 5.194 13.995 776 HA GLU 106 HA GLU 106 -7.322 4.200 15.675 777 HB2 GLU 106 1HB GLU 106 -9.661 3.964 16.291 778 HB3 GLU 106 2HB GLU 106 -9.970 2.995 14.859 779 HG2 GLU 106 1HG GLU 106 -8.476 1.262 15.718 780 HG3 GLU 106 2HG GLU 106 -8.188 2.234 17.160 781 H GLN 107 H GLN 107 -8.529 3.382 12.495 782 HA GLN 107 HA GLN 107 -7.256 0.856 12.283 783 HB2 GLN 107 1HB GLN 107 -8.206 2.745 10.123 784 HB3 GLN 107 2HB GLN 107 -7.722 1.076 9.860 785 HG2 GLN 107 1HG GLN 107 -9.543 0.322 11.309 786 HG3 GLN 107 2HG GLN 107 -10.028 1.998 11.562 787 HE21 GLN 107 2HE2 GLN 107 -11.524 -0.231 10.421 788 HE22 GLN 107 1HE2 GLN 107 -11.985 0.268 8.833 789 H VAL 108 H VAL 108 -6.185 4.134 11.711 790 HA VAL 108 HA VAL 108 -3.763 3.151 10.393 791 HB VAL 108 HB VAL 108 -3.263 5.520 9.912 792 HG11 VAL 108 1HG1 VAL 108 -4.511 4.183 8.302 793 HG12 VAL 108 2HG1 VAL 108 -5.051 5.861 8.276 794 HG13 VAL 108 3HG1 VAL 108 -6.025 4.634 9.085 795 HG21 VAL 108 3HG2 VAL 108 -4.353 6.560 11.822 796 HG22 VAL 108 1HG2 VAL 108 -5.930 6.049 11.219 797 HG23 VAL 108 2HG2 VAL 108 -4.979 7.227 10.314 798 H ARG 109 H ARG 109 -4.763 3.886 13.495 799 HA ARG 109 HA ARG 109 -2.719 5.384 14.601 800 HE ARG 109 HE ARG 109 -5.932 7.240 17.557 801 HB2 ARG 109 1HB ARG 109 -4.603 3.363 15.702 802 HB3 ARG 109 2HB ARG 109 -3.273 3.908 16.709 803 HG2 ARG 109 1HG ARG 109 -4.021 6.228 16.409 804 HG3 ARG 109 2HG ARG 109 -5.386 5.641 15.455 805 HD2 ARG 109 1HD ARG 109 -6.193 4.373 17.371 806 HD3 ARG 109 2HD ARG 109 -4.810 4.911 18.323 807 HH11 ARG 109 1HH1 ARG 109 -7.221 4.359 19.069 808 HH12 ARG 109 2HH1 ARG 109 -8.470 5.205 19.936 809 HH21 ARG 109 1HH2 ARG 109 -7.581 8.361 18.672 810 HH22 ARG 109 2HH2 ARG 109 -8.692 7.480 19.683 811 HA PRO 110 HA PRO 110 -0.452 1.139 15.794 812 HB2 PRO 110 1HB PRO 110 -1.141 -0.254 13.240 813 HB3 PRO 110 2HB PRO 110 -0.847 -0.927 14.849 814 HG2 PRO 110 1HG PRO 110 -3.323 -0.709 13.949 815 HG3 PRO 110 2HG PRO 110 -2.948 -0.304 15.635 816 HD2 PRO 110 1HD PRO 110 -3.469 1.514 13.320 817 HD3 PRO 110 2HD PRO 110 -3.944 1.688 15.022 818 H LEU 111 H LEU 111 -0.764 2.331 12.474 819 HA LEU 111 HA LEU 111 2.083 1.942 12.029 820 HG LEU 111 HG LEU 111 -0.249 0.569 10.530 821 HB2 LEU 111 1HB LEU 111 -0.090 2.986 10.224 822 HB3 LEU 111 2HB LEU 111 1.592 2.833 9.753 823 HD11 LEU 111 1HD1 LEU 111 0.044 -0.112 8.190 824 HD12 LEU 111 2HD1 LEU 111 0.959 1.365 7.887 825 HD13 LEU 111 3HD1 LEU 111 -0.744 1.459 8.337 826 HD21 LEU 111 3HD2 LEU 111 1.609 -0.893 9.883 827 HD22 LEU 111 1HD2 LEU 111 2.026 0.123 11.263 828 HD23 LEU 111 2HD2 LEU 111 2.638 0.521 9.658 829 H LEU 112 H LEU 112 -0.230 4.597 12.419 830 HA LEU 112 HA LEU 112 1.553 6.710 11.931 831 HG LEU 112 HG LEU 112 -1.468 6.494 11.348 832 HB2 LEU 112 1HB LEU 112 -0.878 6.543 13.700 833 HB3 LEU 112 2HB LEU 112 0.026 8.027 13.476 834 HD11 LEU 112 1HD1 LEU 112 -2.858 8.500 11.257 835 HD12 LEU 112 2HD1 LEU 112 -1.919 9.216 12.568 836 HD13 LEU 112 3HD1 LEU 112 -2.889 7.773 12.863 837 HD21 LEU 112 3HD2 LEU 112 0.163 9.023 11.116 838 HD22 LEU 112 1HD2 LEU 112 -0.837 8.318 9.844 839 HD23 LEU 112 2HD2 LEU 112 0.583 7.452 10.432 840 H ALA 113 H ALA 113 0.964 4.769 14.789 841 HA ALA 113 HA ALA 113 2.503 6.303 16.602 842 HB1 ALA 113 3HB ALA 113 0.867 4.633 17.326 843 HB2 ALA 113 1HB ALA 113 2.458 4.327 18.024 844 HB3 ALA 113 2HB ALA 113 1.887 3.351 16.669 845 H MET 114 H MET 114 3.351 4.062 14.117 846 HA MET 114 HA MET 114 6.064 3.711 15.121 847 HB2 MET 114 1HB MET 114 4.748 2.695 12.593 848 HB3 MET 114 2HB MET 114 6.369 2.280 13.130 849 HG2 MET 114 1HG MET 114 5.468 1.195 15.098 850 HG3 MET 114 2HG MET 114 3.835 1.665 14.628 851 HE1 MET 114 3HE MET 114 3.832 -2.213 14.063 852 HE2 MET 114 1HE MET 114 3.034 -0.859 14.862 853 HE3 MET 114 2HE MET 114 4.667 -1.326 15.339 854 H GLY 115 H GLY 115 4.355 5.935 13.316 855 HA2 GLY 115 1HA GLY 115 5.327 7.932 12.488 856 HA3 GLY 115 2HA GLY 115 6.843 7.071 12.264 857 H VAL 116 H VAL 116 4.200 5.284 11.185 858 HA VAL 116 HA VAL 116 4.973 5.789 8.411 859 HB VAL 116 HB VAL 116 3.156 3.633 9.509 860 HG11 VAL 116 1HG1 VAL 116 3.543 2.527 7.362 861 HG12 VAL 116 2HG1 VAL 116 4.515 3.897 6.829 862 HG13 VAL 116 3HG1 VAL 116 2.793 4.107 7.146 863 HG21 VAL 116 3HG2 VAL 116 5.390 3.395 10.436 864 HG22 VAL 116 1HG2 VAL 116 6.091 3.495 8.820 865 HG23 VAL 116 2HG2 VAL 116 5.073 2.122 9.258 866 H GLY 117 H GLY 117 3.849 7.296 7.358 867 HA2 GLY 117 1HA GLY 117 1.172 8.033 8.156 868 HA3 GLY 117 2HA GLY 117 2.096 8.722 6.827 869 H VAL 118 H VAL 118 -0.608 7.036 7.501 870 HA VAL 118 HA VAL 118 -0.424 5.202 5.232 871 HB VAL 118 HB VAL 118 -2.723 5.480 7.166 872 HG11 VAL 118 1HG1 VAL 118 -3.253 4.334 5.086 873 HG12 VAL 118 2HG1 VAL 118 -3.256 3.204 6.440 874 HG13 VAL 118 3HG1 VAL 118 -1.890 3.241 5.326 875 HG21 VAL 118 3HG2 VAL 118 -1.771 3.567 8.372 876 HG22 VAL 118 1HG2 VAL 118 -0.707 4.973 8.430 877 HG23 VAL 118 2HG2 VAL 118 -0.343 3.635 7.340 878 H GLU 119 H GLU 119 -1.078 5.872 3.313 879 HA GLU 119 HA GLU 119 -3.192 7.925 3.165 880 HB2 GLU 119 1HB GLU 119 -1.055 7.307 1.116 881 HB3 GLU 119 2HB GLU 119 -2.229 8.612 1.039 882 HG2 GLU 119 1HG GLU 119 -0.103 8.359 3.154 883 HG3 GLU 119 2HG GLU 119 0.055 9.324 1.688 884 H ALA 120 H ALA 120 -5.077 6.951 2.701 885 HA ALA 120 HA ALA 120 -5.100 4.616 0.931 886 HB1 ALA 120 3HB ALA 120 -7.426 4.348 1.619 887 HB2 ALA 120 1HB ALA 120 -7.338 5.851 2.534 888 HB3 ALA 120 2HB ALA 120 -6.367 4.463 3.023 889 H MET 121 H MET 121 -5.249 5.010 -1.174 890 HA MET 121 HA MET 121 -7.001 7.168 -2.109 891 HB2 MET 121 1HB MET 121 -4.117 6.809 -2.949 892 HB3 MET 121 2HB MET 121 -5.256 7.906 -3.716 893 HG2 MET 121 1HG MET 121 -5.475 9.124 -1.588 894 HG3 MET 121 2HG MET 121 -4.272 8.051 -0.876 895 HE1 MET 121 3HE MET 121 -1.728 7.925 -1.725 896 HE2 MET 121 1HE MET 121 -1.099 8.912 -3.045 897 HE3 MET 121 2HE MET 121 -2.296 7.660 -3.373 898 H ASP 122 H ASP 122 -6.643 7.078 -4.739 899 HA ASP 122 HA ASP 122 -7.806 4.646 -5.591 900 HB2 ASP 122 1HB ASP 122 -8.325 6.565 -6.865 901 HB3 ASP 122 2HB ASP 122 -6.630 7.006 -7.050 902 H THR 123 H THR 123 -6.937 3.112 -7.124 903 HA THR 123 HA THR 123 -4.491 2.042 -6.234 904 HB THR 123 HB THR 123 -6.182 0.548 -7.033 905 HG1 THR 123 HG1 THR 123 -4.566 0.039 -9.160 906 HG21 THR 123 3HG2 THR 123 -7.285 2.008 -8.645 907 HG22 THR 123 1HG2 THR 123 -6.887 0.452 -9.377 908 HG23 THR 123 2HG2 THR 123 -5.902 1.872 -9.731 909 H GLN 124 H GLN 124 -5.328 3.771 -9.244 910 HA GLN 124 HA GLN 124 -2.693 3.453 -10.328 911 HB2 GLN 124 1HB GLN 124 -4.777 3.758 -11.709 912 HB3 GLN 124 2HB GLN 124 -4.807 5.437 -11.181 913 HG2 GLN 124 1HG GLN 124 -2.500 5.670 -12.142 914 HG3 GLN 124 2HG GLN 124 -2.713 4.069 -12.847 915 HE21 GLN 124 2HE2 GLN 124 -2.298 6.615 -14.155 916 HE22 GLN 124 1HE2 GLN 124 -3.664 6.863 -15.197 917 H ALA 125 H ALA 125 -4.470 5.964 -8.633 918 HA ALA 125 HA ALA 125 -2.567 8.018 -8.787 919 HB1 ALA 125 3HB ALA 125 -4.859 8.380 -8.024 920 HB2 ALA 125 1HB ALA 125 -3.694 8.973 -6.840 921 HB3 ALA 125 2HB ALA 125 -4.529 7.442 -6.567 922 H ALA 126 H ALA 126 -2.953 5.360 -6.484 923 HA ALA 126 HA ALA 126 -0.885 6.107 -4.722 924 HB1 ALA 126 3HB ALA 126 -2.586 4.452 -4.136 925 HB2 ALA 126 1HB ALA 126 -0.961 3.801 -3.930 926 HB3 ALA 126 2HB ALA 126 -1.924 3.341 -5.335 927 H ALA 127 H ALA 127 -0.898 3.898 -7.515 928 HA ALA 127 HA ALA 127 1.820 3.187 -7.378 929 HB1 ALA 127 3HB ALA 127 0.047 3.308 -9.818 930 HB2 ALA 127 1HB ALA 127 0.171 1.947 -8.702 931 HB3 ALA 127 2HB ALA 127 1.564 2.420 -9.675 932 H ARG 128 H ARG 128 0.163 5.846 -8.979 933 HA ARG 128 HA ARG 128 2.346 6.875 -10.432 934 HE ARG 128 HE ARG 128 1.130 10.973 -12.839 935 HB2 ARG 128 1HB ARG 128 -0.087 7.473 -10.715 936 HB3 ARG 128 2HB ARG 128 0.046 8.445 -9.256 937 HG2 ARG 128 1HG ARG 128 1.756 9.824 -10.351 938 HG3 ARG 128 2HG ARG 128 1.562 8.866 -11.822 939 HD2 ARG 128 1HD ARG 128 -0.858 9.501 -11.813 940 HD3 ARG 128 2HD ARG 128 -0.506 10.602 -10.482 941 HH11 ARG 128 1HH1 ARG 128 -1.802 11.930 -11.155 942 HH12 ARG 128 2HH1 ARG 128 -1.950 13.426 -12.022 943 HH21 ARG 128 1HH2 ARG 128 0.922 12.915 -13.972 944 HH22 ARG 128 2HH2 ARG 128 -0.397 13.995 -13.623 945 H THR 129 H THR 129 1.058 7.703 -7.231 946 HA THR 129 HA THR 129 2.992 9.675 -6.623 947 HB THR 129 HB THR 129 1.453 7.991 -4.634 948 HG1 THR 129 HG1 THR 129 -0.030 8.898 -6.080 949 HG21 THR 129 3HG2 THR 129 1.604 10.006 -3.230 950 HG22 THR 129 1HG2 THR 129 2.562 10.799 -4.482 951 HG23 THR 129 2HG2 THR 129 3.201 9.384 -3.646 952 H TYR 130 H TYR 130 2.794 6.206 -6.007 953 HA TYR 130 HA TYR 130 5.056 5.900 -4.394 954 HD1 TYR 130 HD1 TYR 130 5.687 3.524 -3.225 955 HD2 TYR 130 HD2 TYR 130 5.186 2.551 -7.339 956 HE1 TYR 130 HE1 TYR 130 7.437 1.805 -3.029 957 HE2 TYR 130 HE2 TYR 130 6.935 0.835 -7.152 958 HH TYR 130 HH TYR 130 8.804 0.258 -5.780 959 HB2 TYR 130 1HB TYR 130 3.541 4.072 -4.599 960 HB3 TYR 130 2HB TYR 130 3.706 4.040 -6.350 961 H ASN 131 H ASN 131 4.725 5.842 -7.918 962 HA ASN 131 HA ASN 131 7.339 5.187 -8.608 963 HB2 ASN 131 1HB ASN 131 5.354 5.393 -10.153 964 HB3 ASN 131 2HB ASN 131 5.560 7.138 -10.091 965 HD21 ASN 131 2HD2 ASN 131 5.708 5.247 -12.329 966 HD22 ASN 131 1HD2 ASN 131 7.262 5.497 -13.043 967 H ILE 132 H ILE 132 5.900 8.404 -8.107 968 HA ILE 132 HA ILE 132 8.244 9.890 -8.558 969 HB ILE 132 HB ILE 132 5.894 10.620 -6.801 970 HG12 ILE 132 1HG1 ILE 132 6.417 11.244 -9.718 971 HG13 ILE 132 2HG1 ILE 132 5.282 10.030 -9.136 972 HG21 ILE 132 1HG2 ILE 132 8.001 12.352 -8.094 973 HG22 ILE 132 2HG2 ILE 132 7.833 12.026 -6.369 974 HG23 ILE 132 3HG2 ILE 132 6.586 12.940 -7.219 975 HD11 ILE 132 3HD1 ILE 132 3.985 11.787 -8.037 976 HD12 ILE 132 1HD1 ILE 132 4.130 12.061 -9.773 977 HD13 ILE 132 2HD1 ILE 132 5.115 12.995 -8.647 978 H LEU 133 H LEU 133 6.810 8.718 -5.512 979 HA LEU 133 HA LEU 133 8.752 9.902 -3.833 980 HG LEU 133 HG LEU 133 5.664 9.594 -3.730 981 HB2 LEU 133 1HB LEU 133 6.949 7.534 -3.335 982 HB3 LEU 133 2HB LEU 133 7.885 8.356 -2.101 983 HD11 LEU 133 1HD1 LEU 133 5.763 8.782 -0.829 984 HD12 LEU 133 2HD1 LEU 133 4.860 7.962 -2.103 985 HD13 LEU 133 3HD1 LEU 133 4.426 9.605 -1.633 986 HD21 LEU 133 3HD2 LEU 133 7.297 10.715 -1.454 987 HD22 LEU 133 1HD2 LEU 133 5.906 11.496 -2.209 988 HD23 LEU 133 2HD2 LEU 133 7.379 11.223 -3.142 989 H MET 134 H MET 134 8.575 6.754 -5.407 990 HA MET 134 HA MET 134 10.833 5.637 -4.094 991 HB2 MET 134 1HB MET 134 9.160 4.263 -5.280 992 HB3 MET 134 2HB MET 134 9.676 4.963 -6.807 993 HG2 MET 134 1HG MET 134 11.881 3.977 -6.533 994 HG3 MET 134 2HG MET 134 11.398 3.305 -4.977 995 HE1 MET 134 3HE MET 134 10.866 3.192 -8.869 996 HE2 MET 134 1HE MET 134 9.245 3.554 -8.276 997 HE3 MET 134 2HE MET 134 9.584 1.991 -9.018 998 H ALA 135 H ALA 135 10.392 7.627 -6.946 999 HA ALA 135 HA ALA 135 13.036 7.430 -7.940 1000 HB1 ALA 135 3HB ALA 135 11.157 8.228 -9.299 1001 HB2 ALA 135 1HB ALA 135 12.488 9.387 -9.277 1002 HB3 ALA 135 2HB ALA 135 11.051 9.674 -8.295 1003 H GLU 136 H GLU 136 11.567 9.343 -5.418 1004 HA GLU 136 HA GLU 136 13.765 11.151 -5.099 1005 HB2 GLU 136 1HB GLU 136 11.651 10.342 -3.091 1006 HB3 GLU 136 2HB GLU 136 12.752 11.699 -2.925 1007 HG2 GLU 136 1HG GLU 136 11.723 12.649 -5.012 1008 HG3 GLU 136 2HG GLU 136 10.504 11.380 -4.889 1009 H GLY 137 H GLY 137 13.125 7.907 -4.179 1010 HA2 GLY 137 1HA GLY 137 14.589 6.399 -3.153 1011 HA3 GLY 137 2HA GLY 137 15.608 7.750 -2.669 1012 H ARG 138 H ARG 138 12.250 8.042 -2.103 1013 HA ARG 138 HA ARG 138 12.712 8.223 0.738 1014 HE ARG 138 HE ARG 138 9.332 11.261 -0.686 1015 HB2 ARG 138 1HB ARG 138 11.244 9.804 -0.543 1016 HB3 ARG 138 2HB ARG 138 10.114 8.482 -0.793 1017 HG2 ARG 138 1HG ARG 138 9.904 8.281 1.677 1018 HG3 ARG 138 2HG ARG 138 10.900 9.729 1.828 1019 HD2 ARG 138 1HD ARG 138 8.227 9.512 0.455 1020 HD3 ARG 138 2HD ARG 138 8.559 10.315 1.987 1021 HH11 ARG 138 1HH1 ARG 138 9.271 11.768 2.784 1022 HH12 ARG 138 2HH1 ARG 138 9.448 13.499 2.655 1023 HH21 ARG 138 1HH2 ARG 138 9.578 13.494 -0.867 1024 HH22 ARG 138 2HH2 ARG 138 9.625 14.489 0.565 1025 H ARG 139 H ARG 139 11.538 7.020 2.326 1026 HA ARG 139 HA ARG 139 11.156 4.266 1.602 1027 HE ARG 139 HE ARG 139 15.006 3.603 3.936 1028 HB2 ARG 139 1HB ARG 139 10.863 5.718 4.234 1029 HB3 ARG 139 2HB ARG 139 10.618 3.988 4.041 1030 HG2 ARG 139 1HG ARG 139 13.178 5.465 3.464 1031 HG3 ARG 139 2HG ARG 139 12.846 4.486 4.897 1032 HD2 ARG 139 1HD ARG 139 12.568 2.513 3.499 1033 HD3 ARG 139 2HD ARG 139 12.838 3.481 2.052 1034 HH11 ARG 139 1HH1 ARG 139 13.654 1.887 1.198 1035 HH12 ARG 139 2HH1 ARG 139 15.159 1.116 0.786 1036 HH21 ARG 139 1HH2 ARG 139 16.984 2.581 3.379 1037 HH22 ARG 139 2HH2 ARG 139 17.023 1.512 2.000 1038 H VAL 140 H VAL 140 9.424 3.925 0.399 1039 HA VAL 140 HA VAL 140 6.806 4.581 1.543 1040 HB VAL 140 HB VAL 140 7.133 6.248 -0.164 1041 HG11 VAL 140 1HG1 VAL 140 8.916 5.185 -1.429 1042 HG12 VAL 140 2HG1 VAL 140 7.604 5.675 -2.501 1043 HG13 VAL 140 3HG1 VAL 140 7.784 3.981 -2.044 1044 HG21 VAL 140 3HG2 VAL 140 5.289 5.740 -1.696 1045 HG22 VAL 140 1HG2 VAL 140 4.900 5.292 -0.035 1046 HG23 VAL 140 2HG2 VAL 140 5.350 4.048 -1.202 1047 H VAL 141 H VAL 141 5.396 2.937 1.503 1048 HA VAL 141 HA VAL 141 6.047 0.584 -0.156 1049 HB VAL 141 HB VAL 141 4.439 0.569 2.408 1050 HG11 VAL 141 1HG1 VAL 141 5.595 -1.679 0.766 1051 HG12 VAL 141 2HG1 VAL 141 3.892 -1.236 0.877 1052 HG13 VAL 141 3HG1 VAL 141 4.735 -1.858 2.296 1053 HG21 VAL 141 3HG2 VAL 141 6.719 1.162 2.950 1054 HG22 VAL 141 1HG2 VAL 141 7.329 -0.187 1.991 1055 HG23 VAL 141 2HG2 VAL 141 6.396 -0.495 3.456 1056 H VAL 142 H VAL 142 4.417 -0.194 -1.481 1057 HA VAL 142 HA VAL 142 1.879 1.293 -1.342 1058 HB VAL 142 HB VAL 142 3.227 2.024 -3.266 1059 HG11 VAL 142 1HG1 VAL 142 4.474 -0.011 -3.686 1060 HG12 VAL 142 2HG1 VAL 142 3.629 0.508 -5.145 1061 HG13 VAL 142 3HG1 VAL 142 2.998 -0.835 -4.189 1062 HG21 VAL 142 3HG2 VAL 142 0.760 0.462 -4.022 1063 HG22 VAL 142 1HG2 VAL 142 1.510 1.729 -4.993 1064 HG23 VAL 142 2HG2 VAL 142 0.808 2.122 -3.424 1065 H ALA 143 H ALA 143 0.043 0.178 -1.409 1066 HA ALA 143 HA ALA 143 0.176 -2.716 -1.963 1067 HB1 ALA 143 3HB ALA 143 -1.622 -1.311 0.015 1068 HB2 ALA 143 1HB ALA 143 -0.200 -2.271 0.423 1069 HB3 ALA 143 2HB ALA 143 -1.599 -3.042 -0.323 1070 H LEU 144 H LEU 144 -0.817 -3.133 -3.816 1071 HA LEU 144 HA LEU 144 -2.944 -1.308 -4.712 1072 HG LEU 144 HG LEU 144 0.048 -1.171 -5.585 1073 HB2 LEU 144 1HB LEU 144 -1.189 -3.178 -6.305 1074 HB3 LEU 144 2HB LEU 144 -2.444 -2.157 -6.979 1075 HD11 LEU 144 1HD1 LEU 144 0.550 -2.156 -7.748 1076 HD12 LEU 144 2HD1 LEU 144 0.715 -0.401 -7.811 1077 HD13 LEU 144 3HD1 LEU 144 -0.710 -1.178 -8.502 1078 HD21 LEU 144 3HD2 LEU 144 -2.143 0.335 -7.008 1079 HD22 LEU 144 1HD2 LEU 144 -0.656 1.035 -6.367 1080 HD23 LEU 144 2HD2 LEU 144 -1.844 0.331 -5.270 1081 H LEU 145 H LEU 145 -4.927 -2.052 -5.270 1082 HA LEU 145 HA LEU 145 -5.440 -4.926 -4.848 1083 HG LEU 145 HG LEU 145 -6.533 -5.157 -2.612 1084 HB2 LEU 145 1HB LEU 145 -6.400 -2.816 -3.358 1085 HB3 LEU 145 2HB LEU 145 -7.708 -3.104 -4.488 1086 HD11 LEU 145 1HD1 LEU 145 -8.675 -4.978 -1.447 1087 HD12 LEU 145 2HD1 LEU 145 -9.159 -3.678 -2.537 1088 HD13 LEU 145 3HD1 LEU 145 -7.799 -3.447 -1.437 1089 HD21 LEU 145 3HD2 LEU 145 -7.369 -6.155 -4.680 1090 HD22 LEU 145 1HD2 LEU 145 -8.913 -5.333 -4.454 1091 HD23 LEU 145 2HD2 LEU 145 -8.391 -6.564 -3.303 1092 HA PRO 146 HA PRO 146 -7.011 -4.129 -9.062 1093 HB2 PRO 146 1HB PRO 146 -5.725 -6.090 -10.322 1094 HB3 PRO 146 2HB PRO 146 -4.878 -4.616 -9.834 1095 HG2 PRO 146 1HG PRO 146 -4.807 -7.332 -8.623 1096 HG3 PRO 146 2HG PRO 146 -3.528 -6.110 -8.723 1097 HD2 PRO 146 1HD PRO 146 -5.214 -6.638 -6.504 1098 HD3 PRO 146 2HD PRO 146 -4.087 -5.280 -6.689 1099 H ASP 147 H ASP 147 -8.607 -5.148 -10.223 1100 HA ASP 147 HA ASP 147 -10.338 -6.523 -10.724 1101 HB2 ASP 147 1HB ASP 147 -8.234 -8.108 -10.906 1102 HB3 ASP 147 2HB ASP 147 -8.947 -8.872 -9.490 1103 H GLY 148 H GLY 148 -11.568 -8.646 -9.503 1104 HA2 GLY 148 1HA GLY 148 -11.740 -8.901 -6.825 1105 HA3 GLY 148 2HA GLY 148 -12.614 -7.403 -7.103 1106 H ASP 149 H ASP 149 -13.928 -7.967 -9.459 1107 HA ASP 149 HA ASP 149 -16.193 -9.259 -8.344 1108 HB2 ASP 149 1HB ASP 149 -16.331 -7.357 -9.929 1109 HB3 ASP 149 2HB ASP 149 -15.729 -8.402 -11.209 1110 H SER 150 H SER 150 -17.337 -11.093 -9.186 1111 HA SER 150 HA SER 150 -15.595 -13.058 -10.492 1112 HG SER 150 HG SER 150 -14.724 -12.661 -8.343 1113 HB2 SER 150 1HB SER 150 -17.263 -13.592 -8.023 1114 HB3 SER 150 2HB SER 150 -16.231 -14.753 -8.859 1115 H LEU 151 H LEU 151 -17.026 -15.154 -10.878 1116 HA LEU 151 HA LEU 151 -18.909 -14.438 -12.827 1117 HG LEU 151 HG LEU 151 -20.620 -17.015 -12.804 1118 HB2 LEU 151 1HB LEU 151 -17.638 -16.541 -12.857 1119 HB3 LEU 151 2HB LEU 151 -18.529 -17.101 -11.454 1120 HD11 LEU 151 1HD1 LEU 151 -18.721 -16.472 -15.082 1121 HD12 LEU 151 2HD1 LEU 151 -19.939 -15.364 -14.452 1122 HD13 LEU 151 3HD1 LEU 151 -20.434 -16.861 -15.239 1123 HD21 LEU 151 3HD2 LEU 151 -19.393 -19.099 -12.501 1124 HD22 LEU 151 1HD2 LEU 151 -18.411 -18.736 -13.919 1125 HD23 LEU 151 2HD2 LEU 151 -20.141 -19.028 -14.096 1126 H GLU 152 H GLU 152 -19.355 -15.668 -9.520 1127 HA GLU 152 HA GLU 152 -22.220 -15.601 -9.763 1128 HB2 GLU 152 1HB GLU 152 -20.364 -16.146 -7.469 1129 HB3 GLU 152 2HB GLU 152 -22.094 -15.966 -7.220 1130 HG2 GLU 152 1HG GLU 152 -22.435 -17.792 -8.893 1131 HG3 GLU 152 2HG GLU 152 -20.689 -18.041 -8.877 1132 H HIS 153 H HIS 153 -21.823 -13.217 -10.511 1133 HA HIS 153 HA HIS 153 -21.962 -11.341 -8.326 1134 HD1 HIS 153 HD1 HIS 153 -20.227 -8.742 -9.804 1135 HD2 HIS 153 HD2 HIS 153 -24.396 -8.729 -9.770 1136 HE1 HIS 153 HE1 HIS 153 -20.902 -6.412 -9.128 1137 HE2 HIS 153 HE2 HIS 153 -23.423 -6.397 -9.192 1138 HB2 HIS 153 1HB HIS 153 -21.211 -10.843 -10.752 1139 HB3 HIS 153 2HB HIS 153 -22.926 -10.833 -11.144 1140 H HIS 154 H HIS 154 -23.619 -11.663 -6.977 1141 HA HIS 154 HA HIS 154 -25.924 -13.132 -7.759 1142 HD1 HIS 154 HD1 HIS 154 -26.984 -14.465 -4.174 1143 HD2 HIS 154 HD2 HIS 154 -23.358 -14.287 -6.220 1144 HE1 HIS 154 HE1 HIS 154 -25.866 -16.683 -3.785 1145 HE2 HIS 154 HE2 HIS 154 -23.570 -16.432 -4.798 1146 HB2 HIS 154 1HB HIS 154 -25.029 -11.822 -5.230 1147 HB3 HIS 154 2HB HIS 154 -26.705 -12.330 -5.380 1148 H HIS 155 H HIS 155 -27.816 -12.511 -8.469 1149 HA HIS 155 HA HIS 155 -28.652 -9.749 -8.468 1150 HD1 HIS 155 HD1 HIS 155 -28.890 -13.246 -11.008 1151 HD2 HIS 155 HD2 HIS 155 -29.501 -9.141 -11.321 1152 HE1 HIS 155 HE1 HIS 155 -28.073 -12.607 -13.300 1153 HE2 HIS 155 HE2 HIS 155 -28.450 -10.119 -13.471 1154 HB2 HIS 155 1HB HIS 155 -30.174 -12.309 -9.071 1155 HB3 HIS 155 2HB HIS 155 -30.840 -10.690 -9.259 1156 H HIS 156 H HIS 156 -29.122 -8.841 -6.541 1157 HA HIS 156 HA HIS 156 -29.226 -10.652 -4.324 1158 HD1 HIS 156 HD1 HIS 156 -27.645 -10.877 -2.744 1159 HD2 HIS 156 HD2 HIS 156 -26.121 -7.421 -4.510 1160 HE1 HIS 156 HE1 HIS 156 -25.146 -11.052 -2.546 1161 HE2 HIS 156 HE2 HIS 156 -24.250 -8.894 -3.485 1162 HB2 HIS 156 1HB HIS 156 -28.805 -7.723 -4.574 1163 HB3 HIS 156 2HB HIS 156 -29.267 -8.388 -3.009 1164 H HIS 157 H HIS 157 -31.486 -11.294 -5.274 1165 HA HIS 157 HA HIS 157 -33.266 -10.239 -3.187 1166 HD1 HIS 157 HD1 HIS 157 -35.720 -9.422 -3.989 1167 HD2 HIS 157 HD2 HIS 157 -36.064 -13.549 -3.598 1168 HE1 HIS 157 HE1 HIS 157 -37.953 -9.816 -2.904 1169 HE2 HIS 157 HE2 HIS 157 -38.057 -12.301 -2.505 1170 HB2 HIS 157 1HB HIS 157 -34.097 -10.978 -5.563 1171 HB3 HIS 157 2HB HIS 157 -33.888 -12.613 -4.942 1172 H HIS 158 H HIS 158 -30.775 -12.219 -3.839 1173 HA HIS 158 HA HIS 158 -30.474 -13.086 -1.202 1174 HD1 HIS 158 HD1 HIS 158 -29.572 -16.386 -4.072 1175 HD2 HIS 158 HD2 HIS 158 -33.486 -14.995 -3.912 1176 HE1 HIS 158 HE1 HIS 158 -30.662 -17.180 -6.193 1177 HE2 HIS 158 HE2 HIS 158 -33.081 -16.505 -5.973 1178 HB2 HIS 158 1HB HIS 158 -30.339 -15.580 -1.725 1179 HB3 HIS 158 2HB HIS 158 -31.955 -14.905 -1.585 Start of MODEL 12 1 HA MET 1 HA MET 1 25.092 -11.380 -24.617 2 H1 MET 1 1H MET 1 23.295 -9.140 -23.892 3 H2 MET 1 2H MET 1 23.011 -10.320 -25.075 4 H3 MET 1 3H MET 1 24.264 -9.196 -25.284 5 HB2 MET 1 1HB MET 1 25.413 -9.097 -22.670 6 HB3 MET 1 2HB MET 1 26.338 -10.584 -22.538 7 HG2 MET 1 1HG MET 1 27.276 -10.189 -24.760 8 HG3 MET 1 2HG MET 1 26.362 -8.687 -24.872 9 HE1 MET 1 3HE MET 1 26.564 -7.675 -21.836 10 HE2 MET 1 1HE MET 1 26.761 -6.600 -23.220 11 HE3 MET 1 2HE MET 1 27.965 -6.607 -21.932 12 H LYS 2 H LYS 2 25.611 -12.543 -22.444 13 HA LYS 2 HA LYS 2 23.073 -13.030 -21.041 14 HB2 LYS 2 1HB LYS 2 24.279 -14.974 -22.070 15 HB3 LYS 2 2HB LYS 2 25.627 -14.656 -20.986 16 HG2 LYS 2 1HG LYS 2 23.972 -14.952 -19.082 17 HG3 LYS 2 2HG LYS 2 22.866 -15.604 -20.294 18 HD2 LYS 2 1HD LYS 2 24.645 -17.248 -20.914 19 HD3 LYS 2 2HD LYS 2 25.585 -16.664 -19.541 20 HE2 LYS 2 1HE LYS 2 22.875 -17.980 -19.458 21 HE3 LYS 2 2HE LYS 2 24.402 -18.669 -18.912 22 HZ1 LYS 2 3HZ LYS 2 24.506 -16.852 -17.247 23 HZ2 LYS 2 1HZ LYS 2 23.193 -17.903 -17.027 24 HZ3 LYS 2 2HZ LYS 2 22.945 -16.375 -17.715 25 H LEU 3 H LEU 3 22.846 -12.346 -18.978 26 HA LEU 3 HA LEU 3 24.940 -10.893 -17.698 27 HG LEU 3 HG LEU 3 21.948 -10.250 -18.393 28 HB2 LEU 3 1HB LEU 3 22.309 -11.895 -16.601 29 HB3 LEU 3 2HB LEU 3 23.378 -10.771 -15.784 30 HD11 LEU 3 1HD1 LEU 3 20.433 -10.284 -16.490 31 HD12 LEU 3 2HD1 LEU 3 20.648 -8.640 -17.091 32 HD13 LEU 3 3HD1 LEU 3 21.477 -9.157 -15.623 33 HD21 LEU 3 3HD2 LEU 3 22.772 -7.965 -18.149 34 HD22 LEU 3 1HD2 LEU 3 24.106 -9.111 -18.278 35 HD23 LEU 3 2HD2 LEU 3 23.671 -8.437 -16.707 36 H HIS 4 H HIS 4 26.398 -11.557 -16.224 37 HA HIS 4 HA HIS 4 26.941 -14.314 -15.913 38 HD1 HIS 4 HD1 HIS 4 30.432 -14.220 -15.649 39 HD2 HIS 4 HD2 HIS 4 28.186 -14.128 -12.147 40 HE1 HIS 4 HE1 HIS 4 31.574 -15.807 -14.062 41 HE2 HIS 4 HE2 HIS 4 30.318 -15.564 -11.885 42 HB2 HIS 4 1HB HIS 4 28.645 -12.488 -15.714 43 HB3 HIS 4 2HB HIS 4 27.923 -12.031 -14.176 44 H THR 5 H THR 5 25.631 -11.904 -13.695 45 HA THR 5 HA THR 5 23.810 -13.836 -12.578 46 HB THR 5 HB THR 5 25.866 -12.483 -10.805 47 HG1 THR 5 HG1 THR 5 25.697 -14.957 -11.946 48 HG21 THR 5 3HG2 THR 5 23.666 -12.455 -9.748 49 HG22 THR 5 1HG2 THR 5 24.727 -13.608 -8.940 50 HG23 THR 5 2HG2 THR 5 23.483 -14.183 -10.052 51 H ASP 6 H ASP 6 21.948 -12.751 -12.677 52 HA ASP 6 HA ASP 6 21.929 -9.880 -12.801 53 HB2 ASP 6 1HB ASP 6 19.458 -10.155 -13.047 54 HB3 ASP 6 2HB ASP 6 20.395 -11.055 -14.233 55 HA PRO 7 HA PRO 7 21.111 -9.429 -8.446 56 HB2 PRO 7 1HB PRO 7 21.571 -6.803 -8.314 57 HB3 PRO 7 2HB PRO 7 22.890 -7.945 -8.595 58 HG2 PRO 7 1HG PRO 7 21.521 -6.126 -10.508 59 HG3 PRO 7 2HG PRO 7 23.210 -6.659 -10.473 60 HD2 PRO 7 1HD PRO 7 21.144 -7.710 -12.083 61 HD3 PRO 7 2HD PRO 7 22.758 -8.402 -11.844 62 H ALA 8 H ALA 8 19.794 -7.702 -7.154 63 HA ALA 8 HA ALA 8 17.171 -7.509 -8.410 64 HB1 ALA 8 3HB ALA 8 17.332 -8.403 -6.133 65 HB2 ALA 8 1HB ALA 8 16.361 -6.932 -6.186 66 HB3 ALA 8 2HB ALA 8 18.017 -6.873 -5.583 67 H THR 9 H THR 9 16.271 -5.681 -9.103 68 HA THR 9 HA THR 9 17.836 -3.285 -9.253 69 HB THR 9 HB THR 9 14.921 -3.639 -9.982 70 HG1 THR 9 HG1 THR 9 16.313 -5.189 -11.038 71 HG21 THR 9 3HG2 THR 9 15.370 -1.823 -11.570 72 HG22 THR 9 1HG2 THR 9 17.028 -1.716 -10.981 73 HG23 THR 9 2HG2 THR 9 15.685 -1.314 -9.911 74 H ALA 10 H ALA 10 17.831 -1.608 -7.899 75 HA ALA 10 HA ALA 10 16.382 -1.697 -5.452 76 HB1 ALA 10 3HB ALA 10 18.612 -0.709 -5.632 77 HB2 ALA 10 1HB ALA 10 17.448 0.436 -4.965 78 HB3 ALA 10 2HB ALA 10 17.959 0.578 -6.646 79 H LEU 11 H LEU 11 15.499 -0.631 -8.518 80 HA LEU 11 HA LEU 11 13.384 1.078 -7.402 81 HG LEU 11 HG LEU 11 15.994 2.175 -8.792 82 HB2 LEU 11 1HB LEU 11 14.434 0.952 -10.231 83 HB3 LEU 11 2HB LEU 11 13.117 1.973 -9.687 84 HD11 LEU 11 1HD1 LEU 11 14.329 3.983 -10.540 85 HD12 LEU 11 2HD1 LEU 11 15.644 2.941 -11.081 86 HD13 LEU 11 3HD1 LEU 11 15.980 4.296 -10.003 87 HD21 LEU 11 3HD2 LEU 11 13.615 3.897 -8.098 88 HD22 LEU 11 1HD2 LEU 11 15.287 4.194 -7.622 89 HD23 LEU 11 2HD2 LEU 11 14.434 2.778 -7.008 90 H ASN 12 H ASN 12 12.454 -1.036 -6.791 91 HA ASN 12 HA ASN 12 11.457 -2.859 -8.695 92 HB2 ASN 12 1HB ASN 12 11.676 -3.435 -6.332 93 HB3 ASN 12 2HB ASN 12 10.482 -2.216 -5.900 94 HD21 ASN 12 2HD2 ASN 12 9.153 -3.691 -4.929 95 HD22 ASN 12 1HD2 ASN 12 8.227 -4.846 -5.822 96 H THR 13 H THR 13 10.127 -2.287 -10.290 97 HA THR 13 HA THR 13 7.851 -0.529 -9.673 98 HB THR 13 HB THR 13 9.412 -0.353 -12.254 99 HG1 THR 13 HG1 THR 13 10.659 0.247 -10.308 100 HG21 THR 13 3HG2 THR 13 7.123 0.507 -12.320 101 HG22 THR 13 1HG2 THR 13 8.290 1.823 -12.445 102 HG23 THR 13 2HG2 THR 13 7.455 1.526 -10.920 103 H VAL 14 H VAL 14 5.983 -0.888 -10.927 104 HA VAL 14 HA VAL 14 5.582 -3.553 -11.865 105 HB VAL 14 HB VAL 14 3.792 -1.137 -12.215 106 HG11 VAL 14 1HG1 VAL 14 3.168 -4.084 -12.355 107 HG12 VAL 14 2HG1 VAL 14 3.214 -2.963 -13.715 108 HG13 VAL 14 3HG1 VAL 14 1.990 -2.776 -12.459 109 HG21 VAL 14 3HG2 VAL 14 3.840 -3.209 -10.023 110 HG22 VAL 14 1HG2 VAL 14 2.606 -1.964 -10.228 111 HG23 VAL 14 2HG2 VAL 14 4.271 -1.506 -9.866 112 H THR 15 H THR 15 5.778 -4.345 -13.884 113 HA THR 15 HA THR 15 6.796 -2.588 -15.940 114 HB THR 15 HB THR 15 6.956 -4.789 -17.244 115 HG1 THR 15 HG1 THR 15 5.855 -6.331 -16.276 116 HG21 THR 15 3HG2 THR 15 8.461 -4.501 -14.642 117 HG22 THR 15 1HG2 THR 15 8.881 -3.733 -16.173 118 HG23 THR 15 2HG2 THR 15 8.962 -5.488 -16.015 119 H ALA 16 H ALA 16 3.878 -4.453 -15.301 120 HA ALA 16 HA ALA 16 2.529 -2.937 -17.405 121 HB1 ALA 16 3HB ALA 16 2.355 -5.946 -17.225 122 HB2 ALA 16 1HB ALA 16 3.194 -5.039 -18.484 123 HB3 ALA 16 2HB ALA 16 1.442 -4.915 -18.326 124 H TYR 17 H TYR 17 0.938 -1.940 -16.341 125 HA TYR 17 HA TYR 17 -0.021 -2.852 -13.826 126 HD1 TYR 17 HD1 TYR 17 -0.370 -0.775 -12.013 127 HD2 TYR 17 HD2 TYR 17 -3.470 -0.718 -14.923 128 HE1 TYR 17 HE1 TYR 17 -2.018 -0.362 -10.237 129 HE2 TYR 17 HE2 TYR 17 -5.129 -0.302 -13.157 130 HH TYR 17 HH TYR 17 -5.354 -0.664 -10.727 131 HB2 TYR 17 1HB TYR 17 0.092 -0.450 -14.463 132 HB3 TYR 17 2HB TYR 17 -1.209 -0.722 -15.618 133 H GLY 18 H GLY 18 -1.303 -2.941 -17.112 134 HA2 GLY 18 1HA GLY 18 -2.901 -4.290 -18.058 135 HA3 GLY 18 2HA GLY 18 -2.836 -5.266 -16.599 136 H ASP 19 H ASP 19 -5.184 -5.453 -17.075 137 HA ASP 19 HA ASP 19 -6.698 -3.152 -16.100 138 HB2 ASP 19 1HB ASP 19 -7.488 -5.613 -17.649 139 HB3 ASP 19 2HB ASP 19 -8.665 -4.548 -16.909 140 H GLY 20 H GLY 20 -7.278 -6.629 -15.926 141 HA2 GLY 20 1HA GLY 20 -7.755 -6.344 -13.033 142 HA3 GLY 20 2HA GLY 20 -8.471 -7.584 -14.055 143 H TYR 21 H TYR 21 -5.139 -6.595 -14.198 144 HA TYR 21 HA TYR 21 -4.116 -8.767 -12.649 145 HD1 TYR 21 HD2 TYR 21 -6.107 -8.896 -16.206 146 HD2 TYR 21 HD1 TYR 21 -1.861 -8.661 -16.369 147 HE1 TYR 21 HE2 TYR 21 -6.249 -8.005 -18.490 148 HE2 TYR 21 HE1 TYR 21 -1.994 -7.768 -18.655 149 HH TYR 21 HH TYR 21 -3.348 -7.419 -20.425 150 HB2 TYR 21 1HB TYR 21 -2.943 -9.867 -14.591 151 HB3 TYR 21 2HB TYR 21 -4.686 -10.099 -14.578 152 H ILE 22 H ILE 22 -2.365 -7.907 -11.744 153 HA ILE 22 HA ILE 22 -0.953 -5.773 -13.187 154 HB ILE 22 HB ILE 22 -0.731 -6.538 -10.266 155 HG12 ILE 22 1HG1 ILE 22 -2.213 -4.248 -11.584 156 HG13 ILE 22 2HG1 ILE 22 -2.957 -5.645 -10.814 157 HG21 ILE 22 1HG2 ILE 22 0.330 -4.150 -11.775 158 HG22 ILE 22 2HG2 ILE 22 1.287 -5.480 -11.122 159 HG23 ILE 22 3HG2 ILE 22 0.431 -4.389 -10.031 160 HD11 ILE 22 3HD1 ILE 22 -1.278 -3.565 -9.431 161 HD12 ILE 22 1HD1 ILE 22 -2.052 -4.953 -8.666 162 HD13 ILE 22 2HD1 ILE 22 -3.037 -3.680 -9.387 163 H GLU 23 H GLU 23 0.716 -6.464 -14.342 164 HA GLU 23 HA GLU 23 2.110 -8.891 -13.483 165 HB2 GLU 23 1HB GLU 23 1.204 -8.764 -15.808 166 HB3 GLU 23 2HB GLU 23 2.319 -7.441 -16.127 167 HG2 GLU 23 1HG GLU 23 4.207 -8.925 -15.667 168 HG3 GLU 23 2HG GLU 23 3.085 -10.251 -15.364 169 H VAL 24 H VAL 24 3.811 -8.579 -12.261 170 HA VAL 24 HA VAL 24 5.566 -6.276 -12.823 171 HB VAL 24 HB VAL 24 5.367 -7.831 -10.234 172 HG11 VAL 24 1HG1 VAL 24 6.802 -5.262 -10.897 173 HG12 VAL 24 2HG1 VAL 24 7.556 -6.830 -10.608 174 HG13 VAL 24 3HG1 VAL 24 6.705 -6.007 -9.302 175 HG21 VAL 24 3HG2 VAL 24 4.243 -5.114 -10.915 176 HG22 VAL 24 1HG2 VAL 24 4.238 -5.860 -9.316 177 HG23 VAL 24 2HG2 VAL 24 3.310 -6.583 -10.630 178 H ASN 25 H ASN 25 7.201 -6.936 -14.052 179 HA ASN 25 HA ASN 25 9.042 -8.057 -14.776 180 HB2 ASN 25 1HB ASN 25 8.969 -9.281 -12.007 181 HB3 ASN 25 2HB ASN 25 10.310 -9.432 -13.138 182 HD21 ASN 25 2HD2 ASN 25 10.154 -8.237 -10.458 183 HD22 ASN 25 1HD2 ASN 25 10.720 -6.615 -10.644 184 H GLN 26 H GLN 26 6.612 -9.045 -15.551 185 HA GLN 26 HA GLN 26 5.752 -10.772 -16.731 186 HB2 GLN 26 1HB GLN 26 8.373 -12.118 -16.069 187 HB3 GLN 26 2HB GLN 26 7.160 -12.795 -17.147 188 HG2 GLN 26 1HG GLN 26 7.400 -10.908 -18.648 189 HG3 GLN 26 2HG GLN 26 8.561 -10.163 -17.550 190 HE21 GLN 26 2HE2 GLN 26 8.854 -10.973 -20.340 191 HE22 GLN 26 1HE2 GLN 26 10.198 -12.068 -20.379 192 H VAL 27 H VAL 27 5.913 -10.633 -13.576 193 HA VAL 27 HA VAL 27 4.601 -13.233 -13.172 194 HB VAL 27 HB VAL 27 5.479 -11.245 -11.066 195 HG11 VAL 27 1HG1 VAL 27 5.084 -13.099 -9.501 196 HG12 VAL 27 2HG1 VAL 27 4.470 -14.079 -10.834 197 HG13 VAL 27 3HG1 VAL 27 3.610 -12.618 -10.344 198 HG21 VAL 27 3HG2 VAL 27 7.400 -12.208 -12.220 199 HG22 VAL 27 1HG2 VAL 27 6.770 -13.830 -11.934 200 HG23 VAL 27 2HG2 VAL 27 7.280 -12.829 -10.573 201 H ARG 28 H ARG 28 2.481 -13.206 -13.384 202 HA ARG 28 HA ARG 28 1.102 -10.647 -13.438 203 HE ARG 28 HE ARG 28 1.279 -11.796 -17.631 204 HB2 ARG 28 1HB ARG 28 0.977 -12.981 -14.956 205 HB3 ARG 28 2HB ARG 28 -0.516 -12.980 -14.028 206 HG2 ARG 28 1HG ARG 28 -1.260 -10.997 -14.991 207 HG3 ARG 28 2HG ARG 28 0.356 -10.555 -15.552 208 HD2 ARG 28 1HD ARG 28 -1.259 -12.891 -16.570 209 HD3 ARG 28 2HD ARG 28 -1.109 -11.332 -17.382 210 HH11 ARG 28 1HH1 ARG 28 -0.799 -14.518 -16.820 211 HH12 ARG 28 2HH1 ARG 28 0.281 -15.697 -17.514 212 HH21 ARG 28 1HH2 ARG 28 2.696 -13.374 -18.520 213 HH22 ARG 28 2HH2 ARG 28 2.248 -15.054 -18.460 214 H PHE 29 H PHE 29 0.236 -9.931 -11.612 215 HA PHE 29 HA PHE 29 -0.782 -11.848 -9.649 216 HD1 PHE 29 HD1 PHE 29 0.660 -11.828 -7.396 217 HD2 PHE 29 HD2 PHE 29 1.974 -8.563 -9.789 218 HE1 PHE 29 HE1 PHE 29 2.987 -12.298 -6.752 219 HE2 PHE 29 HE2 PHE 29 4.304 -9.029 -9.152 220 HZ PHE 29 HZ PHE 29 4.814 -10.899 -7.631 221 HB2 PHE 29 1HB PHE 29 -0.297 -8.870 -9.421 222 HB3 PHE 29 2HB PHE 29 -0.862 -9.908 -8.117 223 H SER 30 H SER 30 -2.857 -12.332 -9.701 224 HA SER 30 HA SER 30 -4.748 -10.518 -10.993 225 HG SER 30 HG SER 30 -5.203 -12.633 -12.669 226 HB2 SER 30 1HB SER 30 -5.085 -13.349 -9.971 227 HB3 SER 30 2HB SER 30 -6.310 -12.430 -10.847 228 H HIS 31 H HIS 31 -3.512 -10.443 -8.106 229 HA HIS 31 HA HIS 31 -5.962 -9.542 -6.854 230 HD1 HIS 31 HD1 HIS 31 -3.940 -11.442 -3.236 231 HD2 HIS 31 HD2 HIS 31 -3.084 -12.837 -7.058 232 HE1 HIS 31 HE1 HIS 31 -1.817 -12.765 -3.012 233 HE2 HIS 31 HE2 HIS 31 -1.476 -13.815 -5.280 234 HB2 HIS 31 1HB HIS 31 -5.711 -10.861 -4.837 235 HB3 HIS 31 2HB HIS 31 -5.828 -11.935 -6.223 236 H ALA 32 H ALA 32 -5.211 -8.896 -4.404 237 HA ALA 32 HA ALA 32 -3.751 -6.553 -4.851 238 HB1 ALA 32 3HB ALA 32 -3.937 -6.163 -2.478 239 HB2 ALA 32 1HB ALA 32 -4.349 -7.857 -2.206 240 HB3 ALA 32 2HB ALA 32 -5.453 -6.814 -3.103 241 H ILE 33 H ILE 33 -1.762 -5.849 -4.236 242 HA ILE 33 HA ILE 33 0.159 -7.737 -3.090 243 HB ILE 33 HB ILE 33 1.869 -7.008 -4.806 244 HG12 ILE 33 1HG1 ILE 33 -0.605 -6.248 -6.377 245 HG13 ILE 33 2HG1 ILE 33 0.568 -5.111 -5.722 246 HG21 ILE 33 1HG2 ILE 33 0.962 -9.250 -4.788 247 HG22 ILE 33 2HG2 ILE 33 1.177 -8.698 -6.450 248 HG23 ILE 33 3HG2 ILE 33 -0.433 -8.718 -5.727 249 HD11 ILE 33 3HD1 ILE 33 2.290 -6.047 -7.163 250 HD12 ILE 33 1HD1 ILE 33 0.906 -5.480 -8.098 251 HD13 ILE 33 2HD1 ILE 33 1.127 -7.206 -7.809 252 H ALA 34 H ALA 34 1.881 -6.762 -2.054 253 HA ALA 34 HA ALA 34 1.889 -3.817 -1.968 254 HB1 ALA 34 3HB ALA 34 0.840 -4.672 0.071 255 HB2 ALA 34 1HB ALA 34 2.395 -3.922 0.427 256 HB3 ALA 34 2HB ALA 34 2.253 -5.680 0.384 257 H PHE 35 H PHE 35 3.881 -2.917 -2.233 258 HA PHE 35 HA PHE 35 6.268 -4.470 -1.760 259 HD1 PHE 35 HD1 PHE 35 3.496 -4.567 -4.781 260 HD2 PHE 35 HD2 PHE 35 7.054 -2.310 -5.374 261 HE1 PHE 35 HE1 PHE 35 2.379 -3.276 -6.551 262 HE2 PHE 35 HE2 PHE 35 5.942 -1.013 -7.142 263 HZ PHE 35 HZ PHE 35 3.601 -1.495 -7.733 264 HB2 PHE 35 1HB PHE 35 7.094 -4.307 -4.090 265 HB3 PHE 35 2HB PHE 35 5.677 -5.338 -3.941 266 H ALA 36 H ALA 36 8.221 -3.287 -2.076 267 HA ALA 36 HA ALA 36 7.911 -0.369 -2.239 268 HB1 ALA 36 3HB ALA 36 9.484 -0.101 -0.393 269 HB2 ALA 36 1HB ALA 36 9.607 -1.853 -0.224 270 HB3 ALA 36 2HB ALA 36 8.085 -1.037 0.127 271 HA PRO 37 HA PRO 37 11.447 -0.360 -4.983 272 HB2 PRO 37 1HB PRO 37 12.774 1.525 -3.095 273 HB3 PRO 37 2HB PRO 37 12.491 1.688 -4.832 274 HG2 PRO 37 1HG PRO 37 11.024 3.057 -3.080 275 HG3 PRO 37 2HG PRO 37 10.294 2.372 -4.545 276 HD2 PRO 37 1HD PRO 37 10.139 1.416 -1.720 277 HD3 PRO 37 2HD PRO 37 8.901 1.386 -2.993 278 H GLU 38 H GLU 38 12.371 -0.155 -1.562 279 HA GLU 38 HA GLU 38 14.121 -2.474 -1.988 280 HB2 GLU 38 1HB GLU 38 15.452 -0.529 -1.357 281 HB3 GLU 38 2HB GLU 38 14.416 -0.241 0.035 282 HG2 GLU 38 1HG GLU 38 15.149 -2.301 1.057 283 HG3 GLU 38 2HG GLU 38 16.105 -2.700 -0.370 284 H GLY 39 H GLY 39 12.683 -4.047 -1.531 285 HA2 GLY 39 1HA GLY 39 12.208 -4.846 1.066 286 HA3 GLY 39 2HA GLY 39 10.793 -3.913 0.591 287 HA PRO 40 HA PRO 40 10.432 -8.241 -1.099 288 HB2 PRO 40 1HB PRO 40 8.666 -9.329 0.599 289 HB3 PRO 40 2HB PRO 40 10.393 -9.266 0.972 290 HG2 PRO 40 1HG PRO 40 8.167 -7.585 2.015 291 HG3 PRO 40 2HG PRO 40 9.624 -8.162 2.839 292 HD2 PRO 40 1HD PRO 40 9.256 -5.611 1.752 293 HD3 PRO 40 2HD PRO 40 10.809 -6.328 2.221 294 H VAL 41 H VAL 41 8.996 -8.634 -2.689 295 HA VAL 41 HA VAL 41 6.582 -7.070 -2.918 296 HB VAL 41 HB VAL 41 7.452 -9.409 -4.633 297 HG11 VAL 41 1HG1 VAL 41 5.991 -8.400 -6.321 298 HG12 VAL 41 2HG1 VAL 41 5.517 -7.157 -5.163 299 HG13 VAL 41 3HG1 VAL 41 5.099 -8.844 -4.866 300 HG21 VAL 41 3HG2 VAL 41 7.996 -6.467 -5.012 301 HG22 VAL 41 1HG2 VAL 41 8.344 -7.734 -6.189 302 HG23 VAL 41 2HG2 VAL 41 9.190 -7.713 -4.641 303 H ALA 42 H ALA 42 4.962 -7.600 -1.568 304 HA ALA 42 HA ALA 42 4.702 -10.407 -0.771 305 HB1 ALA 42 3HB ALA 42 5.038 -8.784 1.028 306 HB2 ALA 42 1HB ALA 42 3.469 -9.578 1.155 307 HB3 ALA 42 2HB ALA 42 3.576 -7.931 0.531 308 H SER 43 H SER 43 3.183 -11.568 -1.698 309 HA SER 43 HA SER 43 0.930 -10.521 -3.043 310 HG SER 43 HG SER 43 1.691 -13.502 -1.022 311 HB2 SER 43 1HB SER 43 0.128 -13.007 -2.597 312 HB3 SER 43 2HB SER 43 1.433 -12.677 -3.736 313 H TRP 44 H TRP 44 -0.902 -9.713 -2.197 314 HA TRP 44 HA TRP 44 -1.100 -9.791 0.724 315 HD1 TRP 44 HD1 TRP 44 -0.896 -8.550 2.324 316 HE1 TRP 44 HE1 TRP 44 -1.671 -6.793 4.038 317 HE3 TRP 44 HE3 TRP 44 -3.695 -5.586 -0.759 318 HZ2 TRP 44 HZ2 TRP 44 -3.253 -4.455 4.076 319 HZ3 TRP 44 HZ3 TRP 44 -4.800 -3.605 0.193 320 HH2 TRP 44 HH2 TRP 44 -4.583 -3.053 2.561 321 HB2 TRP 44 1HB TRP 44 -1.035 -7.660 -0.876 322 HB3 TRP 44 2HB TRP 44 -2.764 -7.970 -0.962 323 HA PRO 45 HA PRO 45 -4.506 -12.612 0.310 324 HB2 PRO 45 1HB PRO 45 -5.047 -12.006 3.130 325 HB3 PRO 45 2HB PRO 45 -4.544 -13.526 2.387 326 HG2 PRO 45 1HG PRO 45 -2.888 -12.089 3.941 327 HG3 PRO 45 2HG PRO 45 -2.301 -13.017 2.549 328 HD2 PRO 45 1HD PRO 45 -2.841 -10.077 2.773 329 HD3 PRO 45 2HD PRO 45 -1.473 -10.915 2.008 330 H VAL 46 H VAL 46 -4.767 -9.361 0.590 331 HA VAL 46 HA VAL 46 -7.574 -9.229 1.296 332 HB VAL 46 HB VAL 46 -5.643 -7.087 0.377 333 HG11 VAL 46 1HG1 VAL 46 -8.479 -6.803 1.363 334 HG12 VAL 46 2HG1 VAL 46 -7.908 -6.488 -0.274 335 HG13 VAL 46 3HG1 VAL 46 -7.362 -5.475 1.062 336 HG21 VAL 46 3HG2 VAL 46 -5.147 -7.984 2.582 337 HG22 VAL 46 1HG2 VAL 46 -6.811 -7.690 3.086 338 HG23 VAL 46 2HG2 VAL 46 -5.754 -6.332 2.699 339 H GLN 47 H GLN 47 -9.224 -9.102 -0.108 340 HA GLN 47 HA GLN 47 -8.563 -9.122 -2.973 341 HB2 GLN 47 1HB GLN 47 -9.733 -11.113 -2.340 342 HB3 GLN 47 2HB GLN 47 -10.929 -10.197 -1.437 343 HG2 GLN 47 1HG GLN 47 -11.873 -11.003 -3.502 344 HG3 GLN 47 2HG GLN 47 -11.775 -9.245 -3.523 345 HE21 GLN 47 2HE2 GLN 47 -11.845 -9.130 -5.733 346 HE22 GLN 47 1HE2 GLN 47 -10.509 -9.604 -6.732 347 H ARG 48 H ARG 48 -10.646 -7.686 -0.523 348 HA ARG 48 HA ARG 48 -11.363 -5.578 -2.449 349 HE ARG 48 HE ARG 48 -14.493 -9.144 -4.102 350 HB2 ARG 48 1HB ARG 48 -13.212 -6.938 -0.472 351 HB3 ARG 48 2HB ARG 48 -13.645 -5.574 -1.500 352 HG2 ARG 48 1HG ARG 48 -13.492 -6.853 -3.456 353 HG3 ARG 48 2HG ARG 48 -12.622 -8.150 -2.640 354 HD2 ARG 48 1HD ARG 48 -14.719 -8.494 -1.259 355 HD3 ARG 48 2HD ARG 48 -15.528 -7.423 -2.409 356 HH11 ARG 48 1HH1 ARG 48 -16.065 -9.786 -1.028 357 HH12 ARG 48 2HH1 ARG 48 -16.530 -11.409 -1.462 358 HH21 ARG 48 1HH2 ARG 48 -15.106 -11.273 -4.666 359 HH22 ARG 48 2HH2 ARG 48 -15.985 -12.248 -3.527 360 HA PRO 49 HA PRO 49 -10.124 -2.629 0.555 361 HB2 PRO 49 1HB PRO 49 -12.582 -1.073 0.042 362 HB3 PRO 49 2HB PRO 49 -10.893 -0.623 -0.205 363 HG2 PRO 49 1HG PRO 49 -12.499 -1.161 -2.273 364 HG3 PRO 49 2HG PRO 49 -10.789 -1.632 -2.283 365 HD2 PRO 49 1HD PRO 49 -13.215 -3.312 -1.762 366 HD3 PRO 49 2HD PRO 49 -11.757 -3.699 -2.701 367 H ALA 50 H ALA 50 -12.825 -4.484 1.036 368 HA ALA 50 HA ALA 50 -13.705 -3.197 3.493 369 HB1 ALA 50 3HB ALA 50 -14.643 -5.744 2.177 370 HB2 ALA 50 1HB ALA 50 -15.373 -4.151 1.976 371 HB3 ALA 50 2HB ALA 50 -15.403 -4.943 3.552 372 H ASP 51 H ASP 51 -11.443 -5.539 2.496 373 HA ASP 51 HA ASP 51 -11.598 -7.123 4.931 374 HB2 ASP 51 1HB ASP 51 -9.603 -7.332 2.667 375 HB3 ASP 51 2HB ASP 51 -9.887 -8.523 3.927 376 H ILE 52 H ILE 52 -10.016 -4.357 3.859 377 HA ILE 52 HA ILE 52 -7.431 -4.659 4.891 378 HB ILE 52 HB ILE 52 -9.006 -2.109 4.542 379 HG12 ILE 52 1HG1 ILE 52 -7.103 -3.515 2.653 380 HG13 ILE 52 2HG1 ILE 52 -8.853 -3.455 2.478 381 HG21 ILE 52 1HG2 ILE 52 -6.033 -2.562 4.764 382 HG22 ILE 52 2HG2 ILE 52 -7.066 -1.775 5.959 383 HG23 ILE 52 3HG2 ILE 52 -6.809 -1.023 4.384 384 HD11 ILE 52 3HD1 ILE 52 -6.988 -1.095 2.379 385 HD12 ILE 52 1HD1 ILE 52 -8.741 -1.035 2.199 386 HD13 ILE 52 2HD1 ILE 52 -7.759 -1.874 0.998 387 H THR 53 H THR 53 -6.891 -5.028 6.918 388 HA THR 53 HA THR 53 -8.235 -3.512 9.053 389 HB THR 53 HB THR 53 -7.611 -5.447 10.563 390 HG1 THR 53 HG1 THR 53 -7.605 -7.232 8.477 391 HG21 THR 53 3HG2 THR 53 -9.909 -5.124 9.803 392 HG22 THR 53 1HG2 THR 53 -9.514 -6.840 9.897 393 HG23 THR 53 2HG2 THR 53 -9.560 -6.029 8.330 394 H ALA 54 H ALA 54 -6.753 -3.543 11.095 395 HA ALA 54 HA ALA 54 -4.467 -2.052 10.521 396 HB1 ALA 54 3HB ALA 54 -3.968 -2.206 12.896 397 HB2 ALA 54 1HB ALA 54 -5.121 -3.529 13.066 398 HB3 ALA 54 2HB ALA 54 -5.688 -1.915 12.638 399 H SER 55 H SER 55 -4.810 -5.472 11.375 400 HA SER 55 HA SER 55 -2.101 -6.108 11.642 401 HG SER 55 HG SER 55 -4.972 -8.286 12.567 402 HB2 SER 55 1HB SER 55 -4.129 -8.025 10.515 403 HB3 SER 55 2HB SER 55 -2.797 -8.352 11.625 404 H LEU 56 H LEU 56 -4.227 -6.086 8.833 405 HA LEU 56 HA LEU 56 -2.343 -7.271 7.059 406 HG LEU 56 HG LEU 56 -5.311 -7.754 7.733 407 HB2 LEU 56 1HB LEU 56 -4.832 -5.668 6.476 408 HB3 LEU 56 2HB LEU 56 -3.936 -6.611 5.300 409 HD11 LEU 56 1HD1 LEU 56 -6.902 -6.874 6.089 410 HD12 LEU 56 2HD1 LEU 56 -6.950 -8.636 6.181 411 HD13 LEU 56 3HD1 LEU 56 -6.126 -7.845 4.838 412 HD21 LEU 56 3HD2 LEU 56 -4.007 -9.104 5.372 413 HD22 LEU 56 1HD2 LEU 56 -4.873 -9.913 6.678 414 HD23 LEU 56 2HD2 LEU 56 -3.372 -9.052 7.016 415 H LEU 57 H LEU 57 -3.087 -4.008 8.036 416 HA LEU 57 HA LEU 57 -1.675 -2.667 5.983 417 HG LEU 57 HG LEU 57 -4.304 -2.046 7.314 418 HB2 LEU 57 1HB LEU 57 -2.330 -1.843 8.810 419 HB3 LEU 57 2HB LEU 57 -1.582 -0.776 7.637 420 HD11 LEU 57 1HD1 LEU 57 -3.542 0.777 8.051 421 HD12 LEU 57 2HD1 LEU 57 -4.282 -0.412 9.124 422 HD13 LEU 57 3HD1 LEU 57 -5.176 0.195 7.729 423 HD21 LEU 57 3HD2 LEU 57 -3.191 -1.598 5.187 424 HD22 LEU 57 1HD2 LEU 57 -2.877 0.062 5.691 425 HD23 LEU 57 2HD2 LEU 57 -4.535 -0.484 5.441 426 H GLN 58 H GLN 58 -0.725 -3.935 9.134 427 HA GLN 58 HA GLN 58 1.919 -2.957 9.139 428 HB2 GLN 58 1HB GLN 58 0.718 -5.406 10.443 429 HB3 GLN 58 2HB GLN 58 2.348 -4.826 10.758 430 HG2 GLN 58 1HG GLN 58 1.476 -2.755 11.646 431 HG3 GLN 58 2HG GLN 58 -0.169 -3.251 11.247 432 HE21 GLN 58 2HE2 GLN 58 1.059 -2.565 13.826 433 HE22 GLN 58 1HE2 GLN 58 0.786 -3.930 14.847 434 H GLN 59 H GLN 59 0.465 -5.888 7.834 435 HA GLN 59 HA GLN 59 2.887 -7.091 6.974 436 HB2 GLN 59 1HB GLN 59 0.075 -7.429 5.912 437 HB3 GLN 59 2HB GLN 59 1.433 -8.473 5.521 438 HG2 GLN 59 1HG GLN 59 1.611 -9.099 7.887 439 HG3 GLN 59 2HG GLN 59 0.213 -8.085 8.244 440 HE21 GLN 59 2HE2 GLN 59 0.582 -10.956 8.595 441 HE22 GLN 59 1HE2 GLN 59 -0.684 -11.712 7.696 442 H ALA 60 H ALA 60 0.517 -5.000 5.381 443 HA ALA 60 HA ALA 60 1.704 -5.054 2.817 444 HB1 ALA 60 3HB ALA 60 -0.075 -2.943 4.031 445 HB2 ALA 60 1HB ALA 60 -0.621 -4.396 3.193 446 HB3 ALA 60 2HB ALA 60 0.268 -3.153 2.314 447 H ALA 61 H ALA 61 2.373 -3.212 5.680 448 HA ALA 61 HA ALA 61 3.893 -1.167 4.371 449 HB1 ALA 61 3HB ALA 61 2.812 -0.772 6.533 450 HB2 ALA 61 1HB ALA 61 4.551 -0.492 6.621 451 HB3 ALA 61 2HB ALA 61 3.862 -1.976 7.279 452 H GLY 62 H GLY 62 4.493 -4.400 4.948 453 HA2 GLY 62 1HA GLY 62 6.390 -5.691 4.817 454 HA3 GLY 62 2HA GLY 62 7.215 -4.271 4.187 455 H LEU 63 H LEU 63 5.622 -4.135 7.243 456 HA LEU 63 HA LEU 63 7.891 -3.142 8.572 457 HG LEU 63 HG LEU 63 7.236 -3.825 11.393 458 HB2 LEU 63 1HB LEU 63 5.545 -2.662 9.190 459 HB3 LEU 63 2HB LEU 63 5.369 -4.316 9.742 460 HD11 LEU 63 1HD1 LEU 63 7.590 -1.473 11.961 461 HD12 LEU 63 2HD1 LEU 63 6.584 -0.990 10.595 462 HD13 LEU 63 3HD1 LEU 63 8.113 -1.822 10.313 463 HD21 LEU 63 3HD2 LEU 63 4.637 -2.314 11.625 464 HD22 LEU 63 1HD2 LEU 63 5.709 -2.733 12.962 465 HD23 LEU 63 2HD2 LEU 63 4.901 -4.007 12.048 466 H ALA 64 H ALA 64 6.275 -6.295 8.761 467 HA ALA 64 HA ALA 64 8.373 -7.307 10.491 468 HB1 ALA 64 3HB ALA 64 5.901 -8.683 9.448 469 HB2 ALA 64 1HB ALA 64 6.051 -7.870 11.006 470 HB3 ALA 64 2HB ALA 64 7.004 -9.314 10.670 471 H GLU 65 H GLU 65 10.058 -7.106 8.891 472 HA GLU 65 HA GLU 65 10.031 -8.845 6.601 473 HB2 GLU 65 1HB GLU 65 11.385 -6.718 6.768 474 HB3 GLU 65 2HB GLU 65 12.433 -7.551 7.907 475 HG2 GLU 65 1HG GLU 65 12.877 -9.252 6.142 476 HG3 GLU 65 2HG GLU 65 11.974 -8.242 5.017 477 H VAL 66 H VAL 66 12.108 -8.789 9.499 478 HA VAL 66 HA VAL 66 12.531 -11.652 9.283 479 HB VAL 66 HB VAL 66 13.544 -9.759 11.416 480 HG11 VAL 66 1HG1 VAL 66 14.439 -12.527 10.621 481 HG12 VAL 66 2HG1 VAL 66 13.576 -12.093 12.095 482 HG13 VAL 66 3HG1 VAL 66 15.216 -11.504 11.829 483 HG21 VAL 66 3HG2 VAL 66 14.900 -10.675 8.880 484 HG22 VAL 66 1HG2 VAL 66 15.661 -9.746 10.172 485 HG23 VAL 66 2HG2 VAL 66 14.343 -9.040 9.238 486 H VAL 67 H VAL 67 10.634 -12.646 9.804 487 HA VAL 67 HA VAL 67 9.149 -11.801 12.150 488 HB VAL 67 HB VAL 67 8.579 -14.090 10.257 489 HG11 VAL 67 1HG1 VAL 67 6.833 -12.757 12.328 490 HG12 VAL 67 2HG1 VAL 67 7.510 -14.382 12.423 491 HG13 VAL 67 3HG1 VAL 67 6.310 -13.998 11.188 492 HG21 VAL 67 3HG2 VAL 67 8.545 -11.953 9.089 493 HG22 VAL 67 1HG2 VAL 67 7.455 -11.289 10.307 494 HG23 VAL 67 2HG2 VAL 67 6.912 -12.597 9.255 495 H ARG 68 H ARG 68 10.071 -12.398 14.009 496 HA ARG 68 HA ARG 68 10.965 -15.181 14.291 497 HE ARG 68 HE ARG 68 15.413 -12.618 13.952 498 HB2 ARG 68 1HB ARG 68 11.545 -12.750 15.991 499 HB3 ARG 68 2HB ARG 68 12.054 -14.382 16.395 500 HG2 ARG 68 1HG ARG 68 13.372 -14.450 14.308 501 HG3 ARG 68 2HG ARG 68 12.917 -12.771 14.002 502 HD2 ARG 68 1HD ARG 68 13.959 -12.107 16.113 503 HD3 ARG 68 2HD ARG 68 14.412 -13.781 16.418 504 HH11 ARG 68 1HH1 ARG 68 16.016 -13.462 17.295 505 HH12 ARG 68 2HH1 ARG 68 17.745 -13.300 17.157 506 HH21 ARG 68 1HH2 ARG 68 17.683 -12.417 13.753 507 HH22 ARG 68 2HH2 ARG 68 18.695 -12.701 15.147 508 H ASP 69 H ASP 69 9.818 -16.550 15.491 509 HA ASP 69 HA ASP 69 7.411 -15.710 16.795 510 HB2 ASP 69 1HB ASP 69 8.847 -18.373 16.716 511 HB3 ASP 69 2HB ASP 69 7.302 -18.122 17.521 512 HA PRO 70 HA PRO 70 8.963 -14.880 20.795 513 HB2 PRO 70 1HB PRO 70 6.757 -16.235 22.136 514 HB3 PRO 70 2HB PRO 70 7.080 -14.508 21.987 515 HG2 PRO 70 1HG PRO 70 5.021 -15.741 20.719 516 HG3 PRO 70 2HG PRO 70 5.838 -14.306 20.072 517 HD2 PRO 70 1HD PRO 70 6.172 -17.184 19.318 518 HD3 PRO 70 2HD PRO 70 6.129 -15.742 18.279 519 H LEU 71 H LEU 71 10.655 -16.658 20.276 520 HA LEU 71 HA LEU 71 10.471 -19.022 21.902 521 HG LEU 71 HG LEU 71 12.955 -19.943 19.336 522 HB2 LEU 71 1HB LEU 71 12.722 -17.702 20.409 523 HB3 LEU 71 2HB LEU 71 13.039 -19.019 21.519 524 HD11 LEU 71 1HD1 LEU 71 11.893 -21.289 21.047 525 HD12 LEU 71 2HD1 LEU 71 11.091 -21.513 19.493 526 HD13 LEU 71 3HD1 LEU 71 10.348 -20.502 20.731 527 HD21 LEU 71 3HD2 LEU 71 11.793 -18.156 18.181 528 HD22 LEU 71 1HD2 LEU 71 10.286 -18.586 18.992 529 HD23 LEU 71 2HD2 LEU 71 11.024 -19.708 17.849 530 H ALA 72 H ALA 72 12.019 -15.866 22.160 531 HA ALA 72 HA ALA 72 12.402 -16.347 25.034 532 HB1 ALA 72 3HB ALA 72 13.718 -14.284 23.263 533 HB2 ALA 72 1HB ALA 72 14.464 -15.768 23.857 534 HB3 ALA 72 2HB ALA 72 14.008 -14.495 24.990 535 H PHE 73 H PHE 73 10.085 -15.998 25.219 536 HA PHE 73 HA PHE 73 9.103 -13.334 24.649 537 HD1 PHE 73 HD1 PHE 73 8.736 -17.348 24.695 538 HD2 PHE 73 HD2 PHE 73 6.405 -15.196 27.530 539 HE1 PHE 73 HE1 PHE 73 8.487 -19.394 26.038 540 HE2 PHE 73 HE2 PHE 73 6.155 -17.236 28.880 541 HZ PHE 73 HZ PHE 73 7.195 -19.339 28.134 542 HB2 PHE 73 1HB PHE 73 6.929 -14.214 25.476 543 HB3 PHE 73 2HB PHE 73 7.603 -15.159 24.156 544 H LEU 74 H LEU 74 7.877 -12.159 26.339 545 HA LEU 74 HA LEU 74 9.548 -11.978 28.719 546 HG LEU 74 HG LEU 74 9.194 -10.114 26.141 547 HB2 LEU 74 1HB LEU 74 7.332 -10.162 27.759 548 HB3 LEU 74 2HB LEU 74 8.459 -9.822 29.057 549 HD11 LEU 74 1HD1 LEU 74 8.989 -7.669 27.892 550 HD12 LEU 74 2HD1 LEU 74 7.908 -8.095 26.565 551 HD13 LEU 74 3HD1 LEU 74 9.596 -7.703 26.236 552 HD21 LEU 74 3HD2 LEU 74 10.863 -9.277 28.511 553 HD22 LEU 74 1HD2 LEU 74 11.386 -9.301 26.827 554 HD23 LEU 74 2HD2 LEU 74 10.993 -10.811 27.650 555 H ASP 75 H ASP 75 7.879 -10.886 30.563 556 HA ASP 75 HA ASP 75 5.961 -13.035 31.136 557 HB2 ASP 75 1HB ASP 75 7.150 -10.855 32.865 558 HB3 ASP 75 2HB ASP 75 5.836 -11.891 33.406 559 H GLU 76 H GLU 76 6.260 -9.792 30.185 560 HA GLU 76 HA GLU 76 3.660 -8.877 30.932 561 HB2 GLU 76 1HB GLU 76 5.682 -7.780 28.967 562 HB3 GLU 76 2HB GLU 76 4.216 -6.948 29.455 563 HG2 GLU 76 1HG GLU 76 6.031 -6.014 30.662 564 HG3 GLU 76 2HG GLU 76 5.059 -6.953 31.789 565 HA PRO 77 HA PRO 77 1.449 -10.390 27.338 566 HB2 PRO 77 1HB PRO 77 -0.715 -8.771 27.521 567 HB3 PRO 77 2HB PRO 77 -0.470 -10.151 28.599 568 HG2 PRO 77 1HG PRO 77 0.059 -7.245 29.087 569 HG3 PRO 77 2HG PRO 77 -0.674 -8.447 30.167 570 HD2 PRO 77 1HD PRO 77 1.921 -7.663 30.367 571 HD3 PRO 77 2HD PRO 77 1.364 -9.289 30.816 572 H GLU 78 H GLU 78 2.517 -7.193 27.919 573 HA GLU 78 HA GLU 78 2.054 -6.364 25.150 574 HB2 GLU 78 1HB GLU 78 2.882 -4.835 27.621 575 HB3 GLU 78 2HB GLU 78 2.879 -4.130 26.011 576 HG2 GLU 78 1HG GLU 78 0.446 -5.325 27.308 577 HG3 GLU 78 2HG GLU 78 0.874 -3.617 27.404 578 H ALA 79 H ALA 79 3.631 -7.466 24.037 579 HA ALA 79 HA ALA 79 6.408 -7.211 24.923 580 HB1 ALA 79 3HB ALA 79 6.916 -8.819 23.161 581 HB2 ALA 79 1HB ALA 79 5.245 -8.752 22.603 582 HB3 ALA 79 2HB ALA 79 5.616 -9.415 24.193 583 H GLY 80 H GLY 80 4.330 -5.341 23.324 584 HA2 GLY 80 1HA GLY 80 6.143 -4.519 21.183 585 HA3 GLY 80 2HA GLY 80 4.484 -3.979 21.401 586 H ALA 81 H ALA 81 7.791 -3.395 22.105 587 HA ALA 81 HA ALA 81 7.147 -1.196 23.937 588 HB1 ALA 81 3HB ALA 81 9.552 -1.085 24.344 589 HB2 ALA 81 1HB ALA 81 9.829 -2.314 23.109 590 HB3 ALA 81 2HB ALA 81 8.951 -2.726 24.583 591 H GLY 82 H GLY 82 6.727 -1.344 20.920 592 HA2 GLY 82 1HA GLY 82 6.674 0.282 19.275 593 HA3 GLY 82 2HA GLY 82 7.597 1.336 20.340 594 H ALA 83 H ALA 83 8.587 -1.900 19.476 595 HA ALA 83 HA ALA 83 11.135 -0.980 18.596 596 HB1 ALA 83 3HB ALA 83 10.849 -3.121 19.759 597 HB2 ALA 83 1HB ALA 83 11.637 -3.323 18.194 598 HB3 ALA 83 2HB ALA 83 9.933 -3.739 18.382 599 H ARG 84 H ARG 84 11.117 0.194 16.784 600 HA ARG 84 HA ARG 84 10.185 -1.139 14.340 601 HE ARG 84 HE ARG 84 11.078 3.791 13.661 602 HB2 ARG 84 1HB ARG 84 9.682 1.181 13.447 603 HB3 ARG 84 2HB ARG 84 8.571 0.571 14.667 604 HG2 ARG 84 1HG ARG 84 9.332 2.034 16.284 605 HG3 ARG 84 2HG ARG 84 10.880 2.284 15.475 606 HD2 ARG 84 1HD ARG 84 8.270 3.181 14.286 607 HD3 ARG 84 2HD ARG 84 9.210 4.197 15.379 608 HH11 ARG 84 1HH1 ARG 84 7.685 4.019 12.846 609 HH12 ARG 84 2HH1 ARG 84 7.981 4.696 11.272 610 HH21 ARG 84 1HH2 ARG 84 11.465 4.682 11.605 611 HH22 ARG 84 2HH2 ARG 84 10.121 5.065 10.568 612 HA PRO 85 HA PRO 85 14.323 -0.363 12.888 613 HB2 PRO 85 1HB PRO 85 13.119 -0.211 10.197 614 HB3 PRO 85 2HB PRO 85 14.342 -1.325 10.818 615 HG2 PRO 85 1HG PRO 85 11.832 -2.130 10.319 616 HG3 PRO 85 2HG PRO 85 12.770 -2.784 11.675 617 HD2 PRO 85 1HD PRO 85 10.602 -0.721 11.683 618 HD3 PRO 85 2HD PRO 85 10.910 -2.037 12.836 619 H ALA 86 H ALA 86 15.532 1.408 12.271 620 HA ALA 86 HA ALA 86 14.304 3.949 12.440 621 HB1 ALA 86 3HB ALA 86 17.083 3.257 11.492 622 HB2 ALA 86 1HB ALA 86 16.604 3.540 13.166 623 HB3 ALA 86 2HB ALA 86 16.520 4.853 11.991 624 H ASN 87 H ASN 87 14.976 1.850 9.794 625 HA ASN 87 HA ASN 87 14.494 4.004 7.862 626 HB2 ASN 87 1HB ASN 87 15.381 2.471 6.168 627 HB3 ASN 87 2HB ASN 87 16.526 2.679 7.485 628 HD21 ASN 87 2HD2 ASN 87 16.272 0.532 5.531 629 HD22 ASN 87 1HD2 ASN 87 16.069 -0.926 6.437 630 H ALA 88 H ALA 88 12.428 2.693 9.534 631 HA ALA 88 HA ALA 88 10.869 0.970 7.904 632 HB1 ALA 88 3HB ALA 88 10.609 1.057 10.341 633 HB2 ALA 88 1HB ALA 88 9.081 1.383 9.523 634 HB3 ALA 88 2HB ALA 88 10.011 2.710 10.219 635 HA PRO 89 HA PRO 89 8.870 3.444 4.891 636 HB2 PRO 89 1HB PRO 89 6.298 2.585 6.143 637 HB3 PRO 89 2HB PRO 89 6.789 2.551 4.445 638 HG2 PRO 89 1HG PRO 89 6.787 0.324 5.898 639 HG3 PRO 89 2HG PRO 89 8.073 0.640 4.717 640 HD2 PRO 89 1HD PRO 89 8.149 0.783 7.687 641 HD3 PRO 89 2HD PRO 89 9.434 0.352 6.541 642 H GLU 90 H GLU 90 8.540 5.552 4.794 643 HA GLU 90 HA GLU 90 7.740 7.088 7.089 644 HB2 GLU 90 1HB GLU 90 8.103 7.919 4.200 645 HB3 GLU 90 2HB GLU 90 7.916 9.012 5.564 646 HG2 GLU 90 1HG GLU 90 10.020 8.319 6.479 647 HG3 GLU 90 2HG GLU 90 10.189 7.069 5.246 648 H VAL 91 H VAL 91 6.368 6.117 3.996 649 HA VAL 91 HA VAL 91 3.703 6.728 5.022 650 HB VAL 91 HB VAL 91 4.323 8.718 3.773 651 HG11 VAL 91 1HG1 VAL 91 6.016 7.798 2.313 652 HG12 VAL 91 2HG1 VAL 91 4.782 8.626 1.362 653 HG13 VAL 91 3HG1 VAL 91 4.797 6.864 1.446 654 HG21 VAL 91 3HG2 VAL 91 2.329 7.020 2.277 655 HG22 VAL 91 1HG2 VAL 91 2.479 8.772 2.151 656 HG23 VAL 91 2HG2 VAL 91 1.997 8.036 3.679 657 H LEU 92 H LEU 92 2.178 5.332 4.434 658 HA LEU 92 HA LEU 92 2.898 3.184 2.549 659 HG LEU 92 HG LEU 92 0.352 1.552 2.948 660 HB2 LEU 92 1HB LEU 92 2.460 2.492 4.894 661 HB3 LEU 92 2HB LEU 92 0.855 3.188 4.781 662 HD11 LEU 92 1HD1 LEU 92 2.632 1.082 2.253 663 HD12 LEU 92 2HD1 LEU 92 1.807 -0.400 2.733 664 HD13 LEU 92 3HD1 LEU 92 2.975 0.351 3.822 665 HD21 LEU 92 3HD2 LEU 92 1.144 0.410 5.626 666 HD22 LEU 92 1HD2 LEU 92 0.062 -0.354 4.461 667 HD23 LEU 92 2HD2 LEU 92 -0.398 1.166 5.228 668 H LEU 93 H LEU 93 1.894 3.297 0.644 669 HA LEU 93 HA LEU 93 -0.484 4.998 0.423 670 HG LEU 93 HG LEU 93 2.480 5.634 -0.473 671 HB2 LEU 93 1HB LEU 93 1.318 3.878 -1.728 672 HB3 LEU 93 2HB LEU 93 -0.037 4.958 -1.998 673 HD11 LEU 93 1HD1 LEU 93 2.850 5.467 -2.867 674 HD12 LEU 93 2HD1 LEU 93 2.914 7.150 -2.342 675 HD13 LEU 93 3HD1 LEU 93 1.481 6.537 -3.168 676 HD21 LEU 93 3HD2 LEU 93 0.097 7.343 -1.174 677 HD22 LEU 93 1HD2 LEU 93 1.592 7.913 -0.429 678 HD23 LEU 93 2HD2 LEU 93 0.544 6.793 0.441 679 H VAL 94 H VAL 94 -2.413 4.101 0.321 680 HA VAL 94 HA VAL 94 -2.620 1.294 -0.557 681 HB VAL 94 HB VAL 94 -4.591 2.891 1.095 682 HG11 VAL 94 1HG1 VAL 94 -4.532 -0.039 0.377 683 HG12 VAL 94 2HG1 VAL 94 -5.679 1.160 -0.219 684 HG13 VAL 94 3HG1 VAL 94 -5.672 0.719 1.488 685 HG21 VAL 94 3HG2 VAL 94 -2.534 2.456 2.335 686 HG22 VAL 94 1HG2 VAL 94 -2.654 0.740 1.946 687 HG23 VAL 94 2HG2 VAL 94 -3.871 1.499 2.974 688 H GLY 95 H GLY 95 -3.497 0.940 -2.488 689 HA2 GLY 95 1HA GLY 95 -4.986 3.129 -3.771 690 HA3 GLY 95 2HA GLY 95 -4.219 1.781 -4.599 691 H THR 96 H THR 96 -7.112 3.039 -3.585 692 HA THR 96 HA THR 96 -8.460 0.540 -3.056 693 HB THR 96 HB THR 96 -10.518 2.028 -3.008 694 HG1 THR 96 HG1 THR 96 -8.604 4.144 -3.013 695 HG21 THR 96 3HG2 THR 96 -9.337 1.372 -0.973 696 HG22 THR 96 1HG2 THR 96 -9.913 3.035 -0.847 697 HG23 THR 96 2HG2 THR 96 -8.211 2.714 -1.181 698 H GLY 97 H GLY 97 -9.264 3.132 -5.384 699 HA2 GLY 97 1HA GLY 97 -9.515 2.996 -7.688 700 HA3 GLY 97 2HA GLY 97 -9.113 1.290 -7.606 701 H ARG 98 H ARG 98 -10.925 -0.020 -6.399 702 HA ARG 98 HA ARG 98 -13.204 0.212 -8.085 703 HE ARG 98 HE ARG 98 -13.840 -4.666 -6.212 704 HB2 ARG 98 1HB ARG 98 -12.508 -1.622 -5.805 705 HB3 ARG 98 2HB ARG 98 -14.075 -1.700 -6.606 706 HG2 ARG 98 1HG ARG 98 -13.015 -2.160 -8.726 707 HG3 ARG 98 2HG ARG 98 -11.420 -1.962 -8.005 708 HD2 ARG 98 1HD ARG 98 -12.032 -4.322 -8.322 709 HD3 ARG 98 2HD ARG 98 -11.749 -3.917 -6.633 710 HH11 ARG 98 1HH1 ARG 98 -13.833 -3.569 -9.567 711 HH12 ARG 98 2HH1 ARG 98 -15.482 -4.042 -9.827 712 HH21 ARG 98 1HH2 ARG 98 -15.976 -5.299 -6.597 713 HH22 ARG 98 2HH2 ARG 98 -16.699 -5.016 -8.147 714 H ARG 99 H ARG 99 -12.649 0.915 -4.666 715 HA ARG 99 HA ARG 99 -14.568 3.010 -4.835 716 HE ARG 99 HE ARG 99 -16.136 -2.142 -1.851 717 HB2 ARG 99 1HB ARG 99 -15.973 2.307 -2.921 718 HB3 ARG 99 2HB ARG 99 -16.175 1.293 -4.338 719 HG2 ARG 99 1HG ARG 99 -14.919 -0.473 -3.341 720 HG3 ARG 99 2HG ARG 99 -14.448 0.561 -1.986 721 HD2 ARG 99 1HD ARG 99 -16.703 0.680 -1.203 722 HD3 ARG 99 2HD ARG 99 -17.307 -0.118 -2.653 723 HH11 ARG 99 1HH1 ARG 99 -16.836 0.404 0.461 724 HH12 ARG 99 2HH1 ARG 99 -17.019 -0.698 1.792 725 HH21 ARG 99 1HH2 ARG 99 -16.350 -3.579 -0.074 726 HH22 ARG 99 2HH2 ARG 99 -16.750 -2.939 1.499 727 H GLN 100 H GLN 100 -14.224 4.589 -3.335 728 HA GLN 100 HA GLN 100 -11.594 4.447 -2.158 729 HB2 GLN 100 1HB GLN 100 -12.271 6.427 -3.425 730 HB3 GLN 100 2HB GLN 100 -13.585 6.716 -2.295 731 HG2 GLN 100 1HG GLN 100 -11.765 8.224 -1.844 732 HG3 GLN 100 2HG GLN 100 -11.945 7.092 -0.506 733 HE21 GLN 100 2HE2 GLN 100 -10.324 5.603 -0.101 734 HE22 GLN 100 1HE2 GLN 100 -8.771 5.700 -0.845 735 H HIS 101 H HIS 101 -11.831 3.046 -0.437 736 HA HIS 101 HA HIS 101 -13.499 3.925 1.791 737 HD1 HIS 101 HD1 HIS 101 -14.456 2.412 3.934 738 HD2 HIS 101 HD2 HIS 101 -10.668 0.707 3.690 739 HE1 HIS 101 HE1 HIS 101 -13.876 1.702 6.276 740 HE2 HIS 101 HE2 HIS 101 -11.498 0.890 6.129 741 HB2 HIS 101 1HB HIS 101 -13.558 1.555 1.435 742 HB3 HIS 101 2HB HIS 101 -11.802 1.461 1.354 743 H LEU 102 H LEU 102 -12.646 5.583 2.860 744 HA LEU 102 HA LEU 102 -9.817 5.958 3.139 745 HG LEU 102 HG LEU 102 -12.052 7.828 2.088 746 HB2 LEU 102 1HB LEU 102 -12.149 7.322 4.495 747 HB3 LEU 102 2HB LEU 102 -10.476 7.817 4.664 748 HD11 LEU 102 1HD1 LEU 102 -11.924 10.263 2.288 749 HD12 LEU 102 2HD1 LEU 102 -11.142 10.091 3.859 750 HD13 LEU 102 3HD1 LEU 102 -12.804 9.545 3.637 751 HD21 LEU 102 3HD2 LEU 102 -9.257 8.788 2.698 752 HD22 LEU 102 1HD2 LEU 102 -10.117 9.024 1.176 753 HD23 LEU 102 2HD2 LEU 102 -9.688 7.396 1.703 754 H LEU 103 H LEU 103 -8.622 5.854 5.083 755 HA LEU 103 HA LEU 103 -9.633 3.755 6.862 756 HG LEU 103 HG LEU 103 -7.555 3.469 4.517 757 HB2 LEU 103 1HB LEU 103 -6.820 4.783 6.457 758 HB3 LEU 103 2HB LEU 103 -7.275 3.468 7.524 759 HD11 LEU 103 1HD1 LEU 103 -5.661 1.982 6.328 760 HD12 LEU 103 2HD1 LEU 103 -5.240 3.306 5.240 761 HD13 LEU 103 3HD1 LEU 103 -5.803 1.768 4.583 762 HD21 LEU 103 3HD2 LEU 103 -8.161 1.110 4.791 763 HD22 LEU 103 1HD2 LEU 103 -9.325 2.179 5.576 764 HD23 LEU 103 2HD2 LEU 103 -8.132 1.311 6.543 765 H GLY 104 H GLY 104 -9.392 3.939 9.137 766 HA2 GLY 104 1HA GLY 104 -9.642 6.748 9.984 767 HA3 GLY 104 2HA GLY 104 -10.410 5.380 10.774 768 HA PRO 105 HA PRO 105 -6.251 6.861 12.652 769 HB2 PRO 105 1HB PRO 105 -7.300 7.578 15.091 770 HB3 PRO 105 2HB PRO 105 -7.027 8.694 13.750 771 HG2 PRO 105 1HG PRO 105 -9.550 7.324 14.591 772 HG3 PRO 105 2HG PRO 105 -9.309 8.997 14.052 773 HD2 PRO 105 1HD PRO 105 -10.313 7.132 12.413 774 HD3 PRO 105 2HD PRO 105 -9.215 8.394 11.815 775 H GLU 106 H GLU 106 -8.905 4.864 13.814 776 HA GLU 106 HA GLU 106 -7.175 3.523 15.730 777 HB2 GLU 106 1HB GLU 106 -10.066 3.069 14.987 778 HB3 GLU 106 2HB GLU 106 -9.201 2.153 16.215 779 HG2 GLU 106 1HG GLU 106 -8.850 4.185 17.505 780 HG3 GLU 106 2HG GLU 106 -9.678 5.124 16.264 781 H GLN 107 H GLN 107 -7.923 3.253 12.465 782 HA GLN 107 HA GLN 107 -7.454 0.376 12.343 783 HB2 GLN 107 1HB GLN 107 -8.015 2.405 10.172 784 HB3 GLN 107 2HB GLN 107 -7.817 0.679 9.898 785 HG2 GLN 107 1HG GLN 107 -9.765 0.207 11.250 786 HG3 GLN 107 2HG GLN 107 -9.938 1.917 11.636 787 HE21 GLN 107 2HE2 GLN 107 -11.793 0.068 10.344 788 HE22 GLN 107 1HE2 GLN 107 -12.179 0.792 8.819 789 H VAL 108 H VAL 108 -5.996 3.392 11.198 790 HA VAL 108 HA VAL 108 -3.519 2.002 10.533 791 HB VAL 108 HB VAL 108 -2.726 4.222 9.776 792 HG11 VAL 108 1HG1 VAL 108 -5.430 3.424 8.706 793 HG12 VAL 108 2HG1 VAL 108 -3.871 2.765 8.208 794 HG13 VAL 108 3HG1 VAL 108 -4.261 4.452 7.876 795 HG21 VAL 108 3HG2 VAL 108 -3.951 5.631 11.341 796 HG22 VAL 108 1HG2 VAL 108 -5.477 5.159 10.591 797 HG23 VAL 108 2HG2 VAL 108 -4.300 6.102 9.676 798 H ARG 109 H ARG 109 -4.716 2.438 13.259 799 HA ARG 109 HA ARG 109 -3.438 4.352 14.779 800 HE ARG 109 HE ARG 109 -4.934 4.238 19.424 801 HB2 ARG 109 1HB ARG 109 -5.380 2.736 15.328 802 HB3 ARG 109 2HB ARG 109 -4.118 1.643 15.874 803 HG2 ARG 109 1HG ARG 109 -3.364 3.310 17.485 804 HG3 ARG 109 2HG ARG 109 -4.628 4.413 16.930 805 HD2 ARG 109 1HD ARG 109 -6.274 2.569 17.495 806 HD3 ARG 109 2HD ARG 109 -4.942 1.773 18.329 807 HH11 ARG 109 1HH1 ARG 109 -7.439 1.846 18.903 808 HH12 ARG 109 2HH1 ARG 109 -8.388 2.347 20.277 809 HH21 ARG 109 1HH2 ARG 109 -6.185 4.930 21.212 810 HH22 ARG 109 2HH2 ARG 109 -7.673 4.113 21.587 811 HA PRO 110 HA PRO 110 -0.095 1.017 16.083 812 HB2 PRO 110 1HB PRO 110 -0.013 -0.641 13.627 813 HB3 PRO 110 2HB PRO 110 0.114 -1.129 15.320 814 HG2 PRO 110 1HG PRO 110 -2.102 -1.610 13.923 815 HG3 PRO 110 2HG PRO 110 -2.180 -1.133 15.629 816 HD2 PRO 110 1HD PRO 110 -2.685 0.504 13.178 817 HD3 PRO 110 2HD PRO 110 -3.544 0.505 14.733 818 H LEU 111 H LEU 111 -0.435 1.750 12.629 819 HA LEU 111 HA LEU 111 2.380 2.041 12.238 820 HG LEU 111 HG LEU 111 0.184 0.419 10.735 821 HB2 LEU 111 1HB LEU 111 0.065 2.860 10.486 822 HB3 LEU 111 2HB LEU 111 1.752 2.897 10.004 823 HD11 LEU 111 1HD1 LEU 111 0.414 -0.151 8.379 824 HD12 LEU 111 2HD1 LEU 111 1.226 1.385 8.078 825 HD13 LEU 111 3HD1 LEU 111 -0.465 1.365 8.581 826 HD21 LEU 111 3HD2 LEU 111 2.173 -0.798 9.976 827 HD22 LEU 111 1HD2 LEU 111 2.526 0.217 11.374 828 HD23 LEU 111 2HD2 LEU 111 3.023 0.733 9.763 829 H LEU 112 H LEU 112 -0.336 4.305 12.640 830 HA LEU 112 HA LEU 112 1.147 6.668 12.308 831 HG LEU 112 HG LEU 112 -1.797 6.052 11.535 832 HB2 LEU 112 1HB LEU 112 -1.342 6.102 13.902 833 HB3 LEU 112 2HB LEU 112 -0.645 7.705 13.781 834 HD11 LEU 112 1HD1 LEU 112 -3.380 7.906 11.369 835 HD12 LEU 112 2HD1 LEU 112 -2.606 8.694 12.744 836 HD13 LEU 112 3HD1 LEU 112 -3.437 7.153 12.964 837 HD21 LEU 112 3HD2 LEU 112 -0.432 8.742 11.410 838 HD22 LEU 112 1HD2 LEU 112 -1.274 7.948 10.079 839 HD23 LEU 112 2HD2 LEU 112 0.192 7.231 10.747 840 H ALA 113 H ALA 113 0.593 4.648 15.143 841 HA ALA 113 HA ALA 113 1.774 6.329 17.061 842 HB1 ALA 113 3HB ALA 113 0.411 4.375 17.637 843 HB2 ALA 113 1HB ALA 113 1.981 4.333 18.440 844 HB3 ALA 113 2HB ALA 113 1.682 3.314 17.032 845 H MET 114 H MET 114 3.132 4.012 14.807 846 HA MET 114 HA MET 114 5.793 4.140 15.870 847 HB2 MET 114 1HB MET 114 4.791 3.169 13.188 848 HB3 MET 114 2HB MET 114 6.426 2.954 13.792 849 HG2 MET 114 1HG MET 114 5.611 1.569 15.599 850 HG3 MET 114 2HG MET 114 3.947 1.837 15.077 851 HE1 MET 114 3HE MET 114 3.487 -0.749 15.004 852 HE2 MET 114 1HE MET 114 5.135 -1.072 15.544 853 HE3 MET 114 2HE MET 114 4.489 -1.906 14.129 854 H GLY 115 H GLY 115 3.941 5.899 13.507 855 HA2 GLY 115 1HA GLY 115 4.684 8.178 13.014 856 HA3 GLY 115 2HA GLY 115 6.326 7.551 12.943 857 H VAL 116 H VAL 116 4.109 5.419 11.590 858 HA VAL 116 HA VAL 116 5.021 6.099 8.903 859 HB VAL 116 HB VAL 116 3.388 3.722 9.828 860 HG11 VAL 116 1HG1 VAL 116 3.061 4.200 7.475 861 HG12 VAL 116 2HG1 VAL 116 4.027 2.737 7.666 862 HG13 VAL 116 3HG1 VAL 116 4.805 4.256 7.220 863 HG21 VAL 116 3HG2 VAL 116 5.597 3.694 10.852 864 HG22 VAL 116 1HG2 VAL 116 6.348 3.921 9.271 865 HG23 VAL 116 2HG2 VAL 116 5.467 2.434 9.624 866 H GLY 117 H GLY 117 3.812 7.502 7.790 867 HA2 GLY 117 1HA GLY 117 1.030 7.942 8.451 868 HA3 GLY 117 2HA GLY 117 1.957 8.772 7.205 869 H VAL 118 H VAL 118 -0.699 7.067 7.472 870 HA VAL 118 HA VAL 118 -0.183 5.390 5.111 871 HB VAL 118 HB VAL 118 -2.511 5.194 7.029 872 HG11 VAL 118 1HG1 VAL 118 -2.925 3.041 5.943 873 HG12 VAL 118 2HG1 VAL 118 -1.581 3.337 4.839 874 HG13 VAL 118 3HG1 VAL 118 -3.010 4.370 4.786 875 HG21 VAL 118 3HG2 VAL 118 -1.407 3.182 7.891 876 HG22 VAL 118 1HG2 VAL 118 -0.431 4.627 8.157 877 HG23 VAL 118 2HG2 VAL 118 -0.016 3.509 6.859 878 H GLU 119 H GLU 119 -1.016 5.993 3.235 879 HA GLU 119 HA GLU 119 -3.094 8.082 3.266 880 HB2 GLU 119 1HB GLU 119 -0.590 8.340 2.272 881 HB3 GLU 119 2HB GLU 119 -1.424 7.736 0.847 882 HG2 GLU 119 1HG GLU 119 -1.393 10.138 0.826 883 HG3 GLU 119 2HG GLU 119 -3.047 9.564 1.042 884 H ALA 120 H ALA 120 -4.988 7.156 2.818 885 HA ALA 120 HA ALA 120 -5.118 4.904 0.959 886 HB1 ALA 120 3HB ALA 120 -7.286 6.140 2.657 887 HB2 ALA 120 1HB ALA 120 -6.330 4.719 3.081 888 HB3 ALA 120 2HB ALA 120 -7.430 4.664 1.702 889 H MET 121 H MET 121 -5.299 5.369 -1.123 890 HA MET 121 HA MET 121 -7.076 7.551 -1.958 891 HB2 MET 121 1HB MET 121 -4.222 7.162 -2.884 892 HB3 MET 121 2HB MET 121 -5.374 8.245 -3.653 893 HG2 MET 121 1HG MET 121 -5.522 9.567 -1.629 894 HG3 MET 121 2HG MET 121 -4.427 8.457 -0.805 895 HE1 MET 121 3HE MET 121 -1.069 9.014 -2.713 896 HE2 MET 121 1HE MET 121 -2.295 7.784 -3.029 897 HE3 MET 121 2HE MET 121 -1.867 8.198 -1.369 898 H ASP 122 H ASP 122 -6.862 7.466 -4.605 899 HA ASP 122 HA ASP 122 -7.962 4.976 -5.410 900 HB2 ASP 122 1HB ASP 122 -8.584 7.038 -6.553 901 HB3 ASP 122 2HB ASP 122 -6.916 7.297 -7.051 902 H THR 123 H THR 123 -7.052 3.482 -6.957 903 HA THR 123 HA THR 123 -4.487 2.647 -6.149 904 HB THR 123 HB THR 123 -6.134 1.016 -6.809 905 HG1 THR 123 HG1 THR 123 -4.498 0.467 -8.909 906 HG21 THR 123 3HG2 THR 123 -5.947 2.195 -9.581 907 HG22 THR 123 1HG2 THR 123 -7.336 2.290 -8.500 908 HG23 THR 123 2HG2 THR 123 -6.828 0.730 -9.149 909 H GLN 124 H GLN 124 -5.609 4.386 -9.021 910 HA GLN 124 HA GLN 124 -3.050 4.161 -10.342 911 HB2 GLN 124 1HB GLN 124 -5.164 4.308 -11.612 912 HB3 GLN 124 2HB GLN 124 -5.427 5.925 -10.973 913 HG2 GLN 124 1HG GLN 124 -3.441 6.723 -12.115 914 HG3 GLN 124 2HG GLN 124 -3.117 5.097 -12.717 915 HE21 GLN 124 2HE2 GLN 124 -3.599 7.564 -14.200 916 HE22 GLN 124 1HE2 GLN 124 -4.974 7.259 -15.208 917 H ALA 125 H ALA 125 -4.805 6.539 -8.457 918 HA ALA 125 HA ALA 125 -3.001 8.692 -8.787 919 HB1 ALA 125 3HB ALA 125 -4.093 9.669 -6.837 920 HB2 ALA 125 1HB ALA 125 -4.858 8.119 -6.478 921 HB3 ALA 125 2HB ALA 125 -5.280 8.992 -7.952 922 H ALA 126 H ALA 126 -3.181 6.046 -6.465 923 HA ALA 126 HA ALA 126 -1.070 6.982 -4.798 924 HB1 ALA 126 3HB ALA 126 -2.183 4.194 -5.093 925 HB2 ALA 126 1HB ALA 126 -2.774 5.430 -3.983 926 HB3 ALA 126 2HB ALA 126 -1.152 4.765 -3.782 927 H ALA 127 H ALA 127 -1.243 4.718 -7.517 928 HA ALA 127 HA ALA 127 1.366 3.717 -7.344 929 HB1 ALA 127 3HB ALA 127 -0.380 2.698 -8.728 930 HB2 ALA 127 1HB ALA 127 1.085 3.015 -9.658 931 HB3 ALA 127 2HB ALA 127 -0.312 4.077 -9.824 932 H ARG 128 H ARG 128 0.115 6.625 -8.916 933 HA ARG 128 HA ARG 128 2.565 7.230 -10.242 934 HE ARG 128 HE ARG 128 1.389 10.505 -12.128 935 HB2 ARG 128 1HB ARG 128 0.135 8.907 -9.663 936 HB3 ARG 128 2HB ARG 128 1.524 9.503 -10.560 937 HG2 ARG 128 1HG ARG 128 1.162 7.504 -12.105 938 HG3 ARG 128 2HG ARG 128 -0.416 7.355 -11.329 939 HD2 ARG 128 1HD ARG 128 -0.558 8.667 -13.383 940 HD3 ARG 128 2HD ARG 128 -0.959 9.644 -11.969 941 HH11 ARG 128 1HH1 ARG 128 -0.307 9.280 -14.931 942 HH12 ARG 128 2HH1 ARG 128 0.668 10.158 -16.076 943 HH21 ARG 128 1HH2 ARG 128 2.673 11.680 -13.627 944 HH22 ARG 128 2HH2 ARG 128 2.339 11.544 -15.328 945 H THR 129 H THR 129 1.065 8.401 -7.238 946 HA THR 129 HA THR 129 3.131 10.247 -6.634 947 HB THR 129 HB THR 129 2.219 9.884 -4.212 948 HG1 THR 129 HG1 THR 129 -0.010 8.853 -5.631 949 HG21 THR 129 3HG2 THR 129 0.467 10.988 -6.409 950 HG22 THR 129 1HG2 THR 129 1.762 11.856 -5.582 951 HG23 THR 129 2HG2 THR 129 0.323 11.360 -4.692 952 H TYR 130 H TYR 130 2.630 6.859 -6.001 953 HA TYR 130 HA TYR 130 4.708 6.309 -4.241 954 HD1 TYR 130 HD2 TYR 130 4.718 4.001 -3.017 955 HD2 TYR 130 HD1 TYR 130 5.069 2.977 -7.128 956 HE1 TYR 130 HE2 TYR 130 6.164 2.106 -2.415 957 HE2 TYR 130 HE1 TYR 130 6.510 1.076 -6.540 958 HH TYR 130 HH TYR 130 6.772 -0.125 -3.439 959 HB2 TYR 130 1HB TYR 130 2.997 4.684 -4.877 960 HB3 TYR 130 2HB TYR 130 3.612 4.650 -6.521 961 H ASN 131 H ASN 131 4.720 6.480 -7.787 962 HA ASN 131 HA ASN 131 7.443 5.827 -8.122 963 HB2 ASN 131 1HB ASN 131 5.918 5.668 -9.991 964 HB3 ASN 131 2HB ASN 131 5.567 7.392 -9.905 965 HD21 ASN 131 2HD2 ASN 131 6.882 8.810 -10.917 966 HD22 ASN 131 1HD2 ASN 131 8.301 8.359 -11.812 967 H ILE 132 H ILE 132 5.795 8.893 -7.592 968 HA ILE 132 HA ILE 132 7.990 10.607 -8.030 969 HB ILE 132 HB ILE 132 5.695 10.999 -6.095 970 HG12 ILE 132 1HG1 ILE 132 5.981 11.939 -8.958 971 HG13 ILE 132 2HG1 ILE 132 4.992 10.575 -8.448 972 HG21 ILE 132 1HG2 ILE 132 7.585 12.992 -7.345 973 HG22 ILE 132 2HG2 ILE 132 7.557 12.505 -5.650 974 HG23 ILE 132 3HG2 ILE 132 6.194 13.391 -6.336 975 HD11 ILE 132 3HD1 ILE 132 4.606 13.444 -7.630 976 HD12 ILE 132 1HD1 ILE 132 3.621 12.081 -7.100 977 HD13 ILE 132 2HD1 ILE 132 3.636 12.548 -8.800 978 H LEU 133 H LEU 133 6.739 9.127 -5.055 979 HA LEU 133 HA LEU 133 8.753 10.140 -3.354 980 HG LEU 133 HG LEU 133 5.693 9.767 -3.256 981 HB2 LEU 133 1HB LEU 133 7.029 7.680 -3.038 982 HB3 LEU 133 2HB LEU 133 7.955 8.442 -1.759 983 HD11 LEU 133 1HD1 LEU 133 4.888 7.915 -1.889 984 HD12 LEU 133 2HD1 LEU 133 4.405 9.469 -1.210 985 HD13 LEU 133 3HD1 LEU 133 5.741 8.571 -0.491 986 HD21 LEU 133 3HD2 LEU 133 5.841 11.450 -1.489 987 HD22 LEU 133 1HD2 LEU 133 7.344 11.340 -2.407 988 HD23 LEU 133 2HD2 LEU 133 7.233 10.609 -0.806 989 H MET 134 H MET 134 8.538 7.284 -5.365 990 HA MET 134 HA MET 134 10.848 5.950 -4.426 991 HB2 MET 134 1HB MET 134 9.234 4.813 -5.849 992 HB3 MET 134 2HB MET 134 9.548 5.945 -7.159 993 HG2 MET 134 1HG MET 134 11.886 5.123 -7.235 994 HG3 MET 134 2HG MET 134 11.455 3.913 -6.029 995 HE1 MET 134 3HE MET 134 8.524 3.080 -6.886 996 HE2 MET 134 1HE MET 134 9.774 1.910 -6.464 997 HE3 MET 134 2HE MET 134 8.853 1.715 -7.955 998 H ALA 135 H ALA 135 10.332 8.378 -6.946 999 HA ALA 135 HA ALA 135 12.981 8.485 -7.903 1000 HB1 ALA 135 3HB ALA 135 10.875 10.647 -7.897 1001 HB2 ALA 135 1HB ALA 135 11.098 9.417 -9.142 1002 HB3 ALA 135 2HB ALA 135 12.343 10.638 -8.876 1003 H GLU 136 H GLU 136 11.358 10.078 -5.233 1004 HA GLU 136 HA GLU 136 13.538 11.824 -4.608 1005 HB2 GLU 136 1HB GLU 136 11.185 10.948 -2.924 1006 HB3 GLU 136 2HB GLU 136 12.314 12.225 -2.497 1007 HG2 GLU 136 1HG GLU 136 11.633 13.416 -4.581 1008 HG3 GLU 136 2HG GLU 136 10.379 12.194 -4.793 1009 H GLY 137 H GLY 137 12.907 8.524 -4.099 1010 HA2 GLY 137 1HA GLY 137 14.211 6.902 -3.112 1011 HA3 GLY 137 2HA GLY 137 15.369 8.155 -2.686 1012 H ARG 138 H ARG 138 11.964 8.126 -1.795 1013 HA ARG 138 HA ARG 138 12.743 8.267 1.002 1014 HE ARG 138 HE ARG 138 10.231 10.659 2.533 1015 HB2 ARG 138 1HB ARG 138 10.114 8.717 -0.411 1016 HB3 ARG 138 2HB ARG 138 10.333 8.840 1.322 1017 HG2 ARG 138 1HG ARG 138 12.060 10.608 0.884 1018 HG3 ARG 138 2HG ARG 138 11.544 10.575 -0.804 1019 HD2 ARG 138 1HD ARG 138 10.416 12.364 0.383 1020 HD3 ARG 138 2HD ARG 138 9.257 11.125 -0.099 1021 HH11 ARG 138 1HH1 ARG 138 7.993 12.669 0.719 1022 HH12 ARG 138 2HH1 ARG 138 6.946 12.938 2.081 1023 HH21 ARG 138 1HH2 ARG 138 8.874 11.019 4.306 1024 HH22 ARG 138 2HH2 ARG 138 7.448 12.000 4.124 1025 H ARG 139 H ARG 139 11.289 7.104 2.581 1026 HA ARG 139 HA ARG 139 11.147 4.307 1.818 1027 HE ARG 139 HE ARG 139 14.291 4.729 2.452 1028 HB2 ARG 139 1HB ARG 139 10.592 5.703 4.442 1029 HB3 ARG 139 2HB ARG 139 10.463 3.966 4.210 1030 HG2 ARG 139 1HG ARG 139 12.979 5.571 3.822 1031 HG3 ARG 139 2HG ARG 139 12.575 4.647 5.269 1032 HD2 ARG 139 1HD ARG 139 13.370 2.789 4.341 1033 HD3 ARG 139 2HD ARG 139 12.267 2.972 2.975 1034 HH11 ARG 139 1HH1 ARG 139 14.185 1.277 3.112 1035 HH12 ARG 139 2HH1 ARG 139 15.575 0.921 2.129 1036 HH21 ARG 139 1HH2 ARG 139 16.087 4.273 1.181 1037 HH22 ARG 139 2HH2 ARG 139 16.664 2.637 1.017 1038 H VAL 140 H VAL 140 9.477 4.189 0.364 1039 HA VAL 140 HA VAL 140 6.800 4.664 1.481 1040 HB VAL 140 HB VAL 140 7.247 6.408 -0.156 1041 HG11 VAL 140 1HG1 VAL 140 7.765 4.170 -2.112 1042 HG12 VAL 140 2HG1 VAL 140 8.959 5.302 -1.477 1043 HG13 VAL 140 3HG1 VAL 140 7.659 5.883 -2.515 1044 HG21 VAL 140 3HG2 VAL 140 5.341 4.323 -1.214 1045 HG22 VAL 140 1HG2 VAL 140 5.355 6.027 -1.673 1046 HG23 VAL 140 2HG2 VAL 140 4.976 5.563 -0.014 1047 H VAL 141 H VAL 141 5.384 3.048 1.282 1048 HA VAL 141 HA VAL 141 6.049 0.802 -0.510 1049 HB VAL 141 HB VAL 141 4.627 0.500 2.141 1050 HG11 VAL 141 1HG1 VAL 141 4.153 -1.237 0.514 1051 HG12 VAL 141 2HG1 VAL 141 5.129 -1.879 1.835 1052 HG13 VAL 141 3HG1 VAL 141 5.878 -1.515 0.281 1053 HG21 VAL 141 3HG2 VAL 141 6.886 1.251 2.606 1054 HG22 VAL 141 1HG2 VAL 141 7.541 0.010 1.539 1055 HG23 VAL 141 2HG2 VAL 141 6.712 -0.453 3.025 1056 H VAL 142 H VAL 142 4.269 -0.097 -1.625 1057 HA VAL 142 HA VAL 142 1.759 1.411 -1.300 1058 HB VAL 142 HB VAL 142 3.047 2.100 -3.331 1059 HG11 VAL 142 1HG1 VAL 142 4.043 -0.034 -3.917 1060 HG12 VAL 142 2HG1 VAL 142 3.100 0.601 -5.265 1061 HG13 VAL 142 3HG1 VAL 142 2.450 -0.700 -4.269 1062 HG21 VAL 142 3HG2 VAL 142 0.658 2.446 -3.235 1063 HG22 VAL 142 1HG2 VAL 142 0.369 0.804 -3.811 1064 HG23 VAL 142 2HG2 VAL 142 1.132 1.989 -4.870 1065 H ALA 143 H ALA 143 -0.107 0.302 -1.360 1066 HA ALA 143 HA ALA 143 0.011 -2.583 -1.966 1067 HB1 ALA 143 3HB ALA 143 -1.811 -2.900 -0.357 1068 HB2 ALA 143 1HB ALA 143 -1.781 -1.177 0.020 1069 HB3 ALA 143 2HB ALA 143 -0.393 -2.192 0.417 1070 H LEU 144 H LEU 144 -0.995 -2.998 -3.818 1071 HA LEU 144 HA LEU 144 -3.001 -1.069 -4.764 1072 HG LEU 144 HG LEU 144 -0.018 -1.060 -5.602 1073 HB2 LEU 144 1HB LEU 144 -1.312 -3.043 -6.299 1074 HB3 LEU 144 2HB LEU 144 -2.520 -1.993 -7.015 1075 HD11 LEU 144 1HD1 LEU 144 0.482 -2.128 -7.730 1076 HD12 LEU 144 2HD1 LEU 144 0.719 -0.383 -7.835 1077 HD13 LEU 144 3HD1 LEU 144 -0.723 -1.121 -8.532 1078 HD21 LEU 144 3HD2 LEU 144 -2.134 0.476 -7.106 1079 HD22 LEU 144 1HD2 LEU 144 -0.631 1.147 -6.471 1080 HD23 LEU 144 2HD2 LEU 144 -1.853 0.521 -5.365 1081 H LEU 145 H LEU 145 -5.027 -1.645 -5.141 1082 HA LEU 145 HA LEU 145 -5.764 -4.482 -4.908 1083 HG LEU 145 HG LEU 145 -5.934 -2.397 -2.639 1084 HB2 LEU 145 1HB LEU 145 -7.461 -2.001 -4.579 1085 HB3 LEU 145 2HB LEU 145 -8.035 -3.648 -4.411 1086 HD11 LEU 145 1HD1 LEU 145 -8.872 -2.849 -2.130 1087 HD12 LEU 145 2HD1 LEU 145 -8.084 -1.286 -2.349 1088 HD13 LEU 145 3HD1 LEU 145 -7.693 -2.283 -0.947 1089 HD21 LEU 145 3HD2 LEU 145 -6.351 -4.332 -1.211 1090 HD22 LEU 145 1HD2 LEU 145 -5.785 -4.827 -2.806 1091 HD23 LEU 145 2HD2 LEU 145 -7.494 -4.965 -2.395 1092 HA PRO 146 HA PRO 146 -6.451 -3.872 -9.346 1093 HB2 PRO 146 1HB PRO 146 -6.493 -6.774 -9.489 1094 HB3 PRO 146 2HB PRO 146 -5.318 -5.648 -10.171 1095 HG2 PRO 146 1HG PRO 146 -4.742 -7.334 -8.116 1096 HG3 PRO 146 2HG PRO 146 -3.946 -5.765 -8.340 1097 HD2 PRO 146 1HD PRO 146 -6.182 -6.511 -6.490 1098 HD3 PRO 146 2HD PRO 146 -4.766 -5.479 -6.188 1099 H ASP 147 H ASP 147 -8.208 -4.251 -10.719 1100 HA ASP 147 HA ASP 147 -10.685 -4.884 -9.362 1101 HB2 ASP 147 1HB ASP 147 -10.415 -2.963 -11.004 1102 HB3 ASP 147 2HB ASP 147 -10.317 -4.174 -12.278 1103 H GLY 148 H GLY 148 -10.986 -7.018 -9.063 1104 HA2 GLY 148 1HA GLY 148 -10.847 -8.752 -11.432 1105 HA3 GLY 148 2HA GLY 148 -9.961 -9.208 -9.985 1106 H ASP 149 H ASP 149 -12.621 -7.726 -8.828 1107 HA ASP 149 HA ASP 149 -13.708 -10.025 -7.704 1108 HB2 ASP 149 1HB ASP 149 -14.825 -7.261 -8.073 1109 HB3 ASP 149 2HB ASP 149 -15.780 -8.535 -7.325 1110 H SER 150 H SER 150 -14.675 -8.295 -10.620 1111 HA SER 150 HA SER 150 -16.395 -10.581 -11.271 1112 HG SER 150 HG SER 150 -17.681 -6.793 -11.097 1113 HB2 SER 150 1HB SER 150 -17.859 -8.838 -12.476 1114 HB3 SER 150 2HB SER 150 -17.962 -8.904 -10.717 1115 H LEU 151 H LEU 151 -16.314 -11.304 -13.352 1116 HA LEU 151 HA LEU 151 -14.169 -10.292 -15.019 1117 HG LEU 151 HG LEU 151 -15.159 -11.786 -17.592 1118 HB2 LEU 151 1HB LEU 151 -14.506 -12.713 -14.794 1119 HB3 LEU 151 2HB LEU 151 -16.127 -12.558 -15.443 1120 HD11 LEU 151 1HD1 LEU 151 -13.060 -10.882 -16.745 1121 HD12 LEU 151 2HD1 LEU 151 -12.774 -12.087 -18.002 1122 HD13 LEU 151 3HD1 LEU 151 -12.530 -12.506 -16.306 1123 HD21 LEU 151 3HD2 LEU 151 -15.762 -14.118 -17.282 1124 HD22 LEU 151 1HD2 LEU 151 -14.172 -14.454 -16.596 1125 HD23 LEU 151 2HD2 LEU 151 -14.321 -13.979 -18.289 1126 H GLU 152 H GLU 152 -17.672 -10.709 -15.157 1127 HA GLU 152 HA GLU 152 -17.956 -9.183 -17.573 1128 HB2 GLU 152 1HB GLU 152 -19.560 -10.960 -16.885 1129 HB3 GLU 152 2HB GLU 152 -20.046 -9.959 -15.524 1130 HG2 GLU 152 1HG GLU 152 -20.907 -8.276 -17.009 1131 HG3 GLU 152 2HG GLU 152 -20.305 -9.158 -18.412 1132 H HIS 153 H HIS 153 -17.405 -7.113 -17.514 1133 HA HIS 153 HA HIS 153 -17.712 -5.604 -15.045 1134 HD1 HIS 153 HD1 HIS 153 -14.775 -7.189 -16.598 1135 HD2 HIS 153 HD2 HIS 153 -14.838 -3.711 -14.329 1136 HE1 HIS 153 HE1 HIS 153 -12.863 -7.403 -14.981 1137 HE2 HIS 153 HE2 HIS 153 -13.101 -5.408 -13.448 1138 HB2 HIS 153 1HB HIS 153 -16.205 -5.149 -17.597 1139 HB3 HIS 153 2HB HIS 153 -16.500 -3.816 -16.486 1140 H HIS 154 H HIS 154 -19.347 -4.350 -14.658 1141 HA HIS 154 HA HIS 154 -20.647 -2.949 -16.884 1142 HD1 HIS 154 HD1 HIS 154 -22.576 -6.780 -15.903 1143 HD2 HIS 154 HD2 HIS 154 -22.514 -3.605 -18.592 1144 HE1 HIS 154 HE1 HIS 154 -23.205 -7.760 -18.133 1145 HE2 HIS 154 HE2 HIS 154 -23.359 -5.790 -19.692 1146 HB2 HIS 154 1HB HIS 154 -21.981 -4.660 -14.807 1147 HB3 HIS 154 2HB HIS 154 -22.838 -3.309 -15.540 1148 H HIS 155 H HIS 155 -20.426 -0.862 -16.493 1149 HA HIS 155 HA HIS 155 -20.179 0.150 -13.811 1150 HD1 HIS 155 HD1 HIS 155 -17.898 1.718 -17.319 1151 HD2 HIS 155 HD2 HIS 155 -18.111 1.362 -13.177 1152 HE1 HIS 155 HE1 HIS 155 -15.512 1.768 -16.503 1153 HE2 HIS 155 HE2 HIS 155 -15.661 1.460 -13.999 1154 HB2 HIS 155 1HB HIS 155 -20.221 1.417 -16.533 1155 HB3 HIS 155 2HB HIS 155 -20.411 2.411 -15.093 1156 H HIS 156 H HIS 156 -21.765 0.792 -12.540 1157 HA HIS 156 HA HIS 156 -24.485 0.399 -13.394 1158 HD1 HIS 156 HD1 HIS 156 -25.262 -1.780 -11.548 1159 HD2 HIS 156 HD2 HIS 156 -26.465 1.942 -10.118 1160 HE1 HIS 156 HE1 HIS 156 -27.620 -2.092 -10.733 1161 HE2 HIS 156 HE2 HIS 156 -28.254 0.113 -9.704 1162 HB2 HIS 156 1HB HIS 156 -23.310 -0.049 -11.059 1163 HB3 HIS 156 2HB HIS 156 -23.801 1.613 -10.750 1164 H HIS 157 H HIS 157 -22.392 2.817 -13.788 1165 HA HIS 157 HA HIS 157 -24.514 4.756 -14.274 1166 HD1 HIS 157 HD1 HIS 157 -21.624 7.332 -14.722 1167 HD2 HIS 157 HD2 HIS 157 -24.898 7.722 -12.181 1168 HE1 HIS 157 HE1 HIS 157 -22.340 9.733 -14.898 1169 HE2 HIS 157 HE2 HIS 157 -24.246 9.977 -13.275 1170 HB2 HIS 157 1HB HIS 157 -23.530 5.368 -12.076 1171 HB3 HIS 157 2HB HIS 157 -21.933 5.409 -12.812 1172 H HIS 158 H HIS 158 -24.167 5.843 -16.194 1173 HA HIS 158 HA HIS 158 -21.791 5.034 -17.689 1174 HD1 HIS 158 HD1 HIS 158 -25.825 4.230 -18.329 1175 HD2 HIS 158 HD2 HIS 158 -22.225 3.560 -20.306 1176 HE1 HIS 158 HE1 HIS 158 -25.991 1.908 -19.282 1177 HE2 HIS 158 HE2 HIS 158 -23.878 1.597 -20.622 1178 HB2 HIS 158 1HB HIS 158 -24.406 6.297 -18.498 1179 HB3 HIS 158 2HB HIS 158 -23.029 6.245 -19.595 Start of MODEL 13 1 HA MET 1 HA MET 1 25.575 -14.775 -1.544 2 H1 MET 1 1H MET 1 27.610 -15.960 -1.085 3 H2 MET 1 2H MET 1 26.763 -17.421 -0.936 4 H3 MET 1 3H MET 1 26.506 -16.173 0.184 5 HB2 MET 1 1HB MET 1 25.919 -17.248 -3.254 6 HB3 MET 1 2HB MET 1 25.012 -15.819 -3.720 7 HG2 MET 1 1HG MET 1 27.037 -14.492 -3.672 8 HG3 MET 1 2HG MET 1 27.960 -15.896 -3.135 9 HE1 MET 1 3HE MET 1 28.322 -18.084 -4.625 10 HE2 MET 1 1HE MET 1 27.647 -18.277 -6.244 11 HE3 MET 1 2HE MET 1 26.576 -18.214 -4.844 12 H LYS 2 H LYS 2 23.400 -14.638 -1.412 13 HA LYS 2 HA LYS 2 21.891 -17.089 -0.769 14 HB2 LYS 2 1HB LYS 2 21.028 -14.200 -0.460 15 HB3 LYS 2 2HB LYS 2 20.151 -15.616 0.097 16 HG2 LYS 2 1HG LYS 2 21.853 -16.083 1.740 17 HG3 LYS 2 2HG LYS 2 22.853 -14.765 1.121 18 HD2 LYS 2 1HD LYS 2 21.000 -13.189 1.694 19 HD3 LYS 2 2HD LYS 2 20.161 -14.536 2.463 20 HE2 LYS 2 1HE LYS 2 22.924 -13.610 3.226 21 HE3 LYS 2 2HE LYS 2 21.451 -13.067 4.024 22 HZ1 LYS 2 3HZ LYS 2 20.987 -15.372 4.635 23 HZ2 LYS 2 1HZ LYS 2 22.487 -14.865 5.243 24 HZ3 LYS 2 2HZ LYS 2 22.420 -15.878 3.887 25 H LEU 3 H LEU 3 20.364 -17.803 -2.242 26 HA LEU 3 HA LEU 3 20.803 -16.659 -4.880 27 HG LEU 3 HG LEU 3 19.281 -18.514 -6.631 28 HB2 LEU 3 1HB LEU 3 21.019 -19.126 -4.235 29 HB3 LEU 3 2HB LEU 3 19.267 -19.163 -4.259 30 HD11 LEU 3 1HD1 LEU 3 22.279 -18.689 -6.364 31 HD12 LEU 3 2HD1 LEU 3 21.340 -17.227 -6.668 32 HD13 LEU 3 3HD1 LEU 3 21.391 -18.511 -7.877 33 HD21 LEU 3 3HD2 LEU 3 21.026 -20.893 -6.006 34 HD22 LEU 3 1HD2 LEU 3 20.169 -20.610 -7.521 35 HD23 LEU 3 2HD2 LEU 3 19.263 -20.879 -6.031 36 H HIS 4 H HIS 4 18.823 -15.540 -2.803 37 HA HIS 4 HA HIS 4 16.794 -14.987 -4.834 38 HD1 HIS 4 HD1 HIS 4 14.279 -15.720 -5.374 39 HD2 HIS 4 HD2 HIS 4 15.740 -18.698 -2.860 40 HE1 HIS 4 HE1 HIS 4 13.412 -17.894 -6.309 41 HE2 HIS 4 HE2 HIS 4 14.202 -19.666 -4.702 42 HB2 HIS 4 1HB HIS 4 16.240 -16.151 -2.137 43 HB3 HIS 4 2HB HIS 4 15.096 -15.004 -2.818 44 H THR 5 H THR 5 19.091 -13.646 -3.181 45 HA THR 5 HA THR 5 17.483 -11.451 -2.064 46 HB THR 5 HB THR 5 19.585 -10.814 -0.854 47 HG1 THR 5 HG1 THR 5 20.782 -12.339 -2.468 48 HG21 THR 5 3HG2 THR 5 17.819 -12.067 0.267 49 HG22 THR 5 1HG2 THR 5 19.404 -12.605 0.823 50 HG23 THR 5 2HG2 THR 5 18.495 -13.583 -0.331 51 H ASP 6 H ASP 6 17.610 -9.462 -2.829 52 HA ASP 6 HA ASP 6 19.609 -8.841 -4.889 53 HB2 ASP 6 1HB ASP 6 17.106 -7.358 -4.028 54 HB3 ASP 6 2HB ASP 6 18.218 -6.793 -5.268 55 HA PRO 7 HA PRO 7 21.659 -7.011 -1.344 56 HB2 PRO 7 1HB PRO 7 24.073 -6.679 -2.465 57 HB3 PRO 7 2HB PRO 7 23.461 -8.281 -2.034 58 HG2 PRO 7 1HG PRO 7 23.524 -6.934 -4.707 59 HG3 PRO 7 2HG PRO 7 23.923 -8.611 -4.290 60 HD2 PRO 7 1HD PRO 7 21.520 -7.837 -5.350 61 HD3 PRO 7 2HD PRO 7 21.725 -9.265 -4.316 62 H ALA 8 H ALA 8 20.126 -5.348 -3.394 63 HA ALA 8 HA ALA 8 21.377 -2.810 -2.754 64 HB1 ALA 8 3HB ALA 8 20.862 -3.606 -5.620 65 HB2 ALA 8 1HB ALA 8 22.449 -3.424 -4.872 66 HB3 ALA 8 2HB ALA 8 21.397 -2.021 -5.063 67 H THR 9 H THR 9 19.945 -0.971 -3.481 68 HA THR 9 HA THR 9 17.212 -1.527 -2.839 69 HB THR 9 HB THR 9 18.426 1.021 -3.937 70 HG1 THR 9 HG1 THR 9 17.842 0.490 -1.213 71 HG21 THR 9 3HG2 THR 9 15.992 0.966 -4.125 72 HG22 THR 9 1HG2 THR 9 16.492 2.112 -2.883 73 HG23 THR 9 2HG2 THR 9 15.859 0.531 -2.420 74 H ALA 10 H ALA 10 15.743 -2.280 -4.224 75 HA ALA 10 HA ALA 10 16.361 -2.297 -7.062 76 HB1 ALA 10 3HB ALA 10 14.096 -3.610 -5.562 77 HB2 ALA 10 1HB ALA 10 15.630 -4.372 -5.985 78 HB3 ALA 10 2HB ALA 10 14.511 -3.874 -7.255 79 H LEU 11 H LEU 11 15.890 -0.389 -8.000 80 HA LEU 11 HA LEU 11 13.471 1.054 -7.465 81 HG LEU 11 HG LEU 11 16.505 1.828 -7.640 82 HB2 LEU 11 1HB LEU 11 15.396 1.291 -9.784 83 HB3 LEU 11 2HB LEU 11 14.122 2.431 -9.395 84 HD11 LEU 11 1HD1 LEU 11 17.260 4.066 -8.253 85 HD12 LEU 11 2HD1 LEU 11 15.899 4.224 -9.363 86 HD13 LEU 11 3HD1 LEU 11 17.146 3.014 -9.665 87 HD21 LEU 11 3HD2 LEU 11 14.323 3.892 -7.373 88 HD22 LEU 11 1HD2 LEU 11 15.747 3.759 -6.343 89 HD23 LEU 11 2HD2 LEU 11 14.543 2.471 -6.351 90 H ASN 12 H ASN 12 11.843 -0.444 -7.747 91 HA ASN 12 HA ASN 12 11.651 -1.801 -10.337 92 HB2 ASN 12 1HB ASN 12 11.657 -3.191 -8.288 93 HB3 ASN 12 2HB ASN 12 10.199 -2.369 -7.744 94 HD21 ASN 12 2HD2 ASN 12 9.069 -4.311 -7.686 95 HD22 ASN 12 1HD2 ASN 12 8.547 -5.117 -9.127 96 H THR 13 H THR 13 10.427 -0.827 -11.775 97 HA THR 13 HA THR 13 8.161 0.807 -10.886 98 HB THR 13 HB THR 13 9.360 0.659 -13.661 99 HG1 THR 13 HG1 THR 13 10.361 1.752 -11.394 100 HG21 THR 13 3HG2 THR 13 7.113 1.615 -13.564 101 HG22 THR 13 1HG2 THR 13 8.304 2.862 -13.934 102 HG23 THR 13 2HG2 THR 13 7.635 2.738 -12.307 103 H VAL 14 H VAL 14 6.076 0.406 -11.595 104 HA VAL 14 HA VAL 14 5.304 -2.214 -12.219 105 HB VAL 14 HB VAL 14 3.723 0.312 -12.757 106 HG11 VAL 14 1HG1 VAL 14 1.762 -1.133 -12.507 107 HG12 VAL 14 2HG1 VAL 14 2.821 -2.531 -12.309 108 HG13 VAL 14 3HG1 VAL 14 2.790 -1.658 -13.841 109 HG21 VAL 14 3HG2 VAL 14 2.751 -0.030 -10.528 110 HG22 VAL 14 1HG2 VAL 14 4.489 0.262 -10.445 111 HG23 VAL 14 2HG2 VAL 14 3.858 -1.375 -10.256 112 H THR 15 H THR 15 5.614 -3.290 -14.053 113 HA THR 15 HA THR 15 6.580 -2.051 -16.398 114 HB THR 15 HB THR 15 5.667 -4.635 -17.054 115 HG1 THR 15 HG1 THR 15 5.792 -5.759 -15.249 116 HG21 THR 15 3HG2 THR 15 8.377 -3.672 -16.116 117 HG22 THR 15 1HG2 THR 15 7.779 -3.626 -17.774 118 HG23 THR 15 2HG2 THR 15 8.070 -5.176 -16.983 119 H ALA 16 H ALA 16 3.433 -3.529 -15.597 120 HA ALA 16 HA ALA 16 2.248 -1.926 -17.739 121 HB1 ALA 16 3HB ALA 16 2.701 -4.119 -18.732 122 HB2 ALA 16 1HB ALA 16 0.971 -3.789 -18.618 123 HB3 ALA 16 2HB ALA 16 1.738 -4.881 -17.468 124 H TYR 17 H TYR 17 0.868 -0.692 -16.683 125 HA TYR 17 HA TYR 17 -0.757 -1.871 -14.545 126 HD1 TYR 17 HD2 TYR 17 -0.990 -0.529 -12.053 127 HD2 TYR 17 HD1 TYR 17 -2.677 1.830 -15.169 128 HE1 TYR 17 HE2 TYR 17 -2.895 0.021 -10.601 129 HE2 TYR 17 HE1 TYR 17 -4.587 2.383 -13.723 130 HH TYR 17 HH TYR 17 -5.744 1.264 -11.709 131 HB2 TYR 17 1HB TYR 17 0.363 0.255 -14.006 132 HB3 TYR 17 2HB TYR 17 -0.445 1.032 -15.364 133 H GLY 18 H GLY 18 -2.846 -2.343 -14.850 134 HA2 GLY 18 1HA GLY 18 -4.186 -1.176 -17.199 135 HA3 GLY 18 2HA GLY 18 -4.260 -2.906 -16.892 136 H ASP 19 H ASP 19 -6.624 -2.025 -17.075 137 HA ASP 19 HA ASP 19 -7.614 -0.879 -14.611 138 HB2 ASP 19 1HB ASP 19 -8.994 -1.779 -17.145 139 HB3 ASP 19 2HB ASP 19 -9.816 -1.051 -15.779 140 H GLY 20 H GLY 20 -7.133 -3.973 -16.006 141 HA2 GLY 20 1HA GLY 20 -8.712 -5.168 -13.815 142 HA3 GLY 20 2HA GLY 20 -8.749 -5.828 -15.442 143 H TYR 21 H TYR 21 -5.709 -4.625 -14.380 144 HA TYR 21 HA TYR 21 -4.776 -7.029 -13.163 145 HD1 TYR 21 HD1 TYR 21 -5.461 -5.687 -17.049 146 HD2 TYR 21 HD2 TYR 21 -1.511 -6.770 -15.886 147 HE1 TYR 21 HE1 TYR 21 -4.550 -4.339 -18.894 148 HE2 TYR 21 HE2 TYR 21 -0.594 -5.421 -17.725 149 HH TYR 21 HH TYR 21 -1.374 -4.576 -19.951 150 HB2 TYR 21 1HB TYR 21 -3.338 -7.858 -14.895 151 HB3 TYR 21 2HB TYR 21 -4.953 -7.715 -15.576 152 H ILE 22 H ILE 22 -2.692 -6.826 -12.326 153 HA ILE 22 HA ILE 22 -1.286 -4.296 -12.881 154 HB ILE 22 HB ILE 22 -1.407 -5.704 -10.201 155 HG12 ILE 22 1HG1 ILE 22 -2.640 -3.070 -11.050 156 HG13 ILE 22 2HG1 ILE 22 -3.531 -4.566 -10.792 157 HG21 ILE 22 1HG2 ILE 22 0.722 -4.600 -10.597 158 HG22 ILE 22 2HG2 ILE 22 -0.202 -3.736 -9.368 159 HG23 ILE 22 3HG2 ILE 22 -0.112 -3.104 -11.013 160 HD11 ILE 22 3HD1 ILE 22 -3.755 -3.095 -8.891 161 HD12 ILE 22 1HD1 ILE 22 -2.001 -3.023 -8.713 162 HD13 ILE 22 2HD1 ILE 22 -2.853 -4.542 -8.440 163 H GLU 23 H GLU 23 0.424 -4.897 -14.077 164 HA GLU 23 HA GLU 23 1.761 -7.431 -13.417 165 HB2 GLU 23 1HB GLU 23 0.797 -7.065 -15.732 166 HB3 GLU 23 2HB GLU 23 2.021 -5.829 -15.960 167 HG2 GLU 23 1HG GLU 23 2.904 -8.538 -15.136 168 HG3 GLU 23 2HG GLU 23 2.357 -8.303 -16.793 169 H VAL 24 H VAL 24 3.591 -7.292 -12.353 170 HA VAL 24 HA VAL 24 5.243 -4.868 -12.637 171 HB VAL 24 HB VAL 24 4.942 -6.457 -10.081 172 HG11 VAL 24 1HG1 VAL 24 6.049 -4.533 -9.052 173 HG12 VAL 24 2HG1 VAL 24 6.191 -3.769 -10.636 174 HG13 VAL 24 3HG1 VAL 24 7.055 -5.269 -10.301 175 HG21 VAL 24 3HG2 VAL 24 3.637 -3.838 -10.820 176 HG22 VAL 24 1HG2 VAL 24 3.598 -4.594 -9.228 177 HG23 VAL 24 2HG2 VAL 24 2.818 -5.383 -10.599 178 H ASN 25 H ASN 25 7.423 -5.185 -12.810 179 HA ASN 25 HA ASN 25 9.375 -6.211 -13.332 180 HB2 ASN 25 1HB ASN 25 8.232 -8.556 -11.790 181 HB3 ASN 25 2HB ASN 25 9.888 -8.452 -12.378 182 HD21 ASN 25 2HD2 ASN 25 11.334 -7.072 -11.357 183 HD22 ASN 25 1HD2 ASN 25 11.005 -6.372 -9.813 184 H GLN 26 H GLN 26 7.508 -9.165 -13.335 185 HA GLN 26 HA GLN 26 7.069 -9.133 -16.191 186 HB2 GLN 26 1HB GLN 26 8.982 -11.046 -14.859 187 HB3 GLN 26 2HB GLN 26 8.126 -11.493 -16.327 188 HG2 GLN 26 1HG GLN 26 9.146 -9.665 -17.527 189 HG3 GLN 26 2HG GLN 26 9.932 -9.101 -16.054 190 HE21 GLN 26 2HE2 GLN 26 11.029 -9.973 -18.638 191 HE22 GLN 26 1HE2 GLN 26 12.160 -11.231 -18.260 192 H VAL 27 H VAL 27 5.762 -9.379 -13.407 193 HA VAL 27 HA VAL 27 4.322 -11.906 -13.893 194 HB VAL 27 HB VAL 27 4.867 -10.665 -11.191 195 HG11 VAL 27 1HG1 VAL 27 2.795 -11.935 -11.268 196 HG12 VAL 27 2HG1 VAL 27 4.007 -12.785 -10.312 197 HG13 VAL 27 3HG1 VAL 27 3.649 -13.317 -11.957 198 HG21 VAL 27 3HG2 VAL 27 6.407 -12.528 -10.820 199 HG22 VAL 27 1HG2 VAL 27 6.929 -11.525 -12.174 200 HG23 VAL 27 2HG2 VAL 27 6.146 -13.077 -12.475 201 H ARG 28 H ARG 28 2.285 -11.594 -14.410 202 HA ARG 28 HA ARG 28 0.941 -9.099 -13.822 203 HE ARG 28 HE ARG 28 -2.696 -12.196 -15.421 204 HB2 ARG 28 1HB ARG 28 0.605 -10.218 -15.991 205 HB3 ARG 28 2HB ARG 28 -0.075 -11.613 -15.166 206 HG2 ARG 28 1HG ARG 28 -1.883 -10.146 -14.298 207 HG3 ARG 28 2HG ARG 28 -1.232 -8.838 -15.288 208 HD2 ARG 28 1HD ARG 28 -3.062 -9.889 -16.453 209 HD3 ARG 28 2HD ARG 28 -1.553 -10.241 -17.293 210 HH11 ARG 28 1HH1 ARG 28 -1.672 -11.317 -18.648 211 HH12 ARG 28 2HH1 ARG 28 -1.800 -12.935 -19.266 212 HH21 ARG 28 1HH2 ARG 28 -2.881 -14.332 -16.230 213 HH22 ARG 28 2HH2 ARG 28 -2.501 -14.647 -17.903 214 H PHE 29 H PHE 29 0.230 -8.820 -11.806 215 HA PHE 29 HA PHE 29 -0.562 -11.115 -10.217 216 HD1 PHE 29 HD2 PHE 29 0.951 -11.239 -7.875 217 HD2 PHE 29 HD1 PHE 29 1.902 -7.733 -10.092 218 HE1 PHE 29 HE2 PHE 29 3.343 -11.618 -7.441 219 HE2 PHE 29 HE1 PHE 29 4.296 -8.104 -9.663 220 HZ PHE 29 HZ PHE 29 5.019 -10.047 -8.334 221 HB2 PHE 29 1HB PHE 29 -0.333 -8.185 -9.504 222 HB3 PHE 29 2HB PHE 29 -0.739 -9.466 -8.367 223 H SER 30 H SER 30 -2.559 -11.725 -9.844 224 HA SER 30 HA SER 30 -4.763 -9.942 -10.636 225 HG SER 30 HG SER 30 -3.736 -12.756 -12.134 226 HB2 SER 30 1HB SER 30 -4.773 -12.953 -10.271 227 HB3 SER 30 2HB SER 30 -6.108 -11.972 -10.881 228 H HIS 31 H HIS 31 -3.155 -10.144 -8.070 229 HA HIS 31 HA HIS 31 -5.439 -10.029 -6.275 230 HD1 HIS 31 HD1 HIS 31 -2.169 -12.399 -7.473 231 HD2 HIS 31 HD2 HIS 31 -2.054 -11.624 -3.394 232 HE1 HIS 31 HE1 HIS 31 0.200 -12.816 -6.779 233 HE2 HIS 31 HE2 HIS 31 0.150 -12.667 -4.269 234 HB2 HIS 31 1HB HIS 31 -4.471 -11.460 -4.588 235 HB3 HIS 31 2HB HIS 31 -4.570 -12.366 -6.091 236 H ALA 32 H ALA 32 -4.658 -9.185 -4.066 237 HA ALA 32 HA ALA 32 -3.393 -6.710 -4.548 238 HB1 ALA 32 3HB ALA 32 -5.080 -6.937 -2.851 239 HB2 ALA 32 1HB ALA 32 -3.572 -6.403 -2.110 240 HB3 ALA 32 2HB ALA 32 -4.082 -8.086 -1.962 241 H ILE 33 H ILE 33 -1.405 -5.929 -3.999 242 HA ILE 33 HA ILE 33 0.576 -7.799 -2.911 243 HB ILE 33 HB ILE 33 2.235 -6.922 -4.608 244 HG12 ILE 33 1HG1 ILE 33 -0.295 -6.096 -6.058 245 HG13 ILE 33 2HG1 ILE 33 0.893 -4.990 -5.372 246 HG21 ILE 33 1HG2 ILE 33 -0.055 -8.613 -5.596 247 HG22 ILE 33 2HG2 ILE 33 1.371 -9.178 -4.726 248 HG23 ILE 33 3HG2 ILE 33 1.535 -8.509 -6.350 249 HD11 ILE 33 3HD1 ILE 33 1.156 -5.197 -7.774 250 HD12 ILE 33 1HD1 ILE 33 1.381 -6.939 -7.615 251 HD13 ILE 33 2HD1 ILE 33 2.571 -5.828 -6.931 252 H ALA 34 H ALA 34 2.054 -6.879 -1.595 253 HA ALA 34 HA ALA 34 2.151 -3.935 -1.472 254 HB1 ALA 34 3HB ALA 34 2.235 -5.841 0.867 255 HB2 ALA 34 1HB ALA 34 0.881 -4.799 0.432 256 HB3 ALA 34 2HB ALA 34 2.407 -4.089 0.956 257 H PHE 35 H PHE 35 4.151 -3.205 -1.908 258 HA PHE 35 HA PHE 35 6.445 -4.771 -1.058 259 HD1 PHE 35 HD2 PHE 35 3.929 -4.936 -4.290 260 HD2 PHE 35 HD1 PHE 35 7.617 -2.854 -4.721 261 HE1 PHE 35 HE2 PHE 35 3.017 -3.729 -6.230 262 HE2 PHE 35 HE1 PHE 35 6.712 -1.645 -6.662 263 HZ PHE 35 HZ PHE 35 4.410 -2.083 -7.420 264 HB2 PHE 35 1HB PHE 35 7.469 -4.763 -3.312 265 HB3 PHE 35 2HB PHE 35 6.008 -5.736 -3.230 266 H ALA 36 H ALA 36 8.499 -3.676 -1.469 267 HA ALA 36 HA ALA 36 8.315 -0.765 -1.737 268 HB1 ALA 36 3HB ALA 36 9.732 -0.452 0.245 269 HB2 ALA 36 1HB ALA 36 9.683 -2.187 0.553 270 HB3 ALA 36 2HB ALA 36 8.206 -1.231 0.668 271 HA PRO 37 HA PRO 37 11.878 -1.204 -4.297 272 HB2 PRO 37 1HB PRO 37 13.108 1.073 -2.838 273 HB3 PRO 37 2HB PRO 37 12.769 0.890 -4.562 274 HG2 PRO 37 1HG PRO 37 11.275 2.488 -3.041 275 HG3 PRO 37 2HG PRO 37 10.548 1.506 -4.327 276 HD2 PRO 37 1HD PRO 37 10.554 1.056 -1.368 277 HD3 PRO 37 2HD PRO 37 9.253 0.783 -2.547 278 H GLU 38 H GLU 38 12.485 -0.766 -0.842 279 HA GLU 38 HA GLU 38 15.086 -2.094 -1.130 280 HB2 GLU 38 1HB GLU 38 14.156 -1.093 1.512 281 HB3 GLU 38 2HB GLU 38 15.763 -1.062 0.807 282 HG2 GLU 38 1HG GLU 38 15.296 1.153 0.740 283 HG3 GLU 38 2HG GLU 38 14.621 0.684 -0.821 284 H GLY 39 H GLY 39 12.342 -3.384 -1.192 285 HA2 GLY 39 1HA GLY 39 12.954 -5.474 0.758 286 HA3 GLY 39 2HA GLY 39 11.399 -4.671 0.913 287 HA PRO 40 HA PRO 40 10.872 -8.082 -2.173 288 HB2 PRO 40 1HB PRO 40 9.643 -9.929 -0.694 289 HB3 PRO 40 2HB PRO 40 11.399 -9.735 -0.629 290 HG2 PRO 40 1HG PRO 40 9.322 -8.866 1.320 291 HG3 PRO 40 2HG PRO 40 10.964 -9.458 1.617 292 HD2 PRO 40 1HD PRO 40 10.140 -6.767 1.569 293 HD3 PRO 40 2HD PRO 40 11.813 -7.357 1.546 294 H VAL 41 H VAL 41 8.610 -9.416 -2.410 295 HA VAL 41 HA VAL 41 6.500 -7.363 -2.258 296 HB VAL 41 HB VAL 41 6.622 -9.792 -4.061 297 HG11 VAL 41 1HG1 VAL 41 4.761 -8.724 -5.248 298 HG12 VAL 41 2HG1 VAL 41 4.738 -7.435 -4.045 299 HG13 VAL 41 3HG1 VAL 41 4.344 -9.088 -3.573 300 HG21 VAL 41 3HG2 VAL 41 7.164 -6.893 -4.699 301 HG22 VAL 41 1HG2 VAL 41 7.086 -8.208 -5.873 302 HG23 VAL 41 2HG2 VAL 41 8.358 -8.189 -4.652 303 H ALA 42 H ALA 42 5.063 -7.672 -0.685 304 HA ALA 42 HA ALA 42 4.775 -10.300 0.523 305 HB1 ALA 42 3HB ALA 42 4.985 -8.345 1.971 306 HB2 ALA 42 1HB ALA 42 3.437 -9.153 2.212 307 HB3 ALA 42 2HB ALA 42 3.516 -7.663 1.272 308 H SER 43 H SER 43 3.156 -11.649 0.161 309 HA SER 43 HA SER 43 1.187 -11.070 -1.821 310 HG SER 43 HG SER 43 1.652 -13.760 0.835 311 HB2 SER 43 1HB SER 43 0.381 -13.435 -0.886 312 HB3 SER 43 2HB SER 43 1.793 -13.283 -1.930 313 H TRP 44 H TRP 44 -0.696 -10.120 -1.508 314 HA TRP 44 HA TRP 44 -1.862 -10.136 1.197 315 HD1 TRP 44 HD1 TRP 44 -1.002 -8.938 2.690 316 HE1 TRP 44 HE1 TRP 44 -1.559 -7.168 4.479 317 HE3 TRP 44 HE3 TRP 44 -3.641 -5.653 -0.205 318 HZ2 TRP 44 HZ2 TRP 44 -2.934 -4.708 4.638 319 HZ3 TRP 44 HZ3 TRP 44 -4.540 -3.617 0.842 320 HH2 TRP 44 HH2 TRP 44 -4.194 -3.155 3.213 321 HB2 TRP 44 1HB TRP 44 -1.150 -7.974 -0.464 322 HB3 TRP 44 2HB TRP 44 -2.905 -8.061 -0.520 323 HA PRO 45 HA PRO 45 -5.020 -12.439 -1.017 324 HB2 PRO 45 1HB PRO 45 -6.287 -13.408 1.117 325 HB3 PRO 45 2HB PRO 45 -4.654 -13.953 0.708 326 HG2 PRO 45 1HG PRO 45 -5.523 -11.945 2.756 327 HG3 PRO 45 2HG PRO 45 -4.320 -13.239 2.901 328 HD2 PRO 45 1HD PRO 45 -3.706 -10.606 2.390 329 HD3 PRO 45 2HD PRO 45 -2.677 -11.978 1.934 330 H VAL 46 H VAL 46 -5.329 -9.485 -0.229 331 HA VAL 46 HA VAL 46 -8.107 -9.369 0.615 332 HB VAL 46 HB VAL 46 -6.188 -7.108 0.015 333 HG11 VAL 46 1HG1 VAL 46 -8.869 -7.110 1.396 334 HG12 VAL 46 2HG1 VAL 46 -8.504 -6.408 -0.180 335 HG13 VAL 46 3HG1 VAL 46 -7.781 -5.727 1.277 336 HG21 VAL 46 3HG2 VAL 46 -5.980 -6.900 2.448 337 HG22 VAL 46 1HG2 VAL 46 -5.408 -8.467 1.877 338 HG23 VAL 46 2HG2 VAL 46 -6.987 -8.335 2.652 339 H GLN 47 H GLN 47 -9.731 -9.275 -0.774 340 HA GLN 47 HA GLN 47 -9.211 -8.390 -3.541 341 HB2 GLN 47 1HB GLN 47 -11.602 -9.893 -2.453 342 HB3 GLN 47 2HB GLN 47 -11.271 -9.544 -4.142 343 HG2 GLN 47 1HG GLN 47 -9.329 -10.998 -4.083 344 HG3 GLN 47 2HG GLN 47 -9.607 -11.318 -2.369 345 HE21 GLN 47 2HE2 GLN 47 -9.535 -13.198 -4.576 346 HE22 GLN 47 1HE2 GLN 47 -11.083 -13.980 -4.606 347 H ARG 48 H ARG 48 -11.184 -7.962 -0.702 348 HA ARG 48 HA ARG 48 -12.272 -5.482 -1.853 349 HE ARG 48 HE ARG 48 -15.052 -9.794 -1.427 350 HB2 ARG 48 1HB ARG 48 -13.555 -7.463 0.036 351 HB3 ARG 48 2HB ARG 48 -14.193 -5.847 -0.238 352 HG2 ARG 48 1HG ARG 48 -14.594 -6.336 -2.557 353 HG3 ARG 48 2HG ARG 48 -13.797 -7.904 -2.404 354 HD2 ARG 48 1HD ARG 48 -16.214 -7.154 -0.777 355 HD3 ARG 48 2HD ARG 48 -16.345 -7.889 -2.375 356 HH11 ARG 48 1HH1 ARG 48 -16.863 -7.667 0.683 357 HH12 ARG 48 2HH1 ARG 48 -17.075 -8.857 1.927 358 HH21 ARG 48 1HH2 ARG 48 -15.358 -11.387 0.196 359 HH22 ARG 48 2HH2 ARG 48 -16.227 -10.976 1.650 360 HA PRO 49 HA PRO 49 -9.941 -3.522 1.348 361 HB2 PRO 49 1HB PRO 49 -11.730 -1.220 0.941 362 HB3 PRO 49 2HB PRO 49 -9.988 -1.347 0.683 363 HG2 PRO 49 1HG PRO 49 -11.702 -1.186 -1.373 364 HG3 PRO 49 2HG PRO 49 -10.231 -2.173 -1.462 365 HD2 PRO 49 1HD PRO 49 -13.061 -3.029 -0.962 366 HD3 PRO 49 2HD PRO 49 -11.823 -3.783 -1.990 367 H ALA 50 H ALA 50 -12.946 -4.659 1.738 368 HA ALA 50 HA ALA 50 -13.568 -3.235 4.210 369 HB1 ALA 50 3HB ALA 50 -15.402 -3.635 2.643 370 HB2 ALA 50 1HB ALA 50 -15.672 -4.476 4.170 371 HB3 ALA 50 2HB ALA 50 -15.121 -5.371 2.755 372 H ASP 51 H ASP 51 -11.691 -5.778 3.288 373 HA ASP 51 HA ASP 51 -12.175 -7.289 5.771 374 HB2 ASP 51 1HB ASP 51 -10.764 -8.151 3.233 375 HB3 ASP 51 2HB ASP 51 -10.944 -9.144 4.673 376 H ILE 52 H ILE 52 -10.456 -4.787 5.128 377 HA ILE 52 HA ILE 52 -7.775 -5.792 5.635 378 HB ILE 52 HB ILE 52 -8.716 -2.941 5.284 379 HG12 ILE 52 1HG1 ILE 52 -7.382 -4.827 3.325 380 HG13 ILE 52 2HG1 ILE 52 -9.068 -4.324 3.275 381 HG21 ILE 52 1HG2 ILE 52 -5.938 -4.113 5.298 382 HG22 ILE 52 2HG2 ILE 52 -6.640 -3.080 6.543 383 HG23 ILE 52 3HG2 ILE 52 -6.340 -2.437 4.927 384 HD11 ILE 52 3HD1 ILE 52 -8.374 -2.021 2.891 385 HD12 ILE 52 1HD1 ILE 52 -7.727 -3.103 1.658 386 HD13 ILE 52 2HD1 ILE 52 -6.684 -2.515 2.956 387 H THR 53 H THR 53 -7.082 -6.127 7.621 388 HA THR 53 HA THR 53 -8.208 -4.574 9.844 389 HB THR 53 HB THR 53 -7.079 -6.308 11.276 390 HG1 THR 53 HG1 THR 53 -5.913 -7.837 10.362 391 HG21 THR 53 3HG2 THR 53 -9.456 -6.483 10.737 392 HG22 THR 53 1HG2 THR 53 -8.710 -8.081 10.810 393 HG23 THR 53 2HG2 THR 53 -9.063 -7.342 9.248 394 H ALA 54 H ALA 54 -6.579 -4.073 11.629 395 HA ALA 54 HA ALA 54 -4.514 -2.444 10.594 396 HB1 ALA 54 3HB ALA 54 -3.878 -2.085 12.921 397 HB2 ALA 54 1HB ALA 54 -4.900 -3.433 13.418 398 HB3 ALA 54 2HB ALA 54 -5.628 -1.984 12.725 399 H SER 55 H SER 55 -4.606 -5.738 11.719 400 HA SER 55 HA SER 55 -1.834 -6.136 12.074 401 HG SER 55 HG SER 55 -4.777 -8.937 11.805 402 HB2 SER 55 1HB SER 55 -2.516 -8.596 11.733 403 HB3 SER 55 2HB SER 55 -3.260 -7.728 13.078 404 H LEU 56 H LEU 56 -3.995 -6.587 9.307 405 HA LEU 56 HA LEU 56 -2.064 -7.692 7.566 406 HG LEU 56 HG LEU 56 -5.095 -8.267 8.061 407 HB2 LEU 56 1HB LEU 56 -4.586 -6.148 6.956 408 HB3 LEU 56 2HB LEU 56 -3.627 -6.987 5.753 409 HD11 LEU 56 1HD1 LEU 56 -5.617 -8.325 5.091 410 HD12 LEU 56 2HD1 LEU 56 -6.578 -7.474 6.299 411 HD13 LEU 56 3HD1 LEU 56 -6.503 -9.237 6.314 412 HD21 LEU 56 3HD2 LEU 56 -3.036 -9.464 7.550 413 HD22 LEU 56 1HD2 LEU 56 -3.474 -9.515 5.843 414 HD23 LEU 56 2HD2 LEU 56 -4.443 -10.390 7.029 415 H LEU 57 H LEU 57 -2.985 -4.402 8.355 416 HA LEU 57 HA LEU 57 -1.602 -3.088 6.289 417 HG LEU 57 HG LEU 57 -4.272 -2.588 7.591 418 HB2 LEU 57 1HB LEU 57 -2.314 -2.176 9.075 419 HB3 LEU 57 2HB LEU 57 -1.644 -1.123 7.845 420 HD11 LEU 57 1HD1 LEU 57 -3.704 0.303 8.232 421 HD12 LEU 57 2HD1 LEU 57 -4.370 -0.895 9.341 422 HD13 LEU 57 3HD1 LEU 57 -5.296 -0.393 7.925 423 HD21 LEU 57 3HD2 LEU 57 -3.011 -0.433 5.898 424 HD22 LEU 57 1HD2 LEU 57 -4.613 -1.130 5.662 425 HD23 LEU 57 2HD2 LEU 57 -3.176 -2.131 5.452 426 H GLN 58 H GLN 58 -0.586 -4.076 9.537 427 HA GLN 58 HA GLN 58 1.966 -2.861 9.427 428 HB2 GLN 58 1HB GLN 58 0.964 -5.188 11.068 429 HB3 GLN 58 2HB GLN 58 2.533 -4.429 11.293 430 HG2 GLN 58 1HG GLN 58 1.369 -2.281 11.733 431 HG3 GLN 58 2HG GLN 58 -0.163 -3.149 11.655 432 HE21 GLN 58 2HE2 GLN 58 1.069 -1.682 13.867 433 HE22 GLN 58 1HE2 GLN 58 1.207 -2.807 15.175 434 H GLN 59 H GLN 59 0.782 -6.035 8.472 435 HA GLN 59 HA GLN 59 3.355 -7.096 7.862 436 HB2 GLN 59 1HB GLN 59 0.610 -7.922 6.912 437 HB3 GLN 59 2HB GLN 59 2.084 -8.829 6.601 438 HG2 GLN 59 1HG GLN 59 2.403 -9.070 9.038 439 HG3 GLN 59 2HG GLN 59 0.859 -8.257 9.290 440 HE21 GLN 59 2HE2 GLN 59 1.731 -10.949 10.007 441 HE22 GLN 59 1HE2 GLN 59 0.608 -12.032 9.256 442 H ALA 60 H ALA 60 0.896 -5.364 6.042 443 HA ALA 60 HA ALA 60 2.086 -5.624 3.487 444 HB1 ALA 60 3HB ALA 60 0.628 -3.786 2.825 445 HB2 ALA 60 1HB ALA 60 0.273 -3.443 4.518 446 HB3 ALA 60 2HB ALA 60 -0.253 -4.965 3.796 447 H ALA 61 H ALA 61 2.665 -3.518 6.186 448 HA ALA 61 HA ALA 61 4.213 -1.577 4.779 449 HB1 ALA 61 3HB ALA 61 4.846 -0.772 6.990 450 HB2 ALA 61 1HB ALA 61 4.183 -2.230 7.727 451 HB3 ALA 61 2HB ALA 61 3.113 -1.084 6.920 452 H GLY 62 H GLY 62 4.796 -4.769 5.586 453 HA2 GLY 62 1HA GLY 62 6.681 -6.039 5.144 454 HA3 GLY 62 2HA GLY 62 7.563 -4.559 4.804 455 H LEU 63 H LEU 63 5.884 -4.601 7.771 456 HA LEU 63 HA LEU 63 8.428 -4.550 9.178 457 HG LEU 63 HG LEU 63 6.315 -2.301 8.580 458 HB2 LEU 63 1HB LEU 63 5.625 -4.040 10.180 459 HB3 LEU 63 2HB LEU 63 7.097 -3.777 11.096 460 HD11 LEU 63 1HD1 LEU 63 4.920 -1.703 10.489 461 HD12 LEU 63 2HD1 LEU 63 6.007 -0.384 10.055 462 HD13 LEU 63 3HD1 LEU 63 6.363 -1.396 11.456 463 HD21 LEU 63 3HD2 LEU 63 8.653 -1.905 10.447 464 HD22 LEU 63 1HD2 LEU 63 8.232 -0.871 9.081 465 HD23 LEU 63 2HD2 LEU 63 8.734 -2.538 8.802 466 H ALA 64 H ALA 64 6.923 -7.025 8.132 467 HA ALA 64 HA ALA 64 6.595 -8.510 10.628 468 HB1 ALA 64 3HB ALA 64 4.817 -8.687 8.949 469 HB2 ALA 64 1HB ALA 64 5.576 -10.247 9.266 470 HB3 ALA 64 2HB ALA 64 5.978 -9.352 7.800 471 H GLU 65 H GLU 65 8.898 -7.990 8.178 472 HA GLU 65 HA GLU 65 10.353 -10.418 8.983 473 HB2 GLU 65 1HB GLU 65 9.538 -10.636 6.679 474 HB3 GLU 65 2HB GLU 65 10.328 -9.126 6.248 475 HG2 GLU 65 1HG GLU 65 12.489 -10.082 6.585 476 HG3 GLU 65 2HG GLU 65 11.790 -11.552 7.258 477 H VAL 66 H VAL 66 12.088 -9.926 10.101 478 HA VAL 66 HA VAL 66 13.302 -7.296 9.873 479 HB VAL 66 HB VAL 66 14.073 -9.601 11.677 480 HG11 VAL 66 1HG1 VAL 66 15.891 -8.021 11.336 481 HG12 VAL 66 2HG1 VAL 66 15.257 -7.889 12.976 482 HG13 VAL 66 3HG1 VAL 66 14.828 -6.681 11.765 483 HG21 VAL 66 3HG2 VAL 66 12.341 -7.196 12.241 484 HG22 VAL 66 1HG2 VAL 66 12.888 -8.366 13.441 485 HG23 VAL 66 2HG2 VAL 66 11.804 -8.873 12.146 486 H VAL 67 H VAL 67 14.949 -6.901 8.555 487 HA VAL 67 HA VAL 67 16.434 -9.129 7.388 488 HB VAL 67 HB VAL 67 16.545 -6.185 6.695 489 HG11 VAL 67 1HG1 VAL 67 18.579 -7.358 6.065 490 HG12 VAL 67 2HG1 VAL 67 17.640 -6.938 4.631 491 HG13 VAL 67 3HG1 VAL 67 17.629 -8.593 5.237 492 HG21 VAL 67 3HG2 VAL 67 15.192 -6.787 4.741 493 HG22 VAL 67 1HG2 VAL 67 14.338 -7.110 6.251 494 HG23 VAL 67 2HG2 VAL 67 15.063 -8.439 5.344 495 H ARG 68 H ARG 68 18.498 -9.580 7.887 496 HA ARG 68 HA ARG 68 19.918 -7.720 9.671 497 HE ARG 68 HE ARG 68 18.364 -10.113 14.229 498 HB2 ARG 68 1HB ARG 68 19.767 -10.733 9.826 499 HB3 ARG 68 2HB ARG 68 20.925 -9.769 10.731 500 HG2 ARG 68 1HG ARG 68 19.194 -8.715 11.976 501 HG3 ARG 68 2HG ARG 68 17.947 -9.414 10.942 502 HD2 ARG 68 1HD ARG 68 18.468 -11.627 11.730 503 HD3 ARG 68 2HD ARG 68 19.841 -11.018 12.653 504 HH11 ARG 68 1HH1 ARG 68 16.634 -11.719 11.630 505 HH12 ARG 68 2HH1 ARG 68 15.143 -11.819 12.525 506 HH21 ARG 68 1HH2 ARG 68 16.433 -10.274 15.402 507 HH22 ARG 68 2HH2 ARG 68 15.044 -11.044 14.690 508 H ASP 69 H ASP 69 22.085 -7.451 9.333 509 HA ASP 69 HA ASP 69 23.117 -8.260 6.761 510 HB2 ASP 69 1HB ASP 69 24.270 -6.606 9.014 511 HB3 ASP 69 2HB ASP 69 25.156 -6.962 7.535 512 HA PRO 70 HA PRO 70 25.633 -11.763 7.814 513 HB2 PRO 70 1HB PRO 70 28.007 -10.177 6.952 514 HB3 PRO 70 2HB PRO 70 27.491 -11.792 6.453 515 HG2 PRO 70 1HG PRO 70 27.135 -9.711 4.840 516 HG3 PRO 70 2HG PRO 70 25.894 -10.970 4.980 517 HD2 PRO 70 1HD PRO 70 25.947 -8.221 6.141 518 HD3 PRO 70 2HD PRO 70 24.577 -9.149 5.499 519 H LEU 71 H LEU 71 27.162 -12.522 9.354 520 HA LEU 71 HA LEU 71 27.061 -10.975 11.745 521 HG LEU 71 HG LEU 71 26.029 -13.804 10.916 522 HB2 LEU 71 1HB LEU 71 28.464 -13.576 11.153 523 HB3 LEU 71 2HB LEU 71 28.249 -12.896 12.754 524 HD11 LEU 71 1HD1 LEU 71 25.708 -15.582 12.555 525 HD12 LEU 71 2HD1 LEU 71 27.104 -15.003 13.465 526 HD13 LEU 71 3HD1 LEU 71 27.319 -15.655 11.840 527 HD21 LEU 71 3HD2 LEU 71 25.343 -11.919 12.295 528 HD22 LEU 71 1HD2 LEU 71 25.935 -12.742 13.739 529 HD23 LEU 71 2HD2 LEU 71 24.570 -13.408 12.841 530 H ALA 72 H ALA 72 29.112 -10.654 9.228 531 HA ALA 72 HA ALA 72 31.532 -10.178 10.760 532 HB1 ALA 72 3HB ALA 72 31.709 -11.130 8.514 533 HB2 ALA 72 1HB ALA 72 32.524 -9.569 8.608 534 HB3 ALA 72 2HB ALA 72 30.941 -9.693 7.842 535 H PHE 73 H PHE 73 28.705 -8.533 10.072 536 HA PHE 73 HA PHE 73 30.010 -5.904 10.306 537 HD1 PHE 73 HD1 PHE 73 29.939 -4.288 8.003 538 HD2 PHE 73 HD2 PHE 73 27.893 -7.960 7.339 539 HE1 PHE 73 HE1 PHE 73 30.996 -4.472 5.790 540 HE2 PHE 73 HE2 PHE 73 28.950 -8.151 5.125 541 HZ PHE 73 HZ PHE 73 30.503 -6.406 4.349 542 HB2 PHE 73 1HB PHE 73 27.296 -6.594 9.155 543 HB3 PHE 73 2HB PHE 73 27.935 -4.962 9.328 544 H LEU 74 H LEU 74 29.917 -5.096 12.277 545 HA LEU 74 HA LEU 74 27.641 -5.751 14.009 546 HG LEU 74 HG LEU 74 28.544 -3.777 16.281 547 HB2 LEU 74 1HB LEU 74 29.893 -6.116 14.925 548 HB3 LEU 74 2HB LEU 74 30.286 -4.432 14.645 549 HD11 LEU 74 1HD1 LEU 74 28.332 -6.743 16.776 550 HD12 LEU 74 2HD1 LEU 74 27.087 -5.717 16.064 551 HD13 LEU 74 3HD1 LEU 74 27.574 -5.476 17.741 552 HD21 LEU 74 3HD2 LEU 74 30.861 -3.993 16.984 553 HD22 LEU 74 1HD2 LEU 74 30.618 -5.708 17.311 554 HD23 LEU 74 2HD2 LEU 74 29.770 -4.498 18.274 555 H ASP 75 H ASP 75 26.093 -4.305 14.380 556 HA ASP 75 HA ASP 75 26.158 -1.758 13.084 557 HB2 ASP 75 1HB ASP 75 24.149 -3.173 14.813 558 HB3 ASP 75 2HB ASP 75 23.926 -1.480 14.387 559 H GLU 76 H GLU 76 25.502 0.246 14.269 560 HA GLU 76 HA GLU 76 27.463 0.765 16.290 561 HB2 GLU 76 1HB GLU 76 25.339 2.525 15.065 562 HB3 GLU 76 2HB GLU 76 26.465 3.086 16.288 563 HG2 GLU 76 1HG GLU 76 27.276 3.779 14.171 564 HG3 GLU 76 2HG GLU 76 28.329 2.490 14.751 565 HA PRO 77 HA PRO 77 23.594 1.453 19.120 566 HB2 PRO 77 1HB PRO 77 21.426 -0.010 17.781 567 HB3 PRO 77 2HB PRO 77 21.427 1.620 18.457 568 HG2 PRO 77 1HG PRO 77 21.349 1.193 15.809 569 HG3 PRO 77 2HG PRO 77 22.218 2.573 16.509 570 HD2 PRO 77 1HD PRO 77 23.298 -0.046 15.527 571 HD3 PRO 77 2HD PRO 77 23.926 1.596 15.269 572 H GLU 78 H GLU 78 21.983 -0.214 20.287 573 HA GLU 78 HA GLU 78 23.606 -2.558 20.782 574 HB2 GLU 78 1HB GLU 78 21.009 -1.673 22.058 575 HB3 GLU 78 2HB GLU 78 21.996 -3.020 22.600 576 HG2 GLU 78 1HG GLU 78 22.487 -1.260 24.059 577 HG3 GLU 78 2HG GLU 78 23.855 -1.332 22.950 578 H ALA 79 H ALA 79 20.748 -1.684 19.092 579 HA ALA 79 HA ALA 79 20.005 -4.475 18.643 580 HB1 ALA 79 3HB ALA 79 18.202 -2.889 19.117 581 HB2 ALA 79 1HB ALA 79 18.046 -3.562 17.494 582 HB3 ALA 79 2HB ALA 79 18.670 -1.927 17.715 583 H GLY 80 H GLY 80 19.753 -5.264 16.458 584 HA2 GLY 80 1HA GLY 80 21.862 -4.250 14.709 585 HA3 GLY 80 2HA GLY 80 21.040 -5.797 14.556 586 H ALA 81 H ALA 81 21.206 -4.764 12.260 587 HA ALA 81 HA ALA 81 19.990 -4.271 10.414 588 HB1 ALA 81 3HB ALA 81 17.583 -4.037 10.489 589 HB2 ALA 81 1HB ALA 81 17.629 -3.861 12.243 590 HB3 ALA 81 2HB ALA 81 18.092 -5.390 11.500 591 H GLY 82 H GLY 82 19.155 -2.074 13.097 592 HA2 GLY 82 1HA GLY 82 20.428 0.144 12.019 593 HA3 GLY 82 2HA GLY 82 18.781 0.178 11.412 594 H ALA 83 H ALA 83 17.230 -0.546 13.430 595 HA ALA 83 HA ALA 83 16.139 0.265 15.254 596 HB1 ALA 83 3HB ALA 83 17.425 0.897 17.231 597 HB2 ALA 83 1HB ALA 83 18.900 0.960 16.267 598 HB3 ALA 83 2HB ALA 83 18.073 -0.578 16.514 599 H ARG 84 H ARG 84 16.812 1.927 12.923 600 HA ARG 84 HA ARG 84 16.933 4.619 14.108 601 HE ARG 84 HE ARG 84 21.896 5.290 12.029 602 HB2 ARG 84 1HB ARG 84 17.630 3.615 11.345 603 HB3 ARG 84 2HB ARG 84 17.571 5.320 11.773 604 HG2 ARG 84 1HG ARG 84 19.394 5.115 13.252 605 HG3 ARG 84 2HG ARG 84 19.319 3.351 13.219 606 HD2 ARG 84 1HD ARG 84 20.056 3.298 10.944 607 HD3 ARG 84 2HD ARG 84 19.923 5.049 10.805 608 HH11 ARG 84 1HH1 ARG 84 21.019 1.918 11.721 609 HH12 ARG 84 2HH1 ARG 84 22.593 1.334 12.167 610 HH21 ARG 84 1HH2 ARG 84 23.961 4.533 12.606 611 HH22 ARG 84 2HH2 ARG 84 24.270 2.820 12.653 612 HA PRO 85 HA PRO 85 12.752 5.589 13.053 613 HB2 PRO 85 1HB PRO 85 13.878 8.048 11.798 614 HB3 PRO 85 2HB PRO 85 12.588 7.885 12.994 615 HG2 PRO 85 1HG PRO 85 15.009 8.714 13.716 616 HG3 PRO 85 2HG PRO 85 14.076 7.621 14.755 617 HD2 PRO 85 1HD PRO 85 16.409 7.033 12.991 618 HD3 PRO 85 2HD PRO 85 15.973 6.331 14.562 619 H ALA 86 H ALA 86 15.221 6.039 10.553 620 HA ALA 86 HA ALA 86 13.400 6.193 8.375 621 HB1 ALA 86 3HB ALA 86 16.327 5.482 8.336 622 HB2 ALA 86 1HB ALA 86 15.668 7.118 8.287 623 HB3 ALA 86 2HB ALA 86 15.354 5.999 6.959 624 H ASN 87 H ASN 87 14.125 3.577 10.298 625 HA ASN 87 HA ASN 87 14.185 1.551 8.268 626 HB2 ASN 87 1HB ASN 87 13.735 1.413 11.251 627 HB3 ASN 87 2HB ASN 87 13.724 -0.008 10.213 628 HD21 ASN 87 2HD2 ASN 87 15.814 1.078 8.469 629 HD22 ASN 87 1HD2 ASN 87 17.298 0.917 9.348 630 H ALA 88 H ALA 88 11.722 3.195 10.101 631 HA ALA 88 HA ALA 88 9.625 1.387 9.283 632 HB1 ALA 88 3HB ALA 88 8.121 2.962 10.391 633 HB2 ALA 88 1HB ALA 88 9.453 4.097 10.603 634 HB3 ALA 88 2HB ALA 88 9.481 2.542 11.434 635 HA PRO 89 HA PRO 89 8.664 3.305 5.415 636 HB2 PRO 89 1HB PRO 89 5.803 2.933 5.979 637 HB3 PRO 89 2HB PRO 89 6.799 2.207 4.715 638 HG2 PRO 89 1HG PRO 89 5.879 0.777 6.801 639 HG3 PRO 89 2HG PRO 89 7.452 0.450 6.050 640 HD2 PRO 89 1HD PRO 89 6.830 1.909 8.588 641 HD3 PRO 89 2HD PRO 89 8.143 0.764 8.240 642 H GLU 90 H GLU 90 8.767 5.433 5.105 643 HA GLU 90 HA GLU 90 7.723 7.387 6.837 644 HB2 GLU 90 1HB GLU 90 9.553 7.955 5.383 645 HB3 GLU 90 2HB GLU 90 8.622 7.531 3.955 646 HG2 GLU 90 1HG GLU 90 7.091 9.402 4.439 647 HG3 GLU 90 2HG GLU 90 8.113 9.849 5.803 648 H VAL 91 H VAL 91 6.589 6.143 3.725 649 HA VAL 91 HA VAL 91 3.906 7.099 4.407 650 HB VAL 91 HB VAL 91 4.785 8.748 2.878 651 HG11 VAL 91 1HG1 VAL 91 5.373 6.455 1.017 652 HG12 VAL 91 2HG1 VAL 91 6.559 7.450 1.862 653 HG13 VAL 91 3HG1 VAL 91 5.531 8.165 0.619 654 HG21 VAL 91 3HG2 VAL 91 3.149 8.593 1.059 655 HG22 VAL 91 1HG2 VAL 91 2.436 8.162 2.614 656 HG23 VAL 91 2HG2 VAL 91 2.867 6.899 1.461 657 H LEU 92 H LEU 92 2.314 5.702 4.005 658 HA LEU 92 HA LEU 92 2.979 3.228 2.548 659 HG LEU 92 HG LEU 92 0.240 1.873 3.164 660 HB2 LEU 92 1HB LEU 92 2.475 2.874 4.932 661 HB3 LEU 92 2HB LEU 92 0.931 3.677 4.728 662 HD11 LEU 92 1HD1 LEU 92 1.548 -0.188 3.087 663 HD12 LEU 92 2HD1 LEU 92 2.816 0.577 4.044 664 HD13 LEU 92 3HD1 LEU 92 2.453 1.173 2.423 665 HD21 LEU 92 3HD2 LEU 92 -0.396 1.798 5.514 666 HD22 LEU 92 1HD2 LEU 92 1.104 0.957 5.904 667 HD23 LEU 92 2HD2 LEU 92 -0.106 0.175 4.887 668 H LEU 93 H LEU 93 2.239 3.472 0.541 669 HA LEU 93 HA LEU 93 -0.164 5.046 0.067 670 HG LEU 93 HG LEU 93 2.681 5.829 -0.675 671 HB2 LEU 93 1HB LEU 93 1.838 3.812 -1.820 672 HB3 LEU 93 2HB LEU 93 0.425 4.711 -2.342 673 HD11 LEU 93 1HD1 LEU 93 3.378 5.358 -2.958 674 HD12 LEU 93 2HD1 LEU 93 3.249 7.096 -2.682 675 HD13 LEU 93 3HD1 LEU 93 1.988 6.249 -3.578 676 HD21 LEU 93 3HD2 LEU 93 0.550 6.903 -0.189 677 HD22 LEU 93 1HD2 LEU 93 0.278 7.169 -1.912 678 HD23 LEU 93 2HD2 LEU 93 1.606 7.989 -1.092 679 H VAL 94 H VAL 94 -2.024 4.044 0.252 680 HA VAL 94 HA VAL 94 -2.209 1.220 -0.511 681 HB VAL 94 HB VAL 94 -4.200 2.934 0.991 682 HG11 VAL 94 1HG1 VAL 94 -5.340 0.822 1.487 683 HG12 VAL 94 2HG1 VAL 94 -4.184 -0.039 0.471 684 HG13 VAL 94 3HG1 VAL 94 -5.286 1.136 -0.248 685 HG21 VAL 94 3HG2 VAL 94 -3.530 1.642 2.960 686 HG22 VAL 94 1HG2 VAL 94 -2.170 2.540 2.285 687 HG23 VAL 94 2HG2 VAL 94 -2.311 0.806 1.996 688 H GLY 95 H GLY 95 -2.723 0.902 -2.555 689 HA2 GLY 95 1HA GLY 95 -4.450 2.746 -4.002 690 HA3 GLY 95 2HA GLY 95 -3.687 1.294 -4.646 691 H THR 96 H THR 96 -6.446 2.618 -3.079 692 HA THR 96 HA THR 96 -7.565 0.323 -1.945 693 HB THR 96 HB THR 96 -9.304 2.520 -3.004 694 HG1 THR 96 HG1 THR 96 -7.624 3.701 -2.147 695 HG21 THR 96 3HG2 THR 96 -9.210 1.016 -0.387 696 HG22 THR 96 1HG2 THR 96 -10.304 0.679 -1.727 697 HG23 THR 96 2HG2 THR 96 -10.425 2.206 -0.853 698 H GLY 97 H GLY 97 -7.553 1.431 -5.229 699 HA2 GLY 97 1HA GLY 97 -8.091 0.239 -7.133 700 HA3 GLY 97 2HA GLY 97 -8.691 -1.058 -6.112 701 H ARG 98 H ARG 98 -10.760 -0.456 -4.906 702 HA ARG 98 HA ARG 98 -12.623 0.482 -6.943 703 HE ARG 98 HE ARG 98 -14.524 -3.008 -6.371 704 HB2 ARG 98 1HB ARG 98 -13.036 -1.703 -5.890 705 HB3 ARG 98 2HB ARG 98 -13.143 -0.926 -4.317 706 HG2 ARG 98 1HG ARG 98 -15.106 0.314 -5.056 707 HG3 ARG 98 2HG ARG 98 -14.996 -0.450 -6.642 708 HD2 ARG 98 1HD ARG 98 -15.368 -1.918 -4.037 709 HD3 ARG 98 2HD ARG 98 -16.668 -1.507 -5.155 710 HH11 ARG 98 1HH1 ARG 98 -17.498 -3.229 -4.535 711 HH12 ARG 98 2HH1 ARG 98 -17.909 -4.796 -5.158 712 HH21 ARG 98 1HH2 ARG 98 -15.026 -5.101 -7.132 713 HH22 ARG 98 2HH2 ARG 98 -16.506 -5.859 -6.611 714 H ARG 99 H ARG 99 -12.092 2.694 -6.713 715 HA ARG 99 HA ARG 99 -12.508 4.818 -6.074 716 HE ARG 99 HE ARG 99 -17.533 5.976 -7.299 717 HB2 ARG 99 1HB ARG 99 -14.694 3.393 -4.593 718 HB3 ARG 99 2HB ARG 99 -14.464 5.126 -4.416 719 HG2 ARG 99 1HG ARG 99 -14.816 5.457 -6.779 720 HG3 ARG 99 2HG ARG 99 -14.925 3.714 -7.035 721 HD2 ARG 99 1HD ARG 99 -16.936 3.580 -5.751 722 HD3 ARG 99 2HD ARG 99 -16.773 5.253 -5.222 723 HH11 ARG 99 1HH1 ARG 99 -17.139 2.496 -7.309 724 HH12 ARG 99 2HH1 ARG 99 -18.183 2.250 -8.674 725 HH21 ARG 99 1HH2 ARG 99 -18.897 5.666 -9.086 726 HH22 ARG 99 2HH2 ARG 99 -19.198 4.055 -9.679 727 H GLN 100 H GLN 100 -13.052 6.118 -3.826 728 HA GLN 100 HA GLN 100 -10.669 5.603 -2.232 729 HB2 GLN 100 1HB GLN 100 -11.150 7.866 -3.134 730 HB3 GLN 100 2HB GLN 100 -12.625 7.912 -2.181 731 HG2 GLN 100 1HG GLN 100 -11.258 7.753 -0.129 732 HG3 GLN 100 2HG GLN 100 -9.807 7.825 -1.131 733 HE21 GLN 100 2HE2 GLN 100 -10.742 9.669 0.933 734 HE22 GLN 100 1HE2 GLN 100 -10.889 11.213 0.168 735 H HIS 101 H HIS 101 -10.704 5.192 -0.025 736 HA HIS 101 HA HIS 101 -13.327 4.959 1.260 737 HD1 HIS 101 HD1 HIS 101 -14.823 2.138 1.748 738 HD2 HIS 101 HD2 HIS 101 -12.206 2.231 -1.483 739 HE1 HIS 101 HE1 HIS 101 -16.051 1.030 -0.156 740 HE2 HIS 101 HE2 HIS 101 -14.510 1.274 -2.140 741 HB2 HIS 101 1HB HIS 101 -11.232 2.795 1.110 742 HB3 HIS 101 2HB HIS 101 -12.456 2.824 2.374 743 H LEU 102 H LEU 102 -13.371 5.938 3.140 744 HA LEU 102 HA LEU 102 -10.938 6.850 4.399 745 HG LEU 102 HG LEU 102 -12.244 7.408 7.166 746 HB2 LEU 102 1HB LEU 102 -12.961 8.253 4.357 747 HB3 LEU 102 2HB LEU 102 -13.825 7.036 5.276 748 HD11 LEU 102 1HD1 LEU 102 -10.850 9.415 7.146 749 HD12 LEU 102 2HD1 LEU 102 -11.277 9.695 5.459 750 HD13 LEU 102 3HD1 LEU 102 -10.350 8.262 5.908 751 HD21 LEU 102 3HD2 LEU 102 -13.199 9.560 7.847 752 HD22 LEU 102 1HD2 LEU 102 -14.415 8.501 7.132 753 HD23 LEU 102 2HD2 LEU 102 -13.746 9.835 6.193 754 H LEU 103 H LEU 103 -9.777 5.455 5.541 755 HA LEU 103 HA LEU 103 -10.924 3.129 6.758 756 HG LEU 103 HG LEU 103 -8.540 3.641 4.696 757 HB2 LEU 103 1HB LEU 103 -8.149 4.295 7.011 758 HB3 LEU 103 2HB LEU 103 -8.638 2.706 7.567 759 HD11 LEU 103 1HD1 LEU 103 -6.882 1.619 6.195 760 HD12 LEU 103 2HD1 LEU 103 -6.348 3.211 5.656 761 HD13 LEU 103 3HD1 LEU 103 -6.770 1.974 4.471 762 HD21 LEU 103 3HD2 LEU 103 -9.114 1.320 4.129 763 HD22 LEU 103 1HD2 LEU 103 -10.409 2.121 5.019 764 HD23 LEU 103 2HD2 LEU 103 -9.355 0.970 5.841 765 H GLY 104 H GLY 104 -10.247 2.672 9.149 766 HA2 GLY 104 1HA GLY 104 -11.344 4.971 10.633 767 HA3 GLY 104 2HA GLY 104 -11.552 3.287 11.085 768 HA PRO 105 HA PRO 105 -7.872 5.572 13.225 769 HB2 PRO 105 1HB PRO 105 -9.640 5.307 15.592 770 HB3 PRO 105 2HB PRO 105 -8.623 6.663 15.095 771 HG2 PRO 105 1HG PRO 105 -11.278 6.775 14.846 772 HG3 PRO 105 2HG PRO 105 -10.212 7.483 13.616 773 HD2 PRO 105 1HD PRO 105 -11.730 4.904 13.556 774 HD3 PRO 105 2HD PRO 105 -11.459 6.081 12.255 775 H GLU 106 H GLU 106 -10.087 3.007 14.214 776 HA GLU 106 HA GLU 106 -8.363 1.648 15.956 777 HB2 GLU 106 1HB GLU 106 -10.684 0.706 14.279 778 HB3 GLU 106 2HB GLU 106 -9.814 -0.372 15.358 779 HG2 GLU 106 1HG GLU 106 -11.784 0.378 16.469 780 HG3 GLU 106 2HG GLU 106 -10.398 1.139 17.244 781 H GLN 107 H GLN 107 -8.338 1.925 12.550 782 HA GLN 107 HA GLN 107 -6.726 -0.485 12.189 783 HB2 GLN 107 1HB GLN 107 -7.920 1.461 10.216 784 HB3 GLN 107 2HB GLN 107 -6.924 0.087 9.761 785 HG2 GLN 107 1HG GLN 107 -8.544 -1.460 10.489 786 HG3 GLN 107 2HG GLN 107 -9.447 -0.217 11.356 787 HE21 GLN 107 2HE2 GLN 107 -10.251 -2.104 9.214 788 HE22 GLN 107 1HE2 GLN 107 -10.918 -1.112 7.971 789 H VAL 108 H VAL 108 -6.521 2.948 11.182 790 HA VAL 108 HA VAL 108 -3.769 2.484 10.402 791 HB VAL 108 HB VAL 108 -3.872 4.790 9.475 792 HG11 VAL 108 1HG1 VAL 108 -4.400 2.863 8.092 793 HG12 VAL 108 2HG1 VAL 108 -5.423 4.233 7.659 794 HG13 VAL 108 3HG1 VAL 108 -6.078 2.914 8.631 795 HG21 VAL 108 3HG2 VAL 108 -6.749 4.668 10.382 796 HG22 VAL 108 1HG2 VAL 108 -6.050 5.910 9.344 797 HG23 VAL 108 2HG2 VAL 108 -5.506 5.746 11.015 798 H ARG 109 H ARG 109 -5.315 3.831 13.161 799 HA ARG 109 HA ARG 109 -3.623 5.988 13.701 800 HE ARG 109 HE ARG 109 -4.374 8.269 17.917 801 HB2 ARG 109 1HB ARG 109 -5.795 5.445 14.877 802 HB3 ARG 109 2HB ARG 109 -4.880 4.300 15.851 803 HG2 ARG 109 1HG ARG 109 -3.501 6.065 16.723 804 HG3 ARG 109 2HG ARG 109 -4.265 7.239 15.651 805 HD2 ARG 109 1HD ARG 109 -6.453 6.588 16.797 806 HD3 ARG 109 2HD ARG 109 -5.441 5.812 18.016 807 HH11 ARG 109 1HH1 ARG 109 -7.660 7.137 18.264 808 HH12 ARG 109 2HH1 ARG 109 -8.232 8.589 19.025 809 HH21 ARG 109 1HH2 ARG 109 -5.099 10.195 18.935 810 HH22 ARG 109 2HH2 ARG 109 -6.764 10.331 19.420 811 HA PRO 110 HA PRO 110 -0.919 2.804 16.392 812 HB2 PRO 110 1HB PRO 110 -1.218 0.559 14.448 813 HB3 PRO 110 2HB PRO 110 -0.977 0.508 16.199 814 HG2 PRO 110 1HG PRO 110 -3.373 0.030 15.159 815 HG3 PRO 110 2HG PRO 110 -3.207 0.974 16.651 816 HD2 PRO 110 1HD PRO 110 -3.796 1.898 13.874 817 HD3 PRO 110 2HD PRO 110 -4.403 2.515 15.423 818 H LEU 111 H LEU 111 -1.214 2.764 12.862 819 HA LEU 111 HA LEU 111 1.614 2.521 12.439 820 HG LEU 111 HG LEU 111 -0.776 0.925 11.287 821 HB2 LEU 111 1HB LEU 111 -0.615 3.263 10.547 822 HB3 LEU 111 2HB LEU 111 1.050 2.999 10.064 823 HD11 LEU 111 1HD1 LEU 111 0.266 1.248 8.476 824 HD12 LEU 111 2HD1 LEU 111 -1.401 1.478 9.005 825 HD13 LEU 111 3HD1 LEU 111 -0.665 -0.123 9.077 826 HD21 LEU 111 3HD2 LEU 111 2.053 0.707 10.255 827 HD22 LEU 111 1HD2 LEU 111 1.037 -0.646 10.756 828 HD23 LEU 111 2HD2 LEU 111 1.538 0.564 11.936 829 H LEU 112 H LEU 112 -0.749 5.161 12.303 830 HA LEU 112 HA LEU 112 1.077 7.180 11.558 831 HG LEU 112 HG LEU 112 -0.592 8.599 10.393 832 HB2 LEU 112 1HB LEU 112 -1.616 7.164 12.849 833 HB3 LEU 112 2HB LEU 112 -0.687 8.648 12.864 834 HD11 LEU 112 1HD1 LEU 112 -0.786 6.196 10.041 835 HD12 LEU 112 2HD1 LEU 112 -2.024 7.074 9.145 836 HD13 LEU 112 3HD1 LEU 112 -2.444 6.235 10.639 837 HD21 LEU 112 3HD2 LEU 112 -2.335 9.863 11.532 838 HD22 LEU 112 1HD2 LEU 112 -3.374 8.438 11.543 839 HD23 LEU 112 2HD2 LEU 112 -2.928 9.192 10.013 840 H ALA 113 H ALA 113 0.389 5.630 14.581 841 HA ALA 113 HA ALA 113 1.648 7.555 16.263 842 HB1 ALA 113 3HB ALA 113 0.026 5.931 17.116 843 HB2 ALA 113 1HB ALA 113 1.564 5.826 17.974 844 HB3 ALA 113 2HB ALA 113 1.152 4.621 16.754 845 H MET 114 H MET 114 2.787 5.093 14.171 846 HA MET 114 HA MET 114 5.438 5.011 15.380 847 HB2 MET 114 1HB MET 114 4.430 3.725 12.832 848 HB3 MET 114 2HB MET 114 5.976 3.411 13.605 849 HG2 MET 114 1HG MET 114 4.837 2.465 15.532 850 HG3 MET 114 2HG MET 114 3.277 2.805 14.785 851 HE1 MET 114 3HE MET 114 3.933 -0.045 15.861 852 HE2 MET 114 1HE MET 114 3.402 -1.070 14.525 853 HE3 MET 114 2HE MET 114 2.442 0.334 14.996 854 H GLY 115 H GLY 115 3.739 7.006 13.362 855 HA2 GLY 115 1HA GLY 115 4.565 8.922 12.294 856 HA3 GLY 115 2HA GLY 115 6.175 8.217 12.316 857 H VAL 116 H VAL 116 3.666 6.160 11.232 858 HA VAL 116 HA VAL 116 4.755 6.258 8.530 859 HB VAL 116 HB VAL 116 2.730 4.342 9.708 860 HG11 VAL 116 1HG1 VAL 116 4.307 4.212 7.139 861 HG12 VAL 116 2HG1 VAL 116 2.574 4.496 7.285 862 HG13 VAL 116 3HG1 VAL 116 3.254 2.941 7.763 863 HG21 VAL 116 3HG2 VAL 116 4.598 2.739 9.808 864 HG22 VAL 116 1HG2 VAL 116 4.863 4.136 10.852 865 HG23 VAL 116 2HG2 VAL 116 5.705 4.018 9.308 866 H GLY 117 H GLY 117 3.833 7.517 7.062 867 HA2 GLY 117 1HA GLY 117 1.185 8.601 7.501 868 HA3 GLY 117 2HA GLY 117 2.275 8.998 6.179 869 H VAL 118 H VAL 118 -0.263 6.915 7.274 870 HA VAL 118 HA VAL 118 -0.252 5.307 4.868 871 HB VAL 118 HB VAL 118 -2.372 5.442 7.021 872 HG11 VAL 118 1HG1 VAL 118 -1.777 3.332 4.948 873 HG12 VAL 118 2HG1 VAL 118 -3.153 4.433 4.948 874 HG13 VAL 118 3HG1 VAL 118 -2.999 3.215 6.214 875 HG21 VAL 118 3HG2 VAL 118 -1.299 3.458 7.979 876 HG22 VAL 118 1HG2 VAL 118 -0.229 4.859 8.007 877 HG23 VAL 118 2HG2 VAL 118 0.002 3.595 6.797 878 H GLU 119 H GLU 119 -1.146 5.931 3.026 879 HA GLU 119 HA GLU 119 -3.383 7.846 3.123 880 HB2 GLU 119 1HB GLU 119 -1.072 7.796 1.172 881 HB3 GLU 119 2HB GLU 119 -2.504 8.799 0.985 882 HG2 GLU 119 1HG GLU 119 -1.979 9.918 3.105 883 HG3 GLU 119 2HG GLU 119 -0.521 8.937 3.246 884 H ALA 120 H ALA 120 -5.153 7.224 2.085 885 HA ALA 120 HA ALA 120 -4.968 4.825 0.385 886 HB1 ALA 120 3HB ALA 120 -7.272 4.347 1.016 887 HB2 ALA 120 1HB ALA 120 -7.328 5.822 1.981 888 HB3 ALA 120 2HB ALA 120 -6.254 4.504 2.448 889 H MET 121 H MET 121 -5.204 5.192 -1.692 890 HA MET 121 HA MET 121 -7.211 7.103 -2.630 891 HB2 MET 121 1HB MET 121 -4.292 7.151 -3.429 892 HB3 MET 121 2HB MET 121 -5.557 7.939 -4.358 893 HG2 MET 121 1HG MET 121 -6.096 9.336 -2.413 894 HG3 MET 121 2HG MET 121 -4.787 8.564 -1.517 895 HE1 MET 121 3HE MET 121 -2.534 8.239 -3.716 896 HE2 MET 121 1HE MET 121 -2.220 8.847 -2.091 897 HE3 MET 121 2HE MET 121 -1.625 9.734 -3.496 898 H ASP 122 H ASP 122 -6.903 6.936 -5.295 899 HA ASP 122 HA ASP 122 -7.681 4.290 -5.965 900 HB2 ASP 122 1HB ASP 122 -6.831 6.623 -7.691 901 HB3 ASP 122 2HB ASP 122 -7.379 5.089 -8.355 902 H THR 123 H THR 123 -6.586 2.783 -7.338 903 HA THR 123 HA THR 123 -4.002 2.170 -6.502 904 HB THR 123 HB THR 123 -5.235 1.223 -9.090 905 HG1 THR 123 HG1 THR 123 -5.868 -0.515 -7.336 906 HG21 THR 123 3HG2 THR 123 -3.362 -0.096 -7.117 907 HG22 THR 123 1HG2 THR 123 -2.920 0.523 -8.707 908 HG23 THR 123 2HG2 THR 123 -4.019 -0.850 -8.570 909 H GLN 124 H GLN 124 -5.112 3.719 -9.495 910 HA GLN 124 HA GLN 124 -2.634 3.955 -10.763 911 HB2 GLN 124 1HB GLN 124 -4.752 4.352 -11.912 912 HB3 GLN 124 2HB GLN 124 -5.041 5.776 -10.923 913 HG2 GLN 124 1HG GLN 124 -3.142 6.894 -11.915 914 HG3 GLN 124 2HG GLN 124 -2.742 5.445 -12.836 915 HE21 GLN 124 2HE2 GLN 124 -3.392 8.153 -13.749 916 HE22 GLN 124 1HE2 GLN 124 -4.743 7.967 -14.822 917 H ALA 125 H ALA 125 -4.327 6.235 -8.622 918 HA ALA 125 HA ALA 125 -2.372 8.257 -8.688 919 HB1 ALA 125 3HB ALA 125 -4.361 7.638 -6.504 920 HB2 ALA 125 1HB ALA 125 -4.660 8.648 -7.918 921 HB3 ALA 125 2HB ALA 125 -3.482 9.155 -6.707 922 H ALA 126 H ALA 126 -2.825 5.474 -6.564 923 HA ALA 126 HA ALA 126 -0.776 6.092 -4.726 924 HB1 ALA 126 3HB ALA 126 -0.913 3.753 -4.055 925 HB2 ALA 126 1HB ALA 126 -1.843 3.379 -5.506 926 HB3 ALA 126 2HB ALA 126 -2.524 4.436 -4.270 927 H ALA 127 H ALA 127 -0.780 3.983 -7.601 928 HA ALA 127 HA ALA 127 1.946 3.270 -7.435 929 HB1 ALA 127 3HB ALA 127 0.310 2.007 -8.750 930 HB2 ALA 127 1HB ALA 127 1.699 2.485 -9.726 931 HB3 ALA 127 2HB ALA 127 0.174 3.358 -9.876 932 H ARG 128 H ARG 128 0.274 5.897 -9.079 933 HA ARG 128 HA ARG 128 2.418 6.933 -10.551 934 HE ARG 128 HE ARG 128 1.390 11.421 -12.359 935 HB2 ARG 128 1HB ARG 128 0.029 7.591 -10.801 936 HB3 ARG 128 2HB ARG 128 0.138 8.457 -9.276 937 HG2 ARG 128 1HG ARG 128 1.825 9.939 -10.237 938 HG3 ARG 128 2HG ARG 128 1.704 9.072 -11.771 939 HD2 ARG 128 1HD ARG 128 -0.703 9.667 -11.856 940 HD3 ARG 128 2HD ARG 128 -0.479 10.631 -10.396 941 HH11 ARG 128 1HH1 ARG 128 -2.025 11.634 -11.592 942 HH12 ARG 128 2HH1 ARG 128 -2.267 13.095 -12.502 943 HH21 ARG 128 1HH2 ARG 128 1.066 13.343 -13.541 944 HH22 ARG 128 2HH2 ARG 128 -0.510 14.062 -13.602 945 H THR 129 H THR 129 1.232 7.812 -7.319 946 HA THR 129 HA THR 129 3.272 9.675 -6.744 947 HB THR 129 HB THR 129 1.711 8.041 -4.734 948 HG1 THR 129 HG1 THR 129 0.148 8.981 -5.960 949 HG21 THR 129 3HG2 THR 129 1.991 10.012 -3.306 950 HG22 THR 129 1HG2 THR 129 2.916 10.808 -4.579 951 HG23 THR 129 2HG2 THR 129 3.555 9.364 -3.797 952 H TYR 130 H TYR 130 2.976 6.201 -6.257 953 HA TYR 130 HA TYR 130 5.220 5.762 -4.651 954 HD1 TYR 130 HD1 TYR 130 5.603 3.419 -3.460 955 HD2 TYR 130 HD2 TYR 130 5.485 2.482 -7.609 956 HE1 TYR 130 HE1 TYR 130 7.302 1.676 -3.110 957 HE2 TYR 130 HE2 TYR 130 7.183 0.737 -7.269 958 HH TYR 130 HH TYR 130 8.053 -0.403 -4.207 959 HB2 TYR 130 1HB TYR 130 3.605 4.004 -5.027 960 HB3 TYR 130 2HB TYR 130 3.945 3.999 -6.753 961 H ASN 131 H ASN 131 4.924 5.788 -8.195 962 HA ASN 131 HA ASN 131 7.579 5.211 -8.816 963 HB2 ASN 131 1HB ASN 131 5.571 6.919 -10.295 964 HB3 ASN 131 2HB ASN 131 7.138 6.472 -10.960 965 HD21 ASN 131 2HD2 ASN 131 4.478 5.857 -11.946 966 HD22 ASN 131 1HD2 ASN 131 4.374 4.130 -11.999 967 H ILE 132 H ILE 132 6.042 8.334 -8.145 968 HA ILE 132 HA ILE 132 8.314 9.941 -8.604 969 HB ILE 132 HB ILE 132 6.037 10.473 -6.686 970 HG12 ILE 132 1HG1 ILE 132 6.373 11.312 -9.575 971 HG13 ILE 132 2HG1 ILE 132 5.297 10.036 -9.014 972 HG21 ILE 132 1HG2 ILE 132 6.637 12.838 -6.991 973 HG22 ILE 132 2HG2 ILE 132 8.023 12.348 -7.964 974 HG23 ILE 132 3HG2 ILE 132 7.945 11.909 -6.257 975 HD11 ILE 132 3HD1 ILE 132 5.107 12.955 -8.303 976 HD12 ILE 132 1HD1 ILE 132 4.029 11.682 -7.730 977 HD13 ILE 132 2HD1 ILE 132 4.080 12.087 -9.445 978 H LEU 133 H LEU 133 6.989 8.626 -5.576 979 HA LEU 133 HA LEU 133 8.991 9.682 -3.898 980 HG LEU 133 HG LEU 133 5.981 9.504 -3.750 981 HB2 LEU 133 1HB LEU 133 7.160 7.317 -3.506 982 HB3 LEU 133 2HB LEU 133 8.142 8.032 -2.241 983 HD11 LEU 133 1HD1 LEU 133 5.922 8.279 -0.997 984 HD12 LEU 133 2HD1 LEU 133 5.024 7.713 -2.405 985 HD13 LEU 133 3HD1 LEU 133 4.663 9.292 -1.704 986 HD21 LEU 133 3HD2 LEU 133 7.734 10.953 -2.865 987 HD22 LEU 133 1HD2 LEU 133 7.542 10.222 -1.271 988 HD23 LEU 133 2HD2 LEU 133 6.228 11.164 -1.972 989 H MET 134 H MET 134 8.738 6.626 -5.627 990 HA MET 134 HA MET 134 10.970 5.358 -4.449 991 HB2 MET 134 1HB MET 134 9.347 4.095 -5.743 992 HB3 MET 134 2HB MET 134 9.744 5.012 -7.191 993 HG2 MET 134 1HG MET 134 12.030 4.092 -7.104 994 HG3 MET 134 2HG MET 134 11.554 3.115 -5.716 995 HE1 MET 134 3HE MET 134 10.843 3.853 -9.530 996 HE2 MET 134 1HE MET 134 9.254 3.967 -8.775 997 HE3 MET 134 2HE MET 134 9.611 2.639 -9.881 998 H ALA 135 H ALA 135 10.626 7.454 -7.278 999 HA ALA 135 HA ALA 135 13.305 7.304 -8.144 1000 HB1 ALA 135 3HB ALA 135 11.486 8.175 -9.539 1001 HB2 ALA 135 1HB ALA 135 12.826 9.316 -9.420 1002 HB3 ALA 135 2HB ALA 135 11.356 9.581 -8.481 1003 H GLU 136 H GLU 136 11.701 9.241 -5.711 1004 HA GLU 136 HA GLU 136 13.898 10.997 -5.214 1005 HB2 GLU 136 1HB GLU 136 11.517 10.246 -3.513 1006 HB3 GLU 136 2HB GLU 136 12.676 11.495 -3.086 1007 HG2 GLU 136 1HG GLU 136 12.068 12.732 -5.116 1008 HG3 GLU 136 2HG GLU 136 10.873 11.490 -5.497 1009 H GLY 137 H GLY 137 13.189 7.757 -4.377 1010 HA2 GLY 137 1HA GLY 137 14.460 6.206 -3.235 1011 HA3 GLY 137 2HA GLY 137 15.643 7.468 -2.914 1012 H ARG 138 H ARG 138 12.210 7.472 -2.100 1013 HA ARG 138 HA ARG 138 12.929 7.987 0.674 1014 HE ARG 138 HE ARG 138 9.826 10.718 1.342 1015 HB2 ARG 138 1HB ARG 138 10.302 8.252 -0.793 1016 HB3 ARG 138 2HB ARG 138 10.599 8.728 0.866 1017 HG2 ARG 138 1HG ARG 138 12.197 10.397 0.137 1018 HG3 ARG 138 2HG ARG 138 11.966 9.894 -1.539 1019 HD2 ARG 138 1HD ARG 138 10.647 11.828 -1.247 1020 HD3 ARG 138 2HD ARG 138 9.532 10.463 -1.248 1021 HH11 ARG 138 1HH1 ARG 138 9.558 13.249 -1.072 1022 HH12 ARG 138 2HH1 ARG 138 8.893 14.411 0.036 1023 HH21 ARG 138 1HH2 ARG 138 8.967 12.245 2.805 1024 HH22 ARG 138 2HH2 ARG 138 8.530 13.838 2.235 1025 H ARG 139 H ARG 139 11.594 6.996 2.368 1026 HA ARG 139 HA ARG 139 11.350 4.159 1.998 1027 HE ARG 139 HE ARG 139 12.146 2.680 6.009 1028 HB2 ARG 139 1HB ARG 139 10.741 6.000 4.309 1029 HB3 ARG 139 2HB ARG 139 10.431 4.272 4.376 1030 HG2 ARG 139 1HG ARG 139 13.139 5.423 3.765 1031 HG3 ARG 139 2HG ARG 139 12.592 5.049 5.401 1032 HD2 ARG 139 1HD ARG 139 12.684 3.063 3.134 1033 HD3 ARG 139 2HD ARG 139 13.947 3.244 4.350 1034 HH11 ARG 139 1HH1 ARG 139 12.055 1.535 2.689 1035 HH12 ARG 139 2HH1 ARG 139 11.074 0.148 3.073 1036 HH21 ARG 139 1HH2 ARG 139 10.896 0.825 6.511 1037 HH22 ARG 139 2HH2 ARG 139 10.402 -0.254 5.238 1038 H VAL 140 H VAL 140 9.785 4.113 0.313 1039 HA VAL 140 HA VAL 140 7.054 4.709 1.226 1040 HB VAL 140 HB VAL 140 7.584 6.201 -0.573 1041 HG11 VAL 140 1HG1 VAL 140 9.457 5.022 -1.565 1042 HG12 VAL 140 2HG1 VAL 140 8.258 5.412 -2.800 1043 HG13 VAL 140 3HG1 VAL 140 8.374 3.769 -2.170 1044 HG21 VAL 140 3HG2 VAL 140 5.327 5.300 -0.579 1045 HG22 VAL 140 1HG2 VAL 140 5.852 3.942 -1.574 1046 HG23 VAL 140 2HG2 VAL 140 5.882 5.578 -2.229 1047 H VAL 141 H VAL 141 5.872 3.003 1.579 1048 HA VAL 141 HA VAL 141 6.392 0.549 0.033 1049 HB VAL 141 HB VAL 141 4.904 0.796 2.660 1050 HG11 VAL 141 1HG1 VAL 141 4.175 -1.093 1.305 1051 HG12 VAL 141 2HG1 VAL 141 5.073 -1.647 2.718 1052 HG13 VAL 141 3HG1 VAL 141 5.847 -1.630 1.133 1053 HG21 VAL 141 3HG2 VAL 141 7.710 -0.177 2.130 1054 HG22 VAL 141 1HG2 VAL 141 6.869 -0.261 3.679 1055 HG23 VAL 141 2HG2 VAL 141 7.263 1.307 2.971 1056 H VAL 142 H VAL 142 4.783 -0.234 -1.252 1057 HA VAL 142 HA VAL 142 2.281 1.317 -1.224 1058 HB VAL 142 HB VAL 142 3.709 1.825 -3.183 1059 HG11 VAL 142 1HG1 VAL 142 3.974 0.165 -4.961 1060 HG12 VAL 142 2HG1 VAL 142 3.246 -1.059 -3.922 1061 HG13 VAL 142 3HG1 VAL 142 4.788 -0.329 -3.476 1062 HG21 VAL 142 3HG2 VAL 142 1.113 0.430 -3.802 1063 HG22 VAL 142 1HG2 VAL 142 1.960 1.533 -4.887 1064 HG23 VAL 142 2HG2 VAL 142 1.321 2.122 -3.352 1065 H ALA 143 H ALA 143 0.429 0.257 -1.128 1066 HA ALA 143 HA ALA 143 0.449 -2.666 -1.530 1067 HB1 ALA 143 3HB ALA 143 -1.413 -2.788 0.057 1068 HB2 ALA 143 1HB ALA 143 -1.340 -1.040 0.283 1069 HB3 ALA 143 2HB ALA 143 0.007 -2.055 0.802 1070 H LEU 144 H LEU 144 -0.453 -3.123 -3.431 1071 HA LEU 144 HA LEU 144 -2.423 -1.248 -4.538 1072 HG LEU 144 HG LEU 144 0.598 -1.459 -5.292 1073 HB2 LEU 144 1HB LEU 144 -0.787 -3.402 -5.878 1074 HB3 LEU 144 2HB LEU 144 -1.921 -2.347 -6.700 1075 HD11 LEU 144 1HD1 LEU 144 1.075 -2.680 -7.337 1076 HD12 LEU 144 2HD1 LEU 144 1.412 -0.962 -7.546 1077 HD13 LEU 144 3HD1 LEU 144 -0.057 -1.663 -8.230 1078 HD21 LEU 144 3HD2 LEU 144 -1.410 0.102 -6.914 1079 HD22 LEU 144 1HD2 LEU 144 0.124 0.723 -6.303 1080 HD23 LEU 144 2HD2 LEU 144 -1.140 0.232 -5.177 1081 H LEU 145 H LEU 145 -4.484 -1.772 -4.445 1082 HA LEU 145 HA LEU 145 -5.263 -4.595 -4.232 1083 HG LEU 145 HG LEU 145 -5.127 -2.697 -1.901 1084 HB2 LEU 145 1HB LEU 145 -6.824 -2.067 -3.671 1085 HB3 LEU 145 2HB LEU 145 -7.466 -3.690 -3.524 1086 HD11 LEU 145 1HD1 LEU 145 -7.082 -1.329 -1.400 1087 HD12 LEU 145 2HD1 LEU 145 -6.728 -2.423 -0.064 1088 HD13 LEU 145 3HD1 LEU 145 -8.054 -2.782 -1.169 1089 HD21 LEU 145 3HD2 LEU 145 -5.303 -5.113 -2.127 1090 HD22 LEU 145 1HD2 LEU 145 -6.984 -5.052 -1.601 1091 HD23 LEU 145 2HD2 LEU 145 -5.694 -4.610 -0.484 1092 HA PRO 146 HA PRO 146 -6.959 -3.965 -8.393 1093 HB2 PRO 146 1HB PRO 146 -6.727 -6.534 -9.172 1094 HB3 PRO 146 2HB PRO 146 -5.362 -5.413 -9.238 1095 HG2 PRO 146 1HG PRO 146 -5.944 -7.578 -7.285 1096 HG3 PRO 146 2HG PRO 146 -4.386 -7.008 -7.901 1097 HD2 PRO 146 1HD PRO 146 -5.514 -6.338 -5.435 1098 HD3 PRO 146 2HD PRO 146 -4.184 -5.479 -6.234 1099 H ASP 147 H ASP 147 -9.104 -4.309 -8.928 1100 HA ASP 147 HA ASP 147 -10.838 -5.170 -6.874 1101 HB2 ASP 147 1HB ASP 147 -11.303 -3.540 -8.851 1102 HB3 ASP 147 2HB ASP 147 -11.717 -5.000 -9.744 1103 H GLY 148 H GLY 148 -12.277 -6.962 -6.868 1104 HA2 GLY 148 1HA GLY 148 -11.351 -9.281 -8.412 1105 HA3 GLY 148 2HA GLY 148 -11.291 -9.347 -6.657 1106 H ASP 149 H ASP 149 -13.876 -7.477 -7.288 1107 HA ASP 149 HA ASP 149 -15.670 -9.813 -7.214 1108 HB2 ASP 149 1HB ASP 149 -15.481 -8.314 -5.126 1109 HB3 ASP 149 2HB ASP 149 -16.355 -7.113 -6.071 1110 H SER 150 H SER 150 -17.764 -9.536 -8.243 1111 HA SER 150 HA SER 150 -17.399 -8.153 -10.758 1112 HG SER 150 HG SER 150 -17.200 -10.472 -11.212 1113 HB2 SER 150 1HB SER 150 -19.642 -9.967 -9.850 1114 HB3 SER 150 2HB SER 150 -19.333 -9.438 -11.505 1115 H LEU 151 H LEU 151 -19.140 -7.672 -7.809 1116 HA LEU 151 HA LEU 151 -20.672 -5.520 -9.120 1117 HG LEU 151 HG LEU 151 -21.899 -8.401 -9.136 1118 HB2 LEU 151 1HB LEU 151 -21.625 -7.377 -6.942 1119 HB3 LEU 151 2HB LEU 151 -22.492 -5.951 -7.476 1120 HD11 LEU 151 1HD1 LEU 151 -24.485 -7.308 -8.038 1121 HD12 LEU 151 2HD1 LEU 151 -23.640 -8.744 -7.463 1122 HD13 LEU 151 3HD1 LEU 151 -24.321 -8.713 -9.091 1123 HD21 LEU 151 3HD2 LEU 151 -23.411 -5.894 -9.863 1124 HD22 LEU 151 1HD2 LEU 151 -23.262 -7.340 -10.860 1125 HD23 LEU 151 2HD2 LEU 151 -21.836 -6.370 -10.495 1126 H GLU 152 H GLU 152 -21.294 -3.759 -7.721 1127 HA GLU 152 HA GLU 152 -19.214 -2.724 -6.171 1128 HB2 GLU 152 1HB GLU 152 -22.146 -2.004 -6.219 1129 HB3 GLU 152 2HB GLU 152 -20.903 -1.043 -5.432 1130 HG2 GLU 152 1HG GLU 152 -19.871 -0.516 -7.486 1131 HG3 GLU 152 2HG GLU 152 -20.817 -1.731 -8.348 1132 H HIS 153 H HIS 153 -22.092 -4.508 -5.274 1133 HA HIS 153 HA HIS 153 -21.059 -4.696 -2.525 1134 HD1 HIS 153 HD1 HIS 153 -24.021 -2.164 -4.025 1135 HD2 HIS 153 HD2 HIS 153 -22.431 -2.964 -0.263 1136 HE1 HIS 153 HE1 HIS 153 -23.868 0.060 -2.864 1137 HE2 HIS 153 HE2 HIS 153 -23.089 -0.475 -0.525 1138 HB2 HIS 153 1HB HIS 153 -23.930 -4.636 -3.483 1139 HB3 HIS 153 2HB HIS 153 -23.461 -5.105 -1.853 1140 H HIS 154 H HIS 154 -20.665 -6.694 -1.794 1141 HA HIS 154 HA HIS 154 -20.848 -8.910 -3.585 1142 HD1 HIS 154 HD1 HIS 154 -18.269 -10.404 -3.544 1143 HD2 HIS 154 HD2 HIS 154 -20.602 -11.741 -0.357 1144 HE1 HIS 154 HE1 HIS 154 -17.954 -12.896 -3.461 1145 HE2 HIS 154 HE2 HIS 154 -19.303 -13.684 -1.486 1146 HB2 HIS 154 1HB HIS 154 -19.040 -8.541 -1.849 1147 HB3 HIS 154 2HB HIS 154 -20.218 -9.010 -0.629 1148 H HIS 155 H HIS 155 -22.837 -7.590 -1.105 1149 HA HIS 155 HA HIS 155 -24.647 -9.895 -1.251 1150 HD1 HIS 155 HD1 HIS 155 -25.361 -10.937 1.601 1151 HD2 HIS 155 HD2 HIS 155 -22.360 -8.065 1.840 1152 HE1 HIS 155 HE1 HIS 155 -23.733 -11.792 3.320 1153 HE2 HIS 155 HE2 HIS 155 -22.059 -9.928 3.608 1154 HB2 HIS 155 1HB HIS 155 -24.716 -7.420 0.493 1155 HB3 HIS 155 2HB HIS 155 -25.958 -8.667 0.498 1156 H HIS 156 H HIS 156 -26.557 -9.782 -2.356 1157 HA HIS 156 HA HIS 156 -26.731 -7.989 -4.496 1158 HD1 HIS 156 HD1 HIS 156 -30.934 -8.421 -4.624 1159 HD2 HIS 156 HD2 HIS 156 -27.683 -9.358 -7.053 1160 HE1 HIS 156 HE1 HIS 156 -31.692 -7.978 -6.977 1161 HE2 HIS 156 HE2 HIS 156 -29.753 -8.646 -8.439 1162 HB2 HIS 156 1HB HIS 156 -27.785 -10.291 -4.320 1163 HB3 HIS 156 2HB HIS 156 -29.061 -9.546 -3.364 1164 H HIS 157 H HIS 157 -28.406 -8.008 -1.380 1165 HA HIS 157 HA HIS 157 -28.876 -5.140 -1.772 1166 HD1 HIS 157 HD1 HIS 157 -30.832 -3.464 -1.912 1167 HD2 HIS 157 HD2 HIS 157 -32.317 -5.688 1.277 1168 HE1 HIS 157 HE1 HIS 157 -32.129 -1.837 -0.493 1169 HE2 HIS 157 HE2 HIS 157 -32.813 -3.161 1.545 1170 HB2 HIS 157 1HB HIS 157 -31.029 -6.275 -2.170 1171 HB3 HIS 157 2HB HIS 157 -30.913 -7.045 -0.589 1172 H HIS 158 H HIS 158 -27.239 -4.547 -0.457 1173 HA HIS 158 HA HIS 158 -27.048 -5.653 2.229 1174 HD1 HIS 158 HD1 HIS 158 -24.465 -5.862 3.682 1175 HD2 HIS 158 HD2 HIS 158 -24.499 -1.859 2.542 1176 HE1 HIS 158 HE1 HIS 158 -23.286 -4.618 5.522 1177 HE2 HIS 158 HE2 HIS 158 -23.172 -2.228 4.732 1178 HB2 HIS 158 1HB HIS 158 -24.950 -5.354 1.072 1179 HB3 HIS 158 2HB HIS 158 -25.339 -3.683 0.692 Start of MODEL 14 1 HA MET 1 HA MET 1 35.964 -3.287 -0.061 2 H1 MET 1 1H MET 1 33.941 -4.375 0.664 3 H2 MET 1 2H MET 1 34.839 -5.351 -0.392 4 H3 MET 1 3H MET 1 33.446 -4.562 -0.948 5 HB2 MET 1 1HB MET 1 34.694 -3.632 -2.775 6 HB3 MET 1 2HB MET 1 35.959 -2.454 -2.461 7 HG2 MET 1 1HG MET 1 37.473 -4.243 -1.796 8 HG3 MET 1 2HG MET 1 36.203 -5.429 -2.092 9 HE1 MET 1 3HE MET 1 38.761 -6.045 -5.012 10 HE2 MET 1 1HE MET 1 37.920 -6.764 -3.640 11 HE3 MET 1 2HE MET 1 39.156 -5.536 -3.372 12 H LYS 2 H LYS 2 32.563 -2.943 -0.675 13 HA LYS 2 HA LYS 2 32.823 -0.037 -0.273 14 HB2 LYS 2 1HB LYS 2 30.660 -1.630 -1.646 15 HB3 LYS 2 2HB LYS 2 30.499 0.073 -1.245 16 HG2 LYS 2 1HG LYS 2 32.459 0.558 -2.659 17 HG3 LYS 2 2HG LYS 2 32.518 -1.148 -3.114 18 HD2 LYS 2 1HD LYS 2 30.304 -0.996 -4.089 19 HD3 LYS 2 2HD LYS 2 30.156 0.679 -3.553 20 HE2 LYS 2 1HE LYS 2 30.723 0.663 -5.883 21 HE3 LYS 2 2HE LYS 2 32.109 1.251 -4.965 22 HZ1 LYS 2 3HZ LYS 2 31.767 -1.304 -6.382 23 HZ2 LYS 2 1HZ LYS 2 32.824 -1.225 -5.057 24 HZ3 LYS 2 2HZ LYS 2 33.075 -0.224 -6.401 25 H LEU 3 H LEU 3 31.056 0.979 0.946 26 HA LEU 3 HA LEU 3 30.287 -0.589 3.262 27 HG LEU 3 HG LEU 3 32.085 1.993 2.897 28 HB2 LEU 3 1HB LEU 3 29.664 2.281 2.540 29 HB3 LEU 3 2HB LEU 3 29.350 1.526 4.090 30 HD11 LEU 3 1HD1 LEU 3 30.675 3.366 5.180 31 HD12 LEU 3 2HD1 LEU 3 30.999 4.063 3.593 32 HD13 LEU 3 3HD1 LEU 3 32.338 3.653 4.667 33 HD21 LEU 3 3HD2 LEU 3 31.271 0.915 5.594 34 HD22 LEU 3 1HD2 LEU 3 32.917 1.289 5.087 35 HD23 LEU 3 2HD2 LEU 3 32.022 -0.005 4.291 36 H HIS 4 H HIS 4 28.861 0.984 0.480 37 HA HIS 4 HA HIS 4 26.579 -0.862 0.704 38 HD1 HIS 4 HD1 HIS 4 25.065 3.518 1.272 39 HD2 HIS 4 HD2 HIS 4 25.151 -0.455 2.511 40 HE1 HIS 4 HE1 HIS 4 23.962 3.485 3.533 41 HE2 HIS 4 HE2 HIS 4 23.949 1.059 4.231 42 HB2 HIS 4 1HB HIS 4 26.546 2.031 -0.177 43 HB3 HIS 4 2HB HIS 4 25.261 0.903 -0.586 44 H THR 5 H THR 5 27.081 -2.366 -0.788 45 HA THR 5 HA THR 5 28.602 -1.594 -3.140 46 HB THR 5 HB THR 5 27.700 -4.391 -2.457 47 HG1 THR 5 HG1 THR 5 28.964 -4.255 -0.762 48 HG21 THR 5 3HG2 THR 5 28.678 -4.053 -4.682 49 HG22 THR 5 1HG2 THR 5 29.751 -5.013 -3.662 50 HG23 THR 5 2HG2 THR 5 30.099 -3.307 -3.949 51 H ASP 6 H ASP 6 26.306 -0.388 -3.457 52 HA ASP 6 HA ASP 6 25.349 -1.385 -5.904 53 HB2 ASP 6 1HB ASP 6 24.140 -2.812 -3.987 54 HB3 ASP 6 2HB ASP 6 23.082 -1.404 -3.963 55 HA PRO 7 HA PRO 7 24.710 3.001 -5.880 56 HB2 PRO 7 1HB PRO 7 23.639 3.240 -8.364 57 HB3 PRO 7 2HB PRO 7 25.359 2.969 -8.074 58 HG2 PRO 7 1HG PRO 7 23.232 0.995 -8.815 59 HG3 PRO 7 2HG PRO 7 24.882 1.152 -9.446 60 HD2 PRO 7 1HD PRO 7 24.220 -0.692 -7.589 61 HD3 PRO 7 2HD PRO 7 25.816 0.085 -7.628 62 H ALA 8 H ALA 8 22.121 0.739 -6.558 63 HA ALA 8 HA ALA 8 20.201 2.491 -5.280 64 HB1 ALA 8 3HB ALA 8 18.606 2.447 -7.127 65 HB2 ALA 8 1HB ALA 8 19.777 1.593 -8.131 66 HB3 ALA 8 2HB ALA 8 20.104 3.244 -7.607 67 H THR 9 H THR 9 18.866 1.298 -4.070 68 HA THR 9 HA THR 9 19.223 -1.529 -4.007 69 HB THR 9 HB THR 9 17.390 -1.359 -2.212 70 HG1 THR 9 HG1 THR 9 16.448 0.577 -2.618 71 HG21 THR 9 3HG2 THR 9 19.952 0.210 -1.892 72 HG22 THR 9 1HG2 THR 9 19.777 -1.534 -1.701 73 HG23 THR 9 2HG2 THR 9 18.970 -0.440 -0.578 74 H ALA 10 H ALA 10 18.472 -2.191 -6.054 75 HA ALA 10 HA ALA 10 17.034 -3.391 -7.306 76 HB1 ALA 10 3HB ALA 10 14.940 -4.169 -6.390 77 HB2 ALA 10 1HB ALA 10 15.034 -2.972 -5.098 78 HB3 ALA 10 2HB ALA 10 16.217 -4.277 -5.180 79 H LEU 11 H LEU 11 14.922 -0.937 -5.816 80 HA LEU 11 HA LEU 11 13.397 0.491 -6.669 81 HG LEU 11 HG LEU 11 16.339 1.421 -7.252 82 HB2 LEU 11 1HB LEU 11 15.165 0.379 -9.114 83 HB3 LEU 11 2HB LEU 11 13.820 1.486 -8.919 84 HD11 LEU 11 1HD1 LEU 11 16.755 3.610 -8.248 85 HD12 LEU 11 2HD1 LEU 11 15.291 3.451 -9.219 86 HD13 LEU 11 3HD1 LEU 11 16.647 2.355 -9.483 87 HD21 LEU 11 3HD2 LEU 11 14.418 2.014 -5.879 88 HD22 LEU 11 1HD2 LEU 11 13.933 3.231 -7.060 89 HD23 LEU 11 2HD2 LEU 11 15.439 3.424 -6.164 90 H ASN 12 H ASN 12 12.181 -1.567 -6.454 91 HA ASN 12 HA ASN 12 11.455 -3.118 -8.696 92 HB2 ASN 12 1HB ASN 12 11.171 -3.776 -6.290 93 HB3 ASN 12 2HB ASN 12 9.841 -2.628 -6.184 94 HD21 ASN 12 2HD2 ASN 12 8.345 -4.203 -5.700 95 HD22 ASN 12 1HD2 ASN 12 7.793 -5.351 -6.865 96 H THR 13 H THR 13 10.451 -2.326 -10.451 97 HA THR 13 HA THR 13 8.546 -0.115 -10.057 98 HB THR 13 HB THR 13 10.315 -0.538 -12.476 99 HG1 THR 13 HG1 THR 13 11.390 0.049 -10.401 100 HG21 THR 13 3HG2 THR 13 9.676 1.761 -13.029 101 HG22 THR 13 1HG2 THR 13 8.646 1.825 -11.599 102 HG23 THR 13 2HG2 THR 13 8.256 0.722 -12.918 103 H VAL 14 H VAL 14 6.588 -0.259 -10.980 104 HA VAL 14 HA VAL 14 5.641 -2.650 -12.172 105 HB VAL 14 HB VAL 14 4.400 0.112 -12.183 106 HG11 VAL 14 1HG1 VAL 14 3.409 -1.331 -13.873 107 HG12 VAL 14 2HG1 VAL 14 2.278 -1.046 -12.551 108 HG13 VAL 14 3HG1 VAL 14 3.135 -2.583 -12.661 109 HG21 VAL 14 3HG2 VAL 14 3.106 -0.665 -10.261 110 HG22 VAL 14 1HG2 VAL 14 4.838 -0.686 -9.924 111 HG23 VAL 14 2HG2 VAL 14 3.991 -2.192 -10.281 112 H THR 15 H THR 15 5.476 -3.228 -14.298 113 HA THR 15 HA THR 15 6.887 -1.501 -16.181 114 HB THR 15 HB THR 15 6.721 -3.619 -17.649 115 HG1 THR 15 HG1 THR 15 5.706 -5.251 -16.770 116 HG21 THR 15 3HG2 THR 15 8.658 -4.621 -16.520 117 HG22 THR 15 1HG2 THR 15 8.321 -3.647 -15.090 118 HG23 THR 15 2HG2 THR 15 8.789 -2.864 -16.599 119 H ALA 16 H ALA 16 3.817 -3.268 -15.901 120 HA ALA 16 HA ALA 16 2.666 -1.437 -17.869 121 HB1 ALA 16 3HB ALA 16 1.630 -3.248 -19.122 122 HB2 ALA 16 1HB ALA 16 2.424 -4.435 -18.086 123 HB3 ALA 16 2HB ALA 16 3.388 -3.401 -19.141 124 H TYR 17 H TYR 17 0.437 -1.170 -17.706 125 HA TYR 17 HA TYR 17 -0.729 -2.174 -15.202 126 HD1 TYR 17 HD1 TYR 17 -1.077 0.022 -13.233 127 HD2 TYR 17 HD2 TYR 17 0.551 1.391 -16.917 128 HE1 TYR 17 HE1 TYR 17 0.513 1.435 -11.999 129 HE2 TYR 17 HE2 TYR 17 2.149 2.804 -15.695 130 HH TYR 17 HH TYR 17 2.679 2.511 -12.341 131 HB2 TYR 17 1HB TYR 17 -1.538 0.219 -16.874 132 HB3 TYR 17 2HB TYR 17 -2.285 -0.269 -15.358 133 H GLY 18 H GLY 18 -2.193 -0.938 -18.187 134 HA2 GLY 18 1HA GLY 18 -3.522 -2.018 -19.749 135 HA3 GLY 18 2HA GLY 18 -3.277 -3.524 -18.874 136 H ASP 19 H ASP 19 -4.932 -4.297 -17.772 137 HA ASP 19 HA ASP 19 -6.835 -2.629 -16.432 138 HB2 ASP 19 1HB ASP 19 -7.626 -2.516 -18.809 139 HB3 ASP 19 2HB ASP 19 -7.826 -4.265 -18.782 140 H GLY 20 H GLY 20 -7.567 -3.722 -14.709 141 HA2 GLY 20 1HA GLY 20 -8.462 -5.541 -13.546 142 HA3 GLY 20 2HA GLY 20 -7.992 -6.592 -14.873 143 H TYR 21 H TYR 21 -5.299 -6.116 -15.077 144 HA TYR 21 HA TYR 21 -4.371 -7.204 -12.500 145 HD1 TYR 21 HD1 TYR 21 -1.032 -7.287 -14.959 146 HD2 TYR 21 HD2 TYR 21 -4.860 -8.019 -16.670 147 HE1 TYR 21 HE1 TYR 21 -0.150 -6.688 -17.173 148 HE2 TYR 21 HE2 TYR 21 -3.984 -7.420 -18.889 149 HH TYR 21 HH TYR 21 -0.612 -7.006 -19.483 150 HB2 TYR 21 1HB TYR 21 -2.737 -8.503 -13.720 151 HB3 TYR 21 2HB TYR 21 -4.325 -8.799 -14.418 152 H ILE 22 H ILE 22 -1.973 -6.930 -12.166 153 HA ILE 22 HA ILE 22 -0.973 -4.377 -13.249 154 HB ILE 22 HB ILE 22 -0.641 -5.333 -10.396 155 HG12 ILE 22 1HG1 ILE 22 -2.227 -2.974 -11.438 156 HG13 ILE 22 2HG1 ILE 22 -2.935 -4.509 -10.945 157 HG21 ILE 22 1HG2 ILE 22 0.404 -3.140 -10.018 158 HG22 ILE 22 2HG2 ILE 22 0.258 -2.785 -11.739 159 HG23 ILE 22 3HG2 ILE 22 1.297 -4.102 -11.197 160 HD11 ILE 22 3HD1 ILE 22 -1.420 -2.598 -9.184 161 HD12 ILE 22 1HD1 ILE 22 -2.072 -4.158 -8.679 162 HD13 ILE 22 2HD1 ILE 22 -3.163 -2.871 -9.193 163 H GLU 23 H GLU 23 0.867 -4.765 -14.365 164 HA GLU 23 HA GLU 23 2.333 -7.229 -13.771 165 HB2 GLU 23 1HB GLU 23 1.619 -6.811 -16.115 166 HB3 GLU 23 2HB GLU 23 2.633 -5.373 -16.138 167 HG2 GLU 23 1HG GLU 23 4.583 -6.858 -15.616 168 HG3 GLU 23 2HG GLU 23 3.515 -8.236 -15.875 169 H VAL 24 H VAL 24 4.034 -7.118 -12.513 170 HA VAL 24 HA VAL 24 5.640 -4.644 -12.514 171 HB VAL 24 HB VAL 24 5.528 -6.717 -10.313 172 HG11 VAL 24 1HG1 VAL 24 6.651 -5.001 -8.977 173 HG12 VAL 24 2HG1 VAL 24 6.704 -3.942 -10.388 174 HG13 VAL 24 3HG1 VAL 24 7.606 -5.458 -10.388 175 HG21 VAL 24 3HG2 VAL 24 4.197 -5.089 -9.048 176 HG22 VAL 24 1HG2 VAL 24 3.360 -5.626 -10.503 177 HG23 VAL 24 2HG2 VAL 24 4.135 -4.043 -10.466 178 H ASN 25 H ASN 25 7.596 -4.802 -13.344 179 HA ASN 25 HA ASN 25 9.553 -5.581 -14.151 180 HB2 ASN 25 1HB ASN 25 9.025 -7.903 -12.288 181 HB3 ASN 25 2HB ASN 25 10.526 -7.668 -13.177 182 HD21 ASN 25 2HD2 ASN 25 9.952 -7.723 -10.287 183 HD22 ASN 25 1HD2 ASN 25 10.547 -6.224 -9.663 184 H GLN 26 H GLN 26 8.026 -8.761 -13.788 185 HA GLN 26 HA GLN 26 7.637 -8.895 -16.688 186 HB2 GLN 26 1HB GLN 26 9.131 -10.993 -15.103 187 HB3 GLN 26 2HB GLN 26 8.671 -11.125 -16.792 188 HG2 GLN 26 1HG GLN 26 10.120 -9.223 -17.323 189 HG3 GLN 26 2HG GLN 26 10.601 -9.132 -15.628 190 HE21 GLN 26 2HE2 GLN 26 12.231 -9.602 -17.988 191 HE22 GLN 26 1HE2 GLN 26 13.005 -11.133 -17.739 192 H VAL 27 H VAL 27 6.393 -9.270 -13.681 193 HA VAL 27 HA VAL 27 4.789 -11.634 -14.396 194 HB VAL 27 HB VAL 27 5.394 -10.608 -11.616 195 HG11 VAL 27 1HG1 VAL 27 3.269 -11.790 -11.768 196 HG12 VAL 27 2HG1 VAL 27 4.453 -12.745 -10.874 197 HG13 VAL 27 3HG1 VAL 27 4.070 -13.155 -12.546 198 HG21 VAL 27 3HG2 VAL 27 7.415 -11.471 -12.666 199 HG22 VAL 27 1HG2 VAL 27 6.572 -12.958 -13.100 200 HG23 VAL 27 2HG2 VAL 27 6.855 -12.569 -11.403 201 H ARG 28 H ARG 28 2.744 -11.256 -14.831 202 HA ARG 28 HA ARG 28 1.475 -8.780 -14.024 203 HE ARG 28 HE ARG 28 0.393 -13.378 -17.921 204 HB2 ARG 28 1HB ARG 28 -0.494 -9.726 -15.292 205 HB3 ARG 28 2HB ARG 28 0.957 -9.459 -16.246 206 HG2 ARG 28 1HG ARG 28 1.459 -11.782 -16.282 207 HG3 ARG 28 2HG ARG 28 0.209 -12.128 -15.087 208 HD2 ARG 28 1HD ARG 28 -1.520 -11.521 -16.651 209 HD3 ARG 28 2HD ARG 28 -0.317 -11.006 -17.836 210 HH11 ARG 28 1HH1 ARG 28 -2.811 -12.603 -16.728 211 HH12 ARG 28 2HH1 ARG 28 -3.482 -14.137 -17.196 212 HH21 ARG 28 1HH2 ARG 28 -0.488 -15.388 -18.534 213 HH22 ARG 28 2HH2 ARG 28 -2.162 -15.726 -18.190 214 H PHE 29 H PHE 29 0.680 -8.629 -12.048 215 HA PHE 29 HA PHE 29 -0.137 -11.042 -10.640 216 HD1 PHE 29 HD2 PHE 29 1.298 -11.373 -8.273 217 HD2 PHE 29 HD1 PHE 29 2.405 -7.763 -10.230 218 HE1 PHE 29 HE2 PHE 29 3.666 -11.864 -7.827 219 HE2 PHE 29 HE1 PHE 29 4.775 -8.250 -9.791 220 HZ PHE 29 HZ PHE 29 5.410 -10.301 -8.588 221 HB2 PHE 29 1HB PHE 29 0.145 -8.180 -9.707 222 HB3 PHE 29 2HB PHE 29 -0.322 -9.526 -8.672 223 H SER 30 H SER 30 -2.145 -11.707 -10.662 224 HA SER 30 HA SER 30 -4.305 -9.799 -11.228 225 HG SER 30 HG SER 30 -3.170 -12.476 -12.925 226 HB2 SER 30 1HB SER 30 -4.408 -12.829 -11.207 227 HB3 SER 30 2HB SER 30 -5.639 -11.732 -11.833 228 H HIS 31 H HIS 31 -2.851 -10.188 -8.664 229 HA HIS 31 HA HIS 31 -5.189 -10.505 -6.956 230 HD1 HIS 31 HD1 HIS 31 -2.003 -13.308 -8.157 231 HD2 HIS 31 HD2 HIS 31 -1.274 -11.078 -4.720 232 HE1 HIS 31 HE1 HIS 31 0.481 -13.415 -7.792 233 HE2 HIS 31 HE2 HIS 31 0.914 -12.041 -5.726 234 HB2 HIS 31 1HB HIS 31 -3.935 -11.879 -5.330 235 HB3 HIS 31 2HB HIS 31 -4.123 -12.704 -6.870 236 H ALA 32 H ALA 32 -4.724 -9.649 -4.727 237 HA ALA 32 HA ALA 32 -3.653 -7.054 -4.941 238 HB1 ALA 32 3HB ALA 32 -5.435 -7.621 -3.376 239 HB2 ALA 32 1HB ALA 32 -4.068 -6.873 -2.550 240 HB3 ALA 32 2HB ALA 32 -4.311 -8.617 -2.452 241 H ILE 33 H ILE 33 -1.745 -6.179 -4.354 242 HA ILE 33 HA ILE 33 0.311 -7.942 -3.232 243 HB ILE 33 HB ILE 33 1.960 -6.965 -4.879 244 HG12 ILE 33 1HG1 ILE 33 -0.571 -6.257 -6.387 245 HG13 ILE 33 2HG1 ILE 33 0.532 -5.099 -5.651 246 HG21 ILE 33 1HG2 ILE 33 -0.214 -8.749 -5.965 247 HG22 ILE 33 2HG2 ILE 33 1.189 -9.264 -5.029 248 HG23 ILE 33 3HG2 ILE 33 1.408 -8.577 -6.639 249 HD11 ILE 33 3HD1 ILE 33 0.898 -5.236 -8.033 250 HD12 ILE 33 1HD1 ILE 33 1.168 -6.974 -7.914 251 HD13 ILE 33 2HD1 ILE 33 2.304 -5.853 -7.166 252 H ALA 34 H ALA 34 1.625 -6.996 -1.828 253 HA ALA 34 HA ALA 34 1.733 -4.048 -1.741 254 HB1 ALA 34 3HB ALA 34 2.078 -4.214 0.682 255 HB2 ALA 34 1HB ALA 34 1.900 -5.967 0.588 256 HB3 ALA 34 2HB ALA 34 0.532 -4.919 0.208 257 H PHE 35 H PHE 35 3.692 -3.446 -2.488 258 HA PHE 35 HA PHE 35 5.955 -5.199 -1.837 259 HD1 PHE 35 HD2 PHE 35 3.292 -4.719 -4.867 260 HD2 PHE 35 HD1 PHE 35 6.978 -2.611 -5.161 261 HE1 PHE 35 HE2 PHE 35 2.281 -3.187 -6.504 262 HE2 PHE 35 HE1 PHE 35 5.972 -1.078 -6.800 263 HZ PHE 35 HZ PHE 35 3.623 -1.364 -7.475 264 HB2 PHE 35 1HB PHE 35 6.889 -4.738 -4.103 265 HB3 PHE 35 2HB PHE 35 5.424 -5.707 -4.102 266 H ALA 36 H ALA 36 7.934 -4.310 -1.577 267 HA ALA 36 HA ALA 36 7.977 -1.415 -1.095 268 HB1 ALA 36 3HB ALA 36 9.943 -1.875 0.303 269 HB2 ALA 36 1HB ALA 36 9.838 -3.587 -0.114 270 HB3 ALA 36 2HB ALA 36 8.549 -2.825 0.819 271 HA PRO 37 HA PRO 37 10.568 -0.533 -4.491 272 HB2 PRO 37 1HB PRO 37 12.512 1.085 -3.418 273 HB3 PRO 37 2HB PRO 37 10.871 1.617 -3.803 274 HG2 PRO 37 1HG PRO 37 12.029 0.795 -1.171 275 HG3 PRO 37 2HG PRO 37 10.920 2.128 -1.542 276 HD2 PRO 37 1HD PRO 37 10.056 -0.173 -0.457 277 HD3 PRO 37 2HD PRO 37 9.076 0.738 -1.623 278 H GLU 38 H GLU 38 12.006 -2.072 -1.749 279 HA GLU 38 HA GLU 38 14.526 -2.492 -3.110 280 HB2 GLU 38 1HB GLU 38 13.588 -3.345 -0.377 281 HB3 GLU 38 2HB GLU 38 15.180 -3.709 -1.025 282 HG2 GLU 38 1HG GLU 38 15.596 -1.275 -1.237 283 HG3 GLU 38 2HG GLU 38 14.047 -0.983 -0.445 284 H GLY 39 H GLY 39 11.728 -3.819 -3.593 285 HA2 GLY 39 1HA GLY 39 11.918 -5.689 -5.225 286 HA3 GLY 39 2HA GLY 39 12.926 -6.487 -4.036 287 HA PRO 40 HA PRO 40 10.025 -8.899 -1.948 288 HB2 PRO 40 1HB PRO 40 9.248 -7.231 0.260 289 HB3 PRO 40 2HB PRO 40 10.325 -8.627 0.262 290 HG2 PRO 40 1HG PRO 40 10.971 -5.749 0.134 291 HG3 PRO 40 2HG PRO 40 11.960 -7.100 0.711 292 HD2 PRO 40 1HD PRO 40 12.507 -5.853 -1.594 293 HD3 PRO 40 2HD PRO 40 12.721 -7.611 -1.426 294 H VAL 41 H VAL 41 8.174 -9.278 -2.881 295 HA VAL 41 HA VAL 41 6.031 -7.250 -2.754 296 HB VAL 41 HB VAL 41 6.234 -9.593 -4.662 297 HG11 VAL 41 1HG1 VAL 41 4.417 -8.468 -5.864 298 HG12 VAL 41 2HG1 VAL 41 4.358 -7.232 -4.608 299 HG13 VAL 41 3HG1 VAL 41 3.947 -8.902 -4.220 300 HG21 VAL 41 3HG2 VAL 41 7.995 -7.983 -5.140 301 HG22 VAL 41 1HG2 VAL 41 6.810 -6.677 -5.179 302 HG23 VAL 41 2HG2 VAL 41 6.760 -7.950 -6.398 303 H ALA 42 H ALA 42 4.634 -7.699 -1.163 304 HA ALA 42 HA ALA 42 4.285 -10.453 -0.263 305 HB1 ALA 42 3HB ALA 42 3.164 -7.887 0.862 306 HB2 ALA 42 1HB ALA 42 4.632 -8.696 1.411 307 HB3 ALA 42 2HB ALA 42 3.066 -9.483 1.609 308 H SER 43 H SER 43 2.473 -11.633 -0.554 309 HA SER 43 HA SER 43 0.506 -10.611 -2.433 310 HG SER 43 HG SER 43 2.604 -13.045 -2.200 311 HB2 SER 43 1HB SER 43 0.649 -13.368 -1.202 312 HB3 SER 43 2HB SER 43 -0.188 -12.893 -2.680 313 H TRP 44 H TRP 44 -1.597 -10.199 -1.987 314 HA TRP 44 HA TRP 44 -2.517 -10.625 0.784 315 HD1 TRP 44 HD1 TRP 44 -0.824 -9.388 1.689 316 HE1 TRP 44 HE1 TRP 44 -0.475 -7.692 3.593 317 HE3 TRP 44 HE3 TRP 44 -4.577 -6.114 0.553 318 HZ2 TRP 44 HZ2 TRP 44 -1.638 -5.276 4.491 319 HZ3 TRP 44 HZ3 TRP 44 -4.894 -4.135 1.981 320 HH2 TRP 44 HH2 TRP 44 -3.457 -3.728 3.910 321 HB2 TRP 44 1HB TRP 44 -2.602 -8.243 -0.966 322 HB3 TRP 44 2HB TRP 44 -4.085 -8.585 -0.087 323 HA PRO 45 HA PRO 45 -5.952 -12.723 -1.241 324 HB2 PRO 45 1HB PRO 45 -7.044 -13.187 1.384 325 HB3 PRO 45 2HB PRO 45 -6.258 -14.346 0.309 326 HG2 PRO 45 1HG PRO 45 -5.203 -13.496 2.696 327 HG3 PRO 45 2HG PRO 45 -4.238 -14.121 1.347 328 HD2 PRO 45 1HD PRO 45 -4.740 -11.285 2.168 329 HD3 PRO 45 2HD PRO 45 -3.242 -12.040 1.579 330 H VAL 46 H VAL 46 -5.832 -9.783 -0.363 331 HA VAL 46 HA VAL 46 -8.594 -9.294 0.443 332 HB VAL 46 HB VAL 46 -6.250 -7.402 0.150 333 HG11 VAL 46 1HG1 VAL 46 -7.675 -5.802 1.393 334 HG12 VAL 46 2HG1 VAL 46 -9.026 -6.924 1.215 335 HG13 VAL 46 3HG1 VAL 46 -8.296 -6.193 -0.213 336 HG21 VAL 46 3HG2 VAL 46 -7.556 -8.559 2.609 337 HG22 VAL 46 1HG2 VAL 46 -6.261 -7.361 2.598 338 HG23 VAL 46 2HG2 VAL 46 -5.966 -8.985 1.975 339 H GLN 47 H GLN 47 -10.110 -8.790 -1.023 340 HA GLN 47 HA GLN 47 -9.201 -7.840 -3.662 341 HB2 GLN 47 1HB GLN 47 -11.509 -9.667 -2.992 342 HB3 GLN 47 2HB GLN 47 -11.232 -8.979 -4.587 343 HG2 GLN 47 1HG GLN 47 -9.073 -10.119 -4.699 344 HG3 GLN 47 2HG GLN 47 -9.360 -10.813 -3.105 345 HE21 GLN 47 2HE2 GLN 47 -8.934 -12.085 -5.711 346 HE22 GLN 47 1HE2 GLN 47 -10.304 -13.109 -5.967 347 H ARG 48 H ARG 48 -10.526 -6.711 -0.988 348 HA ARG 48 HA ARG 48 -11.933 -4.618 -2.400 349 HE ARG 48 HE ARG 48 -12.397 -8.826 1.004 350 HB2 ARG 48 1HB ARG 48 -13.928 -4.774 -0.855 351 HB3 ARG 48 2HB ARG 48 -13.820 -6.039 -2.068 352 HG2 ARG 48 1HG ARG 48 -12.637 -6.590 0.593 353 HG3 ARG 48 2HG ARG 48 -14.397 -6.549 0.462 354 HD2 ARG 48 1HD ARG 48 -14.451 -8.333 -1.027 355 HD3 ARG 48 2HD ARG 48 -12.762 -8.126 -1.487 356 HH11 ARG 48 1HH1 ARG 48 -14.878 -10.069 -1.138 357 HH12 ARG 48 2HH1 ARG 48 -14.827 -11.679 -0.486 358 HH21 ARG 48 1HH2 ARG 48 -12.323 -10.945 1.867 359 HH22 ARG 48 2HH2 ARG 48 -13.342 -12.183 1.198 360 HA PRO 49 HA PRO 49 -10.107 -2.181 0.775 361 HB2 PRO 49 1HB PRO 49 -11.796 -0.064 0.883 362 HB3 PRO 49 2HB PRO 49 -10.699 -0.346 -0.473 363 HG2 PRO 49 1HG PRO 49 -13.616 -0.968 -0.235 364 HG3 PRO 49 2HG PRO 49 -12.732 -0.256 -1.596 365 HD2 PRO 49 1HD PRO 49 -13.433 -2.868 -1.520 366 HD3 PRO 49 2HD PRO 49 -11.959 -2.298 -2.328 367 H ALA 50 H ALA 50 -12.558 -4.080 1.453 368 HA ALA 50 HA ALA 50 -13.482 -2.796 3.901 369 HB1 ALA 50 3HB ALA 50 -14.294 -5.413 2.642 370 HB2 ALA 50 1HB ALA 50 -15.140 -3.876 2.473 371 HB3 ALA 50 2HB ALA 50 -15.050 -4.665 4.048 372 H ASP 51 H ASP 51 -11.347 -5.331 2.823 373 HA ASP 51 HA ASP 51 -11.268 -6.714 5.341 374 HB2 ASP 51 1HB ASP 51 -9.349 -6.928 3.013 375 HB3 ASP 51 2HB ASP 51 -9.503 -8.065 4.345 376 H ILE 52 H ILE 52 -9.717 -3.978 4.034 377 HA ILE 52 HA ILE 52 -7.129 -4.240 5.068 378 HB ILE 52 HB ILE 52 -8.545 -1.606 4.688 379 HG12 ILE 52 1HG1 ILE 52 -7.082 -3.243 2.600 380 HG13 ILE 52 2HG1 ILE 52 -8.833 -3.091 2.699 381 HG21 ILE 52 1HG2 ILE 52 -6.268 -0.829 4.148 382 HG22 ILE 52 2HG2 ILE 52 -5.651 -2.446 4.499 383 HG23 ILE 52 3HG2 ILE 52 -6.382 -1.484 5.783 384 HD11 ILE 52 3HD1 ILE 52 -6.896 -0.841 2.225 385 HD12 ILE 52 1HD1 ILE 52 -8.652 -0.694 2.317 386 HD13 ILE 52 2HD1 ILE 52 -7.911 -1.618 1.008 387 H THR 53 H THR 53 -6.645 -4.533 7.103 388 HA THR 53 HA THR 53 -7.908 -2.848 9.145 389 HB THR 53 HB THR 53 -7.475 -5.021 10.614 390 HG1 THR 53 HG1 THR 53 -8.110 -6.134 8.064 391 HG21 THR 53 3HG2 THR 53 -9.646 -3.933 10.352 392 HG22 THR 53 1HG2 THR 53 -9.813 -5.685 10.235 393 HG23 THR 53 2HG2 THR 53 -9.854 -4.696 8.775 394 H ALA 54 H ALA 54 -6.601 -2.833 11.196 395 HA ALA 54 HA ALA 54 -4.047 -1.846 10.709 396 HB1 ALA 54 3HB ALA 54 -5.111 -2.955 13.302 397 HB2 ALA 54 1HB ALA 54 -5.365 -1.317 12.702 398 HB3 ALA 54 2HB ALA 54 -3.740 -1.860 13.121 399 H SER 55 H SER 55 -5.064 -5.096 11.544 400 HA SER 55 HA SER 55 -2.557 -6.178 12.190 401 HG SER 55 HG SER 55 -5.898 -8.151 10.998 402 HB2 SER 55 1HB SER 55 -3.756 -8.355 11.407 403 HB3 SER 55 2HB SER 55 -4.399 -7.483 12.801 404 H LEU 56 H LEU 56 -4.358 -6.161 9.128 405 HA LEU 56 HA LEU 56 -2.432 -7.516 7.597 406 HG LEU 56 HG LEU 56 -5.643 -7.318 7.765 407 HB2 LEU 56 1HB LEU 56 -4.474 -5.489 6.683 408 HB3 LEU 56 2HB LEU 56 -3.615 -6.611 5.645 409 HD11 LEU 56 1HD1 LEU 56 -6.938 -8.137 5.853 410 HD12 LEU 56 2HD1 LEU 56 -5.691 -7.535 4.760 411 HD13 LEU 56 3HD1 LEU 56 -6.622 -6.405 5.743 412 HD21 LEU 56 3HD2 LEU 56 -4.049 -9.111 5.938 413 HD22 LEU 56 1HD2 LEU 56 -5.368 -9.622 6.991 414 HD23 LEU 56 2HD2 LEU 56 -3.877 -8.992 7.690 415 H LEU 57 H LEU 57 -2.886 -4.117 8.348 416 HA LEU 57 HA LEU 57 -1.081 -3.034 6.496 417 HG LEU 57 HG LEU 57 -3.809 -2.178 7.732 418 HB2 LEU 57 1HB LEU 57 -1.860 -2.016 9.227 419 HB3 LEU 57 2HB LEU 57 -1.010 -1.081 8.011 420 HD11 LEU 57 1HD1 LEU 57 -4.490 0.171 7.857 421 HD12 LEU 57 2HD1 LEU 57 -2.819 0.634 8.177 422 HD13 LEU 57 3HD1 LEU 57 -3.695 -0.360 9.340 423 HD21 LEU 57 3HD2 LEU 57 -2.649 -2.070 5.592 424 HD22 LEU 57 1HD2 LEU 57 -2.198 -0.394 5.908 425 HD23 LEU 57 2HD2 LEU 57 -3.894 -0.826 5.693 426 H GLN 58 H GLN 58 -0.595 -4.218 9.799 427 HA GLN 58 HA GLN 58 2.135 -3.463 9.967 428 HB2 GLN 58 1HB GLN 58 0.553 -5.551 11.471 429 HB3 GLN 58 2HB GLN 58 2.210 -5.108 11.861 430 HG2 GLN 58 1HG GLN 58 1.487 -2.805 12.279 431 HG3 GLN 58 2HG GLN 58 -0.175 -3.272 11.922 432 HE21 GLN 58 2HE2 GLN 58 1.027 -2.189 14.367 433 HE22 GLN 58 1HE2 GLN 58 0.662 -3.328 15.624 434 H GLN 59 H GLN 59 0.480 -6.293 8.748 435 HA GLN 59 HA GLN 59 2.794 -7.937 8.493 436 HB2 GLN 59 1HB GLN 59 0.172 -8.107 6.996 437 HB3 GLN 59 2HB GLN 59 1.382 -9.379 7.117 438 HG2 GLN 59 1HG GLN 59 0.996 -9.552 9.504 439 HG3 GLN 59 2HG GLN 59 -0.169 -8.230 9.428 440 HE21 GLN 59 2HE2 GLN 59 -0.585 -10.938 10.347 441 HE22 GLN 59 1HE2 GLN 59 -1.827 -11.612 9.344 442 H ALA 60 H ALA 60 1.157 -5.635 6.406 443 HA ALA 60 HA ALA 60 2.747 -6.277 4.092 444 HB1 ALA 60 3HB ALA 60 0.924 -3.926 4.597 445 HB2 ALA 60 1HB ALA 60 0.452 -5.457 3.858 446 HB3 ALA 60 2HB ALA 60 1.603 -4.399 3.038 447 H ALA 61 H ALA 61 2.939 -4.067 6.761 448 HA ALA 61 HA ALA 61 4.886 -2.334 5.561 449 HB1 ALA 61 3HB ALA 61 3.372 -1.548 7.326 450 HB2 ALA 61 1HB ALA 61 5.066 -1.331 7.771 451 HB3 ALA 61 2HB ALA 61 4.133 -2.658 8.465 452 H GLY 62 H GLY 62 5.014 -5.437 6.836 453 HA2 GLY 62 1HA GLY 62 6.791 -6.865 7.144 454 HA3 GLY 62 2HA GLY 62 7.840 -5.588 6.548 455 H LEU 63 H LEU 63 5.699 -5.356 9.336 456 HA LEU 63 HA LEU 63 7.875 -4.391 10.944 457 HG LEU 63 HG LEU 63 5.142 -3.137 10.052 458 HB2 LEU 63 1HB LEU 63 5.004 -4.973 11.668 459 HB3 LEU 63 2HB LEU 63 6.158 -4.159 12.707 460 HD11 LEU 63 1HD1 LEU 63 4.619 -2.202 12.868 461 HD12 LEU 63 2HD1 LEU 63 3.469 -3.033 11.820 462 HD13 LEU 63 3HD1 LEU 63 4.046 -1.422 11.394 463 HD21 LEU 63 3HD2 LEU 63 7.442 -2.450 10.427 464 HD22 LEU 63 1HD2 LEU 63 7.029 -1.888 12.047 465 HD23 LEU 63 2HD2 LEU 63 6.352 -1.080 10.634 466 H ALA 64 H ALA 64 7.099 -7.413 10.094 467 HA ALA 64 HA ALA 64 7.474 -8.716 12.656 468 HB1 ALA 64 3HB ALA 64 5.979 -9.717 10.996 469 HB2 ALA 64 1HB ALA 64 7.323 -10.795 11.371 470 HB3 ALA 64 2HB ALA 64 7.327 -9.872 9.868 471 H GLU 65 H GLU 65 9.153 -10.804 12.095 472 HA GLU 65 HA GLU 65 11.723 -9.490 12.040 473 HB2 GLU 65 1HB GLU 65 11.013 -12.415 12.305 474 HB3 GLU 65 2HB GLU 65 12.637 -11.756 12.449 475 HG2 GLU 65 1HG GLU 65 11.835 -10.385 14.362 476 HG3 GLU 65 2HG GLU 65 10.294 -11.239 14.259 477 H VAL 66 H VAL 66 13.063 -9.343 10.370 478 HA VAL 66 HA VAL 66 12.688 -11.144 8.076 479 HB VAL 66 HB VAL 66 13.406 -8.207 7.896 480 HG11 VAL 66 1HG1 VAL 66 12.970 -10.262 5.731 481 HG12 VAL 66 2HG1 VAL 66 14.511 -9.539 6.187 482 HG13 VAL 66 3HG1 VAL 66 13.247 -8.540 5.471 483 HG21 VAL 66 3HG2 VAL 66 11.042 -8.520 8.427 484 HG22 VAL 66 1HG2 VAL 66 10.875 -9.629 7.066 485 HG23 VAL 66 2HG2 VAL 66 11.245 -7.929 6.778 486 H VAL 67 H VAL 67 14.400 -12.466 8.283 487 HA VAL 67 HA VAL 67 16.969 -11.411 9.147 488 HB VAL 67 HB VAL 67 16.261 -14.236 8.331 489 HG11 VAL 67 1HG1 VAL 67 18.641 -13.149 9.835 490 HG12 VAL 67 2HG1 VAL 67 18.646 -13.772 8.184 491 HG13 VAL 67 3HG1 VAL 67 18.304 -14.855 9.534 492 HG21 VAL 67 3HG2 VAL 67 16.153 -14.718 10.729 493 HG22 VAL 67 1HG2 VAL 67 14.938 -13.531 10.253 494 HG23 VAL 67 2HG2 VAL 67 16.404 -13.010 11.084 495 H ARG 68 H ARG 68 18.061 -10.326 7.633 496 HA ARG 68 HA ARG 68 17.891 -10.999 4.845 497 HE ARG 68 HE ARG 68 19.563 -7.598 3.510 498 HB2 ARG 68 1HB ARG 68 19.679 -9.037 6.291 499 HB3 ARG 68 2HB ARG 68 19.568 -9.192 4.545 500 HG2 ARG 68 1HG ARG 68 17.131 -8.645 4.742 501 HG3 ARG 68 2HG ARG 68 17.425 -8.275 6.442 502 HD2 ARG 68 1HD ARG 68 17.480 -6.249 5.099 503 HD3 ARG 68 2HD ARG 68 19.068 -6.584 5.788 504 HH11 ARG 68 1HH1 ARG 68 17.329 -4.930 3.967 505 HH12 ARG 68 2HH1 ARG 68 17.553 -4.304 2.366 506 HH21 ARG 68 1HH2 ARG 68 19.860 -6.773 1.415 507 HH22 ARG 68 2HH2 ARG 68 18.996 -5.345 0.910 508 H ASP 69 H ASP 69 19.534 -11.808 3.536 509 HA ASP 69 HA ASP 69 21.241 -13.689 4.923 510 HB2 ASP 69 1HB ASP 69 21.604 -14.728 2.809 511 HB3 ASP 69 2HB ASP 69 19.899 -14.305 2.885 512 HA PRO 70 HA PRO 70 24.836 -11.151 4.403 513 HB2 PRO 70 1HB PRO 70 26.549 -12.730 5.725 514 HB3 PRO 70 2HB PRO 70 25.247 -11.870 6.554 515 HG2 PRO 70 1HG PRO 70 25.487 -14.748 5.893 516 HG3 PRO 70 2HG PRO 70 24.621 -13.967 7.225 517 HD2 PRO 70 1HD PRO 70 23.533 -14.918 4.772 518 HD3 PRO 70 2HD PRO 70 22.693 -14.014 6.047 519 H LEU 71 H LEU 71 25.855 -10.964 2.500 520 HA LEU 71 HA LEU 71 26.935 -13.370 1.214 521 HG LEU 71 HG LEU 71 24.382 -11.849 0.380 522 HB2 LEU 71 1HB LEU 71 26.496 -10.590 0.127 523 HB3 LEU 71 2HB LEU 71 27.166 -11.928 -0.786 524 HD11 LEU 71 1HD1 LEU 71 24.654 -10.256 -1.445 525 HD12 LEU 71 2HD1 LEU 71 23.654 -11.622 -1.942 526 HD13 LEU 71 3HD1 LEU 71 25.337 -11.527 -2.461 527 HD21 LEU 71 3HD2 LEU 71 24.016 -13.862 -0.955 528 HD22 LEU 71 1HD2 LEU 71 25.298 -14.112 0.231 529 HD23 LEU 71 2HD2 LEU 71 25.704 -13.839 -1.464 530 H ALA 72 H ALA 72 27.930 -10.962 3.237 531 HA ALA 72 HA ALA 72 30.663 -10.974 2.137 532 HB1 ALA 72 3HB ALA 72 31.013 -8.813 3.202 533 HB2 ALA 72 1HB ALA 72 29.370 -8.845 3.839 534 HB3 ALA 72 2HB ALA 72 29.640 -8.751 2.099 535 H PHE 73 H PHE 73 28.773 -12.173 4.581 536 HA PHE 73 HA PHE 73 31.113 -12.671 6.260 537 HD1 PHE 73 HD2 PHE 73 31.940 -11.093 8.385 538 HD2 PHE 73 HD1 PHE 73 28.455 -9.428 6.599 539 HE1 PHE 73 HE2 PHE 73 32.942 -8.850 8.531 540 HE2 PHE 73 HE1 PHE 73 29.450 -7.181 6.742 541 HZ PHE 73 HZ PHE 73 31.695 -6.892 7.707 542 HB2 PHE 73 1HB PHE 73 28.452 -11.663 7.295 543 HB3 PHE 73 2HB PHE 73 29.736 -12.305 8.313 544 H LEU 74 H LEU 74 31.326 -14.794 6.365 545 HA LEU 74 HA LEU 74 29.016 -16.533 6.018 546 HG LEU 74 HG LEU 74 30.370 -19.164 6.809 547 HB2 LEU 74 1HB LEU 74 31.218 -16.976 4.907 548 HB3 LEU 74 2HB LEU 74 31.918 -17.251 6.489 549 HD11 LEU 74 1HD1 LEU 74 29.143 -20.039 4.893 550 HD12 LEU 74 2HD1 LEU 74 29.644 -18.650 3.928 551 HD13 LEU 74 3HD1 LEU 74 28.584 -18.421 5.319 552 HD21 LEU 74 3HD2 LEU 74 32.629 -19.535 5.994 553 HD22 LEU 74 1HD2 LEU 74 32.089 -19.280 4.335 554 HD23 LEU 74 2HD2 LEU 74 31.506 -20.672 5.249 555 H ASP 75 H ASP 75 30.361 -14.895 8.485 556 HA ASP 75 HA ASP 75 30.251 -16.865 10.572 557 HB2 ASP 75 1HB ASP 75 30.420 -13.845 10.719 558 HB3 ASP 75 2HB ASP 75 30.627 -14.941 12.081 559 H GLU 76 H GLU 76 27.968 -15.114 8.883 560 HA GLU 76 HA GLU 76 25.749 -14.737 9.083 561 HB2 GLU 76 1HB GLU 76 25.639 -17.122 9.677 562 HB3 GLU 76 2HB GLU 76 25.903 -16.713 11.367 563 HG2 GLU 76 1HG GLU 76 23.803 -15.413 11.346 564 HG3 GLU 76 2HG GLU 76 23.527 -15.942 9.687 565 HA PRO 77 HA PRO 77 26.128 -11.574 12.333 566 HB2 PRO 77 1HB PRO 77 24.540 -9.960 10.491 567 HB3 PRO 77 2HB PRO 77 26.164 -9.661 11.116 568 HG2 PRO 77 1HG PRO 77 25.682 -10.300 8.523 569 HG3 PRO 77 2HG PRO 77 27.182 -10.735 9.363 570 HD2 PRO 77 1HD PRO 77 24.781 -12.427 8.764 571 HD3 PRO 77 2HD PRO 77 26.507 -12.842 8.671 572 H GLU 78 H GLU 78 24.697 -12.951 13.544 573 HA GLU 78 HA GLU 78 21.877 -12.926 13.083 574 HB2 GLU 78 1HB GLU 78 23.014 -14.790 14.210 575 HB3 GLU 78 2HB GLU 78 23.474 -13.719 15.524 576 HG2 GLU 78 1HG GLU 78 21.108 -13.402 16.079 577 HG3 GLU 78 2HG GLU 78 20.668 -14.508 14.776 578 H ALA 79 H ALA 79 23.999 -11.446 15.521 579 HA ALA 79 HA ALA 79 21.949 -9.673 16.465 580 HB1 ALA 79 3HB ALA 79 23.784 -10.387 17.928 581 HB2 ALA 79 1HB ALA 79 23.732 -8.632 17.771 582 HB3 ALA 79 2HB ALA 79 24.939 -9.561 16.883 583 H GLY 80 H GLY 80 21.161 -8.369 14.906 584 HA2 GLY 80 1HA GLY 80 21.349 -6.220 13.866 585 HA3 GLY 80 2HA GLY 80 23.065 -6.527 13.631 586 H ALA 81 H ALA 81 20.706 -8.979 12.953 587 HA ALA 81 HA ALA 81 21.532 -9.288 10.261 588 HB1 ALA 81 3HB ALA 81 19.055 -10.341 11.630 589 HB2 ALA 81 1HB ALA 81 20.626 -11.143 11.575 590 HB3 ALA 81 2HB ALA 81 19.705 -10.904 10.090 591 H GLY 82 H GLY 82 19.002 -7.463 11.822 592 HA2 GLY 82 1HA GLY 82 17.505 -6.906 9.449 593 HA3 GLY 82 2HA GLY 82 17.381 -6.054 10.982 594 H ALA 83 H ALA 83 20.354 -5.606 10.864 595 HA ALA 83 HA ALA 83 21.898 -4.126 10.140 596 HB1 ALA 83 3HB ALA 83 21.886 -3.335 7.850 597 HB2 ALA 83 1HB ALA 83 20.220 -3.881 7.652 598 HB3 ALA 83 2HB ALA 83 21.508 -5.057 7.916 599 H ARG 84 H ARG 84 18.564 -3.072 9.715 600 HA ARG 84 HA ARG 84 19.390 -0.312 10.302 601 HE ARG 84 HE ARG 84 18.944 -0.656 5.277 602 HB2 ARG 84 1HB ARG 84 16.800 -1.317 9.096 603 HB3 ARG 84 2HB ARG 84 17.274 0.369 9.284 604 HG2 ARG 84 1HG ARG 84 19.033 0.133 7.694 605 HG3 ARG 84 2HG ARG 84 18.823 -1.617 7.636 606 HD2 ARG 84 1HD ARG 84 16.527 -1.234 6.734 607 HD3 ARG 84 2HD ARG 84 16.906 0.487 6.645 608 HH11 ARG 84 1HH1 ARG 84 15.456 -0.954 5.027 609 HH12 ARG 84 2HH1 ARG 84 15.478 -1.299 3.319 610 HH21 ARG 84 1HH2 ARG 84 18.969 -1.129 3.052 611 HH22 ARG 84 2HH2 ARG 84 17.473 -1.414 2.201 612 HA PRO 85 HA PRO 85 17.729 -1.240 14.321 613 HB2 PRO 85 1HB PRO 85 18.429 1.060 15.520 614 HB3 PRO 85 2HB PRO 85 19.628 -0.152 15.051 615 HG2 PRO 85 1HG PRO 85 18.846 2.384 13.660 616 HG3 PRO 85 2HG PRO 85 20.465 1.715 13.939 617 HD2 PRO 85 1HD PRO 85 19.112 1.472 11.579 618 HD3 PRO 85 2HD PRO 85 20.320 0.301 12.142 619 H ALA 86 H ALA 86 15.693 -0.612 12.567 620 HA ALA 86 HA ALA 86 13.878 0.825 14.282 621 HB1 ALA 86 3HB ALA 86 14.440 1.928 11.531 622 HB2 ALA 86 1HB ALA 86 14.907 2.682 13.055 623 HB3 ALA 86 2HB ALA 86 13.200 2.498 12.648 624 H ASN 87 H ASN 87 14.091 0.015 10.838 625 HA ASN 87 HA ASN 87 12.733 -1.109 9.421 626 HB2 ASN 87 1HB ASN 87 13.490 -3.016 10.872 627 HB3 ASN 87 2HB ASN 87 12.013 -2.819 11.811 628 HD21 ASN 87 2HD2 ASN 87 11.143 -4.793 11.294 629 HD22 ASN 87 1HD2 ASN 87 10.584 -5.193 9.706 630 H ALA 88 H ALA 88 11.565 1.083 9.835 631 HA ALA 88 HA ALA 88 8.740 0.397 10.073 632 HB1 ALA 88 3HB ALA 88 9.336 1.378 12.232 633 HB2 ALA 88 1HB ALA 88 8.264 2.448 11.328 634 HB3 ALA 88 2HB ALA 88 9.990 2.798 11.416 635 HA PRO 89 HA PRO 89 8.926 2.494 6.147 636 HB2 PRO 89 1HB PRO 89 6.209 2.590 5.754 637 HB3 PRO 89 2HB PRO 89 7.219 1.186 5.393 638 HG2 PRO 89 1HG PRO 89 5.494 1.721 7.774 639 HG3 PRO 89 2HG PRO 89 5.752 0.205 6.891 640 HD2 PRO 89 1HD PRO 89 6.954 0.725 9.254 641 HD3 PRO 89 2HD PRO 89 7.732 -0.243 7.985 642 H GLU 90 H GLU 90 8.461 4.517 5.297 643 HA GLU 90 HA GLU 90 7.953 6.582 7.263 644 HB2 GLU 90 1HB GLU 90 9.791 6.902 5.742 645 HB3 GLU 90 2HB GLU 90 8.754 6.627 4.351 646 HG2 GLU 90 1HG GLU 90 7.502 8.695 4.989 647 HG3 GLU 90 2HG GLU 90 8.751 8.994 6.201 648 H VAL 91 H VAL 91 6.653 5.597 4.115 649 HA VAL 91 HA VAL 91 4.034 6.616 4.932 650 HB VAL 91 HB VAL 91 4.867 8.397 3.573 651 HG11 VAL 91 1HG1 VAL 91 5.720 8.078 1.303 652 HG12 VAL 91 2HG1 VAL 91 5.578 6.331 1.497 653 HG13 VAL 91 3HG1 VAL 91 6.713 7.240 2.495 654 HG21 VAL 91 3HG2 VAL 91 3.324 8.386 1.660 655 HG22 VAL 91 1HG2 VAL 91 2.550 7.816 3.139 656 HG23 VAL 91 2HG2 VAL 91 3.052 6.660 1.905 657 H LEU 92 H LEU 92 2.360 5.366 4.346 658 HA LEU 92 HA LEU 92 2.964 2.977 2.727 659 HG LEU 92 HG LEU 92 0.247 1.593 3.303 660 HB2 LEU 92 1HB LEU 92 2.511 2.476 5.098 661 HB3 LEU 92 2HB LEU 92 0.967 3.296 4.974 662 HD11 LEU 92 1HD1 LEU 92 2.427 0.911 2.487 663 HD12 LEU 92 2HD1 LEU 92 1.542 -0.477 3.118 664 HD13 LEU 92 3HD1 LEU 92 2.834 0.251 4.071 665 HD21 LEU 92 3HD2 LEU 92 -0.095 -0.198 4.933 666 HD22 LEU 92 1HD2 LEU 92 -0.372 1.390 5.650 667 HD23 LEU 92 2HD2 LEU 92 1.128 0.521 5.981 668 H LEU 93 H LEU 93 1.968 2.965 0.827 669 HA LEU 93 HA LEU 93 -0.394 4.680 0.478 670 HG LEU 93 HG LEU 93 2.506 5.388 -0.471 671 HB2 LEU 93 1HB LEU 93 1.466 3.462 -1.567 672 HB3 LEU 93 2HB LEU 93 0.057 4.429 -1.952 673 HD11 LEU 93 1HD1 LEU 93 2.907 6.722 -2.470 674 HD12 LEU 93 2HD1 LEU 93 1.493 6.005 -3.243 675 HD13 LEU 93 3HD1 LEU 93 2.889 5.001 -2.853 676 HD21 LEU 93 3HD2 LEU 93 1.483 7.608 -0.649 677 HD22 LEU 93 1HD2 LEU 93 0.496 6.513 0.318 678 HD23 LEU 93 2HD2 LEU 93 0.034 6.881 -1.342 679 H VAL 94 H VAL 94 -2.305 3.738 0.457 680 HA VAL 94 HA VAL 94 -2.447 0.899 -0.321 681 HB VAL 94 HB VAL 94 -4.356 2.451 1.441 682 HG11 VAL 94 1HG1 VAL 94 -5.504 0.721 0.182 683 HG12 VAL 94 2HG1 VAL 94 -5.382 0.261 1.881 684 HG13 VAL 94 3HG1 VAL 94 -4.306 -0.469 0.690 685 HG21 VAL 94 3HG2 VAL 94 -2.227 2.028 2.555 686 HG22 VAL 94 1HG2 VAL 94 -2.342 0.314 2.147 687 HG23 VAL 94 2HG2 VAL 94 -3.508 1.036 3.257 688 H GLY 95 H GLY 95 -3.260 0.578 -2.264 689 HA2 GLY 95 1HA GLY 95 -5.037 2.571 -3.464 690 HA3 GLY 95 2HA GLY 95 -4.307 1.194 -4.283 691 H THR 96 H THR 96 -7.076 2.388 -2.730 692 HA THR 96 HA THR 96 -8.098 -0.134 -1.828 693 HB THR 96 HB THR 96 -10.228 1.289 -1.474 694 HG1 THR 96 HG1 THR 96 -9.149 3.012 -2.922 695 HG21 THR 96 3HG2 THR 96 -7.656 1.965 -0.043 696 HG22 THR 96 1HG2 THR 96 -8.706 0.593 0.311 697 HG23 THR 96 2HG2 THR 96 -9.284 2.238 0.577 698 H GLY 97 H GLY 97 -7.636 0.515 -4.826 699 HA2 GLY 97 1HA GLY 97 -8.405 -0.723 -6.606 700 HA3 GLY 97 2HA GLY 97 -9.687 -1.335 -5.580 701 H ARG 98 H ARG 98 -11.582 0.018 -5.281 702 HA ARG 98 HA ARG 98 -12.397 0.858 -7.911 703 HE ARG 98 HE ARG 98 -15.418 -2.811 -4.394 704 HB2 ARG 98 1HB ARG 98 -14.096 0.979 -5.430 705 HB3 ARG 98 2HB ARG 98 -14.618 0.791 -7.098 706 HG2 ARG 98 1HG ARG 98 -13.441 -1.450 -7.069 707 HG3 ARG 98 2HG ARG 98 -13.308 -1.243 -5.320 708 HD2 ARG 98 1HD ARG 98 -15.854 -0.784 -5.430 709 HD3 ARG 98 2HD ARG 98 -15.761 -1.565 -7.007 710 HH11 ARG 98 1HH1 ARG 98 -15.093 -3.148 -7.870 711 HH12 ARG 98 2HH1 ARG 98 -15.224 -4.880 -7.841 712 HH21 ARG 98 1HH2 ARG 98 -15.629 -5.075 -4.356 713 HH22 ARG 98 2HH2 ARG 98 -15.556 -5.984 -5.842 714 H ARG 99 H ARG 99 -11.676 2.408 -4.872 715 HA ARG 99 HA ARG 99 -12.249 5.034 -6.034 716 HE ARG 99 HE ARG 99 -17.711 4.593 -4.988 717 HB2 ARG 99 1HB ARG 99 -13.434 3.946 -3.480 718 HB3 ARG 99 2HB ARG 99 -13.322 5.665 -3.804 719 HG2 ARG 99 1HG ARG 99 -14.717 5.332 -5.821 720 HG3 ARG 99 2HG ARG 99 -14.900 3.634 -5.360 721 HD2 ARG 99 1HD ARG 99 -16.065 4.182 -3.395 722 HD3 ARG 99 2HD ARG 99 -15.570 5.871 -3.476 723 HH11 ARG 99 1HH1 ARG 99 -15.736 7.430 -4.422 724 HH12 ARG 99 2HH1 ARG 99 -16.882 8.532 -5.123 725 HH21 ARG 99 1HH2 ARG 99 -19.234 6.042 -5.919 726 HH22 ARG 99 2HH2 ARG 99 -18.867 7.744 -5.976 727 H GLN 100 H GLN 100 -11.703 6.732 -4.179 728 HA GLN 100 HA GLN 100 -9.199 5.996 -2.883 729 HB2 GLN 100 1HB GLN 100 -10.662 8.602 -3.283 730 HB3 GLN 100 2HB GLN 100 -9.320 8.458 -2.167 731 HG2 GLN 100 1HG GLN 100 -7.845 7.810 -3.969 732 HG3 GLN 100 2HG GLN 100 -9.191 7.870 -5.110 733 HE21 GLN 100 2HE2 GLN 100 -6.679 9.371 -5.086 734 HE22 GLN 100 1HE2 GLN 100 -7.120 11.037 -5.074 735 H HIS 101 H HIS 101 -10.114 4.529 -1.381 736 HA HIS 101 HA HIS 101 -12.170 5.575 0.419 737 HD1 HIS 101 HD1 HIS 101 -11.097 2.173 2.650 738 HD2 HIS 101 HD2 HIS 101 -14.688 3.682 1.202 739 HE1 HIS 101 HE1 HIS 101 -12.797 1.700 4.440 740 HE2 HIS 101 HE2 HIS 101 -14.924 2.780 3.617 741 HB2 HIS 101 1HB HIS 101 -12.515 3.346 -0.580 742 HB3 HIS 101 2HB HIS 101 -11.022 2.785 0.167 743 H LEU 102 H LEU 102 -11.210 6.858 1.919 744 HA LEU 102 HA LEU 102 -8.727 6.311 3.154 745 HG LEU 102 HG LEU 102 -9.290 7.476 5.936 746 HB2 LEU 102 1HB LEU 102 -9.818 8.537 3.157 747 HB3 LEU 102 2HB LEU 102 -11.055 7.912 4.231 748 HD11 LEU 102 1HD1 LEU 102 -7.107 8.539 5.659 749 HD12 LEU 102 2HD1 LEU 102 -7.533 8.985 4.006 750 HD13 LEU 102 3HD1 LEU 102 -7.376 7.284 4.449 751 HD21 LEU 102 3HD2 LEU 102 -9.490 10.321 4.964 752 HD22 LEU 102 1HD2 LEU 102 -9.008 9.811 6.581 753 HD23 LEU 102 2HD2 LEU 102 -10.648 9.501 6.011 754 H LEU 103 H LEU 103 -8.242 5.311 5.076 755 HA LEU 103 HA LEU 103 -10.075 3.250 5.902 756 HG LEU 103 HG LEU 103 -7.335 3.102 4.525 757 HB2 LEU 103 1HB LEU 103 -7.296 3.961 6.848 758 HB3 LEU 103 2HB LEU 103 -8.196 2.547 7.366 759 HD11 LEU 103 1HD1 LEU 103 -5.432 2.629 5.969 760 HD12 LEU 103 2HD1 LEU 103 -5.745 1.279 4.878 761 HD13 LEU 103 3HD1 LEU 103 -6.236 1.178 6.569 762 HD21 LEU 103 3HD2 LEU 103 -8.039 0.797 4.115 763 HD22 LEU 103 1HD2 LEU 103 -9.386 1.799 4.655 764 HD23 LEU 103 2HD2 LEU 103 -8.617 0.677 5.778 765 H GLY 104 H GLY 104 -9.461 3.001 8.609 766 HA2 GLY 104 1HA GLY 104 -10.971 5.310 9.642 767 HA3 GLY 104 2HA GLY 104 -10.986 3.695 10.336 768 HA PRO 105 HA PRO 105 -7.734 6.906 12.087 769 HB2 PRO 105 1HB PRO 105 -9.655 6.866 14.363 770 HB3 PRO 105 2HB PRO 105 -8.700 8.208 13.719 771 HG2 PRO 105 1HG PRO 105 -11.308 8.042 13.224 772 HG3 PRO 105 2HG PRO 105 -10.179 8.589 11.969 773 HD2 PRO 105 1HD PRO 105 -11.543 5.947 12.280 774 HD3 PRO 105 2HD PRO 105 -11.163 6.858 10.803 775 H GLU 106 H GLU 106 -9.649 4.324 13.581 776 HA GLU 106 HA GLU 106 -7.685 3.699 15.562 777 HB2 GLU 106 1HB GLU 106 -9.970 2.007 14.534 778 HB3 GLU 106 2HB GLU 106 -9.077 1.747 16.026 779 HG2 GLU 106 1HG GLU 106 -9.961 3.726 16.997 780 HG3 GLU 106 2HG GLU 106 -10.655 4.239 15.458 781 H GLN 107 H GLN 107 -8.380 2.618 12.321 782 HA GLN 107 HA GLN 107 -6.858 0.217 12.411 783 HB2 GLN 107 1HB GLN 107 -7.700 1.884 10.034 784 HB3 GLN 107 2HB GLN 107 -7.097 0.235 9.963 785 HG2 GLN 107 1HG GLN 107 -9.027 -0.568 11.166 786 HG3 GLN 107 2HG GLN 107 -9.614 1.082 11.379 787 HE21 GLN 107 2HE2 GLN 107 -10.883 -1.210 10.075 788 HE22 GLN 107 1HE2 GLN 107 -11.206 -0.705 8.452 789 H VAL 108 H VAL 108 -6.184 3.510 11.333 790 HA VAL 108 HA VAL 108 -3.484 2.764 10.550 791 HB VAL 108 HB VAL 108 -3.258 5.110 9.815 792 HG11 VAL 108 1HG1 VAL 108 -5.747 3.730 8.817 793 HG12 VAL 108 2HG1 VAL 108 -4.099 3.425 8.270 794 HG13 VAL 108 3HG1 VAL 108 -4.855 4.990 7.965 795 HG21 VAL 108 3HG2 VAL 108 -4.702 6.190 11.442 796 HG22 VAL 108 1HG2 VAL 108 -6.112 5.375 10.763 797 HG23 VAL 108 2HG2 VAL 108 -5.238 6.571 9.807 798 H ARG 109 H ARG 109 -4.983 3.613 13.370 799 HA ARG 109 HA ARG 109 -3.373 5.575 14.507 800 HE ARG 109 HE ARG 109 -4.497 7.493 18.391 801 HB2 ARG 109 1HB ARG 109 -5.546 4.107 15.329 802 HB3 ARG 109 2HB ARG 109 -4.281 3.545 16.413 803 HG2 ARG 109 1HG ARG 109 -5.115 6.410 15.997 804 HG3 ARG 109 2HG ARG 109 -5.506 5.399 17.389 805 HD2 ARG 109 1HD ARG 109 -3.168 5.247 17.984 806 HD3 ARG 109 2HD ARG 109 -2.712 6.136 16.530 807 HH11 ARG 109 1HH1 ARG 109 -1.246 7.043 17.183 808 HH12 ARG 109 2HH1 ARG 109 -0.637 8.526 17.850 809 HH21 ARG 109 1HH2 ARG 109 -3.711 9.447 19.298 810 HH22 ARG 109 2HH2 ARG 109 -2.042 9.897 19.065 811 HA PRO 110 HA PRO 110 -0.677 1.907 16.453 812 HB2 PRO 110 1HB PRO 110 -0.899 0.072 14.111 813 HB3 PRO 110 2HB PRO 110 -0.730 -0.309 15.830 814 HG2 PRO 110 1HG PRO 110 -3.076 -0.580 14.624 815 HG3 PRO 110 2HG PRO 110 -2.977 0.077 16.269 816 HD2 PRO 110 1HD PRO 110 -3.427 1.503 13.684 817 HD3 PRO 110 2HD PRO 110 -4.138 1.809 15.280 818 H LEU 111 H LEU 111 -0.851 2.369 12.934 819 HA LEU 111 HA LEU 111 2.004 2.306 12.653 820 HG LEU 111 HG LEU 111 -0.157 0.652 11.159 821 HB2 LEU 111 1HB LEU 111 -0.185 3.040 10.719 822 HB3 LEU 111 2HB LEU 111 1.517 3.011 10.298 823 HD11 LEU 111 1HD1 LEU 111 -0.578 1.340 8.879 824 HD12 LEU 111 2HD1 LEU 111 0.341 -0.166 8.902 825 HD13 LEU 111 3HD1 LEU 111 1.154 1.357 8.542 826 HD21 LEU 111 3HD2 LEU 111 2.110 0.472 12.047 827 HD22 LEU 111 1HD2 LEU 111 2.769 0.771 10.438 828 HD23 LEU 111 2HD2 LEU 111 1.838 -0.694 10.752 829 H LEU 112 H LEU 112 -0.488 4.816 12.756 830 HA LEU 112 HA LEU 112 1.177 7.002 12.167 831 HG LEU 112 HG LEU 112 -1.782 6.418 11.510 832 HB2 LEU 112 1HB LEU 112 -1.308 6.839 13.870 833 HB3 LEU 112 2HB LEU 112 -0.517 8.346 13.458 834 HD11 LEU 112 1HD1 LEU 112 -3.385 8.233 11.150 835 HD12 LEU 112 2HD1 LEU 112 -2.600 9.173 12.419 836 HD13 LEU 112 3HD1 LEU 112 -3.410 7.658 12.817 837 HD21 LEU 112 3HD2 LEU 112 -1.320 8.144 9.826 838 HD22 LEU 112 1HD2 LEU 112 0.166 7.496 10.524 839 HD23 LEU 112 2HD2 LEU 112 -0.434 9.075 11.033 840 H ALA 113 H ALA 113 0.575 5.253 15.146 841 HA ALA 113 HA ALA 113 1.959 7.045 16.867 842 HB1 ALA 113 3HB ALA 113 1.420 4.097 17.217 843 HB2 ALA 113 1HB ALA 113 0.343 5.405 17.704 844 HB3 ALA 113 2HB ALA 113 1.913 5.219 18.484 845 H MET 114 H MET 114 2.963 4.628 14.633 846 HA MET 114 HA MET 114 5.657 4.471 15.735 847 HB2 MET 114 1HB MET 114 4.416 3.179 13.298 848 HB3 MET 114 2HB MET 114 6.064 2.907 13.841 849 HG2 MET 114 1HG MET 114 5.272 1.916 15.891 850 HG3 MET 114 2HG MET 114 3.605 2.288 15.458 851 HE1 MET 114 3HE MET 114 4.582 -0.606 16.350 852 HE2 MET 114 1HE MET 114 3.747 -1.620 15.172 853 HE3 MET 114 2HE MET 114 2.914 -0.246 15.900 854 H GLY 115 H GLY 115 3.897 6.422 13.649 855 HA2 GLY 115 1HA GLY 115 4.789 8.407 12.708 856 HA3 GLY 115 2HA GLY 115 6.366 7.634 12.638 857 H VAL 116 H VAL 116 3.958 5.556 11.569 858 HA VAL 116 HA VAL 116 4.893 5.832 8.831 859 HB VAL 116 HB VAL 116 2.914 3.846 9.962 860 HG11 VAL 116 1HG1 VAL 116 4.502 3.832 7.398 861 HG12 VAL 116 2HG1 VAL 116 2.763 4.081 7.549 862 HG13 VAL 116 3HG1 VAL 116 3.469 2.521 7.971 863 HG21 VAL 116 3HG2 VAL 116 5.054 3.642 11.106 864 HG22 VAL 116 1HG2 VAL 116 5.892 3.556 9.556 865 HG23 VAL 116 2HG2 VAL 116 4.789 2.265 10.036 866 H GLY 117 H GLY 117 3.926 7.304 7.582 867 HA2 GLY 117 1HA GLY 117 1.217 8.171 8.109 868 HA3 GLY 117 2HA GLY 117 2.284 8.782 6.853 869 H VAL 118 H VAL 118 -0.347 6.764 7.563 870 HA VAL 118 HA VAL 118 -0.120 5.216 5.106 871 HB VAL 118 HB VAL 118 -2.345 5.171 7.148 872 HG11 VAL 118 1HG1 VAL 118 -2.872 2.985 6.181 873 HG12 VAL 118 2HG1 VAL 118 -1.583 3.198 4.996 874 HG13 VAL 118 3HG1 VAL 118 -2.984 4.268 4.976 875 HG21 VAL 118 3HG2 VAL 118 -1.265 3.163 8.044 876 HG22 VAL 118 1HG2 VAL 118 -0.238 4.587 8.205 877 HG23 VAL 118 2HG2 VAL 118 0.088 3.404 6.939 878 H GLU 119 H GLU 119 -0.911 5.932 3.262 879 HA GLU 119 HA GLU 119 -3.213 7.776 3.321 880 HB2 GLU 119 1HB GLU 119 -0.888 7.669 1.393 881 HB3 GLU 119 2HB GLU 119 -2.337 8.629 1.121 882 HG2 GLU 119 1HG GLU 119 -1.886 9.919 3.126 883 HG3 GLU 119 2HG GLU 119 -0.465 8.928 3.460 884 H ALA 120 H ALA 120 -4.989 6.833 2.630 885 HA ALA 120 HA ALA 120 -4.809 4.548 0.807 886 HB1 ALA 120 3HB ALA 120 -7.116 4.080 1.467 887 HB2 ALA 120 1HB ALA 120 -7.126 5.533 2.465 888 HB3 ALA 120 2HB ALA 120 -6.055 4.191 2.872 889 H MET 121 H MET 121 -5.171 4.856 -1.269 890 HA MET 121 HA MET 121 -7.076 6.904 -2.130 891 HB2 MET 121 1HB MET 121 -4.220 6.691 -3.101 892 HB3 MET 121 2HB MET 121 -5.464 7.634 -3.911 893 HG2 MET 121 1HG MET 121 -5.709 9.021 -1.916 894 HG3 MET 121 2HG MET 121 -4.456 8.077 -1.109 895 HE1 MET 121 3HE MET 121 -1.911 8.091 -1.794 896 HE2 MET 121 1HE MET 121 -1.277 8.945 -3.203 897 HE3 MET 121 2HE MET 121 -2.354 7.563 -3.418 898 H ASP 122 H ASP 122 -6.880 6.723 -4.784 899 HA ASP 122 HA ASP 122 -7.945 4.166 -5.421 900 HB2 ASP 122 1HB ASP 122 -8.559 6.323 -6.562 901 HB3 ASP 122 2HB ASP 122 -6.971 6.314 -7.322 902 H THR 123 H THR 123 -7.029 2.586 -6.844 903 HA THR 123 HA THR 123 -4.370 1.907 -6.348 904 HB THR 123 HB THR 123 -6.111 1.019 -8.658 905 HG1 THR 123 HG1 THR 123 -6.637 -0.703 -7.215 906 HG21 THR 123 3HG2 THR 123 -3.728 -0.334 -7.385 907 HG22 THR 123 1HG2 THR 123 -3.733 0.454 -8.963 908 HG23 THR 123 2HG2 THR 123 -4.719 -0.982 -8.690 909 H GLN 124 H GLN 124 -5.827 3.696 -9.029 910 HA GLN 124 HA GLN 124 -3.455 3.798 -10.620 911 HB2 GLN 124 1HB GLN 124 -5.623 4.106 -11.651 912 HB3 GLN 124 2HB GLN 124 -5.962 5.489 -10.622 913 HG2 GLN 124 1HG GLN 124 -4.102 6.698 -11.693 914 HG3 GLN 124 2HG GLN 124 -3.872 5.327 -12.778 915 HE21 GLN 124 2HE2 GLN 124 -5.340 4.965 -14.420 916 HE22 GLN 124 1HE2 GLN 124 -6.535 6.131 -14.877 917 H ALA 125 H ALA 125 -4.961 5.969 -8.278 918 HA ALA 125 HA ALA 125 -3.145 8.114 -8.623 919 HB1 ALA 125 3HB ALA 125 -4.090 9.004 -6.560 920 HB2 ALA 125 1HB ALA 125 -4.866 7.454 -6.234 921 HB3 ALA 125 2HB ALA 125 -5.362 8.412 -7.630 922 H ALA 126 H ALA 126 -3.275 5.385 -6.381 923 HA ALA 126 HA ALA 126 -1.072 6.152 -4.790 924 HB1 ALA 126 3HB ALA 126 -2.716 4.500 -4.056 925 HB2 ALA 126 1HB ALA 126 -1.079 3.844 -3.994 926 HB3 ALA 126 2HB ALA 126 -2.163 3.389 -5.309 927 H ALA 127 H ALA 127 -1.347 4.217 -7.732 928 HA ALA 127 HA ALA 127 1.265 3.218 -7.824 929 HB1 ALA 127 3HB ALA 127 -0.540 2.398 -9.257 930 HB2 ALA 127 1HB ALA 127 0.878 2.858 -10.200 931 HB3 ALA 127 2HB ALA 127 -0.527 3.922 -10.145 932 H ARG 128 H ARG 128 -0.073 6.143 -9.378 933 HA ARG 128 HA ARG 128 2.360 7.011 -10.482 934 HE ARG 128 HE ARG 128 -2.480 9.015 -11.260 935 HB2 ARG 128 1HB ARG 128 -0.061 8.620 -9.665 936 HB3 ARG 128 2HB ARG 128 1.281 9.256 -10.604 937 HG2 ARG 128 1HG ARG 128 0.797 7.497 -12.318 938 HG3 ARG 128 2HG ARG 128 -0.669 7.117 -11.412 939 HD2 ARG 128 1HD ARG 128 0.031 9.803 -12.594 940 HD3 ARG 128 2HD ARG 128 -1.121 8.653 -13.268 941 HH11 ARG 128 1HH1 ARG 128 -0.034 11.388 -12.047 942 HH12 ARG 128 2HH1 ARG 128 -0.831 12.682 -11.208 943 HH21 ARG 128 1HH2 ARG 128 -3.527 10.692 -10.150 944 HH22 ARG 128 2HH2 ARG 128 -2.813 12.280 -10.090 945 H THR 129 H THR 129 0.857 7.657 -7.353 946 HA THR 129 HA THR 129 2.707 9.606 -6.487 947 HB THR 129 HB THR 129 1.097 7.695 -4.775 948 HG1 THR 129 HG1 THR 129 -0.297 8.862 -6.115 949 HG21 THR 129 3HG2 THR 129 2.851 8.849 -3.529 950 HG22 THR 129 1HG2 THR 129 1.262 9.463 -3.076 951 HG23 THR 129 2HG2 THR 129 2.294 10.400 -4.157 952 H TYR 130 H TYR 130 2.610 6.087 -6.210 953 HA TYR 130 HA TYR 130 4.804 5.741 -4.500 954 HD1 TYR 130 HD2 TYR 130 4.871 3.406 -3.165 955 HD2 TYR 130 HD1 TYR 130 5.561 2.509 -7.266 956 HE1 TYR 130 HE2 TYR 130 6.547 1.729 -2.511 957 HE2 TYR 130 HE1 TYR 130 7.239 0.831 -6.622 958 HH TYR 130 HH TYR 130 7.544 -0.340 -3.487 959 HB2 TYR 130 1HB TYR 130 3.199 3.958 -5.026 960 HB3 TYR 130 2HB TYR 130 3.784 3.912 -6.685 961 H ASN 131 H ASN 131 4.621 5.778 -8.050 962 HA ASN 131 HA ASN 131 7.325 5.321 -8.577 963 HB2 ASN 131 1HB ASN 131 5.130 6.667 -10.106 964 HB3 ASN 131 2HB ASN 131 6.783 6.760 -10.705 965 HD21 ASN 131 2HD2 ASN 131 7.788 4.921 -11.463 966 HD22 ASN 131 1HD2 ASN 131 6.922 3.468 -11.809 967 H ILE 132 H ILE 132 5.627 8.320 -7.832 968 HA ILE 132 HA ILE 132 7.834 10.037 -8.325 969 HB ILE 132 HB ILE 132 5.421 10.449 -6.548 970 HG12 ILE 132 1HG1 ILE 132 6.010 11.417 -9.357 971 HG13 ILE 132 2HG1 ILE 132 4.917 10.100 -8.946 972 HG21 ILE 132 1HG2 ILE 132 7.451 12.449 -7.542 973 HG22 ILE 132 2HG2 ILE 132 7.235 11.917 -5.875 974 HG23 ILE 132 3HG2 ILE 132 5.964 12.839 -6.676 975 HD11 ILE 132 3HD1 ILE 132 3.492 11.670 -7.730 976 HD12 ILE 132 1HD1 ILE 132 3.690 12.130 -9.422 977 HD13 ILE 132 2HD1 ILE 132 4.582 12.987 -8.165 978 H LEU 133 H LEU 133 6.479 8.709 -5.310 979 HA LEU 133 HA LEU 133 8.360 9.891 -3.591 980 HG LEU 133 HG LEU 133 5.199 9.053 -3.622 981 HB2 LEU 133 1HB LEU 133 6.833 7.327 -3.152 982 HB3 LEU 133 2HB LEU 133 7.574 8.316 -1.910 983 HD11 LEU 133 1HD1 LEU 133 4.725 7.465 -1.824 984 HD12 LEU 133 2HD1 LEU 133 3.986 9.037 -1.514 985 HD13 LEU 133 3HD1 LEU 133 5.456 8.567 -0.658 986 HD21 LEU 133 3HD2 LEU 133 6.595 11.015 -3.232 987 HD22 LEU 133 1HD2 LEU 133 6.606 10.672 -1.501 988 HD23 LEU 133 2HD2 LEU 133 5.097 11.109 -2.303 989 H MET 134 H MET 134 8.322 6.715 -5.168 990 HA MET 134 HA MET 134 10.636 5.702 -3.902 991 HB2 MET 134 1HB MET 134 9.056 4.246 -5.081 992 HB3 MET 134 2HB MET 134 9.473 5.009 -6.608 993 HG2 MET 134 1HG MET 134 11.764 4.178 -6.395 994 HG3 MET 134 2HG MET 134 11.337 3.404 -4.871 995 HE1 MET 134 3HE MET 134 9.128 3.669 -8.126 996 HE2 MET 134 1HE MET 134 9.567 2.176 -8.956 997 HE3 MET 134 2HE MET 134 10.761 3.456 -8.755 998 H ALA 135 H ALA 135 10.156 7.559 -6.862 999 HA ALA 135 HA ALA 135 12.826 7.441 -7.780 1000 HB1 ALA 135 3HB ALA 135 12.228 9.313 -9.215 1001 HB2 ALA 135 1HB ALA 135 10.756 9.576 -8.281 1002 HB3 ALA 135 2HB ALA 135 10.953 8.095 -9.216 1003 H GLU 136 H GLU 136 11.164 9.535 -5.510 1004 HA GLU 136 HA GLU 136 13.298 11.421 -5.254 1005 HB2 GLU 136 1HB GLU 136 11.002 10.797 -3.390 1006 HB3 GLU 136 2HB GLU 136 12.081 12.175 -3.237 1007 HG2 GLU 136 1HG GLU 136 11.313 12.991 -5.424 1008 HG3 GLU 136 2HG GLU 136 10.191 11.632 -5.512 1009 H GLY 137 H GLY 137 12.572 8.325 -3.876 1010 HA2 GLY 137 1HA GLY 137 14.240 6.999 -2.825 1011 HA3 GLY 137 2HA GLY 137 15.063 8.474 -2.338 1012 H ARG 138 H ARG 138 11.640 8.291 -1.913 1013 HA ARG 138 HA ARG 138 11.941 8.508 0.932 1014 HE ARG 138 HE ARG 138 9.135 12.271 -2.072 1015 HB2 ARG 138 1HB ARG 138 9.425 8.290 -0.729 1016 HB3 ARG 138 2HB ARG 138 9.530 8.798 0.943 1017 HG2 ARG 138 1HG ARG 138 10.903 10.734 0.215 1018 HG3 ARG 138 2HG ARG 138 10.595 10.255 -1.454 1019 HD2 ARG 138 1HD ARG 138 8.132 10.399 -0.908 1020 HD3 ARG 138 2HD ARG 138 8.600 11.160 0.613 1021 HH11 ARG 138 1HH1 ARG 138 8.424 12.688 1.331 1022 HH12 ARG 138 2HH1 ARG 138 8.526 14.426 1.266 1023 HH21 ARG 138 1HH2 ARG 138 9.277 14.536 -2.166 1024 HH22 ARG 138 2HH2 ARG 138 9.028 15.479 -0.717 1025 H ARG 139 H ARG 139 10.765 7.111 2.427 1026 HA ARG 139 HA ARG 139 11.133 4.327 1.635 1027 HE ARG 139 HE ARG 139 11.532 7.557 4.061 1028 HB2 ARG 139 1HB ARG 139 10.643 5.587 4.342 1029 HB3 ARG 139 2HB ARG 139 10.833 3.860 4.075 1030 HG2 ARG 139 1HG ARG 139 13.019 4.094 4.289 1031 HG3 ARG 139 2HG ARG 139 13.036 5.110 2.849 1032 HD2 ARG 139 1HD ARG 139 12.609 6.055 5.683 1033 HD3 ARG 139 2HD ARG 139 14.090 6.234 4.747 1034 HH11 ARG 139 1HH1 ARG 139 15.035 7.555 4.212 1035 HH12 ARG 139 2HH1 ARG 139 15.182 9.169 3.584 1036 HH21 ARG 139 1HH2 ARG 139 11.727 9.649 3.236 1037 HH22 ARG 139 2HH2 ARG 139 13.301 10.352 3.017 1038 H VAL 140 H VAL 140 9.338 4.075 0.305 1039 HA VAL 140 HA VAL 140 6.729 4.280 1.645 1040 HB VAL 140 HB VAL 140 6.890 6.002 -0.035 1041 HG11 VAL 140 1HG1 VAL 140 7.551 3.806 -1.991 1042 HG12 VAL 140 2HG1 VAL 140 8.648 5.064 -1.420 1043 HG13 VAL 140 3HG1 VAL 140 7.248 5.493 -2.405 1044 HG21 VAL 140 3HG2 VAL 140 4.986 5.412 -1.467 1045 HG22 VAL 140 1HG2 VAL 140 4.722 4.935 0.210 1046 HG23 VAL 140 2HG2 VAL 140 5.163 3.722 -0.992 1047 H VAL 141 H VAL 141 5.469 2.551 1.659 1048 HA VAL 141 HA VAL 141 6.089 0.325 -0.175 1049 HB VAL 141 HB VAL 141 4.730 0.134 2.528 1050 HG11 VAL 141 1HG1 VAL 141 5.688 -2.016 0.642 1051 HG12 VAL 141 2HG1 VAL 141 4.008 -1.582 0.956 1052 HG13 VAL 141 3HG1 VAL 141 4.994 -2.283 2.241 1053 HG21 VAL 141 3HG2 VAL 141 6.784 -0.975 3.294 1054 HG22 VAL 141 1HG2 VAL 141 7.076 0.697 2.815 1055 HG23 VAL 141 2HG2 VAL 141 7.542 -0.622 1.741 1056 H VAL 142 H VAL 142 4.373 -0.446 -1.413 1057 HA VAL 142 HA VAL 142 1.851 1.037 -1.071 1058 HB VAL 142 HB VAL 142 3.124 1.840 -3.021 1059 HG11 VAL 142 1HG1 VAL 142 3.392 0.422 -4.992 1060 HG12 VAL 142 2HG1 VAL 142 2.781 -0.958 -4.080 1061 HG13 VAL 142 3HG1 VAL 142 4.300 -0.194 -3.612 1062 HG21 VAL 142 3HG2 VAL 142 0.709 2.002 -3.041 1063 HG22 VAL 142 1HG2 VAL 142 0.583 0.374 -3.709 1064 HG23 VAL 142 2HG2 VAL 142 1.313 1.666 -4.664 1065 H ALA 143 H ALA 143 0.026 -0.075 -1.036 1066 HA ALA 143 HA ALA 143 0.090 -2.931 -1.783 1067 HB1 ALA 143 3HB ALA 143 -0.173 -2.650 0.633 1068 HB2 ALA 143 1HB ALA 143 -1.645 -3.303 -0.085 1069 HB3 ALA 143 2HB ALA 143 -1.565 -1.600 0.368 1070 H LEU 144 H LEU 144 -1.013 -3.237 -3.608 1071 HA LEU 144 HA LEU 144 -3.191 -1.356 -4.240 1072 HG LEU 144 HG LEU 144 -0.235 -1.103 -5.213 1073 HB2 LEU 144 1HB LEU 144 -1.497 -3.028 -6.099 1074 HB3 LEU 144 2HB LEU 144 -2.784 -1.945 -6.599 1075 HD11 LEU 144 1HD1 LEU 144 -1.105 -0.774 -8.079 1076 HD12 LEU 144 2HD1 LEU 144 0.165 -1.850 -7.497 1077 HD13 LEU 144 3HD1 LEU 144 0.356 -0.102 -7.356 1078 HD21 LEU 144 3HD2 LEU 144 -2.132 0.342 -4.669 1079 HD22 LEU 144 1HD2 LEU 144 -2.465 0.554 -6.388 1080 HD23 LEU 144 2HD2 LEU 144 -0.964 1.171 -5.699 1081 H LEU 145 H LEU 145 -5.201 -2.090 -4.640 1082 HA LEU 145 HA LEU 145 -5.623 -4.981 -4.293 1083 HG LEU 145 HG LEU 145 -5.680 -2.825 -2.016 1084 HB2 LEU 145 1HB LEU 145 -7.498 -2.694 -3.695 1085 HB3 LEU 145 2HB LEU 145 -7.840 -4.392 -3.430 1086 HD11 LEU 145 1HD1 LEU 145 -7.146 -3.011 -0.061 1087 HD12 LEU 145 2HD1 LEU 145 -8.388 -3.751 -1.070 1088 HD13 LEU 145 3HD1 LEU 145 -7.898 -2.083 -1.357 1089 HD21 LEU 145 3HD2 LEU 145 -5.537 -4.794 -0.568 1090 HD22 LEU 145 1HD2 LEU 145 -5.143 -5.195 -2.240 1091 HD23 LEU 145 2HD2 LEU 145 -6.721 -5.623 -1.578 1092 HA PRO 146 HA PRO 146 -7.723 -4.714 -8.301 1093 HB2 PRO 146 1HB PRO 146 -6.846 -7.367 -8.843 1094 HB3 PRO 146 2HB PRO 146 -6.245 -5.877 -9.572 1095 HG2 PRO 146 1HG PRO 146 -4.792 -7.557 -7.896 1096 HG3 PRO 146 2HG PRO 146 -4.384 -5.876 -8.275 1097 HD2 PRO 146 1HD PRO 146 -5.754 -7.003 -5.868 1098 HD3 PRO 146 2HD PRO 146 -4.599 -5.657 -5.985 1099 H ASP 147 H ASP 147 -9.831 -5.305 -8.361 1100 HA ASP 147 HA ASP 147 -10.766 -7.142 -6.309 1101 HB2 ASP 147 1HB ASP 147 -12.939 -6.250 -6.658 1102 HB3 ASP 147 2HB ASP 147 -11.835 -4.885 -6.717 1103 H GLY 148 H GLY 148 -13.130 -8.039 -7.512 1104 HA2 GLY 148 1HA GLY 148 -12.194 -9.680 -9.762 1105 HA3 GLY 148 2HA GLY 148 -12.809 -10.475 -8.317 1106 H ASP 149 H ASP 149 -14.511 -7.739 -8.460 1107 HA ASP 149 HA ASP 149 -16.852 -9.070 -9.511 1108 HB2 ASP 149 1HB ASP 149 -16.522 -6.246 -8.466 1109 HB3 ASP 149 2HB ASP 149 -18.052 -7.056 -8.788 1110 H SER 150 H SER 150 -14.553 -6.655 -10.453 1111 HA SER 150 HA SER 150 -16.026 -5.577 -12.639 1112 HG SER 150 HG SER 150 -13.674 -4.576 -10.456 1113 HB2 SER 150 1HB SER 150 -13.027 -5.591 -12.227 1114 HB3 SER 150 2HB SER 150 -13.952 -4.482 -13.241 1115 H LEU 151 H LEU 151 -16.530 -6.630 -14.433 1116 HA LEU 151 HA LEU 151 -15.111 -8.964 -15.322 1117 HG LEU 151 HG LEU 151 -18.073 -8.354 -14.601 1118 HB2 LEU 151 1HB LEU 151 -17.238 -7.317 -16.707 1119 HB3 LEU 151 2HB LEU 151 -16.675 -8.896 -17.223 1120 HD11 LEU 151 1HD1 LEU 151 -19.131 -9.557 -17.153 1121 HD12 LEU 151 2HD1 LEU 151 -19.574 -7.988 -16.481 1122 HD13 LEU 151 3HD1 LEU 151 -19.995 -9.467 -15.619 1123 HD21 LEU 151 3HD2 LEU 151 -18.265 -10.797 -14.503 1124 HD22 LEU 151 1HD2 LEU 151 -16.582 -10.271 -14.509 1125 HD23 LEU 151 2HD2 LEU 151 -17.306 -10.926 -15.977 1126 H GLU 152 H GLU 152 -14.701 -8.866 -17.929 1127 HA GLU 152 HA GLU 152 -12.486 -7.065 -18.183 1128 HB2 GLU 152 1HB GLU 152 -12.024 -8.106 -20.277 1129 HB3 GLU 152 2HB GLU 152 -12.541 -9.380 -19.187 1130 HG2 GLU 152 1HG GLU 152 -14.390 -8.073 -21.162 1131 HG3 GLU 152 2HG GLU 152 -13.407 -9.481 -21.552 1132 H HIS 153 H HIS 153 -15.730 -7.317 -19.465 1133 HA HIS 153 HA HIS 153 -15.755 -4.462 -20.003 1134 HD1 HIS 153 HD1 HIS 153 -15.373 -2.938 -22.604 1135 HD2 HIS 153 HD2 HIS 153 -13.495 -6.644 -22.738 1136 HE1 HIS 153 HE1 HIS 153 -13.097 -2.509 -23.581 1137 HE2 HIS 153 HE2 HIS 153 -11.895 -4.718 -23.394 1138 HB2 HIS 153 1HB HIS 153 -16.200 -6.560 -22.123 1139 HB3 HIS 153 2HB HIS 153 -16.952 -4.974 -22.237 1140 H HIS 154 H HIS 154 -18.086 -3.778 -20.500 1141 HA HIS 154 HA HIS 154 -19.688 -5.015 -18.472 1142 HD1 HIS 154 HD1 HIS 154 -20.748 -2.960 -16.625 1143 HD2 HIS 154 HD2 HIS 154 -23.312 -3.354 -19.877 1144 HE1 HIS 154 HE1 HIS 154 -23.071 -2.933 -15.666 1145 HE2 HIS 154 HE2 HIS 154 -24.588 -3.393 -17.624 1146 HB2 HIS 154 1HB HIS 154 -19.643 -2.527 -18.980 1147 HB3 HIS 154 2HB HIS 154 -20.628 -2.888 -20.395 1148 H HIS 155 H HIS 155 -19.619 -5.038 -21.987 1149 HA HIS 155 HA HIS 155 -22.050 -6.600 -22.135 1150 HD1 HIS 155 HD1 HIS 155 -21.280 -4.091 -25.924 1151 HD2 HIS 155 HD2 HIS 155 -23.666 -5.338 -22.758 1152 HE1 HIS 155 HE1 HIS 155 -23.323 -2.619 -25.990 1153 HE2 HIS 155 HE2 HIS 155 -24.845 -3.558 -24.207 1154 HB2 HIS 155 1HB HIS 155 -20.081 -5.627 -24.176 1155 HB3 HIS 155 2HB HIS 155 -21.205 -6.919 -24.588 1156 H HIS 156 H HIS 156 -21.225 -8.145 -20.580 1157 HA HIS 156 HA HIS 156 -19.367 -10.130 -21.635 1158 HD1 HIS 156 HD1 HIS 156 -17.196 -10.474 -19.301 1159 HD2 HIS 156 HD2 HIS 156 -20.434 -13.085 -19.047 1160 HE1 HIS 156 HE1 HIS 156 -16.221 -12.724 -18.740 1161 HE2 HIS 156 HE2 HIS 156 -18.209 -14.240 -18.410 1162 HB2 HIS 156 1HB HIS 156 -19.507 -9.308 -19.174 1163 HB3 HIS 156 2HB HIS 156 -20.934 -10.329 -19.064 1164 H HIS 157 H HIS 157 -20.056 -12.071 -22.512 1165 HA HIS 157 HA HIS 157 -22.911 -12.045 -23.171 1166 HD1 HIS 157 HD1 HIS 157 -23.362 -11.171 -25.860 1167 HD2 HIS 157 HD2 HIS 157 -19.225 -11.190 -25.416 1168 HE1 HIS 157 HE1 HIS 157 -22.534 -9.144 -27.096 1169 HE2 HIS 157 HE2 HIS 157 -20.057 -9.069 -26.646 1170 HB2 HIS 157 1HB HIS 157 -20.587 -13.402 -24.549 1171 HB3 HIS 157 2HB HIS 157 -22.264 -13.501 -25.079 1172 H HIS 158 H HIS 158 -21.417 -13.334 -20.781 1173 HA HIS 158 HA HIS 158 -23.240 -15.573 -20.654 1174 HD1 HIS 158 HD1 HIS 158 -23.330 -18.223 -20.838 1175 HD2 HIS 158 HD2 HIS 158 -20.139 -17.065 -23.243 1176 HE1 HIS 158 HE1 HIS 158 -23.492 -19.637 -22.905 1177 HE2 HIS 158 HE2 HIS 158 -21.434 -19.079 -24.236 1178 HB2 HIS 158 1HB HIS 158 -20.285 -15.933 -20.796 1179 HB3 HIS 158 2HB HIS 158 -21.168 -16.923 -19.641 Start of MODEL 15 1 HA MET 1 HA MET 1 9.439 -26.114 -9.888 2 H1 MET 1 1H MET 1 8.428 -26.091 -7.727 3 H2 MET 1 2H MET 1 8.189 -24.416 -7.810 4 H3 MET 1 3H MET 1 9.762 -25.046 -7.756 5 HB2 MET 1 1HB MET 1 6.777 -24.679 -9.801 6 HB3 MET 1 2HB MET 1 7.451 -25.435 -11.238 7 HG2 MET 1 1HG MET 1 6.700 -26.830 -8.681 8 HG3 MET 1 2HG MET 1 5.800 -26.867 -10.196 9 HE1 MET 1 3HE MET 1 6.683 -28.055 -12.414 10 HE2 MET 1 1HE MET 1 8.276 -28.799 -12.546 11 HE3 MET 1 2HE MET 1 8.133 -27.054 -12.337 12 H LYS 2 H LYS 2 7.829 -22.925 -9.681 13 HA LYS 2 HA LYS 2 10.023 -21.837 -11.292 14 HB2 LYS 2 1HB LYS 2 7.771 -21.401 -12.140 15 HB3 LYS 2 2HB LYS 2 7.319 -20.656 -10.612 16 HG2 LYS 2 1HG LYS 2 8.889 -18.855 -10.981 17 HG3 LYS 2 2HG LYS 2 9.467 -19.626 -12.458 18 HD2 LYS 2 1HD LYS 2 7.289 -19.341 -13.489 19 HD3 LYS 2 2HD LYS 2 6.649 -18.651 -11.995 20 HE2 LYS 2 1HE LYS 2 8.143 -16.764 -12.178 21 HE3 LYS 2 2HE LYS 2 8.925 -17.476 -13.587 22 HZ1 LYS 2 3HZ LYS 2 6.061 -16.687 -13.482 23 HZ2 LYS 2 1HZ LYS 2 6.918 -17.226 -14.841 24 HZ3 LYS 2 2HZ LYS 2 7.296 -15.727 -14.144 25 H LEU 3 H LEU 3 11.604 -20.837 -10.294 26 HA LEU 3 HA LEU 3 11.540 -20.220 -7.526 27 HG LEU 3 HG LEU 3 13.465 -21.833 -9.391 28 HB2 LEU 3 1HB LEU 3 13.507 -19.392 -9.664 29 HB3 LEU 3 2HB LEU 3 13.758 -19.202 -7.939 30 HD11 LEU 3 1HD1 LEU 3 15.577 -20.713 -9.873 31 HD12 LEU 3 2HD1 LEU 3 15.825 -22.136 -8.862 32 HD13 LEU 3 3HD1 LEU 3 15.879 -20.526 -8.145 33 HD21 LEU 3 3HD2 LEU 3 14.070 -22.844 -7.255 34 HD22 LEU 3 1HD2 LEU 3 12.573 -21.920 -7.118 35 HD23 LEU 3 2HD2 LEU 3 14.082 -21.250 -6.496 36 H HIS 4 H HIS 4 11.578 -18.208 -6.502 37 HA HIS 4 HA HIS 4 10.141 -16.128 -7.949 38 HD1 HIS 4 HD1 HIS 4 10.292 -13.268 -5.540 39 HD2 HIS 4 HD2 HIS 4 7.281 -16.090 -6.060 40 HE1 HIS 4 HE1 HIS 4 8.141 -11.966 -5.579 41 HE2 HIS 4 HE2 HIS 4 6.325 -13.716 -5.681 42 HB2 HIS 4 1HB HIS 4 9.813 -17.002 -5.436 43 HB3 HIS 4 2HB HIS 4 11.018 -15.759 -5.120 44 H THR 5 H THR 5 11.710 -15.375 -9.344 45 HA THR 5 HA THR 5 14.379 -14.930 -8.870 46 HB THR 5 HB THR 5 12.633 -13.212 -10.642 47 HG1 THR 5 HG1 THR 5 13.973 -15.633 -11.345 48 HG21 THR 5 3HG2 THR 5 14.939 -12.402 -10.359 49 HG22 THR 5 1HG2 THR 5 14.657 -12.989 -12.000 50 HG23 THR 5 2HG2 THR 5 15.550 -13.982 -10.848 51 H ASP 6 H ASP 6 15.462 -13.612 -7.567 52 HA ASP 6 HA ASP 6 14.369 -11.547 -6.025 53 HB2 ASP 6 1HB ASP 6 17.232 -11.860 -6.975 54 HB3 ASP 6 2HB ASP 6 16.706 -10.801 -5.674 55 HA PRO 7 HA PRO 7 13.394 -8.402 -8.957 56 HB2 PRO 7 1HB PRO 7 14.470 -6.621 -6.807 57 HB3 PRO 7 2HB PRO 7 12.956 -6.501 -7.715 58 HG2 PRO 7 1HG PRO 7 12.955 -7.421 -5.223 59 HG3 PRO 7 2HG PRO 7 11.921 -8.162 -6.460 60 HD2 PRO 7 1HD PRO 7 14.451 -9.169 -5.254 61 HD3 PRO 7 2HD PRO 7 13.033 -10.071 -5.825 62 H ALA 8 H ALA 8 14.582 -7.876 -10.667 63 HA ALA 8 HA ALA 8 17.374 -7.924 -10.777 64 HB1 ALA 8 3HB ALA 8 15.985 -8.182 -12.762 65 HB2 ALA 8 1HB ALA 8 17.125 -6.854 -12.981 66 HB3 ALA 8 2HB ALA 8 15.434 -6.513 -12.614 67 H THR 9 H THR 9 15.239 -5.090 -10.970 68 HA THR 9 HA THR 9 17.367 -3.405 -9.908 69 HB THR 9 HB THR 9 15.623 -1.579 -10.237 70 HG1 THR 9 HG1 THR 9 13.695 -2.555 -10.423 71 HG21 THR 9 3HG2 THR 9 15.917 -1.507 -12.677 72 HG22 THR 9 1HG2 THR 9 16.462 -3.185 -12.654 73 HG23 THR 9 2HG2 THR 9 17.415 -1.938 -11.851 74 H ALA 10 H ALA 10 17.167 -2.331 -7.912 75 HA ALA 10 HA ALA 10 15.723 -3.666 -5.877 76 HB1 ALA 10 3HB ALA 10 17.760 -2.404 -5.398 77 HB2 ALA 10 1HB ALA 10 16.413 -1.803 -4.433 78 HB3 ALA 10 2HB ALA 10 16.951 -0.904 -5.852 79 H LEU 11 H LEU 11 15.178 -0.746 -7.745 80 HA LEU 11 HA LEU 11 12.748 0.029 -6.518 81 HG LEU 11 HG LEU 11 15.404 1.327 -7.838 82 HB2 LEU 11 1HB LEU 11 13.620 0.544 -9.364 83 HB3 LEU 11 2HB LEU 11 12.446 1.462 -8.443 84 HD11 LEU 11 1HD1 LEU 11 13.747 3.509 -9.098 85 HD12 LEU 11 2HD1 LEU 11 14.970 2.527 -9.904 86 HD13 LEU 11 3HD1 LEU 11 15.440 3.647 -8.625 87 HD21 LEU 11 3HD2 LEU 11 13.231 3.047 -6.647 88 HD22 LEU 11 1HD2 LEU 11 14.951 3.134 -6.271 89 HD23 LEU 11 2HD2 LEU 11 14.028 1.693 -5.846 90 H ASN 12 H ASN 12 11.105 -1.415 -6.412 91 HA ASN 12 HA ASN 12 10.543 -3.361 -8.401 92 HB2 ASN 12 1HB ASN 12 8.972 -2.295 -6.062 93 HB3 ASN 12 2HB ASN 12 8.262 -3.445 -7.187 94 HD21 ASN 12 2HD2 ASN 12 11.652 -3.495 -6.254 95 HD22 ASN 12 1HD2 ASN 12 11.556 -4.960 -5.339 96 H THR 13 H THR 13 10.220 -2.551 -10.405 97 HA THR 13 HA THR 13 8.599 -0.161 -10.748 98 HB THR 13 HB THR 13 10.054 -1.721 -12.888 99 HG1 THR 13 HG1 THR 13 11.263 -0.738 -10.899 100 HG21 THR 13 3HG2 THR 13 9.144 1.156 -12.713 101 HG22 THR 13 1HG2 THR 13 8.421 -0.107 -13.711 102 HG23 THR 13 2HG2 THR 13 10.060 0.452 -14.045 103 H VAL 14 H VAL 14 6.544 -0.198 -11.393 104 HA VAL 14 HA VAL 14 5.226 -2.631 -12.136 105 HB VAL 14 HB VAL 14 4.205 0.211 -12.358 106 HG11 VAL 14 1HG1 VAL 14 2.739 -2.425 -12.322 107 HG12 VAL 14 2HG1 VAL 14 2.922 -1.346 -13.705 108 HG13 VAL 14 3HG1 VAL 14 1.981 -0.833 -12.305 109 HG21 VAL 14 3HG2 VAL 14 4.859 -0.311 -10.065 110 HG22 VAL 14 1HG2 VAL 14 3.874 -1.773 -10.109 111 HG23 VAL 14 2HG2 VAL 14 3.107 -0.189 -10.212 112 H THR 15 H THR 15 5.633 -3.511 -14.041 113 HA THR 15 HA THR 15 6.651 -1.953 -16.234 114 HB THR 15 HB THR 15 5.896 -4.872 -16.320 115 HG1 THR 15 HG1 THR 15 8.229 -5.077 -15.675 116 HG21 THR 15 3HG2 THR 15 6.556 -3.846 -18.440 117 HG22 THR 15 1HG2 THR 15 7.774 -4.996 -17.889 118 HG23 THR 15 2HG2 THR 15 8.049 -3.264 -17.700 119 H ALA 16 H ALA 16 3.654 -3.632 -15.435 120 HA ALA 16 HA ALA 16 2.312 -2.170 -17.560 121 HB1 ALA 16 3HB ALA 16 1.244 -4.144 -18.497 122 HB2 ALA 16 1HB ALA 16 2.160 -5.177 -17.400 123 HB3 ALA 16 2HB ALA 16 2.997 -4.251 -18.647 124 H TYR 17 H TYR 17 0.417 -1.451 -16.909 125 HA TYR 17 HA TYR 17 -0.824 -2.598 -14.512 126 HD1 TYR 17 HD1 TYR 17 -3.906 -0.240 -15.482 127 HD2 TYR 17 HD2 TYR 17 -1.027 -0.407 -12.354 128 HE1 TYR 17 HE1 TYR 17 -5.689 0.130 -13.828 129 HE2 TYR 17 HE2 TYR 17 -2.802 -0.041 -10.693 130 HH TYR 17 HH TYR 17 -6.054 -0.376 -11.366 131 HB2 TYR 17 1HB TYR 17 -0.335 -0.122 -14.646 132 HB3 TYR 17 2HB TYR 17 -1.506 -0.020 -15.951 133 H GLY 18 H GLY 18 -2.203 -4.202 -15.024 134 HA2 GLY 18 1HA GLY 18 -3.462 -4.152 -17.668 135 HA3 GLY 18 2HA GLY 18 -3.293 -5.560 -16.633 136 H ASP 19 H ASP 19 -5.592 -5.698 -17.432 137 HA ASP 19 HA ASP 19 -7.611 -4.015 -16.497 138 HB2 ASP 19 1HB ASP 19 -7.756 -6.987 -17.030 139 HB3 ASP 19 2HB ASP 19 -9.117 -5.885 -16.952 140 H GLY 20 H GLY 20 -6.634 -7.179 -15.247 141 HA2 GLY 20 1HA GLY 20 -7.252 -6.225 -12.531 142 HA3 GLY 20 2HA GLY 20 -7.895 -7.762 -13.094 143 H TYR 21 H TYR 21 -4.711 -6.421 -13.775 144 HA TYR 21 HA TYR 21 -3.432 -8.183 -11.874 145 HD1 TYR 21 HD1 TYR 21 -4.926 -8.655 -15.730 146 HD2 TYR 21 HD2 TYR 21 -0.725 -8.239 -15.188 147 HE1 TYR 21 HE1 TYR 21 -4.695 -7.980 -18.082 148 HE2 TYR 21 HE2 TYR 21 -0.484 -7.559 -17.539 149 HH TYR 21 HH TYR 21 -3.138 -6.701 -19.482 150 HB2 TYR 21 1HB TYR 21 -2.046 -9.342 -13.530 151 HB3 TYR 21 2HB TYR 21 -3.751 -9.684 -13.796 152 H ILE 22 H ILE 22 -1.379 -7.549 -11.345 153 HA ILE 22 HA ILE 22 -0.449 -5.036 -12.590 154 HB ILE 22 HB ILE 22 0.067 -6.020 -9.775 155 HG12 ILE 22 1HG1 ILE 22 -1.737 -3.769 -10.690 156 HG13 ILE 22 2HG1 ILE 22 -2.308 -5.364 -10.211 157 HG21 ILE 22 1HG2 ILE 22 0.705 -3.386 -11.101 158 HG22 ILE 22 2HG2 ILE 22 1.867 -4.630 -10.641 159 HG23 ILE 22 3HG2 ILE 22 0.962 -3.766 -9.398 160 HD11 ILE 22 3HD1 ILE 22 -1.428 -5.015 -7.971 161 HD12 ILE 22 1HD1 ILE 22 -2.561 -3.740 -8.420 162 HD13 ILE 22 2HD1 ILE 22 -0.825 -3.427 -8.451 163 H GLU 23 H GLU 23 1.347 -5.278 -13.760 164 HA GLU 23 HA GLU 23 3.007 -7.645 -13.341 165 HB2 GLU 23 1HB GLU 23 2.232 -7.108 -15.622 166 HB3 GLU 23 2HB GLU 23 3.076 -5.570 -15.540 167 HG2 GLU 23 1HG GLU 23 5.203 -6.713 -15.389 168 HG3 GLU 23 2HG GLU 23 4.384 -8.274 -15.384 169 H VAL 24 H VAL 24 4.613 -7.447 -11.933 170 HA VAL 24 HA VAL 24 5.998 -4.851 -11.726 171 HB VAL 24 HB VAL 24 5.949 -7.113 -9.716 172 HG11 VAL 24 1HG1 VAL 24 7.124 -4.340 -9.541 173 HG12 VAL 24 2HG1 VAL 24 8.021 -5.857 -9.615 174 HG13 VAL 24 3HG1 VAL 24 7.021 -5.491 -8.208 175 HG21 VAL 24 3HG2 VAL 24 3.782 -6.029 -9.857 176 HG22 VAL 24 1HG2 VAL 24 4.540 -4.445 -9.686 177 HG23 VAL 24 2HG2 VAL 24 4.584 -5.593 -8.347 178 H ASN 25 H ASN 25 7.846 -4.771 -12.763 179 HA ASN 25 HA ASN 25 9.908 -5.260 -13.580 180 HB2 ASN 25 1HB ASN 25 10.181 -6.398 -11.286 181 HB3 ASN 25 2HB ASN 25 9.870 -7.906 -12.131 182 HD21 ASN 25 2HD2 ASN 25 11.301 -6.939 -14.562 183 HD22 ASN 25 1HD2 ASN 25 12.979 -7.059 -14.161 184 H GLN 26 H GLN 26 7.877 -8.158 -13.444 185 HA GLN 26 HA GLN 26 7.503 -8.368 -16.213 186 HB2 GLN 26 1HB GLN 26 9.843 -9.045 -16.324 187 HB3 GLN 26 2HB GLN 26 9.581 -10.253 -15.074 188 HG2 GLN 26 1HG GLN 26 8.169 -11.538 -16.527 189 HG3 GLN 26 2HG GLN 26 8.232 -10.282 -17.763 190 HE21 GLN 26 2HE2 GLN 26 9.009 -13.120 -17.846 191 HE22 GLN 26 1HE2 GLN 26 10.668 -13.130 -18.352 192 H VAL 27 H VAL 27 7.603 -9.813 -13.053 193 HA VAL 27 HA VAL 27 5.825 -11.969 -13.616 194 HB VAL 27 HB VAL 27 6.457 -10.713 -10.939 195 HG11 VAL 27 1HG1 VAL 27 5.814 -12.892 -10.023 196 HG12 VAL 27 2HG1 VAL 27 5.390 -13.446 -11.643 197 HG13 VAL 27 3HG1 VAL 27 4.479 -12.133 -10.893 198 HG21 VAL 27 3HG2 VAL 27 8.145 -12.481 -10.706 199 HG22 VAL 27 1HG2 VAL 27 8.505 -11.405 -12.055 200 HG23 VAL 27 2HG2 VAL 27 7.819 -13.000 -12.360 201 H ARG 28 H ARG 28 3.690 -11.948 -13.748 202 HA ARG 28 HA ARG 28 2.287 -9.438 -13.216 203 HE ARG 28 HE ARG 28 2.461 -9.247 -18.134 204 HB2 ARG 28 1HB ARG 28 1.428 -11.930 -14.694 205 HB3 ARG 28 2HB ARG 28 0.431 -10.496 -14.491 206 HG2 ARG 28 1HG ARG 28 2.036 -9.174 -15.738 207 HG3 ARG 28 2HG ARG 28 3.087 -10.581 -15.903 208 HD2 ARG 28 1HD ARG 28 1.393 -11.733 -17.191 209 HD3 ARG 28 2HD ARG 28 0.273 -10.392 -16.962 210 HH11 ARG 28 1HH1 ARG 28 0.404 -11.968 -18.950 211 HH12 ARG 28 2HH1 ARG 28 0.529 -11.718 -20.668 212 HH21 ARG 28 1HH2 ARG 28 2.616 -8.903 -20.394 213 HH22 ARG 28 2HH2 ARG 28 1.783 -9.971 -21.491 214 H PHE 29 H PHE 29 1.196 -9.172 -11.414 215 HA PHE 29 HA PHE 29 0.400 -11.541 -9.875 216 HD1 PHE 29 HD1 PHE 29 1.840 -11.719 -7.344 217 HD2 PHE 29 HD2 PHE 29 2.970 -8.311 -9.629 218 HE1 PHE 29 HE1 PHE 29 4.205 -12.162 -6.827 219 HE2 PHE 29 HE2 PHE 29 5.337 -8.750 -9.119 220 HZ PHE 29 HZ PHE 29 5.956 -10.676 -7.716 221 HB2 PHE 29 1HB PHE 29 0.690 -8.657 -9.010 222 HB3 PHE 29 2HB PHE 29 0.215 -9.987 -7.961 223 H SER 30 H SER 30 -1.617 -12.152 -10.241 224 HA SER 30 HA SER 30 -3.692 -10.191 -10.823 225 HG SER 30 HG SER 30 -3.268 -14.020 -11.706 226 HB2 SER 30 1HB SER 30 -5.071 -12.400 -10.974 227 HB3 SER 30 2HB SER 30 -3.887 -12.051 -12.235 228 H HIS 31 H HIS 31 -2.316 -10.577 -8.195 229 HA HIS 31 HA HIS 31 -4.693 -10.957 -6.503 230 HD1 HIS 31 HD1 HIS 31 -2.157 -10.945 -3.418 231 HD2 HIS 31 HD2 HIS 31 -4.940 -13.829 -4.523 232 HE1 HIS 31 HE1 HIS 31 -3.152 -11.777 -1.269 233 HE2 HIS 31 HE2 HIS 31 -4.736 -13.616 -1.948 234 HB2 HIS 31 1HB HIS 31 -3.165 -12.953 -6.441 235 HB3 HIS 31 2HB HIS 31 -1.879 -11.903 -5.866 236 H ALA 32 H ALA 32 -4.672 -9.622 -4.580 237 HA ALA 32 HA ALA 32 -3.540 -7.076 -4.878 238 HB1 ALA 32 3HB ALA 32 -4.219 -6.671 -2.570 239 HB2 ALA 32 1HB ALA 32 -4.466 -8.400 -2.330 240 HB3 ALA 32 2HB ALA 32 -5.487 -7.511 -3.461 241 H ILE 33 H ILE 33 -1.686 -6.127 -4.130 242 HA ILE 33 HA ILE 33 0.229 -7.802 -2.680 243 HB ILE 33 HB ILE 33 2.026 -7.132 -4.321 244 HG12 ILE 33 1HG1 ILE 33 -0.358 -6.560 -6.098 245 HG13 ILE 33 2HG1 ILE 33 0.735 -5.344 -5.445 246 HG21 ILE 33 1HG2 ILE 33 -0.146 -8.973 -5.310 247 HG22 ILE 33 2HG2 ILE 33 1.154 -9.399 -4.198 248 HG23 ILE 33 3HG2 ILE 33 1.527 -8.960 -5.866 249 HD11 ILE 33 3HD1 ILE 33 1.251 -5.845 -7.759 250 HD12 ILE 33 1HD1 ILE 33 1.480 -7.546 -7.356 251 HD13 ILE 33 2HD1 ILE 33 2.577 -6.329 -6.703 252 H ALA 34 H ALA 34 1.964 -6.686 -1.756 253 HA ALA 34 HA ALA 34 1.837 -3.747 -1.823 254 HB1 ALA 34 3HB ALA 34 2.293 -3.688 0.592 255 HB2 ALA 34 1HB ALA 34 2.182 -5.446 0.653 256 HB3 ALA 34 2HB ALA 34 0.759 -4.488 0.244 257 H PHE 35 H PHE 35 3.778 -2.895 -2.320 258 HA PHE 35 HA PHE 35 6.201 -4.348 -1.632 259 HD1 PHE 35 HD1 PHE 35 3.428 -4.709 -4.509 260 HD2 PHE 35 HD2 PHE 35 6.868 -2.407 -5.495 261 HE1 PHE 35 HE1 PHE 35 2.183 -3.640 -6.341 262 HE2 PHE 35 HE2 PHE 35 5.627 -1.331 -7.325 263 HZ PHE 35 HZ PHE 35 3.281 -1.945 -7.750 264 HB2 PHE 35 1HB PHE 35 7.052 -4.202 -3.987 265 HB3 PHE 35 2HB PHE 35 5.733 -5.342 -3.756 266 H ALA 36 H ALA 36 8.175 -3.123 -2.209 267 HA ALA 36 HA ALA 36 7.717 -0.219 -2.022 268 HB1 ALA 36 3HB ALA 36 9.725 -1.839 -0.447 269 HB2 ALA 36 1HB ALA 36 8.233 -1.152 0.195 270 HB3 ALA 36 2HB ALA 36 9.518 -0.088 -0.375 271 HA PRO 37 HA PRO 37 10.818 0.161 -5.164 272 HB2 PRO 37 1HB PRO 37 12.188 2.384 -4.481 273 HB3 PRO 37 2HB PRO 37 10.513 2.440 -5.040 274 HG2 PRO 37 1HG PRO 37 11.577 2.537 -2.243 275 HG3 PRO 37 2HG PRO 37 10.306 3.524 -2.991 276 HD2 PRO 37 1HD PRO 37 9.762 1.396 -1.402 277 HD3 PRO 37 2HD PRO 37 8.712 1.882 -2.747 278 H GLU 38 H GLU 38 11.566 -1.325 -2.577 279 HA GLU 38 HA GLU 38 14.144 -2.076 -3.376 280 HB2 GLU 38 1HB GLU 38 14.747 0.107 -2.340 281 HB3 GLU 38 2HB GLU 38 14.080 -0.461 -0.816 282 HG2 GLU 38 1HG GLU 38 15.754 -2.141 -0.622 283 HG3 GLU 38 2HG GLU 38 16.331 -1.834 -2.261 284 H GLY 39 H GLY 39 13.171 -4.073 -3.243 285 HA2 GLY 39 1HA GLY 39 13.613 -5.773 -1.265 286 HA3 GLY 39 2HA GLY 39 12.162 -4.982 -0.665 287 HA PRO 40 HA PRO 40 10.671 -8.289 -3.481 288 HB2 PRO 40 1HB PRO 40 9.618 -9.976 -1.706 289 HB3 PRO 40 2HB PRO 40 11.362 -9.927 -1.992 290 HG2 PRO 40 1HG PRO 40 9.791 -8.875 0.299 291 HG3 PRO 40 2HG PRO 40 11.441 -9.516 0.267 292 HD2 PRO 40 1HD PRO 40 10.659 -6.784 0.229 293 HD3 PRO 40 2HD PRO 40 12.295 -7.433 0.013 294 H VAL 41 H VAL 41 8.463 -9.023 -3.897 295 HA VAL 41 HA VAL 41 6.478 -7.036 -3.101 296 HB VAL 41 HB VAL 41 6.220 -9.311 -5.081 297 HG11 VAL 41 1HG1 VAL 41 4.075 -8.549 -4.207 298 HG12 VAL 41 2HG1 VAL 41 4.266 -8.095 -5.901 299 HG13 VAL 41 3HG1 VAL 41 4.483 -6.886 -4.635 300 HG21 VAL 41 3HG2 VAL 41 6.504 -7.609 -6.815 301 HG22 VAL 41 1HG2 VAL 41 7.934 -7.733 -5.790 302 HG23 VAL 41 2HG2 VAL 41 6.806 -6.394 -5.573 303 H ALA 42 H ALA 42 5.077 -7.410 -1.501 304 HA ALA 42 HA ALA 42 4.829 -10.128 -0.447 305 HB1 ALA 42 3HB ALA 42 3.816 -9.073 1.507 306 HB2 ALA 42 1HB ALA 42 3.871 -7.505 0.700 307 HB3 ALA 42 2HB ALA 42 5.371 -8.333 1.126 308 H SER 43 H SER 43 2.924 -11.246 -0.382 309 HA SER 43 HA SER 43 0.807 -10.324 -2.114 310 HG SER 43 HG SER 43 1.383 -14.056 -0.606 311 HB2 SER 43 1HB SER 43 -0.164 -12.633 -1.421 312 HB3 SER 43 2HB SER 43 1.278 -12.594 -2.436 313 H TRP 44 H TRP 44 -0.894 -9.230 -1.445 314 HA TRP 44 HA TRP 44 -1.370 -8.997 1.438 315 HD1 TRP 44 HD1 TRP 44 -1.397 -7.496 2.955 316 HE1 TRP 44 HE1 TRP 44 -2.556 -5.648 4.320 317 HE3 TRP 44 HE3 TRP 44 -3.823 -5.084 -0.846 318 HZ2 TRP 44 HZ2 TRP 44 -4.270 -3.456 3.847 319 HZ3 TRP 44 HZ3 TRP 44 -5.201 -3.119 -0.303 320 HH2 TRP 44 HH2 TRP 44 -5.420 -2.322 1.994 321 HB2 TRP 44 1HB TRP 44 -0.977 -7.014 -0.216 322 HB3 TRP 44 2HB TRP 44 -2.650 -7.287 -0.680 323 HA PRO 45 HA PRO 45 -4.739 -11.802 0.661 324 HB2 PRO 45 1HB PRO 45 -5.523 -12.143 3.208 325 HB3 PRO 45 2HB PRO 45 -4.005 -12.811 2.596 326 HG2 PRO 45 1HG PRO 45 -4.472 -10.325 4.198 327 HG3 PRO 45 2HG PRO 45 -3.217 -11.564 4.394 328 HD2 PRO 45 1HD PRO 45 -2.790 -9.183 3.137 329 HD3 PRO 45 2HD PRO 45 -1.902 -10.668 2.743 330 H VAL 46 H VAL 46 -5.320 -8.920 0.346 331 HA VAL 46 HA VAL 46 -7.974 -8.739 1.590 332 HB VAL 46 HB VAL 46 -6.322 -6.622 0.198 333 HG11 VAL 46 1HG1 VAL 46 -8.049 -5.038 0.944 334 HG12 VAL 46 2HG1 VAL 46 -9.025 -6.389 1.517 335 HG13 VAL 46 3HG1 VAL 46 -8.685 -6.215 -0.204 336 HG21 VAL 46 3HG2 VAL 46 -7.110 -6.943 3.088 337 HG22 VAL 46 1HG2 VAL 46 -6.154 -5.625 2.411 338 HG23 VAL 46 2HG2 VAL 46 -5.512 -7.268 2.416 339 H GLN 47 H GLN 47 -9.805 -8.868 0.421 340 HA GLN 47 HA GLN 47 -9.531 -9.145 -2.504 341 HB2 GLN 47 1HB GLN 47 -11.551 -10.373 -0.621 342 HB3 GLN 47 2HB GLN 47 -11.623 -10.498 -2.373 343 HG2 GLN 47 1HG GLN 47 -9.557 -11.728 -2.416 344 HG3 GLN 47 2HG GLN 47 -9.349 -11.503 -0.679 345 HE21 GLN 47 2HE2 GLN 47 -9.547 -13.961 -2.271 346 HE22 GLN 47 1HE2 GLN 47 -10.868 -14.849 -1.579 347 H ARG 48 H ARG 48 -11.600 -7.968 0.106 348 HA ARG 48 HA ARG 48 -12.854 -6.113 -1.816 349 HE ARG 48 HE ARG 48 -16.814 -9.661 -2.033 350 HB2 ARG 48 1HB ARG 48 -13.991 -7.235 0.759 351 HB3 ARG 48 2HB ARG 48 -14.807 -6.103 -0.312 352 HG2 ARG 48 1HG ARG 48 -14.928 -7.743 -2.055 353 HG3 ARG 48 2HG ARG 48 -13.935 -8.867 -1.128 354 HD2 ARG 48 1HD ARG 48 -15.693 -8.940 0.602 355 HD3 ARG 48 2HD ARG 48 -16.690 -7.882 -0.395 356 HH11 ARG 48 1HH1 ARG 48 -15.564 -10.538 1.123 357 HH12 ARG 48 2HH1 ARG 48 -15.942 -12.228 0.940 358 HH21 ARG 48 1HH2 ARG 48 -17.296 -11.887 -2.277 359 HH22 ARG 48 2HH2 ARG 48 -16.905 -12.998 -0.997 360 HA PRO 49 HA PRO 49 -11.142 -2.731 0.453 361 HB2 PRO 49 1HB PRO 49 -13.736 -1.335 0.202 362 HB3 PRO 49 2HB PRO 49 -12.146 -0.873 -0.411 363 HG2 PRO 49 1HG PRO 49 -14.068 -1.745 -2.055 364 HG3 PRO 49 2HG PRO 49 -12.362 -2.151 -2.324 365 HD2 PRO 49 1HD PRO 49 -14.550 -3.830 -1.154 366 HD3 PRO 49 2HD PRO 49 -13.257 -4.290 -2.282 367 H ALA 50 H ALA 50 -13.799 -4.475 1.565 368 HA ALA 50 HA ALA 50 -14.040 -2.983 4.062 369 HB1 ALA 50 3HB ALA 50 -15.923 -4.440 4.546 370 HB2 ALA 50 1HB ALA 50 -15.571 -5.400 3.109 371 HB3 ALA 50 2HB ALA 50 -16.095 -3.725 2.943 372 H ASP 51 H ASP 51 -12.090 -5.369 2.834 373 HA ASP 51 HA ASP 51 -11.924 -6.999 5.227 374 HB2 ASP 51 1HB ASP 51 -10.247 -6.943 2.713 375 HB3 ASP 51 2HB ASP 51 -9.949 -8.037 4.054 376 H ILE 52 H ILE 52 -10.399 -4.215 3.885 377 HA ILE 52 HA ILE 52 -7.855 -4.328 4.986 378 HB ILE 52 HB ILE 52 -9.498 -1.832 4.540 379 HG12 ILE 52 1HG1 ILE 52 -7.642 -3.295 2.646 380 HG13 ILE 52 2HG1 ILE 52 -9.399 -3.303 2.547 381 HG21 ILE 52 1HG2 ILE 52 -6.515 -2.265 4.670 382 HG22 ILE 52 2HG2 ILE 52 -7.504 -1.410 5.855 383 HG23 ILE 52 3HG2 ILE 52 -7.307 -0.750 4.231 384 HD11 ILE 52 3HD1 ILE 52 -9.386 -0.896 2.145 385 HD12 ILE 52 1HD1 ILE 52 -8.437 -1.766 0.941 386 HD13 ILE 52 2HD1 ILE 52 -7.625 -0.893 2.240 387 H THR 53 H THR 53 -7.315 -4.576 7.027 388 HA THR 53 HA THR 53 -8.694 -3.001 9.091 389 HB THR 53 HB THR 53 -8.234 -4.898 10.668 390 HG1 THR 53 HG1 THR 53 -8.050 -6.987 9.294 391 HG21 THR 53 3HG2 THR 53 -10.015 -5.569 8.321 392 HG22 THR 53 1HG2 THR 53 -10.461 -4.555 9.694 393 HG23 THR 53 2HG2 THR 53 -10.117 -6.269 9.938 394 H ALA 54 H ALA 54 -7.274 -3.056 11.178 395 HA ALA 54 HA ALA 54 -4.873 -1.722 10.672 396 HB1 ALA 54 3HB ALA 54 -4.433 -1.952 13.065 397 HB2 ALA 54 1HB ALA 54 -5.706 -3.168 13.186 398 HB3 ALA 54 2HB ALA 54 -6.113 -1.505 12.766 399 H SER 55 H SER 55 -5.452 -5.105 11.578 400 HA SER 55 HA SER 55 -2.772 -5.903 11.784 401 HG SER 55 HG SER 55 -5.477 -6.562 12.949 402 HB2 SER 55 1HB SER 55 -5.150 -7.572 10.929 403 HB3 SER 55 2HB SER 55 -3.617 -8.190 11.543 404 H LEU 56 H LEU 56 -4.967 -5.849 9.007 405 HA LEU 56 HA LEU 56 -3.132 -7.104 7.234 406 HG LEU 56 HG LEU 56 -6.158 -7.541 7.752 407 HB2 LEU 56 1HB LEU 56 -5.575 -5.425 6.684 408 HB3 LEU 56 2HB LEU 56 -4.669 -6.279 5.449 409 HD11 LEU 56 1HD1 LEU 56 -7.620 -6.683 6.004 410 HD12 LEU 56 2HD1 LEU 56 -7.603 -8.446 6.014 411 HD13 LEU 56 3HD1 LEU 56 -6.693 -7.563 4.790 412 HD21 LEU 56 3HD2 LEU 56 -4.620 -8.831 5.505 413 HD22 LEU 56 1HD2 LEU 56 -5.584 -9.671 6.720 414 HD23 LEU 56 2HD2 LEU 56 -4.134 -8.789 7.199 415 H LEU 57 H LEU 57 -3.680 -3.814 8.234 416 HA LEU 57 HA LEU 57 -2.139 -2.625 6.145 417 HG LEU 57 HG LEU 57 -4.847 -1.813 7.194 418 HB2 LEU 57 1HB LEU 57 -3.021 -1.602 8.839 419 HB3 LEU 57 2HB LEU 57 -2.111 -0.634 7.694 420 HD11 LEU 57 1HD1 LEU 57 -5.617 0.509 7.290 421 HD12 LEU 57 2HD1 LEU 57 -3.993 1.024 7.744 422 HD13 LEU 57 3HD1 LEU 57 -4.922 -0.014 8.825 423 HD21 LEU 57 3HD2 LEU 57 -3.141 0.032 5.523 424 HD22 LEU 57 1HD2 LEU 57 -4.812 -0.413 5.175 425 HD23 LEU 57 2HD2 LEU 57 -3.549 -1.642 5.149 426 H GLN 58 H GLN 58 -1.418 -3.958 9.305 427 HA GLN 58 HA GLN 58 1.235 -3.021 9.535 428 HB2 GLN 58 1HB GLN 58 0.053 -5.623 10.535 429 HB3 GLN 58 2HB GLN 58 1.577 -4.924 11.066 430 HG2 GLN 58 1HG GLN 58 0.399 -3.012 11.991 431 HG3 GLN 58 2HG GLN 58 -1.136 -3.667 11.422 432 HE21 GLN 58 2HE2 GLN 58 -0.336 -3.015 14.125 433 HE22 GLN 58 1HE2 GLN 58 -0.472 -4.473 15.040 434 H GLN 59 H GLN 59 -0.148 -5.940 8.083 435 HA GLN 59 HA GLN 59 2.276 -7.002 7.093 436 HB2 GLN 59 1HB GLN 59 -0.586 -7.336 6.197 437 HB3 GLN 59 2HB GLN 59 0.752 -8.207 5.459 438 HG2 GLN 59 1HG GLN 59 1.263 -9.274 7.569 439 HG3 GLN 59 2HG GLN 59 -0.004 -8.345 8.369 440 HE21 GLN 59 2HE2 GLN 59 0.371 -11.259 8.025 441 HE22 GLN 59 1HE2 GLN 59 -1.079 -11.831 7.270 442 H ALA 60 H ALA 60 -0.114 -4.809 5.696 443 HA ALA 60 HA ALA 60 0.948 -4.648 3.106 444 HB1 ALA 60 3HB ALA 60 -0.358 -2.609 2.874 445 HB2 ALA 60 1HB ALA 60 -0.586 -2.540 4.621 446 HB3 ALA 60 2HB ALA 60 -1.294 -3.861 3.691 447 H ALA 61 H ALA 61 1.759 -2.919 6.060 448 HA ALA 61 HA ALA 61 3.449 -1.012 4.733 449 HB1 ALA 61 3HB ALA 61 4.042 -0.273 6.972 450 HB2 ALA 61 1HB ALA 61 3.253 -1.690 7.664 451 HB3 ALA 61 2HB ALA 61 2.295 -0.469 6.826 452 H GLY 62 H GLY 62 3.836 -4.219 5.181 453 HA2 GLY 62 1HA GLY 62 5.687 -5.551 4.837 454 HA3 GLY 62 2HA GLY 62 6.652 -4.091 4.681 455 H LEU 63 H LEU 63 4.801 -4.217 7.525 456 HA LEU 63 HA LEU 63 7.151 -4.205 9.140 457 HG LEU 63 HG LEU 63 4.747 -2.262 8.755 458 HB2 LEU 63 1HB LEU 63 4.245 -4.368 9.938 459 HB3 LEU 63 2HB LEU 63 5.578 -4.058 11.033 460 HD11 LEU 63 1HD1 LEU 63 3.967 -0.757 10.501 461 HD12 LEU 63 2HD1 LEU 63 4.400 -1.944 11.731 462 HD13 LEU 63 3HD1 LEU 63 3.117 -2.302 10.576 463 HD21 LEU 63 3HD2 LEU 63 6.806 -1.880 10.926 464 HD22 LEU 63 1HD2 LEU 63 6.325 -0.672 9.737 465 HD23 LEU 63 2HD2 LEU 63 7.140 -2.146 9.214 466 H ALA 64 H ALA 64 5.494 -6.701 7.761 467 HA ALA 64 HA ALA 64 5.867 -8.605 9.920 468 HB1 ALA 64 3HB ALA 64 3.904 -8.799 8.466 469 HB2 ALA 64 1HB ALA 64 4.921 -10.237 8.370 470 HB3 ALA 64 2HB ALA 64 4.959 -9.043 7.074 471 H GLU 65 H GLU 65 7.819 -7.163 7.690 472 HA GLU 65 HA GLU 65 9.587 -9.511 7.486 473 HB2 GLU 65 1HB GLU 65 8.526 -8.733 5.320 474 HB3 GLU 65 2HB GLU 65 9.427 -7.235 5.501 475 HG2 GLU 65 1HG GLU 65 10.501 -8.831 3.970 476 HG3 GLU 65 2HG GLU 65 11.516 -8.413 5.351 477 H VAL 66 H VAL 66 11.890 -9.004 7.433 478 HA VAL 66 HA VAL 66 12.496 -6.553 8.959 479 HB VAL 66 HB VAL 66 14.130 -9.099 8.829 480 HG11 VAL 66 1HG1 VAL 66 15.360 -8.128 10.715 481 HG12 VAL 66 2HG1 VAL 66 14.397 -6.657 10.579 482 HG13 VAL 66 3HG1 VAL 66 15.479 -7.127 9.268 483 HG21 VAL 66 3HG2 VAL 66 13.371 -9.493 11.132 484 HG22 VAL 66 1HG2 VAL 66 12.032 -9.509 9.982 485 HG23 VAL 66 2HG2 VAL 66 12.299 -8.099 11.007 486 H VAL 67 H VAL 67 13.234 -5.024 7.617 487 HA VAL 67 HA VAL 67 14.523 -5.561 5.144 488 HB VAL 67 HB VAL 67 14.500 -2.979 6.722 489 HG11 VAL 67 1HG1 VAL 67 14.917 -1.902 4.558 490 HG12 VAL 67 2HG1 VAL 67 15.041 -3.489 3.797 491 HG13 VAL 67 3HG1 VAL 67 16.227 -2.996 5.005 492 HG21 VAL 67 3HG2 VAL 67 12.243 -3.763 6.270 493 HG22 VAL 67 1HG2 VAL 67 12.636 -3.962 4.563 494 HG23 VAL 67 2HG2 VAL 67 12.616 -2.352 5.280 495 H ARG 68 H ARG 68 15.678 -4.917 8.395 496 HA ARG 68 HA ARG 68 18.450 -4.833 7.538 497 HE ARG 68 HE ARG 68 16.175 -2.766 11.440 498 HB2 ARG 68 1HB ARG 68 17.189 -4.790 10.284 499 HB3 ARG 68 2HB ARG 68 18.923 -4.745 10.006 500 HG2 ARG 68 1HG ARG 68 18.666 -2.647 8.769 501 HG3 ARG 68 2HG ARG 68 16.928 -2.689 9.077 502 HD2 ARG 68 1HD ARG 68 19.089 -2.574 11.179 503 HD3 ARG 68 2HD ARG 68 18.100 -1.215 10.647 504 HH11 ARG 68 1HH1 ARG 68 19.322 -2.408 12.946 505 HH12 ARG 68 2HH1 ARG 68 18.743 -2.797 14.542 506 HH21 ARG 68 1HH2 ARG 68 15.413 -3.272 13.545 507 HH22 ARG 68 2HH2 ARG 68 16.528 -3.292 14.882 508 H ASP 69 H ASP 69 17.668 -7.077 6.551 509 HA ASP 69 HA ASP 69 17.750 -9.302 8.338 510 HB2 ASP 69 1HB ASP 69 16.532 -9.536 6.272 511 HB3 ASP 69 2HB ASP 69 17.970 -9.167 5.328 512 HA PRO 70 HA PRO 70 22.240 -9.943 6.580 513 HB2 PRO 70 1HB PRO 70 22.973 -7.242 5.645 514 HB3 PRO 70 2HB PRO 70 23.247 -8.809 4.879 515 HG2 PRO 70 1HG PRO 70 21.436 -7.092 3.917 516 HG3 PRO 70 2HG PRO 70 21.155 -8.844 3.895 517 HD2 PRO 70 1HD PRO 70 20.083 -6.777 5.780 518 HD3 PRO 70 2HD PRO 70 19.249 -8.153 5.028 519 H LEU 71 H LEU 71 23.896 -9.866 7.989 520 HA LEU 71 HA LEU 71 23.640 -8.031 10.227 521 HG LEU 71 HG LEU 71 24.276 -11.319 11.804 522 HB2 LEU 71 1HB LEU 71 25.429 -10.416 9.755 523 HB3 LEU 71 2HB LEU 71 25.521 -9.416 11.189 524 HD11 LEU 71 1HD1 LEU 71 22.061 -10.428 12.339 525 HD12 LEU 71 2HD1 LEU 71 22.330 -9.098 11.213 526 HD13 LEU 71 3HD1 LEU 71 23.341 -9.256 12.650 527 HD21 LEU 71 3HD2 LEU 71 23.763 -12.164 9.577 528 HD22 LEU 71 1HD2 LEU 71 22.562 -10.891 9.361 529 HD23 LEU 71 2HD2 LEU 71 22.321 -12.132 10.591 530 H ALA 72 H ALA 72 25.297 -8.173 7.325 531 HA ALA 72 HA ALA 72 27.551 -6.575 8.197 532 HB1 ALA 72 3HB ALA 72 27.845 -8.175 6.364 533 HB2 ALA 72 1HB ALA 72 28.177 -6.524 5.837 534 HB3 ALA 72 2HB ALA 72 26.652 -7.299 5.406 535 H PHE 73 H PHE 73 26.416 -4.831 9.134 536 HA PHE 73 HA PHE 73 24.518 -3.313 7.609 537 HD1 PHE 73 HD1 PHE 73 22.383 -3.084 9.100 538 HD2 PHE 73 HD2 PHE 73 25.507 -4.443 11.652 539 HE1 PHE 73 HE1 PHE 73 20.801 -4.592 10.229 540 HE2 PHE 73 HE2 PHE 73 23.930 -5.955 12.783 541 HZ PHE 73 HZ PHE 73 21.574 -6.030 12.071 542 HB2 PHE 73 1HB PHE 73 25.901 -2.664 10.220 543 HB3 PHE 73 2HB PHE 73 24.550 -1.767 9.533 544 H LEU 74 H LEU 74 27.877 -3.456 7.727 545 HA LEU 74 HA LEU 74 28.557 -0.813 7.009 546 HG LEU 74 HG LEU 74 29.903 -2.976 8.728 547 HB2 LEU 74 1HB LEU 74 29.887 -3.429 6.295 548 HB3 LEU 74 2HB LEU 74 30.593 -1.851 6.013 549 HD11 LEU 74 1HD1 LEU 74 31.751 -4.174 7.690 550 HD12 LEU 74 2HD1 LEU 74 32.318 -3.173 9.027 551 HD13 LEU 74 3HD1 LEU 74 32.570 -2.647 7.361 552 HD21 LEU 74 3HD2 LEU 74 29.762 -0.545 8.654 553 HD22 LEU 74 1HD2 LEU 74 31.371 -0.462 7.934 554 HD23 LEU 74 2HD2 LEU 74 31.170 -1.064 9.579 555 H ASP 75 H ASP 75 27.094 -3.420 5.276 556 HA ASP 75 HA ASP 75 27.545 -2.267 2.659 557 HB2 ASP 75 1HB ASP 75 27.392 -4.709 2.921 558 HB3 ASP 75 2HB ASP 75 25.752 -4.545 3.540 559 H GLU 76 H GLU 76 25.084 -2.362 5.102 560 HA GLU 76 HA GLU 76 23.248 -1.131 5.518 561 HB2 GLU 76 1HB GLU 76 24.353 0.605 3.317 562 HB3 GLU 76 2HB GLU 76 22.932 1.021 4.264 563 HG2 GLU 76 1HG GLU 76 24.290 0.968 6.303 564 HG3 GLU 76 2HG GLU 76 25.712 0.596 5.328 565 HA PRO 77 HA PRO 77 20.628 -3.028 2.277 566 HB2 PRO 77 1HB PRO 77 18.978 -4.252 4.048 567 HB3 PRO 77 2HB PRO 77 20.472 -4.996 3.469 568 HG2 PRO 77 1HG PRO 77 19.931 -3.588 6.049 569 HG3 PRO 77 2HG PRO 77 20.886 -5.051 5.747 570 HD2 PRO 77 1HD PRO 77 21.990 -2.582 6.117 571 HD3 PRO 77 2HD PRO 77 22.751 -3.858 5.148 572 H GLU 78 H GLU 78 20.237 -1.088 5.089 573 HA GLU 78 HA GLU 78 17.653 -0.061 4.144 574 HB2 GLU 78 1HB GLU 78 17.479 -0.824 6.402 575 HB3 GLU 78 2HB GLU 78 18.982 -0.042 6.857 576 HG2 GLU 78 1HG GLU 78 16.965 1.078 7.734 577 HG3 GLU 78 2HG GLU 78 17.972 2.122 6.735 578 H ALA 79 H ALA 79 17.523 1.988 3.421 579 HA ALA 79 HA ALA 79 19.870 3.432 2.792 580 HB1 ALA 79 3HB ALA 79 16.993 4.343 2.777 581 HB2 ALA 79 1HB ALA 79 17.855 3.594 1.433 582 HB3 ALA 79 2HB ALA 79 18.341 5.187 2.015 583 H GLY 80 H GLY 80 17.609 3.542 5.446 584 HA2 GLY 80 1HA GLY 80 18.504 4.276 7.589 585 HA3 GLY 80 2HA GLY 80 19.350 5.555 6.730 586 H ALA 81 H ALA 81 16.157 4.854 5.703 587 HA ALA 81 HA ALA 81 15.314 7.464 6.714 588 HB1 ALA 81 3HB ALA 81 13.467 7.274 5.136 589 HB2 ALA 81 1HB ALA 81 13.973 5.636 4.725 590 HB3 ALA 81 2HB ALA 81 15.013 7.006 4.331 591 H GLY 82 H GLY 82 15.214 4.342 7.718 592 HA2 GLY 82 1HA GLY 82 12.572 4.571 8.973 593 HA3 GLY 82 2HA GLY 82 13.550 3.110 8.893 594 H ALA 83 H ALA 83 12.754 5.902 10.698 595 HA ALA 83 HA ALA 83 15.042 5.844 12.437 596 HB1 ALA 83 3HB ALA 83 12.380 7.209 12.823 597 HB2 ALA 83 1HB ALA 83 13.788 7.913 12.027 598 HB3 ALA 83 2HB ALA 83 13.853 7.513 13.743 599 H ARG 84 H ARG 84 12.368 3.902 12.113 600 HA ARG 84 HA ARG 84 12.347 3.122 14.941 601 HE ARG 84 HE ARG 84 9.413 2.285 16.055 602 HB2 ARG 84 1HB ARG 84 10.461 2.395 12.689 603 HB3 ARG 84 2HB ARG 84 10.316 1.828 14.347 604 HG2 ARG 84 1HG ARG 84 10.165 4.704 13.466 605 HG3 ARG 84 2HG ARG 84 8.787 3.674 13.860 606 HD2 ARG 84 1HD ARG 84 11.010 4.440 15.750 607 HD3 ARG 84 2HD ARG 84 9.398 5.151 15.723 608 HH11 ARG 84 1HH1 ARG 84 9.590 5.373 17.688 609 HH12 ARG 84 2HH1 ARG 84 9.031 4.756 19.212 610 HH21 ARG 84 1HH2 ARG 84 8.658 1.457 18.041 611 HH22 ARG 84 2HH2 ARG 84 8.499 2.507 19.415 612 HA PRO 85 HA PRO 85 14.964 -0.320 14.096 613 HB2 PRO 85 1HB PRO 85 13.417 -1.725 16.196 614 HB3 PRO 85 2HB PRO 85 15.148 -1.383 16.109 615 HG2 PRO 85 1HG PRO 85 13.580 -0.035 17.787 616 HG3 PRO 85 2HG PRO 85 14.899 0.774 16.921 617 HD2 PRO 85 1HD PRO 85 11.960 0.809 16.353 618 HD3 PRO 85 2HD PRO 85 13.138 2.137 16.282 619 H ALA 86 H ALA 86 11.512 -0.599 14.035 620 HA ALA 86 HA ALA 86 11.462 -3.286 13.006 621 HB1 ALA 86 3HB ALA 86 9.602 -2.416 14.338 622 HB2 ALA 86 1HB ALA 86 9.066 -2.924 12.736 623 HB3 ALA 86 2HB ALA 86 9.274 -1.210 13.093 624 H ASN 87 H ASN 87 12.449 -0.464 11.669 625 HA ASN 87 HA ASN 87 12.847 0.282 9.570 626 HB2 ASN 87 1HB ASN 87 12.260 -2.607 8.990 627 HB3 ASN 87 2HB ASN 87 12.544 -1.470 7.676 628 HD21 ASN 87 2HD2 ASN 87 14.577 -0.583 7.395 629 HD22 ASN 87 1HD2 ASN 87 15.976 -1.225 8.179 630 H ALA 88 H ALA 88 10.363 0.772 10.728 631 HA ALA 88 HA ALA 88 8.182 0.369 8.994 632 HB1 ALA 88 3HB ALA 88 7.914 0.969 11.350 633 HB2 ALA 88 1HB ALA 88 7.067 2.104 10.297 634 HB3 ALA 88 2HB ALA 88 8.609 2.558 11.025 635 HA PRO 89 HA PRO 89 9.209 3.323 5.841 636 HB2 PRO 89 1HB PRO 89 6.497 3.049 4.850 637 HB3 PRO 89 2HB PRO 89 7.998 2.444 4.146 638 HG2 PRO 89 1HG PRO 89 6.076 0.826 5.205 639 HG3 PRO 89 2HG PRO 89 7.797 0.401 5.151 640 HD2 PRO 89 1HD PRO 89 6.174 1.455 7.435 641 HD3 PRO 89 2HD PRO 89 7.439 0.205 7.428 642 H GLU 90 H GLU 90 8.759 5.449 5.291 643 HA GLU 90 HA GLU 90 7.502 7.039 7.262 644 HB2 GLU 90 1HB GLU 90 8.617 7.625 4.530 645 HB3 GLU 90 2HB GLU 90 7.824 8.872 5.482 646 HG2 GLU 90 1HG GLU 90 10.193 7.272 6.417 647 HG3 GLU 90 2HG GLU 90 10.292 8.869 5.674 648 H VAL 91 H VAL 91 6.542 6.051 3.987 649 HA VAL 91 HA VAL 91 3.828 6.932 4.655 650 HB VAL 91 HB VAL 91 4.703 8.691 3.282 651 HG11 VAL 91 1HG1 VAL 91 6.550 7.525 2.239 652 HG12 VAL 91 2HG1 VAL 91 5.549 8.314 1.019 653 HG13 VAL 91 3HG1 VAL 91 5.426 6.572 1.269 654 HG21 VAL 91 3HG2 VAL 91 2.396 8.139 2.871 655 HG22 VAL 91 1HG2 VAL 91 2.863 6.897 1.709 656 HG23 VAL 91 2HG2 VAL 91 3.166 8.597 1.351 657 H LEU 92 H LEU 92 2.238 5.625 4.093 658 HA LEU 92 HA LEU 92 2.866 3.249 2.463 659 HG LEU 92 HG LEU 92 0.091 1.907 3.127 660 HB2 LEU 92 1HB LEU 92 2.487 2.662 4.803 661 HB3 LEU 92 2HB LEU 92 0.970 3.538 4.801 662 HD11 LEU 92 1HD1 LEU 92 2.654 0.440 3.737 663 HD12 LEU 92 2HD1 LEU 92 2.202 1.155 2.188 664 HD13 LEU 92 3HD1 LEU 92 1.285 -0.208 2.832 665 HD21 LEU 92 3HD2 LEU 92 -0.408 1.677 5.501 666 HD22 LEU 92 1HD2 LEU 92 1.070 0.742 5.732 667 HD23 LEU 92 2HD2 LEU 92 -0.236 0.096 4.738 668 H LEU 93 H LEU 93 1.757 3.156 0.614 669 HA LEU 93 HA LEU 93 -0.559 4.945 0.327 670 HG LEU 93 HG LEU 93 2.335 5.604 -0.626 671 HB2 LEU 93 1HB LEU 93 1.238 3.729 -1.774 672 HB3 LEU 93 2HB LEU 93 -0.152 4.744 -2.112 673 HD11 LEU 93 1HD1 LEU 93 2.747 6.994 -2.595 674 HD12 LEU 93 2HD1 LEU 93 1.340 6.287 -3.390 675 HD13 LEU 93 3HD1 LEU 93 2.734 5.279 -3.003 676 HD21 LEU 93 3HD2 LEU 93 -0.096 7.182 -1.468 677 HD22 LEU 93 1HD2 LEU 93 1.366 7.846 -0.739 678 HD23 LEU 93 2HD2 LEU 93 0.340 6.750 0.185 679 H VAL 94 H VAL 94 -2.496 4.067 0.299 680 HA VAL 94 HA VAL 94 -2.758 1.219 -0.388 681 HB VAL 94 HB VAL 94 -4.742 3.018 1.023 682 HG11 VAL 94 1HG1 VAL 94 -5.933 0.938 1.541 683 HG12 VAL 94 2HG1 VAL 94 -4.762 0.032 0.583 684 HG13 VAL 94 3HG1 VAL 94 -5.820 1.204 -0.199 685 HG21 VAL 94 3HG2 VAL 94 -2.778 2.639 2.398 686 HG22 VAL 94 1HG2 VAL 94 -2.895 0.901 2.125 687 HG23 VAL 94 2HG2 VAL 94 -4.150 1.737 3.040 688 H GLY 95 H GLY 95 -3.506 0.735 -2.338 689 HA2 GLY 95 1HA GLY 95 -4.793 2.857 -3.902 690 HA3 GLY 95 2HA GLY 95 -4.047 1.405 -4.549 691 H THR 96 H THR 96 -6.906 2.847 -3.330 692 HA THR 96 HA THR 96 -8.408 0.417 -4.071 693 HB THR 96 HB THR 96 -9.353 2.389 -1.989 694 HG1 THR 96 HG1 THR 96 -7.271 0.896 -1.680 695 HG21 THR 96 3HG2 THR 96 -11.072 0.962 -2.940 696 HG22 THR 96 1HG2 THR 96 -10.745 0.477 -1.276 697 HG23 THR 96 2HG2 THR 96 -10.096 -0.471 -2.616 698 H GLY 97 H GLY 97 -8.943 1.087 -6.143 699 HA2 GLY 97 1HA GLY 97 -9.816 3.872 -6.469 700 HA3 GLY 97 2HA GLY 97 -9.175 2.852 -7.741 701 H ARG 98 H ARG 98 -11.226 0.786 -6.358 702 HA ARG 98 HA ARG 98 -13.284 1.476 -8.301 703 HE ARG 98 HE ARG 98 -15.387 -2.799 -6.860 704 HB2 ARG 98 1HB ARG 98 -12.318 -0.888 -7.997 705 HB3 ARG 98 2HB ARG 98 -13.318 -0.971 -6.549 706 HG2 ARG 98 1HG ARG 98 -15.317 -0.671 -7.834 707 HG3 ARG 98 2HG ARG 98 -14.383 -0.363 -9.298 708 HD2 ARG 98 1HD ARG 98 -15.118 -2.581 -9.488 709 HD3 ARG 98 2HD ARG 98 -13.429 -2.692 -9.001 710 HH11 ARG 98 1HH1 ARG 98 -13.215 -4.537 -8.991 711 HH12 ARG 98 2HH1 ARG 98 -13.377 -6.035 -8.125 712 HH21 ARG 98 1HH2 ARG 98 -15.587 -4.753 -5.714 713 HH22 ARG 98 2HH2 ARG 98 -14.739 -6.167 -6.273 714 H ARG 99 H ARG 99 -12.755 1.402 -4.905 715 HA ARG 99 HA ARG 99 -15.033 3.069 -4.464 716 HE ARG 99 HE ARG 99 -18.538 0.088 -3.702 717 HB2 ARG 99 1HB ARG 99 -16.168 0.922 -4.297 718 HB3 ARG 99 2HB ARG 99 -14.950 0.329 -3.175 719 HG2 ARG 99 1HG ARG 99 -15.683 1.781 -1.460 720 HG3 ARG 99 2HG ARG 99 -16.681 2.711 -2.578 721 HD2 ARG 99 1HD ARG 99 -17.145 -0.192 -1.906 722 HD3 ARG 99 2HD ARG 99 -17.953 1.151 -1.097 723 HH11 ARG 99 1HH1 ARG 99 -18.715 2.935 -1.672 724 HH12 ARG 99 2HH1 ARG 99 -20.034 3.646 -2.551 725 HH21 ARG 99 1HH2 ARG 99 -20.307 1.017 -4.860 726 HH22 ARG 99 2HH2 ARG 99 -20.933 2.557 -4.352 727 H GLN 100 H GLN 100 -13.680 4.578 -3.711 728 HA GLN 100 HA GLN 100 -11.395 4.066 -2.167 729 HB2 GLN 100 1HB GLN 100 -12.918 6.644 -2.583 730 HB3 GLN 100 2HB GLN 100 -11.305 6.517 -1.908 731 HG2 GLN 100 1HG GLN 100 -10.778 7.023 -4.060 732 HG3 GLN 100 2HG GLN 100 -10.803 5.266 -4.164 733 HE21 GLN 100 2HE2 GLN 100 -11.134 7.115 -6.312 734 HE22 GLN 100 1HE2 GLN 100 -12.721 6.856 -6.964 735 H HIS 101 H HIS 101 -11.448 3.280 -0.203 736 HA HIS 101 HA HIS 101 -13.487 4.232 1.685 737 HD1 HIS 101 HD1 HIS 101 -11.132 1.756 4.256 738 HD2 HIS 101 HD2 HIS 101 -15.198 2.251 3.562 739 HE1 HIS 101 HE1 HIS 101 -12.235 1.507 6.502 740 HE2 HIS 101 HE2 HIS 101 -14.676 1.978 6.085 741 HB2 HIS 101 1HB HIS 101 -13.446 1.797 1.366 742 HB3 HIS 101 2HB HIS 101 -11.737 1.759 1.783 743 H LEU 102 H LEU 102 -12.868 5.623 3.193 744 HA LEU 102 HA LEU 102 -10.092 6.327 3.468 745 HG LEU 102 HG LEU 102 -11.957 9.505 3.862 746 HB2 LEU 102 1HB LEU 102 -12.600 7.297 4.825 747 HB3 LEU 102 2HB LEU 102 -11.011 7.859 5.298 748 HD11 LEU 102 1HD1 LEU 102 -9.592 9.101 3.524 749 HD12 LEU 102 2HD1 LEU 102 -10.365 9.557 2.005 750 HD13 LEU 102 3HD1 LEU 102 -9.956 7.870 2.317 751 HD21 LEU 102 3HD2 LEU 102 -13.675 8.167 2.788 752 HD22 LEU 102 1HD2 LEU 102 -12.448 7.298 1.866 753 HD23 LEU 102 2HD2 LEU 102 -12.711 9.019 1.581 754 H LEU 103 H LEU 103 -8.704 5.762 5.043 755 HA LEU 103 HA LEU 103 -9.605 3.726 6.934 756 HG LEU 103 HG LEU 103 -7.617 3.762 4.289 757 HB2 LEU 103 1HB LEU 103 -6.782 4.655 6.397 758 HB3 LEU 103 2HB LEU 103 -7.275 3.197 7.238 759 HD11 LEU 103 1HD1 LEU 103 -5.868 1.792 5.751 760 HD12 LEU 103 2HD1 LEU 103 -5.327 3.258 4.933 761 HD13 LEU 103 3HD1 LEU 103 -6.030 1.936 4.000 762 HD21 LEU 103 3HD2 LEU 103 -8.472 1.492 4.105 763 HD22 LEU 103 1HD2 LEU 103 -9.495 2.455 5.173 764 HD23 LEU 103 2HD2 LEU 103 -8.360 1.291 5.855 765 H GLY 104 H GLY 104 -9.488 3.995 9.153 766 HA2 GLY 104 1HA GLY 104 -9.298 6.831 9.929 767 HA3 GLY 104 2HA GLY 104 -10.338 5.644 10.700 768 HA PRO 105 HA PRO 105 -6.239 6.683 13.015 769 HB2 PRO 105 1HB PRO 105 -8.336 6.791 15.142 770 HB3 PRO 105 2HB PRO 105 -6.883 7.779 14.943 771 HG2 PRO 105 1HG PRO 105 -9.267 8.751 14.291 772 HG3 PRO 105 2HG PRO 105 -7.845 9.092 13.286 773 HD2 PRO 105 1HD PRO 105 -10.119 7.231 12.787 774 HD3 PRO 105 2HD PRO 105 -9.165 8.186 11.635 775 H GLU 106 H GLU 106 -9.028 4.729 14.063 776 HA GLU 106 HA GLU 106 -7.768 3.022 15.835 777 HB2 GLU 106 1HB GLU 106 -10.176 3.049 15.580 778 HB3 GLU 106 2HB GLU 106 -10.045 2.468 13.927 779 HG2 GLU 106 1HG GLU 106 -10.727 0.645 15.277 780 HG3 GLU 106 2HG GLU 106 -9.047 0.366 14.821 781 H GLN 107 H GLN 107 -8.083 2.708 12.328 782 HA GLN 107 HA GLN 107 -6.933 0.086 12.272 783 HB2 GLN 107 1HB GLN 107 -7.589 2.032 10.055 784 HB3 GLN 107 2HB GLN 107 -7.099 0.359 9.810 785 HG2 GLN 107 1HG GLN 107 -9.069 -0.458 10.861 786 HG3 GLN 107 2HG GLN 107 -9.513 1.154 11.416 787 HE21 GLN 107 2HE2 GLN 107 -10.995 -0.768 9.811 788 HE22 GLN 107 1HE2 GLN 107 -11.397 0.048 8.336 789 H VAL 108 H VAL 108 -5.619 3.183 12.469 790 HA VAL 108 HA VAL 108 -3.066 2.202 11.375 791 HB VAL 108 HB VAL 108 -2.500 4.534 10.767 792 HG11 VAL 108 1HG1 VAL 108 -5.023 3.464 9.507 793 HG12 VAL 108 2HG1 VAL 108 -3.371 3.024 9.075 794 HG13 VAL 108 3HG1 VAL 108 -3.950 4.666 8.790 795 HG21 VAL 108 3HG2 VAL 108 -5.376 5.095 11.482 796 HG22 VAL 108 1HG2 VAL 108 -4.295 6.211 10.645 797 HG23 VAL 108 2HG2 VAL 108 -3.949 5.724 12.304 798 H ARG 109 H ARG 109 -4.361 2.503 14.215 799 HA ARG 109 HA ARG 109 -2.965 4.415 15.657 800 HE ARG 109 HE ARG 109 -6.770 1.474 17.872 801 HB2 ARG 109 1HB ARG 109 -4.116 1.760 16.454 802 HB3 ARG 109 2HB ARG 109 -3.261 2.765 17.607 803 HG2 ARG 109 1HG ARG 109 -4.890 4.615 16.916 804 HG3 ARG 109 2HG ARG 109 -5.839 3.310 16.200 805 HD2 ARG 109 1HD ARG 109 -4.973 3.490 19.082 806 HD3 ARG 109 2HD ARG 109 -6.588 3.836 18.471 807 HH11 ARG 109 1HH1 ARG 109 -4.180 2.364 20.081 808 HH12 ARG 109 2HH1 ARG 109 -4.107 0.793 20.819 809 HH21 ARG 109 1HH2 ARG 109 -6.673 -0.573 18.858 810 HH22 ARG 109 2HH2 ARG 109 -5.536 -0.873 20.139 811 HA PRO 110 HA PRO 110 0.519 1.167 16.595 812 HB2 PRO 110 1HB PRO 110 0.257 -0.743 14.357 813 HB3 PRO 110 2HB PRO 110 0.545 -1.054 16.072 814 HG2 PRO 110 1HG PRO 110 -1.813 -1.605 14.932 815 HG3 PRO 110 2HG PRO 110 -1.704 -0.999 16.596 816 HD2 PRO 110 1HD PRO 110 -2.417 0.471 14.087 817 HD3 PRO 110 2HD PRO 110 -3.137 0.590 15.706 818 H LEU 111 H LEU 111 -0.510 2.017 13.383 819 HA LEU 111 HA LEU 111 2.120 1.912 12.228 820 HG LEU 111 HG LEU 111 -0.716 0.708 11.536 821 HB2 LEU 111 1HB LEU 111 -0.419 3.124 11.136 822 HB3 LEU 111 2HB LEU 111 1.040 2.784 10.224 823 HD11 LEU 111 1HD1 LEU 111 -1.803 1.760 9.634 824 HD12 LEU 111 2HD1 LEU 111 -1.336 0.101 9.261 825 HD13 LEU 111 3HD1 LEU 111 -0.381 1.446 8.638 826 HD21 LEU 111 3HD2 LEU 111 0.647 -0.905 10.317 827 HD22 LEU 111 1HD2 LEU 111 1.629 0.036 11.439 828 HD23 LEU 111 2HD2 LEU 111 1.667 0.401 9.714 829 H LEU 112 H LEU 112 -0.144 4.487 13.175 830 HA LEU 112 HA LEU 112 1.454 6.663 12.408 831 HG LEU 112 HG LEU 112 -1.610 6.083 12.443 832 HB2 LEU 112 1HB LEU 112 -0.575 6.470 14.635 833 HB3 LEU 112 2HB LEU 112 0.117 7.970 14.049 834 HD11 LEU 112 1HD1 LEU 112 -2.876 7.257 14.141 835 HD12 LEU 112 2HD1 LEU 112 -3.248 7.912 12.546 836 HD13 LEU 112 3HD1 LEU 112 -2.177 8.794 13.633 837 HD21 LEU 112 3HD2 LEU 112 -0.449 8.775 11.726 838 HD22 LEU 112 1HD2 LEU 112 -1.588 7.848 10.749 839 HD23 LEU 112 2HD2 LEU 112 0.033 7.221 11.045 840 H ALA 113 H ALA 113 1.421 4.712 15.314 841 HA ALA 113 HA ALA 113 3.095 6.357 16.891 842 HB1 ALA 113 3HB ALA 113 1.665 4.610 17.840 843 HB2 ALA 113 1HB ALA 113 3.349 4.409 18.325 844 HB3 ALA 113 2HB ALA 113 2.664 3.378 17.069 845 H MET 114 H MET 114 3.736 4.162 14.305 846 HA MET 114 HA MET 114 6.579 4.003 14.965 847 HB2 MET 114 1HB MET 114 5.088 2.786 12.632 848 HB3 MET 114 2HB MET 114 6.745 2.439 13.105 849 HG2 MET 114 1HG MET 114 5.922 1.499 15.219 850 HG3 MET 114 2HG MET 114 4.268 1.805 14.691 851 HE1 MET 114 3HE MET 114 4.191 -2.006 14.277 852 HE2 MET 114 1HE MET 114 3.291 -0.565 14.748 853 HE3 MET 114 2HE MET 114 4.759 -1.012 15.619 854 H GLY 115 H GLY 115 4.499 6.032 13.348 855 HA2 GLY 115 1HA GLY 115 5.312 8.069 12.403 856 HA3 GLY 115 2HA GLY 115 6.752 7.210 11.879 857 H VAL 116 H VAL 116 4.462 5.102 11.153 858 HA VAL 116 HA VAL 116 4.679 5.531 8.373 859 HB VAL 116 HB VAL 116 2.667 3.782 9.798 860 HG11 VAL 116 1HG1 VAL 116 2.171 4.140 7.436 861 HG12 VAL 116 2HG1 VAL 116 2.675 2.476 7.734 862 HG13 VAL 116 3HG1 VAL 116 3.801 3.622 7.007 863 HG21 VAL 116 3HG2 VAL 116 5.473 3.133 8.897 864 HG22 VAL 116 1HG2 VAL 116 4.301 1.968 9.517 865 HG23 VAL 116 2HG2 VAL 116 4.910 3.250 10.565 866 H GLY 117 H GLY 117 3.622 6.934 7.150 867 HA2 GLY 117 1HA GLY 117 1.003 7.937 8.031 868 HA3 GLY 117 2HA GLY 117 2.025 8.664 6.793 869 H VAL 118 H VAL 118 -0.676 6.781 7.336 870 HA VAL 118 HA VAL 118 -0.410 5.242 4.865 871 HB VAL 118 HB VAL 118 -2.596 5.110 6.945 872 HG11 VAL 118 1HG1 VAL 118 -3.134 2.959 5.911 873 HG12 VAL 118 2HG1 VAL 118 -1.872 3.222 4.707 874 HG13 VAL 118 3HG1 VAL 118 -3.280 4.284 4.755 875 HG21 VAL 118 3HG2 VAL 118 -1.476 3.091 7.749 876 HG22 VAL 118 1HG2 VAL 118 -0.441 4.510 7.912 877 HG23 VAL 118 2HG2 VAL 118 -0.164 3.361 6.603 878 H GLU 119 H GLU 119 -1.031 6.264 3.092 879 HA GLU 119 HA GLU 119 -3.370 8.048 3.219 880 HB2 GLU 119 1HB GLU 119 -1.097 7.933 1.226 881 HB3 GLU 119 2HB GLU 119 -2.486 9.005 1.098 882 HG2 GLU 119 1HG GLU 119 -0.485 9.007 3.350 883 HG3 GLU 119 2HG GLU 119 -0.503 10.134 1.995 884 H ALA 120 H ALA 120 -5.181 7.189 2.477 885 HA ALA 120 HA ALA 120 -5.076 4.946 0.606 886 HB1 ALA 120 3HB ALA 120 -6.461 4.675 2.592 887 HB2 ALA 120 1HB ALA 120 -7.452 4.656 1.133 888 HB3 ALA 120 2HB ALA 120 -7.401 6.099 2.146 889 H MET 121 H MET 121 -5.234 5.328 -1.492 890 HA MET 121 HA MET 121 -6.968 7.498 -2.434 891 HB2 MET 121 1HB MET 121 -4.097 7.066 -3.287 892 HB3 MET 121 2HB MET 121 -5.230 8.092 -4.151 893 HG2 MET 121 1HG MET 121 -5.452 9.504 -2.164 894 HG3 MET 121 2HG MET 121 -4.291 8.482 -1.319 895 HE1 MET 121 3HE MET 121 -1.730 8.280 -1.990 896 HE2 MET 121 1HE MET 121 -1.012 9.100 -3.378 897 HE3 MET 121 2HE MET 121 -2.197 7.818 -3.627 898 H ASP 122 H ASP 122 -6.702 7.316 -5.066 899 HA ASP 122 HA ASP 122 -7.968 4.888 -5.782 900 HB2 ASP 122 1HB ASP 122 -6.587 6.721 -7.739 901 HB3 ASP 122 2HB ASP 122 -8.036 5.751 -7.984 902 H THR 123 H THR 123 -7.130 3.317 -7.382 903 HA THR 123 HA THR 123 -4.686 2.211 -6.591 904 HB THR 123 HB THR 123 -4.912 0.834 -8.722 905 HG1 THR 123 HG1 THR 123 -6.397 1.375 -10.119 906 HG21 THR 123 3HG2 THR 123 -6.853 -0.409 -7.892 907 HG22 THR 123 1HG2 THR 123 -7.282 0.951 -6.855 908 HG23 THR 123 2HG2 THR 123 -5.784 0.065 -6.572 909 H GLN 124 H GLN 124 -5.507 3.910 -9.609 910 HA GLN 124 HA GLN 124 -2.883 3.941 -10.634 911 HB2 GLN 124 1HB GLN 124 -4.868 4.275 -12.038 912 HB3 GLN 124 2HB GLN 124 -5.192 5.803 -11.230 913 HG2 GLN 124 1HG GLN 124 -4.168 6.181 -13.386 914 HG3 GLN 124 2HG GLN 124 -3.089 6.703 -12.094 915 HE21 GLN 124 2HE2 GLN 124 -1.204 5.538 -11.695 916 HE22 GLN 124 1HE2 GLN 124 -0.559 4.421 -12.846 917 H ALA 125 H ALA 125 -4.645 6.181 -8.562 918 HA ALA 125 HA ALA 125 -2.809 8.324 -8.730 919 HB1 ALA 125 3HB ALA 125 -4.731 7.649 -6.508 920 HB2 ALA 125 1HB ALA 125 -5.096 8.625 -7.931 921 HB3 ALA 125 2HB ALA 125 -3.924 9.200 -6.744 922 H ALA 126 H ALA 126 -3.194 5.699 -6.365 923 HA ALA 126 HA ALA 126 -1.037 6.457 -4.708 924 HB1 ALA 126 3HB ALA 126 -2.200 3.703 -5.125 925 HB2 ALA 126 1HB ALA 126 -2.810 4.913 -3.996 926 HB3 ALA 126 2HB ALA 126 -1.204 4.222 -3.766 927 H ALA 127 H ALA 127 -1.265 4.203 -7.435 928 HA ALA 127 HA ALA 127 1.375 3.251 -7.328 929 HB1 ALA 127 3HB ALA 127 -0.413 3.500 -9.743 930 HB2 ALA 127 1HB ALA 127 -0.403 2.152 -8.606 931 HB3 ALA 127 2HB ALA 127 1.015 2.475 -9.604 932 H ARG 128 H ARG 128 -0.044 5.997 -9.065 933 HA ARG 128 HA ARG 128 2.278 6.657 -10.534 934 HE ARG 128 HE ARG 128 0.601 10.476 -13.996 935 HB2 ARG 128 1HB ARG 128 -0.112 7.462 -10.938 936 HB3 ARG 128 2HB ARG 128 0.176 8.633 -9.656 937 HG2 ARG 128 1HG ARG 128 2.104 9.497 -10.943 938 HG3 ARG 128 2HG ARG 128 1.680 8.392 -12.252 939 HD2 ARG 128 1HD ARG 128 -0.579 9.480 -12.303 940 HD3 ARG 128 2HD ARG 128 0.048 10.683 -11.175 941 HH11 ARG 128 1HH1 ARG 128 1.726 11.749 -10.934 942 HH12 ARG 128 2HH1 ARG 128 2.721 12.975 -11.658 943 HH21 ARG 128 1HH2 ARG 128 1.898 12.048 -14.954 944 HH22 ARG 128 2HH2 ARG 128 2.855 13.121 -13.970 945 H THR 129 H THR 129 1.019 7.789 -7.427 946 HA THR 129 HA THR 129 3.070 9.655 -6.886 947 HB THR 129 HB THR 129 1.465 8.091 -4.850 948 HG1 THR 129 HG1 THR 129 -0.042 9.044 -6.165 949 HG21 THR 129 3HG2 THR 129 3.318 9.387 -3.911 950 HG22 THR 129 1HG2 THR 129 1.767 10.099 -3.466 951 HG23 THR 129 2HG2 THR 129 2.740 10.831 -4.742 952 H TYR 130 H TYR 130 2.717 6.213 -6.362 953 HA TYR 130 HA TYR 130 4.956 5.759 -4.743 954 HD1 TYR 130 HD1 TYR 130 5.477 3.398 -3.615 955 HD2 TYR 130 HD2 TYR 130 4.819 2.407 -7.699 956 HE1 TYR 130 HE1 TYR 130 7.122 1.577 -3.433 957 HE2 TYR 130 HE2 TYR 130 6.458 0.587 -7.529 958 HH TYR 130 HH TYR 130 7.583 -0.616 -4.646 959 HB2 TYR 130 1HB TYR 130 3.321 4.037 -4.974 960 HB3 TYR 130 2HB TYR 130 3.494 4.013 -6.725 961 H ASN 131 H ASN 131 4.631 5.787 -8.297 962 HA ASN 131 HA ASN 131 7.267 5.145 -8.952 963 HB2 ASN 131 1HB ASN 131 5.231 6.880 -10.333 964 HB3 ASN 131 2HB ASN 131 6.847 6.672 -10.995 965 HD21 ASN 131 2HD2 ASN 131 7.474 4.649 -11.771 966 HD22 ASN 131 1HD2 ASN 131 6.299 3.437 -12.185 967 H ILE 132 H ILE 132 5.816 8.288 -8.228 968 HA ILE 132 HA ILE 132 8.099 9.864 -8.683 969 HB ILE 132 HB ILE 132 5.845 10.392 -6.734 970 HG12 ILE 132 1HG1 ILE 132 6.157 11.258 -9.619 971 HG13 ILE 132 2HG1 ILE 132 5.093 9.970 -9.067 972 HG21 ILE 132 1HG2 ILE 132 6.452 12.758 -7.032 973 HG22 ILE 132 2HG2 ILE 132 7.831 12.269 -8.016 974 HG23 ILE 132 3HG2 ILE 132 7.759 11.821 -6.310 975 HD11 ILE 132 3HD1 ILE 132 4.883 12.881 -8.331 976 HD12 ILE 132 1HD1 ILE 132 3.824 11.597 -7.750 977 HD13 ILE 132 2HD1 ILE 132 3.852 12.008 -9.465 978 H LEU 133 H LEU 133 6.795 8.570 -5.629 979 HA LEU 133 HA LEU 133 8.872 9.512 -3.986 980 HG LEU 133 HG LEU 133 5.817 9.301 -3.786 981 HB2 LEU 133 1HB LEU 133 7.040 7.144 -3.604 982 HB3 LEU 133 2HB LEU 133 8.044 7.848 -2.350 983 HD11 LEU 133 1HD1 LEU 133 5.897 8.093 -1.025 984 HD12 LEU 133 2HD1 LEU 133 4.943 7.513 -2.390 985 HD13 LEU 133 3HD1 LEU 133 4.596 9.088 -1.679 986 HD21 LEU 133 3HD2 LEU 133 7.485 10.065 -1.391 987 HD22 LEU 133 1HD2 LEU 133 6.120 10.980 -2.032 988 HD23 LEU 133 2HD2 LEU 133 7.582 10.784 -2.999 989 H MET 134 H MET 134 8.540 6.604 -5.900 990 HA MET 134 HA MET 134 10.713 5.124 -4.938 991 HB2 MET 134 1HB MET 134 9.162 4.120 -6.480 992 HB3 MET 134 2HB MET 134 9.517 5.327 -7.707 993 HG2 MET 134 1HG MET 134 11.863 4.447 -7.760 994 HG3 MET 134 2HG MET 134 11.319 3.133 -6.721 995 HE1 MET 134 3HE MET 134 8.643 1.402 -9.022 996 HE2 MET 134 1HE MET 134 8.355 2.700 -7.864 997 HE3 MET 134 2HE MET 134 9.442 1.373 -7.450 998 H ALA 135 H ALA 135 10.542 7.509 -7.563 999 HA ALA 135 HA ALA 135 13.289 7.383 -8.235 1000 HB1 ALA 135 3HB ALA 135 11.567 8.201 -9.774 1001 HB2 ALA 135 1HB ALA 135 12.858 9.382 -9.553 1002 HB3 ALA 135 2HB ALA 135 11.311 9.604 -8.735 1003 H GLU 136 H GLU 136 11.459 9.292 -5.937 1004 HA GLU 136 HA GLU 136 13.583 11.097 -5.317 1005 HB2 GLU 136 1HB GLU 136 11.107 10.368 -3.746 1006 HB3 GLU 136 2HB GLU 136 12.196 11.692 -3.351 1007 HG2 GLU 136 1HG GLU 136 11.686 12.703 -5.551 1008 HG3 GLU 136 2HG GLU 136 10.509 11.419 -5.827 1009 H GLY 137 H GLY 137 12.751 7.892 -4.349 1010 HA2 GLY 137 1HA GLY 137 14.176 6.390 -3.275 1011 HA3 GLY 137 2HA GLY 137 15.210 7.732 -2.815 1012 H ARG 138 H ARG 138 11.851 8.070 -2.167 1013 HA ARG 138 HA ARG 138 12.407 8.140 0.661 1014 HE ARG 138 HE ARG 138 11.328 12.741 -1.144 1015 HB2 ARG 138 1HB ARG 138 9.866 8.641 -0.903 1016 HB3 ARG 138 2HB ARG 138 10.055 8.903 0.820 1017 HG2 ARG 138 1HG ARG 138 11.808 10.566 0.362 1018 HG3 ARG 138 2HG ARG 138 11.542 10.334 -1.366 1019 HD2 ARG 138 1HD ARG 138 9.201 11.066 -1.070 1020 HD3 ARG 138 2HD ARG 138 9.534 11.366 0.636 1021 HH11 ARG 138 1HH1 ARG 138 8.209 12.930 0.463 1022 HH12 ARG 138 2HH1 ARG 138 8.131 14.662 0.370 1023 HH21 ARG 138 1HH2 ARG 138 11.234 14.998 -1.243 1024 HH22 ARG 138 2HH2 ARG 138 9.861 15.843 -0.589 1025 H ARG 139 H ARG 139 11.514 6.779 2.221 1026 HA ARG 139 HA ARG 139 11.022 4.100 1.389 1027 HE ARG 139 HE ARG 139 13.919 1.810 4.218 1028 HB2 ARG 139 1HB ARG 139 11.019 5.488 4.045 1029 HB3 ARG 139 2HB ARG 139 10.369 3.862 3.909 1030 HG2 ARG 139 1HG ARG 139 13.171 4.717 3.205 1031 HG3 ARG 139 2HG ARG 139 12.682 3.815 4.640 1032 HD2 ARG 139 1HD ARG 139 11.723 2.101 2.986 1033 HD3 ARG 139 2HD ARG 139 12.700 2.924 1.774 1034 HH11 ARG 139 1HH1 ARG 139 13.829 2.103 0.722 1035 HH12 ARG 139 2HH1 ARG 139 15.198 1.056 0.486 1036 HH21 ARG 139 1HH2 ARG 139 15.671 0.414 3.888 1037 HH22 ARG 139 2HH2 ARG 139 16.226 0.091 2.260 1038 H VAL 140 H VAL 140 9.235 3.996 0.136 1039 HA VAL 140 HA VAL 140 6.671 4.451 1.504 1040 HB VAL 140 HB VAL 140 6.908 6.131 -0.240 1041 HG11 VAL 140 1HG1 VAL 140 7.353 3.822 -2.129 1042 HG12 VAL 140 2HG1 VAL 140 8.550 5.024 -1.647 1043 HG13 VAL 140 3HG1 VAL 140 7.149 5.508 -2.602 1044 HG21 VAL 140 3HG2 VAL 140 4.921 5.630 -1.584 1045 HG22 VAL 140 1HG2 VAL 140 4.681 5.208 0.111 1046 HG23 VAL 140 2HG2 VAL 140 5.004 3.942 -1.075 1047 H VAL 141 H VAL 141 5.256 2.779 1.459 1048 HA VAL 141 HA VAL 141 5.873 0.530 -0.346 1049 HB VAL 141 HB VAL 141 4.445 0.347 2.320 1050 HG11 VAL 141 1HG1 VAL 141 5.380 -1.788 0.405 1051 HG12 VAL 141 2HG1 VAL 141 3.708 -1.337 0.737 1052 HG13 VAL 141 3HG1 VAL 141 4.690 -2.080 2.001 1053 HG21 VAL 141 3HG2 VAL 141 6.813 0.855 2.633 1054 HG22 VAL 141 1HG2 VAL 141 7.248 -0.501 1.595 1055 HG23 VAL 141 2HG2 VAL 141 6.445 -0.794 3.138 1056 H VAL 142 H VAL 142 4.234 -0.139 -1.670 1057 HA VAL 142 HA VAL 142 1.703 1.334 -1.377 1058 HB VAL 142 HB VAL 142 3.015 2.050 -3.343 1059 HG11 VAL 142 1HG1 VAL 142 2.621 -0.774 -4.318 1060 HG12 VAL 142 2HG1 VAL 142 4.153 -0.031 -3.861 1061 HG13 VAL 142 3HG1 VAL 142 3.271 0.563 -5.267 1062 HG21 VAL 142 3HG2 VAL 142 0.461 0.605 -4.027 1063 HG22 VAL 142 1HG2 VAL 142 1.210 1.888 -4.978 1064 HG23 VAL 142 2HG2 VAL 142 0.589 2.233 -3.363 1065 H ALA 143 H ALA 143 -0.076 0.202 -1.141 1066 HA ALA 143 HA ALA 143 -0.031 -2.678 -1.776 1067 HB1 ALA 143 3HB ALA 143 -1.741 -1.203 0.232 1068 HB2 ALA 143 1HB ALA 143 -0.349 -2.221 0.605 1069 HB3 ALA 143 2HB ALA 143 -1.801 -2.934 -0.099 1070 H LEU 144 H LEU 144 -1.039 -3.069 -3.637 1071 HA LEU 144 HA LEU 144 -3.219 -1.251 -4.427 1072 HG LEU 144 HG LEU 144 -0.349 -0.630 -5.195 1073 HB2 LEU 144 1HB LEU 144 -1.242 -2.751 -6.137 1074 HB3 LEU 144 2HB LEU 144 -2.613 -1.861 -6.769 1075 HD11 LEU 144 1HD1 LEU 144 0.353 0.324 -7.332 1076 HD12 LEU 144 2HD1 LEU 144 -0.914 -0.584 -8.156 1077 HD13 LEU 144 3HD1 LEU 144 0.412 -1.438 -7.367 1078 HD21 LEU 144 3HD2 LEU 144 -2.647 0.608 -6.708 1079 HD22 LEU 144 1HD2 LEU 144 -1.316 1.490 -5.958 1080 HD23 LEU 144 2HD2 LEU 144 -2.447 0.581 -4.955 1081 H LEU 145 H LEU 145 -5.136 -2.049 -4.938 1082 HA LEU 145 HA LEU 145 -5.542 -4.940 -4.950 1083 HG LEU 145 HG LEU 145 -6.482 -2.788 -2.863 1084 HB2 LEU 145 1HB LEU 145 -7.531 -2.662 -5.096 1085 HB3 LEU 145 2HB LEU 145 -7.946 -4.361 -4.984 1086 HD11 LEU 145 1HD1 LEU 145 -8.555 -2.996 -1.586 1087 HD12 LEU 145 2HD1 LEU 145 -9.332 -3.765 -2.971 1088 HD13 LEU 145 3HD1 LEU 145 -8.801 -2.086 -3.076 1089 HD21 LEU 145 3HD2 LEU 145 -6.838 -4.759 -1.474 1090 HD22 LEU 145 1HD2 LEU 145 -5.862 -5.147 -2.891 1091 HD23 LEU 145 2HD2 LEU 145 -7.567 -5.601 -2.842 1092 HA PRO 146 HA PRO 146 -5.367 -4.983 -9.374 1093 HB2 PRO 146 1HB PRO 146 -6.886 -7.491 -9.272 1094 HB3 PRO 146 2HB PRO 146 -5.228 -7.203 -9.811 1095 HG2 PRO 146 1HG PRO 146 -5.779 -8.514 -7.521 1096 HG3 PRO 146 2HG PRO 146 -4.350 -7.479 -7.700 1097 HD2 PRO 146 1HD PRO 146 -6.962 -6.889 -6.355 1098 HD3 PRO 146 2HD PRO 146 -5.312 -6.493 -5.829 1099 H ASP 147 H ASP 147 -6.824 -3.227 -9.627 1100 HA ASP 147 HA ASP 147 -9.085 -3.893 -11.210 1101 HB2 ASP 147 1HB ASP 147 -9.911 -4.050 -8.738 1102 HB3 ASP 147 2HB ASP 147 -9.788 -2.295 -8.744 1103 H GLY 148 H GLY 148 -10.375 -1.335 -10.990 1104 HA2 GLY 148 1HA GLY 148 -8.910 0.933 -10.940 1105 HA3 GLY 148 2HA GLY 148 -8.415 0.213 -12.466 1106 H ASP 149 H ASP 149 -11.480 -0.827 -12.076 1107 HA ASP 149 HA ASP 149 -12.623 1.550 -13.372 1108 HB2 ASP 149 1HB ASP 149 -11.917 -0.094 -15.105 1109 HB3 ASP 149 2HB ASP 149 -12.994 -1.282 -14.373 1110 H SER 150 H SER 150 -14.462 2.148 -12.488 1111 HA SER 150 HA SER 150 -15.659 0.731 -10.354 1112 HG SER 150 HG SER 150 -17.512 3.242 -12.560 1113 HB2 SER 150 1HB SER 150 -17.419 2.533 -10.549 1114 HB3 SER 150 2HB SER 150 -15.768 3.135 -10.391 1115 H LEU 151 H LEU 151 -17.754 -0.230 -10.248 1116 HA LEU 151 HA LEU 151 -18.450 -1.876 -12.403 1117 HG LEU 151 HG LEU 151 -21.499 -2.196 -11.819 1118 HB2 LEU 151 1HB LEU 151 -19.054 -2.332 -10.048 1119 HB3 LEU 151 2HB LEU 151 -20.201 -1.006 -10.102 1120 HD11 LEU 151 1HD1 LEU 151 -19.690 -3.453 -12.852 1121 HD12 LEU 151 2HD1 LEU 151 -20.986 -4.531 -12.332 1122 HD13 LEU 151 3HD1 LEU 151 -19.503 -4.412 -11.384 1123 HD21 LEU 151 3HD2 LEU 151 -20.931 -3.808 -9.336 1124 HD22 LEU 151 1HD2 LEU 151 -22.345 -3.990 -10.375 1125 HD23 LEU 151 2HD2 LEU 151 -22.090 -2.488 -9.486 1126 H GLU 152 H GLU 152 -20.014 1.098 -11.210 1127 HA GLU 152 HA GLU 152 -21.652 1.419 -13.516 1128 HB2 GLU 152 1HB GLU 152 -21.986 2.548 -11.263 1129 HB3 GLU 152 2HB GLU 152 -20.646 3.607 -11.683 1130 HG2 GLU 152 1HG GLU 152 -21.898 4.368 -13.657 1131 HG3 GLU 152 2HG GLU 152 -23.253 3.352 -13.166 1132 H HIS 153 H HIS 153 -20.756 1.581 -15.478 1133 HA HIS 153 HA HIS 153 -18.279 3.157 -15.733 1134 HD1 HIS 153 HD1 HIS 153 -18.369 1.112 -19.592 1135 HD2 HIS 153 HD2 HIS 153 -15.502 2.316 -16.833 1136 HE1 HIS 153 HE1 HIS 153 -16.356 1.771 -20.947 1137 HE2 HIS 153 HE2 HIS 153 -14.563 2.241 -19.239 1138 HB2 HIS 153 1HB HIS 153 -17.800 0.774 -15.988 1139 HB3 HIS 153 2HB HIS 153 -19.047 0.636 -17.222 1140 H HIS 154 H HIS 154 -19.101 5.031 -16.476 1141 HA HIS 154 HA HIS 154 -21.005 5.078 -18.649 1142 HD1 HIS 154 HD1 HIS 154 -23.112 6.690 -17.790 1143 HD2 HIS 154 HD2 HIS 154 -20.266 7.308 -14.821 1144 HE1 HIS 154 HE1 HIS 154 -24.401 6.856 -15.638 1145 HE2 HIS 154 HE2 HIS 154 -22.636 6.961 -13.842 1146 HB2 HIS 154 1HB HIS 154 -19.384 7.308 -17.389 1147 HB3 HIS 154 2HB HIS 154 -20.647 7.539 -18.594 1148 H HIS 155 H HIS 155 -20.547 5.876 -20.771 1149 HA HIS 155 HA HIS 155 -18.170 4.651 -21.766 1150 HD1 HIS 155 HD1 HIS 155 -18.662 2.912 -23.920 1151 HD2 HIS 155 HD2 HIS 155 -18.617 6.723 -25.590 1152 HE1 HIS 155 HE1 HIS 155 -17.433 2.685 -26.106 1153 HE2 HIS 155 HE2 HIS 155 -17.256 5.034 -26.998 1154 HB2 HIS 155 1HB HIS 155 -20.421 4.682 -22.918 1155 HB3 HIS 155 2HB HIS 155 -20.105 6.365 -23.327 1156 H HIS 156 H HIS 156 -18.900 7.784 -20.681 1157 HA HIS 156 HA HIS 156 -17.035 9.269 -22.215 1158 HD1 HIS 156 HD1 HIS 156 -17.909 12.489 -21.895 1159 HD2 HIS 156 HD2 HIS 156 -20.744 9.617 -20.899 1160 HE1 HIS 156 HE1 HIS 156 -20.056 13.268 -22.938 1161 HE2 HIS 156 HE2 HIS 156 -21.704 11.418 -22.495 1162 HB2 HIS 156 1HB HIS 156 -18.247 9.721 -19.491 1163 HB3 HIS 156 2HB HIS 156 -17.073 10.833 -20.183 1164 H HIS 157 H HIS 157 -16.730 7.091 -19.554 1165 HA HIS 157 HA HIS 157 -14.005 7.904 -18.957 1166 HD1 HIS 157 HD1 HIS 157 -12.909 7.678 -16.264 1167 HD2 HIS 157 HD2 HIS 157 -13.880 3.742 -17.214 1168 HE1 HIS 157 HE1 HIS 157 -11.115 6.258 -15.211 1169 HE2 HIS 157 HE2 HIS 157 -11.821 3.879 -15.660 1170 HB2 HIS 157 1HB HIS 157 -15.432 7.235 -17.088 1171 HB3 HIS 157 2HB HIS 157 -15.718 5.669 -17.838 1172 H HIS 158 H HIS 158 -12.313 7.102 -19.975 1173 HA HIS 158 HA HIS 158 -12.685 4.689 -21.613 1174 HD1 HIS 158 HD1 HIS 158 -12.037 8.902 -22.257 1175 HD2 HIS 158 HD2 HIS 158 -13.225 5.657 -24.568 1176 HE1 HIS 158 HE1 HIS 158 -13.737 9.807 -23.875 1177 HE2 HIS 158 HE2 HIS 158 -14.605 7.784 -25.101 1178 HB2 HIS 158 1HB HIS 158 -10.605 6.871 -21.897 1179 HB3 HIS 158 2HB HIS 158 -10.827 5.504 -22.984 Start of MODEL 16 1 HA MET 1 HA MET 1 38.241 5.212 -3.210 2 H1 MET 1 1H MET 1 40.379 4.601 -2.372 3 H2 MET 1 2H MET 1 39.568 3.216 -2.913 4 H3 MET 1 3H MET 1 39.690 3.533 -1.251 5 HB2 MET 1 1HB MET 1 37.261 3.200 -1.184 6 HB3 MET 1 2HB MET 1 36.220 4.429 -1.889 7 HG2 MET 1 1HG MET 1 37.693 2.287 -3.404 8 HG3 MET 1 2HG MET 1 35.976 2.282 -3.008 9 HE1 MET 1 3HE MET 1 34.680 5.346 -5.110 10 HE2 MET 1 1HE MET 1 35.259 5.391 -3.445 11 HE3 MET 1 2HE MET 1 34.235 4.063 -3.987 12 H LYS 2 H LYS 2 37.976 7.228 -2.552 13 HA LYS 2 HA LYS 2 38.549 7.928 0.220 14 HB2 LYS 2 1HB LYS 2 37.860 9.692 -2.140 15 HB3 LYS 2 2HB LYS 2 38.376 10.255 -0.558 16 HG2 LYS 2 1HG LYS 2 40.548 9.177 -0.891 17 HG3 LYS 2 2HG LYS 2 40.023 8.636 -2.489 18 HD2 LYS 2 1HD LYS 2 39.738 10.941 -3.200 19 HD3 LYS 2 2HD LYS 2 40.184 11.512 -1.592 20 HE2 LYS 2 1HE LYS 2 42.403 10.440 -1.890 21 HE3 LYS 2 2HE LYS 2 41.940 10.026 -3.541 22 HZ1 LYS 2 3HZ LYS 2 41.704 12.367 -4.039 23 HZ2 LYS 2 1HZ LYS 2 43.258 12.060 -3.438 24 HZ3 LYS 2 2HZ LYS 2 42.093 12.781 -2.441 25 H LEU 3 H LEU 3 35.933 8.054 -2.126 26 HA LEU 3 HA LEU 3 34.103 9.233 -0.208 27 HG LEU 3 HG LEU 3 31.522 8.663 -1.805 28 HB2 LEU 3 1HB LEU 3 34.150 9.923 -2.591 29 HB3 LEU 3 2HB LEU 3 33.633 8.311 -3.044 30 HD11 LEU 3 1HD1 LEU 3 32.565 11.469 -1.454 31 HD12 LEU 3 2HD1 LEU 3 32.317 10.283 -0.173 32 HD13 LEU 3 3HD1 LEU 3 30.936 10.919 -1.066 33 HD21 LEU 3 3HD2 LEU 3 30.531 10.214 -3.406 34 HD22 LEU 3 1HD2 LEU 3 31.648 9.107 -4.202 35 HD23 LEU 3 2HD2 LEU 3 32.139 10.769 -3.873 36 H HIS 4 H HIS 4 32.299 8.263 0.642 37 HA HIS 4 HA HIS 4 31.894 5.412 0.040 38 HD1 HIS 4 HD1 HIS 4 32.560 3.192 1.879 39 HD2 HIS 4 HD2 HIS 4 29.313 5.202 3.525 40 HE1 HIS 4 HE1 HIS 4 31.045 1.402 2.787 41 HE2 HIS 4 HE2 HIS 4 29.000 2.631 3.603 42 HB2 HIS 4 1HB HIS 4 32.928 5.765 2.297 43 HB3 HIS 4 2HB HIS 4 31.509 6.701 2.754 44 H THR 5 H THR 5 30.231 5.771 -1.384 45 HA THR 5 HA THR 5 28.089 7.574 -0.821 46 HB THR 5 HB THR 5 27.073 6.204 -2.833 47 HG1 THR 5 HG1 THR 5 28.374 4.661 -3.469 48 HG21 THR 5 3HG2 THR 5 28.313 7.635 -4.390 49 HG22 THR 5 1HG2 THR 5 29.492 7.990 -3.127 50 HG23 THR 5 2HG2 THR 5 27.821 8.531 -2.952 51 H ASP 6 H ASP 6 25.963 7.095 -0.297 52 HA ASP 6 HA ASP 6 25.540 4.744 1.284 53 HB2 ASP 6 1HB ASP 6 23.201 5.646 1.502 54 HB3 ASP 6 2HB ASP 6 24.464 6.760 2.013 55 HA PRO 7 HA PRO 7 24.239 2.076 -1.991 56 HB2 PRO 7 1HB PRO 7 22.812 0.569 0.099 57 HB3 PRO 7 2HB PRO 7 24.141 0.056 -0.943 58 HG2 PRO 7 1HG PRO 7 24.504 0.510 1.676 59 HG3 PRO 7 2HG PRO 7 25.756 0.894 0.479 60 HD2 PRO 7 1HD PRO 7 23.819 2.722 1.852 61 HD3 PRO 7 2HD PRO 7 25.542 2.969 1.497 62 H ALA 8 H ALA 8 22.445 1.720 -3.242 63 HA ALA 8 HA ALA 8 20.052 3.208 -2.491 64 HB1 ALA 8 3HB ALA 8 19.432 3.028 -4.838 65 HB2 ALA 8 1HB ALA 8 20.811 1.970 -5.135 66 HB3 ALA 8 2HB ALA 8 21.073 3.652 -4.674 67 H THR 9 H THR 9 17.986 2.109 -3.608 68 HA THR 9 HA THR 9 17.854 -0.612 -2.488 69 HB THR 9 HB THR 9 15.356 -0.033 -2.225 70 HG1 THR 9 HG1 THR 9 16.089 2.624 -1.900 71 HG21 THR 9 3HG2 THR 9 16.894 -0.299 -0.334 72 HG22 THR 9 1HG2 THR 9 15.744 1.005 -0.040 73 HG23 THR 9 2HG2 THR 9 17.402 1.380 -0.509 74 H ALA 10 H ALA 10 15.903 -1.857 -3.423 75 HA ALA 10 HA ALA 10 16.312 -1.957 -6.279 76 HB1 ALA 10 3HB ALA 10 14.974 -3.998 -6.189 77 HB2 ALA 10 1HB ALA 10 14.582 -3.673 -4.501 78 HB3 ALA 10 2HB ALA 10 16.247 -4.019 -4.968 79 H LEU 11 H LEU 11 14.989 -1.188 -7.809 80 HA LEU 11 HA LEU 11 12.623 0.263 -6.943 81 HG LEU 11 HG LEU 11 15.465 1.205 -8.152 82 HB2 LEU 11 1HB LEU 11 13.892 0.127 -9.677 83 HB3 LEU 11 2HB LEU 11 12.626 1.231 -9.178 84 HD11 LEU 11 1HD1 LEU 11 15.253 2.049 -10.428 85 HD12 LEU 11 2HD1 LEU 11 15.644 3.347 -9.301 86 HD13 LEU 11 3HD1 LEU 11 13.996 3.169 -9.902 87 HD21 LEU 11 3HD2 LEU 11 13.919 1.875 -6.397 88 HD22 LEU 11 1HD2 LEU 11 13.169 3.043 -7.486 89 HD23 LEU 11 2HD2 LEU 11 14.843 3.262 -6.975 90 H ASN 12 H ASN 12 11.112 -1.366 -6.561 91 HA ASN 12 HA ASN 12 10.428 -3.248 -8.635 92 HB2 ASN 12 1HB ASN 12 8.948 -2.509 -6.092 93 HB3 ASN 12 2HB ASN 12 8.503 -3.827 -7.169 94 HD21 ASN 12 2HD2 ASN 12 10.589 -2.781 -4.646 95 HD22 ASN 12 1HD2 ASN 12 11.413 -4.280 -4.414 96 H THR 13 H THR 13 9.710 -2.295 -10.468 97 HA THR 13 HA THR 13 7.771 -0.099 -10.210 98 HB THR 13 HB THR 13 9.469 -0.758 -12.623 99 HG1 THR 13 HG1 THR 13 10.247 0.248 -10.309 100 HG21 THR 13 3HG2 THR 13 7.454 0.553 -13.107 101 HG22 THR 13 1HG2 THR 13 8.910 1.528 -13.310 102 HG23 THR 13 2HG2 THR 13 7.914 1.721 -11.867 103 H VAL 14 H VAL 14 5.807 -0.236 -11.080 104 HA VAL 14 HA VAL 14 4.805 -2.659 -12.211 105 HB VAL 14 HB VAL 14 3.560 0.102 -12.103 106 HG11 VAL 14 1HG1 VAL 14 2.271 -2.576 -12.608 107 HG12 VAL 14 2HG1 VAL 14 2.493 -1.285 -13.790 108 HG13 VAL 14 3HG1 VAL 14 1.421 -1.043 -12.411 109 HG21 VAL 14 3HG2 VAL 14 3.260 -2.250 -10.241 110 HG22 VAL 14 1HG2 VAL 14 2.325 -0.757 -10.159 111 HG23 VAL 14 2HG2 VAL 14 4.067 -0.724 -9.883 112 H THR 15 H THR 15 4.800 -3.246 -14.319 113 HA THR 15 HA THR 15 6.009 -1.414 -16.221 114 HB THR 15 HB THR 15 5.806 -3.484 -17.761 115 HG1 THR 15 HG1 THR 15 4.701 -5.049 -16.853 116 HG21 THR 15 3HG2 THR 15 7.562 -3.566 -15.307 117 HG22 THR 15 1HG2 THR 15 7.912 -2.702 -16.804 118 HG23 THR 15 2HG2 THR 15 7.837 -4.464 -16.799 119 H ALA 16 H ALA 16 2.928 -2.985 -15.631 120 HA ALA 16 HA ALA 16 1.555 -1.094 -17.278 121 HB1 ALA 16 3HB ALA 16 0.617 -2.659 -18.890 122 HB2 ALA 16 1HB ALA 16 1.582 -3.967 -18.204 123 HB3 ALA 16 2HB ALA 16 2.376 -2.620 -19.021 124 H TYR 17 H TYR 17 -0.839 -1.720 -17.417 125 HA TYR 17 HA TYR 17 -1.624 -3.104 -14.934 126 HD1 TYR 17 HD1 TYR 17 -2.670 -1.252 -12.894 127 HD2 TYR 17 HD2 TYR 17 -1.622 0.774 -16.485 128 HE1 TYR 17 HE1 TYR 17 -1.647 0.550 -11.573 129 HE2 TYR 17 HE2 TYR 17 -0.596 2.579 -15.174 130 HH TYR 17 HH TYR 17 0.073 2.309 -11.878 131 HB2 TYR 17 1HB TYR 17 -3.169 -1.052 -16.543 132 HB3 TYR 17 2HB TYR 17 -3.727 -1.824 -15.064 133 H GLY 18 H GLY 18 -2.077 -2.818 -18.377 134 HA2 GLY 18 1HA GLY 18 -3.002 -4.229 -19.926 135 HA3 GLY 18 2HA GLY 18 -2.888 -5.494 -18.709 136 H ASP 19 H ASP 19 -4.747 -6.394 -18.216 137 HA ASP 19 HA ASP 19 -7.078 -4.797 -17.669 138 HB2 ASP 19 1HB ASP 19 -7.244 -5.069 -20.118 139 HB3 ASP 19 2HB ASP 19 -7.163 -6.817 -19.923 140 H GLY 20 H GLY 20 -7.443 -5.615 -15.706 141 HA2 GLY 20 1HA GLY 20 -8.561 -7.174 -14.362 142 HA3 GLY 20 2HA GLY 20 -8.267 -8.408 -15.577 143 H TYR 21 H TYR 21 -5.543 -6.516 -14.645 144 HA TYR 21 HA TYR 21 -4.781 -8.164 -12.429 145 HD1 TYR 21 HD2 TYR 21 -1.112 -7.854 -14.295 146 HD2 TYR 21 HD1 TYR 21 -4.502 -8.815 -16.674 147 HE1 TYR 21 HE2 TYR 21 0.083 -7.089 -16.293 148 HE2 TYR 21 HE1 TYR 21 -3.306 -8.052 -18.687 149 HH TYR 21 HH TYR 21 0.102 -7.139 -18.557 150 HB2 TYR 21 1HB TYR 21 -2.872 -9.256 -13.415 151 HB3 TYR 21 2HB TYR 21 -4.288 -9.654 -14.380 152 H ILE 22 H ILE 22 -2.379 -7.683 -11.876 153 HA ILE 22 HA ILE 22 -1.687 -4.909 -12.618 154 HB ILE 22 HB ILE 22 -1.180 -6.243 -9.943 155 HG12 ILE 22 1HG1 ILE 22 -3.080 -3.989 -10.636 156 HG13 ILE 22 2HG1 ILE 22 -3.565 -5.654 -10.335 157 HG21 ILE 22 1HG2 ILE 22 -0.416 -4.013 -9.239 158 HG22 ILE 22 2HG2 ILE 22 -0.626 -3.432 -10.892 159 HG23 ILE 22 3HG2 ILE 22 0.573 -4.676 -10.540 160 HD11 ILE 22 3HD1 ILE 22 -3.947 -4.252 -8.392 161 HD12 ILE 22 1HD1 ILE 22 -2.237 -3.822 -8.353 162 HD13 ILE 22 2HD1 ILE 22 -2.735 -5.487 -8.051 163 H GLU 23 H GLU 23 0.268 -4.767 -13.601 164 HA GLU 23 HA GLU 23 1.877 -7.226 -13.626 165 HB2 GLU 23 1HB GLU 23 0.836 -6.337 -15.755 166 HB3 GLU 23 2HB GLU 23 1.958 -4.987 -15.637 167 HG2 GLU 23 1HG GLU 23 3.831 -6.574 -15.709 168 HG3 GLU 23 2HG GLU 23 2.675 -7.893 -15.910 169 H VAL 24 H VAL 24 3.521 -7.103 -12.250 170 HA VAL 24 HA VAL 24 5.079 -4.603 -12.164 171 HB VAL 24 HB VAL 24 5.013 -6.833 -10.118 172 HG11 VAL 24 1HG1 VAL 24 7.190 -5.727 -10.223 173 HG12 VAL 24 2HG1 VAL 24 6.348 -5.324 -8.727 174 HG13 VAL 24 3HG1 VAL 24 6.408 -4.156 -10.048 175 HG21 VAL 24 3HG2 VAL 24 3.843 -4.052 -10.030 176 HG22 VAL 24 1HG2 VAL 24 3.889 -5.185 -8.679 177 HG23 VAL 24 2HG2 VAL 24 2.941 -5.564 -10.118 178 H ASN 25 H ASN 25 6.695 -4.731 -13.545 179 HA ASN 25 HA ASN 25 8.473 -5.454 -14.748 180 HB2 ASN 25 1HB ASN 25 9.344 -5.735 -12.369 181 HB3 ASN 25 2HB ASN 25 8.963 -7.446 -12.528 182 HD21 ASN 25 2HD2 ASN 25 11.000 -4.848 -13.642 183 HD22 ASN 25 1HD2 ASN 25 12.208 -5.844 -14.368 184 H GLN 26 H GLN 26 6.259 -6.380 -15.752 185 HA GLN 26 HA GLN 26 5.516 -7.827 -17.320 186 HB2 GLN 26 1HB GLN 26 8.069 -9.333 -16.765 187 HB3 GLN 26 2HB GLN 26 6.918 -9.767 -18.021 188 HG2 GLN 26 1HG GLN 26 7.261 -7.521 -19.024 189 HG3 GLN 26 2HG GLN 26 8.522 -7.231 -17.827 190 HE21 GLN 26 2HE2 GLN 26 9.403 -10.026 -17.894 191 HE22 GLN 26 1HE2 GLN 26 10.289 -10.215 -19.369 192 H VAL 27 H VAL 27 6.197 -8.876 -14.128 193 HA VAL 27 HA VAL 27 4.881 -11.412 -14.327 194 HB VAL 27 HB VAL 27 5.374 -9.773 -11.835 195 HG11 VAL 27 1HG1 VAL 27 4.860 -12.723 -12.213 196 HG12 VAL 27 2HG1 VAL 27 3.742 -11.550 -11.520 197 HG13 VAL 27 3HG1 VAL 27 5.245 -11.935 -10.683 198 HG21 VAL 27 3HG2 VAL 27 7.403 -11.132 -11.557 199 HG22 VAL 27 1HG2 VAL 27 7.467 -10.149 -13.021 200 HG23 VAL 27 2HG2 VAL 27 7.114 -11.873 -13.130 201 H ARG 28 H ARG 28 2.784 -11.806 -14.359 202 HA ARG 28 HA ARG 28 0.958 -9.538 -14.129 203 HE ARG 28 HE ARG 28 2.200 -12.953 -17.530 204 HB2 ARG 28 1HB ARG 28 0.564 -12.326 -15.227 205 HB3 ARG 28 2HB ARG 28 -0.664 -11.067 -15.227 206 HG2 ARG 28 1HG ARG 28 0.510 -9.768 -16.787 207 HG3 ARG 28 2HG ARG 28 2.002 -10.679 -16.549 208 HD2 ARG 28 1HD ARG 28 -0.526 -11.830 -17.718 209 HD3 ARG 28 2HD ARG 28 0.818 -11.206 -18.676 210 HH11 ARG 28 1HH1 ARG 28 -1.275 -13.358 -17.911 211 HH12 ARG 28 2HH1 ARG 28 -1.190 -15.097 -17.852 212 HH21 ARG 28 1HH2 ARG 28 2.291 -15.236 -17.462 213 HH22 ARG 28 2HH2 ARG 28 0.817 -16.159 -17.593 214 H PHE 29 H PHE 29 0.386 -9.217 -12.058 215 HA PHE 29 HA PHE 29 -0.313 -11.503 -10.381 216 HD1 PHE 29 HD2 PHE 29 1.101 -11.502 -7.913 217 HD2 PHE 29 HD1 PHE 29 2.156 -8.176 -10.345 218 HE1 PHE 29 HE2 PHE 29 3.474 -11.870 -7.378 219 HE2 PHE 29 HE1 PHE 29 4.530 -8.537 -9.816 220 HZ PHE 29 HZ PHE 29 5.193 -10.386 -8.329 221 HB2 PHE 29 1HB PHE 29 -0.099 -8.551 -9.754 222 HB3 PHE 29 2HB PHE 29 -0.551 -9.783 -8.583 223 H SER 30 H SER 30 -2.323 -12.224 -10.396 224 HA SER 30 HA SER 30 -4.512 -10.443 -11.155 225 HG SER 30 HG SER 30 -4.990 -12.472 -13.185 226 HB2 SER 30 1HB SER 30 -4.480 -13.433 -10.663 227 HB3 SER 30 2HB SER 30 -5.856 -12.510 -11.267 228 H HIS 31 H HIS 31 -3.013 -10.433 -8.535 229 HA HIS 31 HA HIS 31 -5.333 -10.275 -6.819 230 HD1 HIS 31 HD1 HIS 31 -2.244 -13.164 -7.779 231 HD2 HIS 31 HD2 HIS 31 -2.040 -11.631 -3.922 232 HE1 HIS 31 HE1 HIS 31 0.087 -13.653 -6.981 233 HE2 HIS 31 HE2 HIS 31 0.098 -12.921 -4.567 234 HB2 HIS 31 1HB HIS 31 -4.503 -11.748 -5.095 235 HB3 HIS 31 2HB HIS 31 -4.586 -12.647 -6.603 236 H ALA 32 H ALA 32 -4.714 -9.349 -4.656 237 HA ALA 32 HA ALA 32 -3.310 -6.954 -5.116 238 HB1 ALA 32 3HB ALA 32 -5.157 -7.155 -3.538 239 HB2 ALA 32 1HB ALA 32 -3.721 -6.469 -2.779 240 HB3 ALA 32 2HB ALA 32 -4.151 -8.156 -2.491 241 H ILE 33 H ILE 33 -1.418 -6.145 -4.306 242 HA ILE 33 HA ILE 33 0.463 -7.960 -2.993 243 HB ILE 33 HB ILE 33 2.267 -7.222 -4.603 244 HG12 ILE 33 1HG1 ILE 33 -0.127 -6.488 -6.306 245 HG13 ILE 33 2HG1 ILE 33 1.027 -5.351 -5.617 246 HG21 ILE 33 1HG2 ILE 33 0.059 -8.972 -5.677 247 HG22 ILE 33 2HG2 ILE 33 1.382 -9.481 -4.628 248 HG23 ILE 33 3HG2 ILE 33 1.719 -8.938 -6.271 249 HD11 ILE 33 3HD1 ILE 33 1.648 -7.476 -7.653 250 HD12 ILE 33 1HD1 ILE 33 2.802 -6.333 -6.969 251 HD13 ILE 33 2HD1 ILE 33 1.472 -5.750 -7.970 252 H ALA 34 H ALA 34 2.141 -6.916 -1.906 253 HA ALA 34 HA ALA 34 2.056 -3.970 -1.863 254 HB1 ALA 34 3HB ALA 34 2.355 -5.780 0.539 255 HB2 ALA 34 1HB ALA 34 0.935 -4.812 0.144 256 HB3 ALA 34 2HB ALA 34 2.456 -4.020 0.556 257 H PHE 35 H PHE 35 4.020 -3.062 -2.182 258 HA PHE 35 HA PHE 35 6.419 -4.563 -1.536 259 HD1 PHE 35 HD2 PHE 35 3.832 -4.917 -4.644 260 HD2 PHE 35 HD1 PHE 35 7.109 -2.246 -5.130 261 HE1 PHE 35 HE2 PHE 35 2.621 -3.763 -6.447 262 HE2 PHE 35 HE1 PHE 35 5.903 -1.090 -6.935 263 HZ PHE 35 HZ PHE 35 3.656 -1.850 -7.596 264 HB2 PHE 35 1HB PHE 35 7.351 -4.250 -3.849 265 HB3 PHE 35 2HB PHE 35 6.050 -5.425 -3.729 266 H ALA 36 H ALA 36 8.332 -3.338 -1.577 267 HA ALA 36 HA ALA 36 8.043 -0.438 -1.866 268 HB1 ALA 36 3HB ALA 36 7.638 -0.935 0.495 269 HB2 ALA 36 1HB ALA 36 9.160 -0.068 0.284 270 HB3 ALA 36 2HB ALA 36 9.168 -1.806 0.580 271 HA PRO 37 HA PRO 37 12.144 -0.528 -3.668 272 HB2 PRO 37 1HB PRO 37 12.849 1.605 -1.712 273 HB3 PRO 37 2HB PRO 37 13.038 1.582 -3.469 274 HG2 PRO 37 1HG PRO 37 11.104 3.014 -2.333 275 HG3 PRO 37 2HG PRO 37 10.817 2.138 -3.849 276 HD2 PRO 37 1HD PRO 37 9.957 1.460 -1.070 277 HD3 PRO 37 2HD PRO 37 9.101 1.220 -2.607 278 H GLU 38 H GLU 38 12.040 -0.133 -0.133 279 HA GLU 38 HA GLU 38 14.336 -1.945 0.088 280 HB2 GLU 38 1HB GLU 38 14.429 0.242 1.320 281 HB3 GLU 38 2HB GLU 38 13.059 -0.297 2.280 282 HG2 GLU 38 1HG GLU 38 14.413 -2.233 3.037 283 HG3 GLU 38 2HG GLU 38 15.790 -1.562 2.164 284 H GLY 39 H GLY 39 13.388 -3.903 -0.229 285 HA2 GLY 39 1HA GLY 39 12.515 -5.544 1.610 286 HA3 GLY 39 2HA GLY 39 11.046 -4.607 1.374 287 HA PRO 40 HA PRO 40 11.012 -7.807 -1.933 288 HB2 PRO 40 1HB PRO 40 9.532 -9.729 -0.832 289 HB3 PRO 40 2HB PRO 40 11.241 -9.556 -0.420 290 HG2 PRO 40 1HG PRO 40 8.836 -8.893 1.180 291 HG3 PRO 40 2HG PRO 40 10.458 -9.353 1.724 292 HD2 PRO 40 1HD PRO 40 9.351 -6.714 1.496 293 HD3 PRO 40 2HD PRO 40 10.986 -7.170 2.016 294 H VAL 41 H VAL 41 9.002 -8.888 -2.956 295 HA VAL 41 HA VAL 41 6.700 -7.077 -2.793 296 HB VAL 41 HB VAL 41 7.241 -9.314 -4.765 297 HG11 VAL 41 1HG1 VAL 41 5.420 -8.310 -6.068 298 HG12 VAL 41 2HG1 VAL 41 5.135 -7.157 -4.764 299 HG13 VAL 41 3HG1 VAL 41 4.866 -8.878 -4.492 300 HG21 VAL 41 3HG2 VAL 41 8.855 -7.497 -5.002 301 HG22 VAL 41 1HG2 VAL 41 7.536 -6.332 -5.108 302 HG23 VAL 41 2HG2 VAL 41 7.746 -7.544 -6.371 303 H ALA 42 H ALA 42 5.195 -7.630 -1.360 304 HA ALA 42 HA ALA 42 5.017 -10.438 -0.539 305 HB1 ALA 42 3HB ALA 42 3.915 -9.614 1.464 306 HB2 ALA 42 1HB ALA 42 3.936 -7.973 0.820 307 HB3 ALA 42 2HB ALA 42 5.451 -8.782 1.218 308 H SER 43 H SER 43 3.211 -11.614 -0.758 309 HA SER 43 HA SER 43 1.079 -10.610 -2.410 310 HG SER 43 HG SER 43 -0.532 -13.638 -1.745 311 HB2 SER 43 1HB SER 43 1.908 -12.939 -2.604 312 HB3 SER 43 2HB SER 43 1.360 -13.259 -0.961 313 H TRP 44 H TRP 44 -0.644 -9.551 -1.652 314 HA TRP 44 HA TRP 44 -1.086 -9.574 1.243 315 HD1 TRP 44 HD1 TRP 44 -0.689 -8.256 2.794 316 HE1 TRP 44 HE1 TRP 44 -1.546 -6.542 4.514 317 HE3 TRP 44 HE3 TRP 44 -3.600 -5.402 -0.289 318 HZ2 TRP 44 HZ2 TRP 44 -3.227 -4.279 4.553 319 HZ3 TRP 44 HZ3 TRP 44 -4.795 -3.477 0.670 320 HH2 TRP 44 HH2 TRP 44 -4.611 -2.928 3.041 321 HB2 TRP 44 1HB TRP 44 -0.777 -7.448 -0.352 322 HB3 TRP 44 2HB TRP 44 -2.514 -7.661 -0.544 323 HA PRO 45 HA PRO 45 -4.526 -12.255 0.519 324 HB2 PRO 45 1HB PRO 45 -5.357 -11.603 3.255 325 HB3 PRO 45 2HB PRO 45 -4.817 -13.144 2.586 326 HG2 PRO 45 1HG PRO 45 -3.305 -11.725 4.302 327 HG3 PRO 45 2HG PRO 45 -2.595 -12.697 2.999 328 HD2 PRO 45 1HD PRO 45 -3.051 -9.739 3.126 329 HD3 PRO 45 2HD PRO 45 -1.645 -10.636 2.515 330 H VAL 46 H VAL 46 -4.767 -8.950 1.106 331 HA VAL 46 HA VAL 46 -7.658 -8.860 1.337 332 HB VAL 46 HB VAL 46 -5.686 -6.592 1.005 333 HG11 VAL 46 1HG1 VAL 46 -7.958 -5.989 0.372 334 HG12 VAL 46 2HG1 VAL 46 -7.482 -5.187 1.870 335 HG13 VAL 46 3HG1 VAL 46 -8.554 -6.586 1.920 336 HG21 VAL 46 3HG2 VAL 46 -6.925 -7.708 3.512 337 HG22 VAL 46 1HG2 VAL 46 -5.896 -6.279 3.415 338 HG23 VAL 46 2HG2 VAL 46 -5.235 -7.869 3.030 339 H GLN 47 H GLN 47 -8.660 -9.433 -0.542 340 HA GLN 47 HA GLN 47 -7.602 -8.371 -3.060 341 HB2 GLN 47 1HB GLN 47 -9.887 -10.316 -2.750 342 HB3 GLN 47 2HB GLN 47 -8.922 -10.005 -4.186 343 HG2 GLN 47 1HG GLN 47 -8.038 -11.388 -1.666 344 HG3 GLN 47 2HG GLN 47 -8.287 -12.115 -3.252 345 HE21 GLN 47 2HE2 GLN 47 -5.937 -12.033 -1.515 346 HE22 GLN 47 1HE2 GLN 47 -4.666 -11.323 -2.443 347 H ARG 48 H ARG 48 -9.801 -7.555 -0.736 348 HA ARG 48 HA ARG 48 -11.326 -5.869 -2.583 349 HE ARG 48 HE ARG 48 -13.178 -9.251 0.105 350 HB2 ARG 48 1HB ARG 48 -12.558 -7.565 -0.397 351 HB3 ARG 48 2HB ARG 48 -13.418 -6.414 -1.409 352 HG2 ARG 48 1HG ARG 48 -13.229 -7.754 -3.306 353 HG3 ARG 48 2HG ARG 48 -11.925 -8.714 -2.605 354 HD2 ARG 48 1HD ARG 48 -14.804 -8.699 -1.712 355 HD3 ARG 48 2HD ARG 48 -14.012 -9.968 -2.648 356 HH11 ARG 48 1HH1 ARG 48 -13.826 -11.625 -2.406 357 HH12 ARG 48 2HH1 ARG 48 -13.596 -12.986 -1.354 358 HH21 ARG 48 1HH2 ARG 48 -12.797 -11.027 1.479 359 HH22 ARG 48 2HH2 ARG 48 -12.976 -12.645 0.858 360 HA PRO 49 HA PRO 49 -10.361 -2.735 0.340 361 HB2 PRO 49 1HB PRO 49 -12.533 -1.094 0.062 362 HB3 PRO 49 2HB PRO 49 -11.203 -1.177 -1.099 363 HG2 PRO 49 1HG PRO 49 -13.887 -2.499 -1.196 364 HG3 PRO 49 2HG PRO 49 -12.990 -1.689 -2.495 365 HD2 PRO 49 1HD PRO 49 -13.048 -4.368 -2.279 366 HD3 PRO 49 2HD PRO 49 -11.598 -3.509 -2.840 367 H ALA 50 H ALA 50 -13.064 -4.743 0.751 368 HA ALA 50 HA ALA 50 -13.894 -3.479 3.251 369 HB1 ALA 50 3HB ALA 50 -15.632 -4.159 1.656 370 HB2 ALA 50 1HB ALA 50 -15.780 -5.013 3.193 371 HB3 ALA 50 2HB ALA 50 -15.091 -5.832 1.792 372 H ASP 51 H ASP 51 -11.596 -5.634 2.330 373 HA ASP 51 HA ASP 51 -11.960 -7.429 4.630 374 HB2 ASP 51 1HB ASP 51 -10.229 -7.677 2.160 375 HB3 ASP 51 2HB ASP 51 -10.201 -8.821 3.495 376 H ILE 52 H ILE 52 -10.656 -4.574 4.344 377 HA ILE 52 HA ILE 52 -7.907 -5.121 5.076 378 HB ILE 52 HB ILE 52 -9.345 -2.472 4.951 379 HG12 ILE 52 1HG1 ILE 52 -7.573 -3.806 2.895 380 HG13 ILE 52 2HG1 ILE 52 -9.321 -3.645 2.774 381 HG21 ILE 52 1HG2 ILE 52 -7.343 -2.403 6.335 382 HG22 ILE 52 2HG2 ILE 52 -7.100 -1.505 4.836 383 HG23 ILE 52 3HG2 ILE 52 -6.401 -3.113 5.023 384 HD11 ILE 52 3HD1 ILE 52 -9.091 -1.218 2.703 385 HD12 ILE 52 1HD1 ILE 52 -8.182 -1.995 1.408 386 HD13 ILE 52 2HD1 ILE 52 -7.340 -1.380 2.831 387 H THR 53 H THR 53 -7.192 -5.352 7.094 388 HA THR 53 HA THR 53 -8.631 -3.999 9.272 389 HB THR 53 HB THR 53 -7.915 -5.893 10.771 390 HG1 THR 53 HG1 THR 53 -7.782 -7.735 8.780 391 HG21 THR 53 3HG2 THR 53 -9.716 -7.413 10.079 392 HG22 THR 53 1HG2 THR 53 -9.801 -6.594 8.521 393 HG23 THR 53 2HG2 THR 53 -10.220 -5.725 9.997 394 H ALA 54 H ALA 54 -7.215 -3.739 11.240 395 HA ALA 54 HA ALA 54 -4.911 -2.284 10.600 396 HB1 ALA 54 3HB ALA 54 -4.500 -2.198 12.998 397 HB2 ALA 54 1HB ALA 54 -5.652 -3.508 13.255 398 HB3 ALA 54 2HB ALA 54 -6.211 -1.949 12.649 399 H SER 55 H SER 55 -5.286 -5.620 11.687 400 HA SER 55 HA SER 55 -2.601 -6.228 12.164 401 HG SER 55 HG SER 55 -5.351 -8.397 13.203 402 HB2 SER 55 1HB SER 55 -4.636 -8.163 11.052 403 HB3 SER 55 2HB SER 55 -3.287 -8.510 12.134 404 H LEU 56 H LEU 56 -4.511 -6.325 9.202 405 HA LEU 56 HA LEU 56 -2.498 -7.587 7.625 406 HG LEU 56 HG LEU 56 -5.524 -7.974 8.137 407 HB2 LEU 56 1HB LEU 56 -4.907 -5.988 6.760 408 HB3 LEU 56 2HB LEU 56 -3.952 -7.043 5.733 409 HD11 LEU 56 1HD1 LEU 56 -6.189 -8.240 5.216 410 HD12 LEU 56 2HD1 LEU 56 -6.970 -7.123 6.334 411 HD13 LEU 56 3HD1 LEU 56 -7.125 -8.865 6.572 412 HD21 LEU 56 3HD2 LEU 56 -4.144 -9.503 5.934 413 HD22 LEU 56 1HD2 LEU 56 -5.120 -10.205 7.224 414 HD23 LEU 56 2HD2 LEU 56 -3.606 -9.386 7.610 415 H LEU 57 H LEU 57 -3.314 -4.295 8.423 416 HA LEU 57 HA LEU 57 -1.730 -3.030 6.437 417 HG LEU 57 HG LEU 57 -4.510 -2.414 7.612 418 HB2 LEU 57 1HB LEU 57 -2.621 -2.069 9.159 419 HB3 LEU 57 2HB LEU 57 -1.834 -1.055 7.964 420 HD11 LEU 57 1HD1 LEU 57 -5.423 -0.148 7.749 421 HD12 LEU 57 2HD1 LEU 57 -3.811 0.480 8.098 422 HD13 LEU 57 3HD1 LEU 57 -4.601 -0.607 9.241 423 HD21 LEU 57 3HD2 LEU 57 -3.283 -2.155 5.507 424 HD22 LEU 57 1HD2 LEU 57 -3.059 -0.440 5.849 425 HD23 LEU 57 2HD2 LEU 57 -4.680 -1.081 5.577 426 H GLN 58 H GLN 58 -1.097 -4.181 9.704 427 HA GLN 58 HA GLN 58 1.523 -3.188 9.980 428 HB2 GLN 58 1HB GLN 58 0.298 -5.702 11.139 429 HB3 GLN 58 2HB GLN 58 1.803 -4.968 11.676 430 HG2 GLN 58 1HG GLN 58 0.625 -2.999 12.419 431 HG3 GLN 58 2HG GLN 58 -0.892 -3.633 11.780 432 HE21 GLN 58 2HE2 GLN 58 -0.192 -2.855 14.503 433 HE22 GLN 58 1HE2 GLN 58 -0.468 -4.248 15.485 434 H GLN 59 H GLN 59 0.246 -6.165 8.588 435 HA GLN 59 HA GLN 59 2.736 -7.369 7.996 436 HB2 GLN 59 1HB GLN 59 0.093 -7.713 6.566 437 HB3 GLN 59 2HB GLN 59 1.469 -8.801 6.464 438 HG2 GLN 59 1HG GLN 59 1.242 -9.311 8.842 439 HG3 GLN 59 2HG GLN 59 -0.140 -8.220 8.940 440 HE21 GLN 59 2HE2 GLN 59 0.002 -11.059 9.505 441 HE22 GLN 59 1HE2 GLN 59 -1.146 -11.818 8.462 442 H ALA 60 H ALA 60 0.620 -5.208 6.178 443 HA ALA 60 HA ALA 60 2.055 -5.310 3.738 444 HB1 ALA 60 3HB ALA 60 0.723 -3.386 3.084 445 HB2 ALA 60 1HB ALA 60 0.217 -3.149 4.759 446 HB3 ALA 60 2HB ALA 60 -0.284 -4.595 3.882 447 H ALA 61 H ALA 61 2.601 -3.636 6.687 448 HA ALA 61 HA ALA 61 4.213 -1.536 5.590 449 HB1 ALA 61 3HB ALA 61 4.032 -2.557 8.423 450 HB2 ALA 61 1HB ALA 61 3.060 -1.260 7.724 451 HB3 ALA 61 2HB ALA 61 4.803 -1.055 7.911 452 H GLY 62 H GLY 62 4.707 -4.814 5.949 453 HA2 GLY 62 1HA GLY 62 6.599 -6.027 5.368 454 HA3 GLY 62 2HA GLY 62 7.513 -4.526 5.329 455 H LEU 63 H LEU 63 5.699 -5.020 8.163 456 HA LEU 63 HA LEU 63 8.181 -5.462 9.646 457 HG LEU 63 HG LEU 63 6.569 -2.825 9.275 458 HB2 LEU 63 1HB LEU 63 5.448 -4.595 10.594 459 HB3 LEU 63 2HB LEU 63 6.875 -4.724 11.603 460 HD11 LEU 63 1HD1 LEU 63 6.472 -2.314 12.244 461 HD12 LEU 63 2HD1 LEU 63 5.107 -2.231 11.129 462 HD13 LEU 63 3HD1 LEU 63 6.439 -1.084 10.981 463 HD21 LEU 63 3HD2 LEU 63 8.882 -3.490 9.639 464 HD22 LEU 63 1HD2 LEU 63 8.741 -3.094 11.353 465 HD23 LEU 63 2HD2 LEU 63 8.629 -1.818 10.141 466 H ALA 64 H ALA 64 6.419 -7.525 8.229 467 HA ALA 64 HA ALA 64 6.156 -9.333 10.531 468 HB1 ALA 64 3HB ALA 64 3.928 -8.610 9.834 469 HB2 ALA 64 1HB ALA 64 4.170 -10.329 9.525 470 HB3 ALA 64 2HB ALA 64 4.255 -9.174 8.196 471 H GLU 65 H GLU 65 8.057 -10.412 10.177 472 HA GLU 65 HA GLU 65 8.430 -11.674 7.559 473 HB2 GLU 65 1HB GLU 65 10.254 -11.505 9.958 474 HB3 GLU 65 2HB GLU 65 10.629 -12.420 8.505 475 HG2 GLU 65 1HG GLU 65 10.458 -10.307 7.210 476 HG3 GLU 65 2HG GLU 65 10.261 -9.445 8.736 477 H VAL 66 H VAL 66 6.972 -13.287 7.508 478 HA VAL 66 HA VAL 66 6.251 -14.989 9.605 479 HB VAL 66 HB VAL 66 6.215 -15.624 6.647 480 HG11 VAL 66 1HG1 VAL 66 5.850 -17.600 8.002 481 HG12 VAL 66 2HG1 VAL 66 4.346 -17.113 7.221 482 HG13 VAL 66 3HG1 VAL 66 4.606 -16.760 8.930 483 HG21 VAL 66 3HG2 VAL 66 4.130 -14.281 8.364 484 HG22 VAL 66 1HG2 VAL 66 3.913 -14.776 6.685 485 HG23 VAL 66 2HG2 VAL 66 5.084 -13.521 7.090 486 H VAL 67 H VAL 67 9.028 -14.985 7.571 487 HA VAL 67 HA VAL 67 9.675 -17.749 7.800 488 HB VAL 67 HB VAL 67 11.873 -17.122 6.875 489 HG11 VAL 67 1HG1 VAL 67 10.020 -17.569 5.370 490 HG12 VAL 67 2HG1 VAL 67 11.050 -16.296 4.714 491 HG13 VAL 67 3HG1 VAL 67 9.511 -15.882 5.468 492 HG21 VAL 67 3HG2 VAL 67 12.290 -14.797 6.204 493 HG22 VAL 67 1HG2 VAL 67 12.160 -14.959 7.955 494 HG23 VAL 67 2HG2 VAL 67 10.813 -14.299 7.029 495 H ARG 68 H ARG 68 9.985 -15.151 9.998 496 HA ARG 68 HA ARG 68 12.317 -16.300 11.321 497 HE ARG 68 HE ARG 68 11.715 -12.361 13.508 498 HB2 ARG 68 1HB ARG 68 10.621 -13.984 12.255 499 HB3 ARG 68 2HB ARG 68 12.203 -14.444 12.858 500 HG2 ARG 68 1HG ARG 68 13.079 -13.959 10.536 501 HG3 ARG 68 2HG ARG 68 11.511 -13.214 10.212 502 HD2 ARG 68 1HD ARG 68 13.683 -12.351 12.070 503 HD3 ARG 68 2HD ARG 68 12.751 -11.399 10.917 504 HH11 ARG 68 1HH1 ARG 68 11.786 -9.967 10.927 505 HH12 ARG 68 2HH1 ARG 68 10.668 -8.905 11.750 506 HH21 ARG 68 1HH2 ARG 68 10.299 -10.932 14.585 507 HH22 ARG 68 2HH2 ARG 68 9.822 -9.457 13.790 508 H ASP 69 H ASP 69 8.870 -15.866 11.856 509 HA ASP 69 HA ASP 69 7.407 -16.636 13.392 510 HB2 ASP 69 1HB ASP 69 8.024 -18.865 12.721 511 HB3 ASP 69 2HB ASP 69 9.487 -18.814 13.698 512 HA PRO 70 HA PRO 70 9.474 -14.376 16.796 513 HB2 PRO 70 1HB PRO 70 6.684 -13.509 17.225 514 HB3 PRO 70 2HB PRO 70 8.145 -12.534 17.047 515 HG2 PRO 70 1HG PRO 70 6.295 -12.646 15.110 516 HG3 PRO 70 2HG PRO 70 8.027 -12.537 14.741 517 HD2 PRO 70 1HD PRO 70 6.221 -14.924 14.668 518 HD3 PRO 70 2HD PRO 70 7.506 -14.449 13.537 519 H LEU 71 H LEU 71 9.794 -15.399 18.657 520 HA LEU 71 HA LEU 71 8.367 -17.643 19.507 521 HG LEU 71 HG LEU 71 11.355 -16.755 19.244 522 HB2 LEU 71 1HB LEU 71 10.099 -15.796 21.153 523 HB3 LEU 71 2HB LEU 71 9.609 -17.411 21.621 524 HD11 LEU 71 1HD1 LEU 71 13.169 -17.699 20.556 525 HD12 LEU 71 2HD1 LEU 71 12.077 -17.942 21.919 526 HD13 LEU 71 3HD1 LEU 71 12.465 -16.308 21.380 527 HD21 LEU 71 3HD2 LEU 71 10.568 -19.395 20.472 528 HD22 LEU 71 1HD2 LEU 71 11.741 -19.177 19.173 529 HD23 LEU 71 2HD2 LEU 71 10.044 -18.776 18.907 530 H ALA 72 H ALA 72 8.163 -14.271 20.485 531 HA ALA 72 HA ALA 72 5.465 -14.708 21.453 532 HB1 ALA 72 3HB ALA 72 6.840 -15.088 23.452 533 HB2 ALA 72 1HB ALA 72 5.876 -13.618 23.603 534 HB3 ALA 72 2HB ALA 72 7.596 -13.510 23.229 535 H PHE 73 H PHE 73 4.426 -12.571 21.966 536 HA PHE 73 HA PHE 73 5.280 -10.594 20.011 537 HD1 PHE 73 HD1 PHE 73 3.248 -10.044 18.206 538 HD2 PHE 73 HD2 PHE 73 1.893 -12.758 21.188 539 HE1 PHE 73 HE1 PHE 73 2.140 -11.390 16.471 540 HE2 PHE 73 HE2 PHE 73 0.784 -14.112 19.459 541 HZ PHE 73 HZ PHE 73 0.907 -13.428 17.097 542 HB2 PHE 73 1HB PHE 73 2.855 -10.713 21.817 543 HB3 PHE 73 2HB PHE 73 3.154 -9.442 20.636 544 H LEU 74 H LEU 74 6.508 -11.253 22.761 545 HA LEU 74 HA LEU 74 6.806 -8.470 23.645 546 HG LEU 74 HG LEU 74 4.389 -10.118 24.681 547 HB2 LEU 74 1HB LEU 74 6.620 -10.920 25.407 548 HB3 LEU 74 2HB LEU 74 6.995 -9.302 25.966 549 HD11 LEU 74 1HD1 LEU 74 5.059 -9.582 27.572 550 HD12 LEU 74 2HD1 LEU 74 4.668 -11.152 26.869 551 HD13 LEU 74 3HD1 LEU 74 3.446 -9.881 26.926 552 HD21 LEU 74 3HD2 LEU 74 3.609 -7.929 25.424 553 HD22 LEU 74 1HD2 LEU 74 4.964 -7.776 24.305 554 HD23 LEU 74 2HD2 LEU 74 5.222 -7.557 26.036 555 H ASP 75 H ASP 75 8.843 -7.823 23.948 556 HA ASP 75 HA ASP 75 11.088 -7.765 23.941 557 HB2 ASP 75 1HB ASP 75 10.511 -10.257 25.412 558 HB3 ASP 75 2HB ASP 75 12.156 -10.077 24.810 559 H GLU 76 H GLU 76 10.747 -7.739 21.598 560 HA GLU 76 HA GLU 76 12.597 -9.710 20.467 561 HB2 GLU 76 1HB GLU 76 10.340 -10.307 19.655 562 HB3 GLU 76 2HB GLU 76 10.124 -8.669 19.054 563 HG2 GLU 76 1HG GLU 76 12.028 -9.008 17.525 564 HG3 GLU 76 2HG GLU 76 12.162 -10.669 18.095 565 HA PRO 77 HA PRO 77 14.680 -5.899 19.565 566 HB2 PRO 77 1HB PRO 77 16.375 -7.503 17.775 567 HB3 PRO 77 2HB PRO 77 16.809 -6.625 19.244 568 HG2 PRO 77 1HG PRO 77 16.745 -9.304 19.185 569 HG3 PRO 77 2HG PRO 77 16.255 -8.393 20.626 570 HD2 PRO 77 1HD PRO 77 14.541 -9.655 18.511 571 HD3 PRO 77 2HD PRO 77 14.350 -9.683 20.278 572 H GLU 78 H GLU 78 12.417 -5.886 18.184 573 HA GLU 78 HA GLU 78 11.470 -4.766 16.471 574 HB2 GLU 78 1HB GLU 78 14.321 -4.234 15.629 575 HB3 GLU 78 2HB GLU 78 12.904 -3.460 14.928 576 HG2 GLU 78 1HG GLU 78 12.352 -2.470 17.071 577 HG3 GLU 78 2HG GLU 78 13.722 -3.286 17.820 578 H ALA 79 H ALA 79 14.293 -6.172 14.795 579 HA ALA 79 HA ALA 79 12.391 -7.388 12.895 580 HB1 ALA 79 3HB ALA 79 14.195 -7.310 11.255 581 HB2 ALA 79 1HB ALA 79 15.285 -6.642 12.469 582 HB3 ALA 79 2HB ALA 79 13.892 -5.707 11.925 583 H GLY 80 H GLY 80 13.156 -8.577 15.428 584 HA2 GLY 80 1HA GLY 80 13.639 -10.720 16.163 585 HA3 GLY 80 2HA GLY 80 14.021 -11.160 14.501 586 H ALA 81 H ALA 81 16.087 -10.227 13.651 587 HA ALA 81 HA ALA 81 18.162 -10.222 15.727 588 HB1 ALA 81 3HB ALA 81 19.747 -10.553 13.880 589 HB2 ALA 81 1HB ALA 81 18.414 -10.489 12.727 590 HB3 ALA 81 2HB ALA 81 18.507 -11.806 13.895 591 H GLY 82 H GLY 82 17.902 -8.137 16.494 592 HA2 GLY 82 1HA GLY 82 17.546 -5.960 14.614 593 HA3 GLY 82 2HA GLY 82 17.461 -5.854 16.364 594 H ALA 83 H ALA 83 19.912 -6.620 13.875 595 HA ALA 83 HA ALA 83 22.006 -5.350 15.362 596 HB1 ALA 83 3HB ALA 83 22.493 -7.116 13.732 597 HB2 ALA 83 1HB ALA 83 23.346 -5.625 13.333 598 HB3 ALA 83 2HB ALA 83 21.901 -6.082 12.432 599 H ARG 84 H ARG 84 19.663 -4.424 12.999 600 HA ARG 84 HA ARG 84 20.470 -1.611 13.332 601 HE ARG 84 HE ARG 84 17.022 -2.981 8.408 602 HB2 ARG 84 1HB ARG 84 19.765 -1.139 11.085 603 HB3 ARG 84 2HB ARG 84 20.844 -2.524 11.005 604 HG2 ARG 84 1HG ARG 84 18.859 -4.004 10.909 605 HG3 ARG 84 2HG ARG 84 17.839 -2.565 10.847 606 HD2 ARG 84 1HD ARG 84 19.122 -1.862 8.812 607 HD3 ARG 84 2HD ARG 84 19.905 -3.441 8.838 608 HH11 ARG 84 1HH1 ARG 84 19.867 -5.008 8.127 609 HH12 ARG 84 2HH1 ARG 84 19.102 -6.155 7.065 610 HH21 ARG 84 1HH2 ARG 84 16.025 -4.441 6.980 611 HH22 ARG 84 2HH2 ARG 84 16.910 -5.828 6.401 612 HA PRO 85 HA PRO 85 16.294 -0.801 14.725 613 HB2 PRO 85 1HB PRO 85 15.410 1.200 13.054 614 HB3 PRO 85 2HB PRO 85 16.456 1.458 14.454 615 HG2 PRO 85 1HG PRO 85 17.183 1.226 11.562 616 HG3 PRO 85 2HG PRO 85 17.810 2.341 12.791 617 HD2 PRO 85 1HD PRO 85 19.198 0.179 12.028 618 HD3 PRO 85 2HD PRO 85 19.208 0.737 13.714 619 H ALA 86 H ALA 86 13.973 -0.690 13.999 620 HA ALA 86 HA ALA 86 13.326 -2.916 12.439 621 HB1 ALA 86 3HB ALA 86 11.866 -1.986 14.173 622 HB2 ALA 86 1HB ALA 86 11.017 -2.198 12.642 623 HB3 ALA 86 2HB ALA 86 11.542 -0.591 13.143 624 H ASN 87 H ASN 87 13.831 0.388 11.523 625 HA ASN 87 HA ASN 87 13.924 1.448 9.523 626 HB2 ASN 87 1HB ASN 87 14.070 -1.408 8.632 627 HB3 ASN 87 2HB ASN 87 13.850 -0.145 7.428 628 HD21 ASN 87 2HD2 ASN 87 15.834 -0.512 6.483 629 HD22 ASN 87 1HD2 ASN 87 17.322 -0.081 7.259 630 H ALA 88 H ALA 88 11.532 1.441 10.757 631 HA ALA 88 HA ALA 88 9.318 0.577 9.290 632 HB1 ALA 88 3HB ALA 88 9.550 3.047 11.007 633 HB2 ALA 88 1HB ALA 88 9.191 1.421 11.587 634 HB3 ALA 88 2HB ALA 88 8.052 2.249 10.525 635 HA PRO 89 HA PRO 89 9.324 3.211 5.720 636 HB2 PRO 89 1HB PRO 89 6.683 3.077 5.090 637 HB3 PRO 89 2HB PRO 89 7.818 1.758 4.782 638 HG2 PRO 89 1HG PRO 89 5.864 2.096 7.023 639 HG3 PRO 89 2HG PRO 89 6.258 0.641 6.088 640 HD2 PRO 89 1HD PRO 89 7.259 1.106 8.563 641 HD3 PRO 89 2HD PRO 89 8.153 0.208 7.321 642 H GLU 90 H GLU 90 8.352 5.197 4.904 643 HA GLU 90 HA GLU 90 7.665 6.995 7.094 644 HB2 GLU 90 1HB GLU 90 8.333 7.548 4.198 645 HB3 GLU 90 2HB GLU 90 8.031 8.778 5.415 646 HG2 GLU 90 1HG GLU 90 9.986 8.144 6.635 647 HG3 GLU 90 2HG GLU 90 10.243 6.749 5.587 648 H VAL 91 H VAL 91 6.411 5.904 3.969 649 HA VAL 91 HA VAL 91 3.752 6.773 4.816 650 HB VAL 91 HB VAL 91 4.563 8.612 3.462 651 HG11 VAL 91 1HG1 VAL 91 5.041 6.570 1.298 652 HG12 VAL 91 2HG1 VAL 91 6.274 7.471 2.182 653 HG13 VAL 91 3HG1 VAL 91 5.165 8.318 1.104 654 HG21 VAL 91 3HG2 VAL 91 2.207 8.068 3.261 655 HG22 VAL 91 1HG2 VAL 91 2.559 6.934 1.957 656 HG23 VAL 91 2HG2 VAL 91 2.832 8.661 1.723 657 H LEU 92 H LEU 92 2.147 5.452 4.256 658 HA LEU 92 HA LEU 92 2.795 3.135 2.551 659 HG LEU 92 HG LEU 92 -0.009 1.773 3.148 660 HB2 LEU 92 1HB LEU 92 2.361 2.508 4.871 661 HB3 LEU 92 2HB LEU 92 0.838 3.373 4.842 662 HD11 LEU 92 1HD1 LEU 92 1.218 -0.294 2.737 663 HD12 LEU 92 2HD1 LEU 92 2.575 0.318 3.681 664 HD13 LEU 92 3HD1 LEU 92 2.123 1.110 2.172 665 HD21 LEU 92 3HD2 LEU 92 -0.508 1.425 5.495 666 HD22 LEU 92 1HD2 LEU 92 1.011 0.555 5.712 667 HD23 LEU 92 2HD2 LEU 92 -0.256 -0.124 4.691 668 H LEU 93 H LEU 93 1.917 3.358 0.614 669 HA LEU 93 HA LEU 93 -0.518 4.954 0.314 670 HG LEU 93 HG LEU 93 2.384 5.748 -0.499 671 HB2 LEU 93 1HB LEU 93 1.399 3.869 -1.751 672 HB3 LEU 93 2HB LEU 93 -0.010 4.850 -2.108 673 HD11 LEU 93 1HD1 LEU 93 2.859 7.176 -2.417 674 HD12 LEU 93 2HD1 LEU 93 1.502 6.466 -3.290 675 HD13 LEU 93 3HD1 LEU 93 2.896 5.470 -2.867 676 HD21 LEU 93 3HD2 LEU 93 0.302 6.816 0.219 677 HD22 LEU 93 1HD2 LEU 93 -0.030 7.288 -1.447 678 HD23 LEU 93 2HD2 LEU 93 1.365 7.957 -0.603 679 H VAL 94 H VAL 94 -2.329 3.841 0.539 680 HA VAL 94 HA VAL 94 -2.407 1.055 -0.374 681 HB VAL 94 HB VAL 94 -4.424 2.536 1.327 682 HG11 VAL 94 1HG1 VAL 94 -4.135 -0.397 0.681 683 HG12 VAL 94 2HG1 VAL 94 -5.407 0.680 0.105 684 HG13 VAL 94 3HG1 VAL 94 -5.294 0.289 1.820 685 HG21 VAL 94 3HG2 VAL 94 -2.297 2.323 2.496 686 HG22 VAL 94 1HG2 VAL 94 -2.261 0.595 2.143 687 HG23 VAL 94 2HG2 VAL 94 -3.504 1.252 3.207 688 H GLY 95 H GLY 95 -2.914 0.970 -2.472 689 HA2 GLY 95 1HA GLY 95 -4.864 2.722 -3.676 690 HA3 GLY 95 2HA GLY 95 -4.104 1.320 -4.430 691 H THR 96 H THR 96 -6.859 2.523 -2.838 692 HA THR 96 HA THR 96 -7.798 0.162 -1.602 693 HB THR 96 HB THR 96 -9.532 2.462 -2.501 694 HG1 THR 96 HG1 THR 96 -7.355 2.596 -0.966 695 HG21 THR 96 3HG2 THR 96 -10.709 0.578 -1.504 696 HG22 THR 96 1HG2 THR 96 -10.730 1.958 -0.408 697 HG23 THR 96 2HG2 THR 96 -9.626 0.613 -0.114 698 H GLY 97 H GLY 97 -7.767 1.086 -4.874 699 HA2 GLY 97 1HA GLY 97 -8.445 -0.118 -6.726 700 HA3 GLY 97 2HA GLY 97 -9.149 -1.310 -5.643 701 H ARG 98 H ARG 98 -11.182 -0.604 -4.531 702 HA ARG 98 HA ARG 98 -12.961 0.474 -6.552 703 HE ARG 98 HE ARG 98 -15.499 -2.319 -6.639 704 HB2 ARG 98 1HB ARG 98 -13.564 -1.586 -5.335 705 HB3 ARG 98 2HB ARG 98 -13.582 -0.686 -3.827 706 HG2 ARG 98 1HG ARG 98 -15.499 0.532 -4.458 707 HG3 ARG 98 2HG ARG 98 -15.366 0.012 -6.140 708 HD2 ARG 98 1HD ARG 98 -15.895 -1.832 -3.813 709 HD3 ARG 98 2HD ARG 98 -17.144 -1.172 -4.870 710 HH11 ARG 98 1HH1 ARG 98 -16.829 -3.556 -3.633 711 HH12 ARG 98 2HH1 ARG 98 -16.895 -5.197 -4.209 712 HH21 ARG 98 1HH2 ARG 98 -15.583 -4.477 -7.367 713 HH22 ARG 98 2HH2 ARG 98 -16.174 -5.723 -6.307 714 H ARG 99 H ARG 99 -11.822 2.548 -6.301 715 HA ARG 99 HA ARG 99 -11.920 4.746 -5.862 716 HE ARG 99 HE ARG 99 -16.012 4.744 -8.560 717 HB2 ARG 99 1HB ARG 99 -14.491 3.990 -4.484 718 HB3 ARG 99 2HB ARG 99 -13.957 5.651 -4.720 719 HG2 ARG 99 1HG ARG 99 -13.943 5.295 -7.142 720 HG3 ARG 99 2HG ARG 99 -14.506 3.643 -6.896 721 HD2 ARG 99 1HD ARG 99 -16.554 4.475 -5.882 722 HD3 ARG 99 2HD ARG 99 -15.986 6.135 -6.065 723 HH11 ARG 99 1HH1 ARG 99 -18.046 6.430 -6.261 724 HH12 ARG 99 2HH1 ARG 99 -19.253 6.846 -7.442 725 HH21 ARG 99 1HH2 ARG 99 -17.589 5.299 -10.117 726 HH22 ARG 99 2HH2 ARG 99 -18.986 6.223 -9.641 727 H GLN 100 H GLN 100 -11.526 6.356 -4.305 728 HA GLN 100 HA GLN 100 -9.812 5.505 -2.249 729 HB2 GLN 100 1HB GLN 100 -9.558 7.651 -3.384 730 HB3 GLN 100 2HB GLN 100 -11.090 8.202 -2.722 731 HG2 GLN 100 1HG GLN 100 -10.190 8.169 -0.492 732 HG3 GLN 100 2HG GLN 100 -8.680 7.474 -1.078 733 HE21 GLN 100 2HE2 GLN 100 -9.135 9.946 0.380 734 HE22 GLN 100 1HE2 GLN 100 -8.497 11.212 -0.605 735 H HIS 101 H HIS 101 -10.152 5.003 -0.180 736 HA HIS 101 HA HIS 101 -12.843 5.490 0.908 737 HD1 HIS 101 HD1 HIS 101 -12.339 2.809 -1.207 738 HD2 HIS 101 HD2 HIS 101 -14.556 2.580 2.297 739 HE1 HIS 101 HE1 HIS 101 -14.476 1.638 -1.833 740 HE2 HIS 101 HE2 HIS 101 -15.892 1.744 0.250 741 HB2 HIS 101 1HB HIS 101 -10.994 3.163 1.127 742 HB3 HIS 101 2HB HIS 101 -12.027 3.534 2.505 743 H LEU 102 H LEU 102 -13.080 6.450 2.827 744 HA LEU 102 HA LEU 102 -10.706 7.608 4.048 745 HG LEU 102 HG LEU 102 -13.170 10.392 3.967 746 HB2 LEU 102 1HB LEU 102 -13.653 8.004 4.594 747 HB3 LEU 102 2HB LEU 102 -12.383 8.788 5.508 748 HD11 LEU 102 1HD1 LEU 102 -10.750 10.330 4.173 749 HD12 LEU 102 2HD1 LEU 102 -11.236 10.843 2.556 750 HD13 LEU 102 3HD1 LEU 102 -10.653 9.200 2.824 751 HD21 LEU 102 3HD2 LEU 102 -13.312 10.004 1.551 752 HD22 LEU 102 1HD2 LEU 102 -14.378 8.928 2.456 753 HD23 LEU 102 2HD2 LEU 102 -12.859 8.317 1.801 754 H LEU 103 H LEU 103 -9.686 6.041 5.151 755 HA LEU 103 HA LEU 103 -11.088 4.082 6.698 756 HG LEU 103 HG LEU 103 -8.599 4.304 4.465 757 HB2 LEU 103 1HB LEU 103 -8.143 4.723 6.803 758 HB3 LEU 103 2HB LEU 103 -8.922 3.223 7.265 759 HD11 LEU 103 1HD1 LEU 103 -7.472 1.862 5.826 760 HD12 LEU 103 2HD1 LEU 103 -6.582 3.322 5.396 761 HD13 LEU 103 3HD1 LEU 103 -7.250 2.291 4.131 762 HD21 LEU 103 3HD2 LEU 103 -9.976 1.768 5.350 763 HD22 LEU 103 1HD2 LEU 103 -9.696 2.280 3.685 764 HD23 LEU 103 2HD2 LEU 103 -10.782 3.206 4.721 765 H GLY 104 H GLY 104 -10.293 3.725 9.057 766 HA2 GLY 104 1HA GLY 104 -10.804 6.292 10.412 767 HA3 GLY 104 2HA GLY 104 -11.240 4.709 11.038 768 HA PRO 105 HA PRO 105 -6.858 6.622 12.145 769 HB2 PRO 105 1HB PRO 105 -8.204 7.338 14.696 770 HB3 PRO 105 2HB PRO 105 -7.012 8.242 13.758 771 HG2 PRO 105 1HG PRO 105 -9.572 8.964 13.754 772 HG3 PRO 105 2HG PRO 105 -8.598 9.055 12.275 773 HD2 PRO 105 1HD PRO 105 -10.653 7.037 13.074 774 HD3 PRO 105 2HD PRO 105 -10.317 7.736 11.477 775 H GLU 106 H GLU 106 -9.233 4.878 14.108 776 HA GLU 106 HA GLU 106 -7.407 3.890 16.003 777 HB2 GLU 106 1HB GLU 106 -10.095 2.812 15.162 778 HB3 GLU 106 2HB GLU 106 -9.193 2.253 16.565 779 HG2 GLU 106 1HG GLU 106 -10.308 5.008 16.106 780 HG3 GLU 106 2HG GLU 106 -10.862 3.813 17.277 781 H GLN 107 H GLN 107 -8.237 2.743 12.809 782 HA GLN 107 HA GLN 107 -6.981 0.173 13.318 783 HB2 GLN 107 1HB GLN 107 -8.294 1.313 10.853 784 HB3 GLN 107 2HB GLN 107 -7.526 -0.270 10.899 785 HG2 GLN 107 1HG GLN 107 -9.071 -0.856 12.783 786 HG3 GLN 107 2HG GLN 107 -9.919 0.654 12.461 787 HE21 GLN 107 2HE2 GLN 107 -9.509 0.445 9.571 788 HE22 GLN 107 1HE2 GLN 107 -10.622 -0.761 9.027 789 H VAL 108 H VAL 108 -5.962 3.239 12.423 790 HA VAL 108 HA VAL 108 -3.555 2.097 11.166 791 HB VAL 108 HB VAL 108 -3.150 4.314 10.145 792 HG11 VAL 108 1HG1 VAL 108 -5.836 3.107 9.492 793 HG12 VAL 108 2HG1 VAL 108 -4.275 2.576 8.866 794 HG13 VAL 108 3HG1 VAL 108 -4.902 4.169 8.439 795 HG21 VAL 108 3HG2 VAL 108 -4.951 5.976 10.095 796 HG22 VAL 108 1HG2 VAL 108 -4.360 5.707 11.735 797 HG23 VAL 108 2HG2 VAL 108 -5.888 4.991 11.219 798 H ARG 109 H ARG 109 -4.598 3.047 14.035 799 HA ARG 109 HA ARG 109 -2.917 4.987 15.031 800 HE ARG 109 HE ARG 109 -6.715 6.310 17.138 801 HB2 ARG 109 1HB ARG 109 -4.143 2.572 16.334 802 HB3 ARG 109 2HB ARG 109 -3.180 3.725 17.234 803 HG2 ARG 109 1HG ARG 109 -5.687 4.374 15.709 804 HG3 ARG 109 2HG ARG 109 -5.576 4.138 17.454 805 HD2 ARG 109 1HD ARG 109 -3.993 6.023 17.577 806 HD3 ARG 109 2HD ARG 109 -4.187 6.277 15.844 807 HH11 ARG 109 1HH1 ARG 109 -3.807 8.241 16.722 808 HH12 ARG 109 2HH1 ARG 109 -4.640 9.757 16.937 809 HH21 ARG 109 1HH2 ARG 109 -7.795 8.322 17.417 810 HH22 ARG 109 2HH2 ARG 109 -6.882 9.801 17.324 811 HA PRO 110 HA PRO 110 0.234 1.400 16.329 812 HB2 PRO 110 1HB PRO 110 -0.247 -0.337 13.954 813 HB3 PRO 110 2HB PRO 110 0.198 -0.785 15.605 814 HG2 PRO 110 1HG PRO 110 -2.289 -1.133 14.746 815 HG3 PRO 110 2HG PRO 110 -1.974 -0.554 16.393 816 HD2 PRO 110 1HD PRO 110 -2.894 0.962 13.993 817 HD3 PRO 110 2HD PRO 110 -3.352 1.158 15.696 818 H LEU 111 H LEU 111 -0.489 2.034 12.910 819 HA LEU 111 HA LEU 111 2.296 2.091 12.197 820 HG LEU 111 HG LEU 111 -0.079 0.432 11.054 821 HB2 LEU 111 1HB LEU 111 -0.170 2.839 10.628 822 HB3 LEU 111 2HB LEU 111 1.455 2.796 9.968 823 HD11 LEU 111 1HD1 LEU 111 -0.905 1.189 8.900 824 HD12 LEU 111 2HD1 LEU 111 -0.047 -0.343 8.737 825 HD13 LEU 111 3HD1 LEU 111 0.732 1.161 8.246 826 HD21 LEU 111 3HD2 LEU 111 2.291 0.195 11.513 827 HD22 LEU 111 1HD2 LEU 111 2.676 0.585 9.836 828 HD23 LEU 111 2HD2 LEU 111 1.807 -0.902 10.218 829 H LEU 112 H LEU 112 -0.275 4.502 12.655 830 HA LEU 112 HA LEU 112 1.227 6.761 11.934 831 HG LEU 112 HG LEU 112 -1.786 6.046 11.640 832 HB2 LEU 112 1HB LEU 112 -1.029 6.477 13.916 833 HB3 LEU 112 2HB LEU 112 -0.357 8.019 13.424 834 HD11 LEU 112 1HD1 LEU 112 -2.567 8.787 12.625 835 HD12 LEU 112 2HD1 LEU 112 -3.262 7.256 13.157 836 HD13 LEU 112 3HD1 LEU 112 -3.484 7.794 11.492 837 HD21 LEU 112 3HD2 LEU 112 -0.002 7.192 10.431 838 HD22 LEU 112 1HD2 LEU 112 -0.612 8.750 10.993 839 HD23 LEU 112 2HD2 LEU 112 -1.589 7.759 9.908 840 H ALA 113 H ALA 113 0.967 4.998 14.963 841 HA ALA 113 HA ALA 113 2.405 6.796 16.587 842 HB1 ALA 113 3HB ALA 113 2.674 4.911 18.116 843 HB2 ALA 113 1HB ALA 113 2.146 3.802 16.851 844 HB3 ALA 113 2HB ALA 113 1.025 5.000 17.500 845 H MET 114 H MET 114 3.417 4.360 14.313 846 HA MET 114 HA MET 114 6.182 4.411 15.167 847 HB2 MET 114 1HB MET 114 4.879 3.156 12.742 848 HB3 MET 114 2HB MET 114 6.555 2.929 13.218 849 HG2 MET 114 1HG MET 114 5.866 1.834 15.257 850 HG3 MET 114 2HG MET 114 4.172 2.142 14.878 851 HE1 MET 114 3HE MET 114 4.382 -1.720 14.415 852 HE2 MET 114 1HE MET 114 3.533 -0.384 15.192 853 HE3 MET 114 2HE MET 114 5.201 -0.744 15.636 854 H GLY 115 H GLY 115 4.167 6.264 13.174 855 HA2 GLY 115 1HA GLY 115 4.941 8.353 12.290 856 HA3 GLY 115 2HA GLY 115 6.522 7.623 12.051 857 H VAL 116 H VAL 116 4.090 5.508 11.148 858 HA VAL 116 HA VAL 116 4.758 5.876 8.349 859 HB VAL 116 HB VAL 116 2.934 3.806 9.585 860 HG11 VAL 116 1HG1 VAL 116 3.389 2.539 7.532 861 HG12 VAL 116 2HG1 VAL 116 4.331 3.896 6.915 862 HG13 VAL 116 3HG1 VAL 116 2.600 4.081 7.199 863 HG21 VAL 116 3HG2 VAL 116 5.148 3.635 10.573 864 HG22 VAL 116 1HG2 VAL 116 5.883 3.623 8.970 865 HG23 VAL 116 2HG2 VAL 116 4.858 2.281 9.480 866 H GLY 117 H GLY 117 3.662 7.422 7.310 867 HA2 GLY 117 1HA GLY 117 0.966 8.145 8.002 868 HA3 GLY 117 2HA GLY 117 1.902 8.773 6.652 869 H VAL 118 H VAL 118 -0.621 6.742 7.581 870 HA VAL 118 HA VAL 118 -0.525 5.070 5.212 871 HB VAL 118 HB VAL 118 -2.703 5.247 7.303 872 HG11 VAL 118 1HG1 VAL 118 -2.087 3.133 5.242 873 HG12 VAL 118 2HG1 VAL 118 -3.454 4.247 5.220 874 HG13 VAL 118 3HG1 VAL 118 -3.336 3.021 6.483 875 HG21 VAL 118 3HG2 VAL 118 -0.372 3.340 7.136 876 HG22 VAL 118 1HG2 VAL 118 -1.687 3.267 8.310 877 HG23 VAL 118 2HG2 VAL 118 -0.569 4.633 8.320 878 H GLU 119 H GLU 119 -1.150 5.899 3.347 879 HA GLU 119 HA GLU 119 -3.410 7.790 3.314 880 HB2 GLU 119 1HB GLU 119 -1.037 7.510 1.470 881 HB3 GLU 119 2HB GLU 119 -2.450 8.473 1.065 882 HG2 GLU 119 1HG GLU 119 -0.766 8.917 3.516 883 HG3 GLU 119 2HG GLU 119 -0.529 9.762 1.987 884 H ALA 120 H ALA 120 -5.227 6.949 2.578 885 HA ALA 120 HA ALA 120 -5.101 4.604 0.816 886 HB1 ALA 120 3HB ALA 120 -6.376 4.339 2.903 887 HB2 ALA 120 1HB ALA 120 -7.398 4.164 1.475 888 HB3 ALA 120 2HB ALA 120 -7.437 5.659 2.409 889 H MET 121 H MET 121 -5.357 4.970 -1.268 890 HA MET 121 HA MET 121 -7.257 7.013 -2.171 891 HB2 MET 121 1HB MET 121 -4.390 6.787 -3.117 892 HB3 MET 121 2HB MET 121 -5.623 7.766 -3.899 893 HG2 MET 121 1HG MET 121 -5.833 9.132 -1.906 894 HG3 MET 121 2HG MET 121 -4.641 8.131 -1.079 895 HE1 MET 121 3HE MET 121 -2.569 7.574 -3.473 896 HE2 MET 121 1HE MET 121 -2.085 7.968 -1.824 897 HE3 MET 121 2HE MET 121 -1.404 8.866 -3.181 898 H ASP 122 H ASP 122 -7.078 6.834 -4.815 899 HA ASP 122 HA ASP 122 -7.962 4.208 -5.478 900 HB2 ASP 122 1HB ASP 122 -7.227 6.584 -7.203 901 HB3 ASP 122 2HB ASP 122 -7.846 5.073 -7.858 902 H THR 123 H THR 123 -6.947 2.815 -7.103 903 HA THR 123 HA THR 123 -4.362 2.101 -6.312 904 HB THR 123 HB THR 123 -5.798 1.291 -8.848 905 HG1 THR 123 HG1 THR 123 -6.290 -0.572 -7.327 906 HG21 THR 123 3HG2 THR 123 -3.634 -0.096 -7.258 907 HG22 THR 123 1HG2 THR 123 -3.429 0.665 -8.836 908 HG23 THR 123 2HG2 THR 123 -4.458 -0.759 -8.669 909 H GLN 124 H GLN 124 -5.495 3.742 -9.265 910 HA GLN 124 HA GLN 124 -2.949 3.993 -10.457 911 HB2 GLN 124 1HB GLN 124 -5.010 4.285 -11.734 912 HB3 GLN 124 2HB GLN 124 -5.411 5.719 -10.797 913 HG2 GLN 124 1HG GLN 124 -3.449 6.859 -11.682 914 HG3 GLN 124 2HG GLN 124 -3.021 5.419 -12.602 915 HE21 GLN 124 2HE2 GLN 124 -3.641 8.139 -13.484 916 HE22 GLN 124 1HE2 GLN 124 -4.943 7.986 -14.617 917 H ALA 125 H ALA 125 -4.749 6.090 -8.258 918 HA ALA 125 HA ALA 125 -3.015 8.311 -8.377 919 HB1 ALA 125 3HB ALA 125 -4.124 9.057 -6.341 920 HB2 ALA 125 1HB ALA 125 -4.830 7.456 -6.125 921 HB3 ALA 125 2HB ALA 125 -5.299 8.447 -7.506 922 H ALA 126 H ALA 126 -3.143 5.499 -6.243 923 HA ALA 126 HA ALA 126 -1.007 6.279 -4.559 924 HB1 ALA 126 3HB ALA 126 -2.630 4.572 -3.911 925 HB2 ALA 126 1HB ALA 126 -0.982 3.948 -3.830 926 HB3 ALA 126 2HB ALA 126 -2.025 3.509 -5.182 927 H ALA 127 H ALA 127 -1.178 4.364 -7.521 928 HA ALA 127 HA ALA 127 1.492 3.477 -7.539 929 HB1 ALA 127 3HB ALA 127 -0.275 2.472 -8.913 930 HB2 ALA 127 1HB ALA 127 1.124 2.942 -9.880 931 HB3 ALA 127 2HB ALA 127 -0.333 3.936 -9.896 932 H ARG 128 H ARG 128 -0.036 6.344 -8.986 933 HA ARG 128 HA ARG 128 2.243 7.276 -10.357 934 HE ARG 128 HE ARG 128 -1.634 10.143 -10.672 935 HB2 ARG 128 1HB ARG 128 -0.143 8.098 -10.633 936 HB3 ARG 128 2HB ARG 128 0.097 9.033 -9.162 937 HG2 ARG 128 1HG ARG 128 2.138 10.023 -10.362 938 HG3 ARG 128 2HG ARG 128 1.424 9.355 -11.828 939 HD2 ARG 128 1HD ARG 128 0.254 11.412 -9.971 940 HD3 ARG 128 2HD ARG 128 0.714 11.620 -11.659 941 HH11 ARG 128 1HH1 ARG 128 0.144 11.616 -13.295 942 HH12 ARG 128 2HH1 ARG 128 -1.184 11.561 -14.410 943 HH21 ARG 128 1HH2 ARG 128 -3.405 10.092 -12.103 944 HH22 ARG 128 2HH2 ARG 128 -3.223 10.724 -13.723 945 H THR 129 H THR 129 0.958 8.079 -7.156 946 HA THR 129 HA THR 129 2.951 9.920 -6.427 947 HB THR 129 HB THR 129 1.397 8.142 -4.538 948 HG1 THR 129 HG1 THR 129 -0.173 9.085 -5.771 949 HG21 THR 129 3HG2 THR 129 3.164 9.476 -3.490 950 HG22 THR 129 1HG2 THR 129 1.572 10.073 -3.025 951 HG23 THR 129 2HG2 THR 129 2.517 10.935 -4.239 952 H TYR 130 H TYR 130 2.702 6.417 -6.052 953 HA TYR 130 HA TYR 130 5.006 6.027 -4.488 954 HD1 TYR 130 HD1 TYR 130 5.619 3.697 -3.350 955 HD2 TYR 130 HD2 TYR 130 4.945 2.659 -7.419 956 HE1 TYR 130 HE1 TYR 130 7.347 1.953 -3.186 957 HE2 TYR 130 HE2 TYR 130 6.670 0.917 -7.268 958 HH TYR 130 HH TYR 130 8.563 0.317 -5.972 959 HB2 TYR 130 1HB TYR 130 3.419 4.246 -4.668 960 HB3 TYR 130 2HB TYR 130 3.556 4.218 -6.422 961 H ASN 131 H ASN 131 4.530 6.064 -8.001 962 HA ASN 131 HA ASN 131 7.065 5.276 -8.819 963 HB2 ASN 131 1HB ASN 131 5.111 5.636 -10.330 964 HB3 ASN 131 2HB ASN 131 5.333 7.373 -10.152 965 HD21 ASN 131 2HD2 ASN 131 5.831 7.846 -12.225 966 HD22 ASN 131 1HD2 ASN 131 7.259 7.278 -13.035 967 H ILE 132 H ILE 132 5.873 8.522 -8.069 968 HA ILE 132 HA ILE 132 8.210 9.951 -8.676 969 HB ILE 132 HB ILE 132 6.111 10.624 -6.602 970 HG12 ILE 132 1HG1 ILE 132 6.304 11.425 -9.518 971 HG13 ILE 132 2HG1 ILE 132 5.185 10.230 -8.867 972 HG21 ILE 132 1HG2 ILE 132 8.139 11.939 -6.319 973 HG22 ILE 132 2HG2 ILE 132 6.833 12.947 -6.943 974 HG23 ILE 132 3HG2 ILE 132 8.108 12.385 -8.025 975 HD11 ILE 132 3HD1 ILE 132 4.095 12.370 -9.252 976 HD12 ILE 132 1HD1 ILE 132 5.236 13.156 -8.159 977 HD13 ILE 132 2HD1 ILE 132 4.101 11.956 -7.538 978 H LEU 133 H LEU 133 7.045 8.700 -5.552 979 HA LEU 133 HA LEU 133 9.289 9.657 -4.092 980 HG LEU 133 HG LEU 133 6.219 9.788 -3.680 981 HB2 LEU 133 1HB LEU 133 7.239 7.565 -3.373 982 HB3 LEU 133 2HB LEU 133 8.399 8.256 -2.255 983 HD11 LEU 133 1HD1 LEU 133 5.196 9.958 -1.471 984 HD12 LEU 133 2HD1 LEU 133 6.466 8.933 -0.800 985 HD13 LEU 133 3HD1 LEU 133 5.337 8.277 -1.986 986 HD21 LEU 133 3HD2 LEU 133 8.187 10.660 -1.566 987 HD22 LEU 133 1HD2 LEU 133 6.858 11.630 -2.202 988 HD23 LEU 133 2HD2 LEU 133 8.190 11.159 -3.256 989 H MET 134 H MET 134 8.563 6.627 -5.704 990 HA MET 134 HA MET 134 10.665 5.102 -4.570 991 HB2 MET 134 1HB MET 134 8.816 4.036 -5.753 992 HB3 MET 134 2HB MET 134 9.289 4.827 -7.251 993 HG2 MET 134 1HG MET 134 11.424 3.595 -7.187 994 HG3 MET 134 2HG MET 134 10.869 2.760 -5.738 995 HE1 MET 134 3HE MET 134 10.164 3.401 -9.557 996 HE2 MET 134 1HE MET 134 8.617 3.773 -8.795 997 HE3 MET 134 2HE MET 134 8.771 2.355 -9.830 998 H ALA 135 H ALA 135 10.434 7.082 -7.496 999 HA ALA 135 HA ALA 135 13.085 6.615 -8.381 1000 HB1 ALA 135 3HB ALA 135 11.298 8.984 -8.927 1001 HB2 ALA 135 1HB ALA 135 11.322 7.481 -9.851 1002 HB3 ALA 135 2HB ALA 135 12.738 8.533 -9.840 1003 H GLU 136 H GLU 136 11.605 9.068 -6.323 1004 HA GLU 136 HA GLU 136 13.884 10.660 -5.912 1005 HB2 GLU 136 1HB GLU 136 11.575 11.333 -5.319 1006 HB3 GLU 136 2HB GLU 136 11.572 10.143 -4.028 1007 HG2 GLU 136 1HG GLU 136 11.962 12.374 -3.174 1008 HG3 GLU 136 2HG GLU 136 13.363 11.339 -2.902 1009 H GLY 137 H GLY 137 12.710 7.749 -4.334 1010 HA2 GLY 137 1HA GLY 137 14.170 6.113 -3.433 1011 HA3 GLY 137 2HA GLY 137 15.388 7.360 -3.210 1012 H ARG 138 H ARG 138 12.012 7.553 -2.226 1013 HA ARG 138 HA ARG 138 12.940 7.932 0.533 1014 HE ARG 138 HE ARG 138 10.124 10.761 3.321 1015 HB2 ARG 138 1HB ARG 138 11.519 9.669 -0.726 1016 HB3 ARG 138 2HB ARG 138 10.181 8.547 -0.517 1017 HG2 ARG 138 1HG ARG 138 10.347 8.705 1.869 1018 HG3 ARG 138 2HG ARG 138 11.813 9.679 1.742 1019 HD2 ARG 138 1HD ARG 138 10.527 11.427 0.590 1020 HD3 ARG 138 2HD ARG 138 9.065 10.460 0.782 1021 HH11 ARG 138 1HH1 ARG 138 9.046 12.908 0.774 1022 HH12 ARG 138 2HH1 ARG 138 8.411 14.108 1.862 1023 HH21 ARG 138 1HH2 ARG 138 9.317 12.347 4.771 1024 HH22 ARG 138 2HH2 ARG 138 8.549 13.775 4.139 1025 H ARG 139 H ARG 139 11.479 7.028 2.284 1026 HA ARG 139 HA ARG 139 11.142 4.223 1.700 1027 HE ARG 139 HE ARG 139 11.886 3.173 6.366 1028 HB2 ARG 139 1HB ARG 139 10.534 5.668 4.283 1029 HB3 ARG 139 2HB ARG 139 10.755 3.936 4.070 1030 HG2 ARG 139 1HG ARG 139 13.097 4.378 3.377 1031 HG3 ARG 139 2HG ARG 139 12.844 6.079 3.763 1032 HD2 ARG 139 1HD ARG 139 13.925 5.032 5.624 1033 HD3 ARG 139 2HD ARG 139 12.264 5.405 6.082 1034 HH11 ARG 139 1HH1 ARG 139 14.765 3.576 4.410 1035 HH12 ARG 139 2HH1 ARG 139 15.137 1.874 4.356 1036 HH21 ARG 139 1HH2 ARG 139 12.389 0.926 6.323 1037 HH22 ARG 139 2HH2 ARG 139 13.802 0.380 5.456 1038 H VAL 140 H VAL 140 9.442 4.491 0.151 1039 HA VAL 140 HA VAL 140 6.793 4.879 1.373 1040 HB VAL 140 HB VAL 140 7.164 6.448 -0.430 1041 HG11 VAL 140 1HG1 VAL 140 7.778 4.053 -2.155 1042 HG12 VAL 140 2HG1 VAL 140 8.925 5.286 -1.628 1043 HG13 VAL 140 3HG1 VAL 140 7.614 5.712 -2.730 1044 HG21 VAL 140 3HG2 VAL 140 4.913 5.537 -0.235 1045 HG22 VAL 140 1HG2 VAL 140 5.337 4.220 -1.328 1046 HG23 VAL 140 2HG2 VAL 140 5.303 5.881 -1.920 1047 H VAL 141 H VAL 141 5.428 3.202 1.457 1048 HA VAL 141 HA VAL 141 6.103 0.783 -0.095 1049 HB VAL 141 HB VAL 141 4.511 0.887 2.477 1050 HG11 VAL 141 1HG1 VAL 141 4.777 -1.541 2.469 1051 HG12 VAL 141 2HG1 VAL 141 5.650 -1.444 0.939 1052 HG13 VAL 141 3HG1 VAL 141 3.948 -0.984 1.015 1053 HG21 VAL 141 3HG2 VAL 141 7.385 0.072 2.062 1054 HG22 VAL 141 1HG2 VAL 141 6.472 -0.115 3.560 1055 HG23 VAL 141 2HG2 VAL 141 6.819 1.496 2.934 1056 H VAL 142 H VAL 142 4.534 -0.009 -1.443 1057 HA VAL 142 HA VAL 142 1.959 1.418 -1.362 1058 HB VAL 142 HB VAL 142 3.350 2.073 -3.302 1059 HG11 VAL 142 1HG1 VAL 142 3.687 0.491 -5.142 1060 HG12 VAL 142 2HG1 VAL 142 3.047 -0.806 -4.133 1061 HG13 VAL 142 3HG1 VAL 142 4.548 0.005 -3.682 1062 HG21 VAL 142 3HG2 VAL 142 0.841 0.555 -3.993 1063 HG22 VAL 142 1HG2 VAL 142 1.616 1.772 -5.008 1064 HG23 VAL 142 2HG2 VAL 142 0.936 2.230 -3.447 1065 H ALA 143 H ALA 143 0.152 0.269 -1.357 1066 HA ALA 143 HA ALA 143 0.327 -2.634 -1.861 1067 HB1 ALA 143 3HB ALA 143 -1.541 -2.915 -0.305 1068 HB2 ALA 143 1HB ALA 143 -1.564 -1.177 -0.009 1069 HB3 ALA 143 2HB ALA 143 -0.171 -2.139 0.490 1070 H LEU 144 H LEU 144 -0.703 -3.225 -3.660 1071 HA LEU 144 HA LEU 144 -2.662 -1.335 -4.781 1072 HG LEU 144 HG LEU 144 0.361 -1.395 -5.524 1073 HB2 LEU 144 1HB LEU 144 -0.934 -3.383 -6.166 1074 HB3 LEU 144 2HB LEU 144 -2.109 -2.359 -6.967 1075 HD11 LEU 144 1HD1 LEU 144 1.150 -0.797 -7.766 1076 HD12 LEU 144 2HD1 LEU 144 -0.278 -1.560 -8.466 1077 HD13 LEU 144 3HD1 LEU 144 0.908 -2.535 -7.596 1078 HD21 LEU 144 3HD2 LEU 144 -0.196 0.789 -6.468 1079 HD22 LEU 144 1HD2 LEU 144 -1.468 0.214 -5.389 1080 HD23 LEU 144 2HD2 LEU 144 -1.687 0.123 -7.137 1081 H LEU 145 H LEU 145 -4.701 -1.925 -4.710 1082 HA LEU 145 HA LEU 145 -5.382 -4.770 -4.542 1083 HG LEU 145 HG LEU 145 -5.544 -2.425 -2.301 1084 HB2 LEU 145 1HB LEU 145 -7.155 -2.358 -4.132 1085 HB3 LEU 145 2HB LEU 145 -7.594 -4.028 -3.834 1086 HD11 LEU 145 1HD1 LEU 145 -7.114 -2.649 -0.445 1087 HD12 LEU 145 2HD1 LEU 145 -8.254 -3.481 -1.503 1088 HD13 LEU 145 3HD1 LEU 145 -7.844 -1.792 -1.802 1089 HD21 LEU 145 3HD2 LEU 145 -4.883 -4.762 -2.477 1090 HD22 LEU 145 1HD2 LEU 145 -6.477 -5.264 -1.911 1091 HD23 LEU 145 2HD2 LEU 145 -5.400 -4.370 -0.837 1092 HA PRO 146 HA PRO 146 -6.903 -4.448 -8.747 1093 HB2 PRO 146 1HB PRO 146 -7.677 -7.201 -8.625 1094 HB3 PRO 146 2HB PRO 146 -6.255 -6.514 -9.411 1095 HG2 PRO 146 1HG PRO 146 -6.199 -8.166 -7.192 1096 HG3 PRO 146 2HG PRO 146 -4.891 -7.074 -7.678 1097 HD2 PRO 146 1HD PRO 146 -6.991 -6.708 -5.583 1098 HD3 PRO 146 2HD PRO 146 -5.285 -6.212 -5.573 1099 H ASP 147 H ASP 147 -8.763 -3.305 -8.712 1100 HA ASP 147 HA ASP 147 -10.989 -3.808 -7.100 1101 HB2 ASP 147 1HB ASP 147 -10.709 -1.627 -8.031 1102 HB3 ASP 147 2HB ASP 147 -10.702 -2.260 -9.674 1103 H GLY 148 H GLY 148 -11.878 -5.792 -7.145 1104 HA2 GLY 148 1HA GLY 148 -13.885 -6.434 -8.840 1105 HA3 GLY 148 2HA GLY 148 -12.475 -7.112 -9.636 1106 H ASP 149 H ASP 149 -11.002 -8.306 -7.843 1107 HA ASP 149 HA ASP 149 -10.824 -10.414 -6.993 1108 HB2 ASP 149 1HB ASP 149 -11.535 -9.326 -4.938 1109 HB3 ASP 149 2HB ASP 149 -13.222 -9.448 -5.411 1110 H SER 150 H SER 150 -11.709 -10.512 -9.375 1111 HA SER 150 HA SER 150 -14.299 -11.609 -9.781 1112 HG SER 150 HG SER 150 -12.687 -9.703 -12.415 1113 HB2 SER 150 1HB SER 150 -11.926 -11.709 -11.653 1114 HB3 SER 150 2HB SER 150 -13.634 -11.798 -12.086 1115 H LEU 151 H LEU 151 -11.200 -12.919 -9.021 1116 HA LEU 151 HA LEU 151 -11.755 -15.571 -9.975 1117 HG LEU 151 HG LEU 151 -9.335 -13.642 -10.402 1118 HB2 LEU 151 1HB LEU 151 -9.595 -14.549 -8.130 1119 HB3 LEU 151 2HB LEU 151 -9.669 -16.172 -8.787 1120 HD11 LEU 151 1HD1 LEU 151 -7.373 -15.823 -9.708 1121 HD12 LEU 151 2HD1 LEU 151 -7.350 -14.167 -9.105 1122 HD13 LEU 151 3HD1 LEU 151 -7.072 -14.486 -10.817 1123 HD21 LEU 151 3HD2 LEU 151 -8.931 -15.154 -12.282 1124 HD22 LEU 151 1HD2 LEU 151 -10.557 -15.357 -11.629 1125 HD23 LEU 151 2HD2 LEU 151 -9.300 -16.537 -11.252 1126 H GLU 152 H GLU 152 -13.275 -16.739 -9.014 1127 HA GLU 152 HA GLU 152 -13.955 -16.362 -6.253 1128 HB2 GLU 152 1HB GLU 152 -14.856 -18.501 -8.186 1129 HB3 GLU 152 2HB GLU 152 -15.562 -18.182 -6.606 1130 HG2 GLU 152 1HG GLU 152 -16.005 -15.830 -7.470 1131 HG3 GLU 152 2HG GLU 152 -15.645 -16.480 -9.068 1132 H HIS 153 H HIS 153 -12.637 -17.010 -4.768 1133 HA HIS 153 HA HIS 153 -10.610 -18.950 -5.160 1134 HD1 HIS 153 HD1 HIS 153 -8.497 -16.847 -4.383 1135 HD2 HIS 153 HD2 HIS 153 -12.085 -15.245 -3.017 1136 HE1 HIS 153 HE1 HIS 153 -8.324 -14.360 -4.756 1137 HE2 HIS 153 HE2 HIS 153 -10.609 -13.457 -4.168 1138 HB2 HIS 153 1HB HIS 153 -11.589 -17.914 -2.490 1139 HB3 HIS 153 2HB HIS 153 -9.973 -18.481 -2.901 1140 H HIS 154 H HIS 154 -10.857 -21.100 -5.143 1141 HA HIS 154 HA HIS 154 -13.389 -22.236 -4.428 1142 HD1 HIS 154 HD1 HIS 154 -11.662 -26.154 -4.516 1143 HD2 HIS 154 HD2 HIS 154 -14.637 -23.896 -6.349 1144 HE1 HIS 154 HE1 HIS 154 -13.580 -27.740 -4.906 1145 HE2 HIS 154 HE2 HIS 154 -15.279 -26.394 -6.197 1146 HB2 HIS 154 1HB HIS 154 -11.805 -23.019 -6.294 1147 HB3 HIS 154 2HB HIS 154 -10.910 -23.840 -5.017 1148 H HIS 155 H HIS 155 -10.438 -21.736 -2.766 1149 HA HIS 155 HA HIS 155 -11.021 -23.606 -0.626 1150 HD1 HIS 155 HD1 HIS 155 -9.432 -24.683 1.041 1151 HD2 HIS 155 HD2 HIS 155 -7.859 -20.868 1.579 1152 HE1 HIS 155 HE1 HIS 155 -8.466 -24.666 3.360 1153 HE2 HIS 155 HE2 HIS 155 -7.360 -22.414 3.591 1154 HB2 HIS 155 1HB HIS 155 -8.690 -23.019 -1.251 1155 HB3 HIS 155 2HB HIS 155 -8.996 -21.349 -0.802 1156 H HIS 156 H HIS 156 -13.123 -21.967 -1.257 1157 HA HIS 156 HA HIS 156 -13.964 -20.627 1.034 1158 HD1 HIS 156 HD1 HIS 156 -13.808 -16.377 -0.616 1159 HD2 HIS 156 HD2 HIS 156 -13.805 -18.803 2.772 1160 HE1 HIS 156 HE1 HIS 156 -14.682 -14.939 1.260 1161 HE2 HIS 156 HE2 HIS 156 -14.804 -16.467 3.263 1162 HB2 HIS 156 1HB HIS 156 -12.003 -19.133 0.152 1163 HB3 HIS 156 2HB HIS 156 -13.119 -18.686 -1.129 1164 H HIS 157 H HIS 157 -15.917 -19.014 0.155 1165 HA HIS 157 HA HIS 157 -17.210 -20.488 -2.008 1166 HD1 HIS 157 HD1 HIS 157 -20.060 -19.155 1.471 1167 HD2 HIS 157 HD2 HIS 157 -18.042 -22.144 -0.607 1168 HE1 HIS 157 HE1 HIS 157 -20.564 -21.297 2.694 1169 HE2 HIS 157 HE2 HIS 157 -19.474 -23.112 1.325 1170 HB2 HIS 157 1HB HIS 157 -18.239 -18.291 -0.197 1171 HB3 HIS 157 2HB HIS 157 -19.175 -18.986 -1.515 1172 H HIS 158 H HIS 158 -16.615 -17.066 -1.220 1173 HA HIS 158 HA HIS 158 -15.537 -16.729 -3.911 1174 HD1 HIS 158 HD1 HIS 158 -17.716 -15.276 -6.291 1175 HD2 HIS 158 HD2 HIS 158 -15.409 -12.882 -3.793 1176 HE1 HIS 158 HE1 HIS 158 -16.749 -13.484 -7.768 1177 HE2 HIS 158 HE2 HIS 158 -15.159 -12.218 -6.279 1178 HB2 HIS 158 1HB HIS 158 -17.942 -15.924 -3.899 1179 HB3 HIS 158 2HB HIS 158 -17.458 -14.714 -2.715 Start of MODEL 17 1 HA MET 1 HA MET 1 17.960 -17.789 -3.168 2 H1 MET 1 1H MET 1 18.040 -20.138 -2.856 3 H2 MET 1 2H MET 1 18.136 -20.411 -4.527 4 H3 MET 1 3H MET 1 16.715 -19.771 -3.856 5 HB2 MET 1 1HB MET 1 20.136 -19.125 -4.791 6 HB3 MET 1 2HB MET 1 20.172 -17.438 -4.299 7 HG2 MET 1 1HG MET 1 20.163 -18.108 -1.962 8 HG3 MET 1 2HG MET 1 20.092 -19.802 -2.441 9 HE1 MET 1 3HE MET 1 22.196 -20.247 -0.855 10 HE2 MET 1 1HE MET 1 22.272 -18.534 -0.444 11 HE3 MET 1 2HE MET 1 23.722 -19.373 -0.994 12 H LYS 2 H LYS 2 19.004 -16.272 -5.202 13 HA LYS 2 HA LYS 2 16.723 -15.873 -6.813 14 HB2 LYS 2 1HB LYS 2 18.427 -14.117 -6.208 15 HB3 LYS 2 2HB LYS 2 19.507 -14.846 -7.389 16 HG2 LYS 2 1HG LYS 2 17.870 -14.401 -9.155 17 HG3 LYS 2 2HG LYS 2 16.804 -13.650 -7.968 18 HD2 LYS 2 1HD LYS 2 17.929 -11.874 -9.032 19 HD3 LYS 2 2HD LYS 2 18.715 -12.062 -7.464 20 HE2 LYS 2 1HE LYS 2 20.518 -13.334 -8.521 21 HE3 LYS 2 2HE LYS 2 19.725 -13.162 -10.087 22 HZ1 LYS 2 3HZ LYS 2 21.344 -11.496 -10.037 23 HZ2 LYS 2 1HZ LYS 2 20.990 -11.058 -8.434 24 HZ3 LYS 2 2HZ LYS 2 19.902 -10.680 -9.675 25 H LEU 3 H LEU 3 16.061 -16.969 -8.502 26 HA LEU 3 HA LEU 3 17.660 -18.985 -9.725 27 HG LEU 3 HG LEU 3 14.848 -19.003 -8.383 28 HB2 LEU 3 1HB LEU 3 14.988 -17.834 -10.537 29 HB3 LEU 3 2HB LEU 3 15.727 -19.250 -11.260 30 HD11 LEU 3 1HD1 LEU 3 13.683 -20.561 -10.685 31 HD12 LEU 3 2HD1 LEU 3 12.972 -19.137 -9.925 32 HD13 LEU 3 3HD1 LEU 3 13.140 -20.635 -9.009 33 HD21 LEU 3 3HD2 LEU 3 15.984 -21.354 -9.892 34 HD22 LEU 3 1HD2 LEU 3 15.353 -21.392 -8.245 35 HD23 LEU 3 2HD2 LEU 3 16.796 -20.448 -8.614 36 H HIS 4 H HIS 4 17.931 -19.119 -12.109 37 HA HIS 4 HA HIS 4 18.943 -16.535 -13.086 38 HD1 HIS 4 HD1 HIS 4 22.043 -16.782 -12.770 39 HD2 HIS 4 HD2 HIS 4 20.388 -20.439 -11.677 40 HE1 HIS 4 HE1 HIS 4 23.408 -17.594 -10.819 41 HE2 HIS 4 HE2 HIS 4 22.220 -19.670 -10.021 42 HB2 HIS 4 1HB HIS 4 19.604 -19.312 -14.101 43 HB3 HIS 4 2HB HIS 4 20.412 -17.809 -14.536 44 H THR 5 H THR 5 16.772 -19.145 -13.703 45 HA THR 5 HA THR 5 16.143 -18.455 -16.409 46 HB THR 5 HB THR 5 14.217 -20.038 -16.042 47 HG1 THR 5 HG1 THR 5 13.869 -19.844 -13.835 48 HG21 THR 5 3HG2 THR 5 16.959 -21.036 -15.258 49 HG22 THR 5 1HG2 THR 5 16.366 -20.827 -16.905 50 HG23 THR 5 2HG2 THR 5 15.631 -22.034 -15.850 51 H ASP 6 H ASP 6 14.950 -17.624 -13.258 52 HA ASP 6 HA ASP 6 12.726 -16.119 -14.445 53 HB2 ASP 6 1HB ASP 6 13.139 -17.085 -11.603 54 HB3 ASP 6 2HB ASP 6 11.778 -16.104 -12.138 55 HA PRO 7 HA PRO 7 15.628 -12.782 -13.681 56 HB2 PRO 7 1HB PRO 7 13.551 -11.164 -14.996 57 HB3 PRO 7 2HB PRO 7 15.234 -11.428 -15.464 58 HG2 PRO 7 1HG PRO 7 13.203 -12.509 -16.845 59 HG3 PRO 7 2HG PRO 7 14.745 -13.360 -16.631 60 HD2 PRO 7 1HD PRO 7 12.149 -13.746 -15.185 61 HD3 PRO 7 2HD PRO 7 13.287 -14.965 -15.797 62 H ALA 8 H ALA 8 15.795 -11.642 -11.892 63 HA ALA 8 HA ALA 8 13.351 -10.565 -10.653 64 HB1 ALA 8 3HB ALA 8 14.439 -12.279 -9.282 65 HB2 ALA 8 1HB ALA 8 14.506 -10.696 -8.506 66 HB3 ALA 8 2HB ALA 8 15.937 -11.349 -9.306 67 H THR 9 H THR 9 13.212 -8.491 -11.203 68 HA THR 9 HA THR 9 15.331 -6.827 -11.957 69 HB THR 9 HB THR 9 12.778 -5.772 -10.761 70 HG1 THR 9 HG1 THR 9 11.783 -6.193 -12.770 71 HG21 THR 9 3HG2 THR 9 14.458 -4.151 -11.504 72 HG22 THR 9 1HG2 THR 9 13.026 -4.090 -12.533 73 HG23 THR 9 2HG2 THR 9 14.486 -4.904 -13.098 74 H ALA 10 H ALA 10 16.767 -5.667 -10.826 75 HA ALA 10 HA ALA 10 17.078 -5.979 -8.040 76 HB1 ALA 10 3HB ALA 10 18.883 -4.359 -8.239 77 HB2 ALA 10 1HB ALA 10 18.313 -3.901 -9.844 78 HB3 ALA 10 2HB ALA 10 18.942 -5.524 -9.563 79 H LEU 11 H LEU 11 15.448 -3.568 -9.954 80 HA LEU 11 HA LEU 11 14.725 -2.136 -7.491 81 HG LEU 11 HG LEU 11 12.852 -0.091 -8.905 82 HB2 LEU 11 1HB LEU 11 15.781 -0.748 -9.246 83 HB3 LEU 11 2HB LEU 11 14.507 -1.207 -10.360 84 HD11 LEU 11 1HD1 LEU 11 13.627 1.374 -7.106 85 HD12 LEU 11 2HD1 LEU 11 15.271 0.773 -7.328 86 HD13 LEU 11 3HD1 LEU 11 14.000 -0.318 -6.776 87 HD21 LEU 11 3HD2 LEU 11 13.529 2.203 -9.416 88 HD22 LEU 11 1HD2 LEU 11 13.840 1.118 -10.772 89 HD23 LEU 11 2HD2 LEU 11 15.171 1.645 -9.742 90 H ASN 12 H ASN 12 12.814 -2.663 -6.710 91 HA ASN 12 HA ASN 12 10.921 -4.178 -8.230 92 HB2 ASN 12 1HB ASN 12 11.292 -4.518 -5.801 93 HB3 ASN 12 2HB ASN 12 10.628 -2.917 -5.495 94 HD21 ASN 12 2HD2 ASN 12 8.975 -3.708 -4.242 95 HD22 ASN 12 1HD2 ASN 12 7.627 -4.561 -4.917 96 H THR 13 H THR 13 9.681 -3.241 -9.724 97 HA THR 13 HA THR 13 8.261 -0.775 -9.084 98 HB THR 13 HB THR 13 9.911 -1.024 -11.610 99 HG1 THR 13 HG1 THR 13 10.568 -0.159 -9.086 100 HG21 THR 13 3HG2 THR 13 9.391 1.356 -11.892 101 HG22 THR 13 1HG2 THR 13 8.400 1.313 -10.433 102 HG23 THR 13 2HG2 THR 13 7.922 0.380 -11.851 103 H VAL 14 H VAL 14 6.328 -0.547 -10.193 104 HA VAL 14 HA VAL 14 5.201 -2.833 -11.484 105 HB VAL 14 HB VAL 14 4.150 0.007 -11.442 106 HG11 VAL 14 1HG1 VAL 14 2.740 -2.613 -11.935 107 HG12 VAL 14 2HG1 VAL 14 3.094 -1.375 -13.141 108 HG13 VAL 14 3HG1 VAL 14 1.965 -1.033 -11.829 109 HG21 VAL 14 3HG2 VAL 14 2.790 -0.697 -9.529 110 HG22 VAL 14 1HG2 VAL 14 4.515 -0.800 -9.174 111 HG23 VAL 14 2HG2 VAL 14 3.599 -2.263 -9.534 112 H THR 15 H THR 15 5.509 -3.397 -13.550 113 HA THR 15 HA THR 15 6.846 -1.497 -15.303 114 HB THR 15 HB THR 15 6.266 -4.182 -16.354 115 HG1 THR 15 HG1 THR 15 6.831 -5.170 -14.569 116 HG21 THR 15 3HG2 THR 15 7.784 -2.617 -17.460 117 HG22 THR 15 1HG2 THR 15 8.651 -4.061 -16.937 118 HG23 THR 15 2HG2 THR 15 8.796 -2.563 -16.017 119 H ALA 16 H ALA 16 3.770 -3.126 -14.976 120 HA ALA 16 HA ALA 16 2.714 -1.491 -17.146 121 HB1 ALA 16 3HB ALA 16 2.347 -4.485 -17.120 122 HB2 ALA 16 1HB ALA 16 3.386 -3.593 -18.230 123 HB3 ALA 16 2HB ALA 16 1.640 -3.353 -18.271 124 H TYR 17 H TYR 17 1.001 -0.504 -16.370 125 HA TYR 17 HA TYR 17 -0.721 -1.915 -14.434 126 HD1 TYR 17 HD1 TYR 17 -1.555 -0.923 -11.970 127 HD2 TYR 17 HD2 TYR 17 -2.286 2.135 -14.835 128 HE1 TYR 17 HE1 TYR 17 -3.638 -0.335 -10.803 129 HE2 TYR 17 HE2 TYR 17 -4.371 2.731 -13.679 130 HH TYR 17 HH TYR 17 -6.009 1.673 -12.176 131 HB2 TYR 17 1HB TYR 17 0.274 0.066 -13.447 132 HB3 TYR 17 2HB TYR 17 -0.212 1.046 -14.823 133 H GLY 18 H GLY 18 -2.590 -2.595 -15.298 134 HA2 GLY 18 1HA GLY 18 -3.847 -0.930 -17.367 135 HA3 GLY 18 2HA GLY 18 -3.512 -2.616 -17.728 136 H ASP 19 H ASP 19 -5.828 -2.682 -18.110 137 HA ASP 19 HA ASP 19 -7.573 -2.448 -15.803 138 HB2 ASP 19 1HB ASP 19 -8.447 -1.663 -17.909 139 HB3 ASP 19 2HB ASP 19 -8.090 -3.201 -18.687 140 H GLY 20 H GLY 20 -7.471 -4.057 -14.369 141 HA2 GLY 20 1HA GLY 20 -8.253 -6.152 -13.659 142 HA3 GLY 20 2HA GLY 20 -8.183 -6.718 -15.319 143 H TYR 21 H TYR 21 -5.292 -5.204 -14.724 144 HA TYR 21 HA TYR 21 -4.017 -7.418 -13.372 145 HD1 TYR 21 HD1 TYR 21 -1.261 -6.127 -16.317 146 HD2 TYR 21 HD2 TYR 21 -5.292 -7.010 -17.349 147 HE1 TYR 21 HE1 TYR 21 -1.034 -4.761 -18.348 148 HE2 TYR 21 HE2 TYR 21 -5.076 -5.647 -19.383 149 HH TYR 21 HH TYR 21 -2.092 -4.559 -20.565 150 HB2 TYR 21 1HB TYR 21 -2.468 -7.940 -15.219 151 HB3 TYR 21 2HB TYR 21 -4.137 -8.299 -15.642 152 H ILE 22 H ILE 22 -2.139 -6.889 -12.428 153 HA ILE 22 HA ILE 22 -0.837 -4.366 -13.221 154 HB ILE 22 HB ILE 22 -1.029 -5.471 -10.407 155 HG12 ILE 22 1HG1 ILE 22 -2.279 -2.993 -11.620 156 HG13 ILE 22 2HG1 ILE 22 -3.142 -4.464 -11.187 157 HG21 ILE 22 1HG2 ILE 22 0.095 -3.394 -9.740 158 HG22 ILE 22 2HG2 ILE 22 0.261 -2.947 -11.438 159 HG23 ILE 22 3HG2 ILE 22 1.099 -4.368 -10.814 160 HD11 ILE 22 3HD1 ILE 22 -2.577 -4.107 -8.843 161 HD12 ILE 22 1HD1 ILE 22 -3.452 -2.733 -9.517 162 HD13 ILE 22 2HD1 ILE 22 -1.707 -2.636 -9.277 163 H GLU 23 H GLU 23 1.045 -4.872 -14.158 164 HA GLU 23 HA GLU 23 2.306 -7.421 -13.483 165 HB2 GLU 23 1HB GLU 23 1.870 -6.850 -15.866 166 HB3 GLU 23 2HB GLU 23 2.968 -5.488 -15.712 167 HG2 GLU 23 1HG GLU 23 4.007 -8.168 -15.000 168 HG3 GLU 23 2HG GLU 23 3.714 -7.830 -16.703 169 H VAL 24 H VAL 24 3.830 -7.469 -12.024 170 HA VAL 24 HA VAL 24 5.677 -5.183 -11.816 171 HB VAL 24 HB VAL 24 4.758 -6.949 -9.536 172 HG11 VAL 24 1HG1 VAL 24 5.977 -5.374 -8.111 173 HG12 VAL 24 2HG1 VAL 24 6.534 -4.513 -9.546 174 HG13 VAL 24 3HG1 VAL 24 7.047 -6.177 -9.259 175 HG21 VAL 24 3HG2 VAL 24 4.074 -4.074 -10.138 176 HG22 VAL 24 1HG2 VAL 24 3.623 -4.953 -8.678 177 HG23 VAL 24 2HG2 VAL 24 2.975 -5.450 -10.242 178 H ASN 25 H ASN 25 7.555 -5.816 -12.625 179 HA ASN 25 HA ASN 25 9.473 -6.969 -13.005 180 HB2 ASN 25 1HB ASN 25 8.655 -8.575 -10.572 181 HB3 ASN 25 2HB ASN 25 10.263 -8.533 -11.289 182 HD21 ASN 25 2HD2 ASN 25 9.348 -7.822 -8.606 183 HD22 ASN 25 1HD2 ASN 25 9.832 -6.184 -8.350 184 H GLN 26 H GLN 26 7.174 -7.714 -14.417 185 HA GLN 26 HA GLN 26 6.600 -9.202 -16.008 186 HB2 GLN 26 1HB GLN 26 9.082 -10.602 -15.054 187 HB3 GLN 26 2HB GLN 26 8.032 -11.323 -16.269 188 HG2 GLN 26 1HG GLN 26 8.313 -9.308 -17.660 189 HG3 GLN 26 2HG GLN 26 9.434 -8.668 -16.462 190 HE21 GLN 26 2HE2 GLN 26 9.780 -9.377 -19.298 191 HE22 GLN 26 1HE2 GLN 26 11.112 -10.483 -19.342 192 H VAL 27 H VAL 27 6.130 -9.546 -12.894 193 HA VAL 27 HA VAL 27 4.627 -12.055 -13.210 194 HB VAL 27 HB VAL 27 5.143 -10.550 -10.637 195 HG11 VAL 27 1HG1 VAL 27 4.118 -13.339 -11.160 196 HG12 VAL 27 2HG1 VAL 27 3.164 -11.966 -10.597 197 HG13 VAL 27 3HG1 VAL 27 4.432 -12.639 -9.572 198 HG21 VAL 27 3HG2 VAL 27 6.811 -12.271 -10.128 199 HG22 VAL 27 1HG2 VAL 27 7.257 -11.339 -11.557 200 HG23 VAL 27 2HG2 VAL 27 6.589 -12.961 -11.735 201 H ARG 28 H ARG 28 2.666 -11.621 -14.017 202 HA ARG 28 HA ARG 28 1.406 -9.080 -13.505 203 HE ARG 28 HE ARG 28 -1.863 -13.257 -16.970 204 HB2 ARG 28 1HB ARG 28 -0.309 -9.800 -15.059 205 HB3 ARG 28 2HB ARG 28 1.279 -10.113 -15.736 206 HG2 ARG 28 1HG ARG 28 0.995 -12.501 -14.929 207 HG3 ARG 28 2HG ARG 28 -0.696 -12.088 -14.636 208 HD2 ARG 28 1HD ARG 28 -0.716 -11.264 -17.060 209 HD3 ARG 28 2HD ARG 28 0.799 -12.144 -17.240 210 HH11 ARG 28 1HH1 ARG 28 1.586 -13.902 -16.856 211 HH12 ARG 28 2HH1 ARG 28 1.395 -15.609 -17.111 212 HH21 ARG 28 1HH2 ARG 28 -2.110 -15.463 -17.370 213 HH22 ARG 28 2HH2 ARG 28 -0.713 -16.503 -17.434 214 H PHE 29 H PHE 29 0.305 -8.685 -11.746 215 HA PHE 29 HA PHE 29 -0.836 -10.915 -10.236 216 HD1 PHE 29 HD2 PHE 29 0.278 -11.291 -7.821 217 HD2 PHE 29 HD1 PHE 29 1.966 -7.785 -9.545 218 HE1 PHE 29 HE2 PHE 29 2.499 -11.960 -6.999 219 HE2 PHE 29 HE1 PHE 29 4.190 -8.449 -8.723 220 HZ PHE 29 HZ PHE 29 4.457 -10.537 -7.449 221 HB2 PHE 29 1HB PHE 29 -0.345 -8.029 -9.473 222 HB3 PHE 29 2HB PHE 29 -1.090 -9.221 -8.416 223 H SER 30 H SER 30 -2.930 -11.313 -10.243 224 HA SER 30 HA SER 30 -4.793 -9.244 -11.162 225 HG SER 30 HG SER 30 -5.622 -12.943 -10.331 226 HB2 SER 30 1HB SER 30 -6.389 -11.233 -11.292 227 HB3 SER 30 2HB SER 30 -5.031 -11.263 -12.419 228 H HIS 31 H HIS 31 -3.457 -9.748 -8.442 229 HA HIS 31 HA HIS 31 -5.890 -9.514 -6.842 230 HD1 HIS 31 HD1 HIS 31 -3.392 -13.192 -7.544 231 HD2 HIS 31 HD2 HIS 31 -2.084 -10.438 -4.709 232 HE1 HIS 31 HE1 HIS 31 -0.952 -13.691 -7.180 233 HE2 HIS 31 HE2 HIS 31 -0.244 -12.155 -5.312 234 HB2 HIS 31 1HB HIS 31 -4.941 -10.999 -5.093 235 HB3 HIS 31 2HB HIS 31 -5.266 -11.849 -6.596 236 H ALA 32 H ALA 32 -5.259 -8.854 -4.525 237 HA ALA 32 HA ALA 32 -3.953 -6.376 -4.664 238 HB1 ALA 32 3HB ALA 32 -4.267 -6.263 -2.272 239 HB2 ALA 32 1HB ALA 32 -4.570 -7.999 -2.203 240 HB3 ALA 32 2HB ALA 32 -5.707 -6.938 -3.033 241 H ILE 33 H ILE 33 -1.981 -5.666 -4.002 242 HA ILE 33 HA ILE 33 -0.030 -7.609 -3.001 243 HB ILE 33 HB ILE 33 1.658 -6.639 -4.664 244 HG12 ILE 33 1HG1 ILE 33 -0.904 -5.971 -6.135 245 HG13 ILE 33 2HG1 ILE 33 0.233 -4.799 -5.479 246 HG21 ILE 33 1HG2 ILE 33 1.066 -8.299 -6.372 247 HG22 ILE 33 2HG2 ILE 33 -0.532 -8.461 -5.645 248 HG23 ILE 33 3HG2 ILE 33 0.901 -8.940 -4.737 249 HD11 ILE 33 3HD1 ILE 33 0.501 -5.050 -7.875 250 HD12 ILE 33 1HD1 ILE 33 0.806 -6.775 -7.674 251 HD13 ILE 33 2HD1 ILE 33 1.944 -5.596 -7.021 252 H ALA 34 H ALA 34 1.361 -6.792 -1.597 253 HA ALA 34 HA ALA 34 1.582 -3.861 -1.369 254 HB1 ALA 34 3HB ALA 34 1.942 -4.165 1.031 255 HB2 ALA 34 1HB ALA 34 1.734 -5.906 0.847 256 HB3 ALA 34 2HB ALA 34 0.380 -4.819 0.538 257 H PHE 35 H PHE 35 3.584 -3.123 -1.772 258 HA PHE 35 HA PHE 35 5.885 -4.804 -1.223 259 HD1 PHE 35 HD1 PHE 35 3.115 -4.860 -4.221 260 HD2 PHE 35 HD2 PHE 35 6.666 -2.597 -4.839 261 HE1 PHE 35 HE1 PHE 35 1.976 -3.554 -5.964 262 HE2 PHE 35 HE2 PHE 35 5.530 -1.288 -6.583 263 HZ PHE 35 HZ PHE 35 3.183 -1.764 -7.147 264 HB2 PHE 35 1HB PHE 35 6.721 -4.624 -3.570 265 HB3 PHE 35 2HB PHE 35 5.294 -5.636 -3.395 266 H ALA 36 H ALA 36 7.929 -3.729 -1.675 267 HA ALA 36 HA ALA 36 7.756 -0.791 -1.666 268 HB1 ALA 36 3HB ALA 36 9.557 -2.450 0.103 269 HB2 ALA 36 1HB ALA 36 8.075 -1.659 0.635 270 HB3 ALA 36 2HB ALA 36 9.439 -0.691 0.075 271 HA PRO 37 HA PRO 37 10.965 -0.844 -4.735 272 HB2 PRO 37 1HB PRO 37 12.704 1.066 -3.754 273 HB3 PRO 37 2HB PRO 37 11.243 1.417 -4.682 274 HG2 PRO 37 1HG PRO 37 11.678 1.490 -1.728 275 HG3 PRO 37 2HG PRO 37 10.745 2.597 -2.755 276 HD2 PRO 37 1HD PRO 37 9.542 0.730 -1.250 277 HD3 PRO 37 2HD PRO 37 8.924 1.168 -2.856 278 H GLU 38 H GLU 38 11.957 -0.906 -1.375 279 HA GLU 38 HA GLU 38 13.999 -2.893 -2.062 280 HB2 GLU 38 1HB GLU 38 15.133 -0.782 -1.523 281 HB3 GLU 38 2HB GLU 38 14.256 -0.687 -0.003 282 HG2 GLU 38 1HG GLU 38 16.531 -1.451 0.343 283 HG3 GLU 38 2HG GLU 38 15.370 -2.702 0.783 284 H GLY 39 H GLY 39 13.017 -4.702 -1.384 285 HA2 GLY 39 1HA GLY 39 12.843 -5.656 1.089 286 HA3 GLY 39 2HA GLY 39 11.390 -4.667 1.029 287 HA PRO 40 HA PRO 40 10.215 -8.731 -0.703 288 HB2 PRO 40 1HB PRO 40 8.199 -9.303 0.945 289 HB3 PRO 40 2HB PRO 40 9.878 -9.479 1.463 290 HG2 PRO 40 1HG PRO 40 7.906 -7.348 2.121 291 HG3 PRO 40 2HG PRO 40 9.182 -8.047 3.130 292 HD2 PRO 40 1HD PRO 40 9.320 -5.625 1.707 293 HD3 PRO 40 2HD PRO 40 10.681 -6.488 2.450 294 H VAL 41 H VAL 41 8.334 -9.427 -1.847 295 HA VAL 41 HA VAL 41 6.345 -7.313 -2.376 296 HB VAL 41 HB VAL 41 7.072 -9.599 -4.224 297 HG11 VAL 41 1HG1 VAL 41 5.778 -8.351 -5.884 298 HG12 VAL 41 2HG1 VAL 41 5.379 -7.143 -4.662 299 HG13 VAL 41 3HG1 VAL 41 4.791 -8.797 -4.491 300 HG21 VAL 41 3HG2 VAL 41 7.895 -6.700 -4.379 301 HG22 VAL 41 1HG2 VAL 41 8.187 -7.917 -5.621 302 HG23 VAL 41 2HG2 VAL 41 8.956 -8.067 -4.040 303 H ALA 42 H ALA 42 4.636 -7.785 -1.110 304 HA ALA 42 HA ALA 42 4.097 -10.618 -0.569 305 HB1 ALA 42 3HB ALA 42 4.638 -9.240 1.381 306 HB2 ALA 42 1HB ALA 42 2.992 -9.868 1.462 307 HB3 ALA 42 2HB ALA 42 3.274 -8.187 1.010 308 H SER 43 H SER 43 2.479 -11.468 -1.671 309 HA SER 43 HA SER 43 0.336 -9.994 -2.784 310 HG SER 43 HG SER 43 2.059 -12.283 -3.645 311 HB2 SER 43 1HB SER 43 0.534 -12.940 -2.093 312 HB3 SER 43 2HB SER 43 -0.733 -12.216 -3.086 313 H TRP 44 H TRP 44 -1.615 -9.451 -1.943 314 HA TRP 44 HA TRP 44 -1.726 -9.595 0.982 315 HD1 TRP 44 HD1 TRP 44 -1.470 -8.330 2.568 316 HE1 TRP 44 HE1 TRP 44 -2.231 -6.600 4.321 317 HE3 TRP 44 HE3 TRP 44 -4.576 -5.518 -0.362 318 HZ2 TRP 44 HZ2 TRP 44 -3.921 -4.342 4.439 319 HZ3 TRP 44 HZ3 TRP 44 -5.722 -3.588 0.645 320 HH2 TRP 44 HH2 TRP 44 -5.401 -3.013 2.996 321 HB2 TRP 44 1HB TRP 44 -1.835 -7.451 -0.622 322 HB3 TRP 44 2HB TRP 44 -3.547 -7.848 -0.607 323 HA PRO 45 HA PRO 45 -4.994 -12.587 0.635 324 HB2 PRO 45 1HB PRO 45 -5.890 -12.454 3.204 325 HB3 PRO 45 2HB PRO 45 -4.408 -13.296 2.734 326 HG2 PRO 45 1HG PRO 45 -4.742 -10.559 3.897 327 HG3 PRO 45 2HG PRO 45 -3.553 -11.808 4.303 328 HD2 PRO 45 1HD PRO 45 -2.944 -9.717 2.719 329 HD3 PRO 45 2HD PRO 45 -2.227 -11.323 2.474 330 H VAL 46 H VAL 46 -5.422 -9.307 0.972 331 HA VAL 46 HA VAL 46 -8.289 -9.360 1.369 332 HB VAL 46 HB VAL 46 -6.500 -7.039 0.615 333 HG11 VAL 46 1HG1 VAL 46 -9.302 -7.089 1.724 334 HG12 VAL 46 2HG1 VAL 46 -8.841 -6.655 0.078 335 HG13 VAL 46 3HG1 VAL 46 -8.334 -5.644 1.432 336 HG21 VAL 46 3HG2 VAL 46 -7.478 -7.917 3.330 337 HG22 VAL 46 1HG2 VAL 46 -6.595 -6.428 2.988 338 HG23 VAL 46 2HG2 VAL 46 -5.817 -7.991 2.744 339 H GLN 47 H GLN 47 -9.164 -10.430 -0.360 340 HA GLN 47 HA GLN 47 -8.444 -9.635 -3.062 341 HB2 GLN 47 1HB GLN 47 -8.816 -12.023 -2.476 342 HB3 GLN 47 2HB GLN 47 -10.495 -11.651 -2.117 343 HG2 GLN 47 1HG GLN 47 -10.936 -11.117 -4.400 344 HG3 GLN 47 2HG GLN 47 -9.225 -11.230 -4.808 345 HE21 GLN 47 2HE2 GLN 47 -11.525 -12.677 -5.896 346 HE22 GLN 47 1HE2 GLN 47 -11.168 -14.357 -5.678 347 H ARG 48 H ARG 48 -10.794 -8.968 -0.676 348 HA ARG 48 HA ARG 48 -12.199 -7.218 -2.574 349 HE ARG 48 HE ARG 48 -14.886 -12.264 -1.352 350 HB2 ARG 48 1HB ARG 48 -13.571 -8.530 -0.225 351 HB3 ARG 48 2HB ARG 48 -14.311 -7.688 -1.581 352 HG2 ARG 48 1HG ARG 48 -13.505 -9.523 -3.066 353 HG3 ARG 48 2HG ARG 48 -12.974 -10.385 -1.620 354 HD2 ARG 48 1HD ARG 48 -15.405 -10.041 -0.813 355 HD3 ARG 48 2HD ARG 48 -15.754 -9.716 -2.510 356 HH11 ARG 48 1HH1 ARG 48 -15.799 -10.463 -4.221 357 HH12 ARG 48 2HH1 ARG 48 -16.182 -11.882 -5.138 358 HH21 ARG 48 1HH2 ARG 48 -15.421 -14.116 -2.542 359 HH22 ARG 48 2HH2 ARG 48 -16.017 -13.957 -4.177 360 HA PRO 49 HA PRO 49 -10.673 -4.202 0.261 361 HB2 PRO 49 1HB PRO 49 -12.160 -2.075 -0.544 362 HB3 PRO 49 2HB PRO 49 -10.797 -2.713 -1.470 363 HG2 PRO 49 1HG PRO 49 -13.730 -3.187 -1.849 364 HG3 PRO 49 2HG PRO 49 -12.480 -2.861 -3.066 365 HD2 PRO 49 1HD PRO 49 -13.400 -5.353 -2.574 366 HD3 PRO 49 2HD PRO 49 -11.720 -5.039 -3.052 367 H ALA 50 H ALA 50 -13.452 -5.723 0.744 368 HA ALA 50 HA ALA 50 -14.661 -3.865 2.622 369 HB1 ALA 50 3HB ALA 50 -16.114 -5.257 1.229 370 HB2 ALA 50 1HB ALA 50 -16.347 -5.603 2.943 371 HB3 ALA 50 2HB ALA 50 -15.409 -6.709 1.939 372 H ASP 51 H ASP 51 -12.069 -5.859 2.662 373 HA ASP 51 HA ASP 51 -12.291 -6.291 5.553 374 HB2 ASP 51 1HB ASP 51 -11.432 -8.253 3.456 375 HB3 ASP 51 2HB ASP 51 -10.739 -8.343 5.071 376 H ILE 52 H ILE 52 -11.194 -4.120 5.258 377 HA ILE 52 HA ILE 52 -8.283 -4.586 5.189 378 HB ILE 52 HB ILE 52 -9.754 -1.969 4.815 379 HG12 ILE 52 1HG1 ILE 52 -8.185 -3.646 2.839 380 HG13 ILE 52 2HG1 ILE 52 -9.939 -3.483 2.878 381 HG21 ILE 52 1HG2 ILE 52 -6.801 -2.586 4.706 382 HG22 ILE 52 2HG2 ILE 52 -7.628 -1.643 5.946 383 HG23 ILE 52 3HG2 ILE 52 -7.541 -1.039 4.292 384 HD11 ILE 52 3HD1 ILE 52 -8.948 -2.100 1.142 385 HD12 ILE 52 1HD1 ILE 52 -7.977 -1.262 2.354 386 HD13 ILE 52 2HD1 ILE 52 -9.734 -1.110 2.373 387 H THR 53 H THR 53 -7.624 -4.954 7.204 388 HA THR 53 HA THR 53 -8.726 -3.305 9.382 389 HB THR 53 HB THR 53 -8.003 -5.133 10.908 390 HG1 THR 53 HG1 THR 53 -7.748 -7.217 9.460 391 HG21 THR 53 3HG2 THR 53 -9.779 -6.720 10.307 392 HG22 THR 53 1HG2 THR 53 -9.882 -5.994 8.703 393 HG23 THR 53 2HG2 THR 53 -10.317 -5.050 10.128 394 H ALA 54 H ALA 54 -7.085 -3.234 11.302 395 HA ALA 54 HA ALA 54 -4.815 -1.788 10.474 396 HB1 ALA 54 3HB ALA 54 -4.169 -1.795 12.817 397 HB2 ALA 54 1HB ALA 54 -5.329 -3.081 13.150 398 HB3 ALA 54 2HB ALA 54 -5.898 -1.487 12.656 399 H SER 55 H SER 55 -5.191 -5.118 11.616 400 HA SER 55 HA SER 55 -2.489 -5.811 11.758 401 HG SER 55 HG SER 55 -5.281 -7.686 13.155 402 HB2 SER 55 1HB SER 55 -4.807 -7.633 11.061 403 HB3 SER 55 2HB SER 55 -3.257 -8.118 11.748 404 H LEU 56 H LEU 56 -4.756 -5.897 9.060 405 HA LEU 56 HA LEU 56 -2.993 -7.219 7.264 406 HG LEU 56 HG LEU 56 -5.904 -7.614 7.991 407 HB2 LEU 56 1HB LEU 56 -5.424 -5.511 6.742 408 HB3 LEU 56 2HB LEU 56 -4.596 -6.465 5.524 409 HD11 LEU 56 1HD1 LEU 56 -7.565 -6.655 6.497 410 HD12 LEU 56 2HD1 LEU 56 -7.635 -8.418 6.469 411 HD13 LEU 56 3HD1 LEU 56 -6.874 -7.544 5.140 412 HD21 LEU 56 3HD2 LEU 56 -4.058 -8.962 7.147 413 HD22 LEU 56 1HD2 LEU 56 -4.762 -8.933 5.531 414 HD23 LEU 56 2HD2 LEU 56 -5.605 -9.754 6.845 415 H LEU 57 H LEU 57 -3.628 -3.856 8.050 416 HA LEU 57 HA LEU 57 -2.076 -2.731 5.955 417 HG LEU 57 HG LEU 57 -4.777 -1.970 7.173 418 HB2 LEU 57 1HB LEU 57 -2.831 -1.628 8.663 419 HB3 LEU 57 2HB LEU 57 -2.051 -0.695 7.400 420 HD11 LEU 57 1HD1 LEU 57 -4.774 -0.136 8.772 421 HD12 LEU 57 2HD1 LEU 57 -5.624 0.321 7.296 422 HD13 LEU 57 3HD1 LEU 57 -3.988 0.910 7.591 423 HD21 LEU 57 3HD2 LEU 57 -3.621 -1.786 5.029 424 HD22 LEU 57 1HD2 LEU 57 -3.316 -0.076 5.334 425 HD23 LEU 57 2HD2 LEU 57 -4.970 -0.653 5.125 426 H GLN 58 H GLN 58 -1.354 -3.837 9.211 427 HA GLN 58 HA GLN 58 1.283 -2.888 9.405 428 HB2 GLN 58 1HB GLN 58 0.019 -5.354 10.619 429 HB3 GLN 58 2HB GLN 58 1.580 -4.696 11.091 430 HG2 GLN 58 1HG GLN 58 0.557 -2.688 11.904 431 HG3 GLN 58 2HG GLN 58 -1.012 -3.180 11.269 432 HE21 GLN 58 2HE2 GLN 58 -0.231 -2.498 13.991 433 HE22 GLN 58 1HE2 GLN 58 -0.624 -3.871 14.961 434 H GLN 59 H GLN 59 -0.030 -5.911 8.110 435 HA GLN 59 HA GLN 59 2.479 -7.025 7.386 436 HB2 GLN 59 1HB GLN 59 -0.298 -7.559 6.317 437 HB3 GLN 59 2HB GLN 59 1.120 -8.505 5.894 438 HG2 GLN 59 1HG GLN 59 1.394 -9.093 8.275 439 HG3 GLN 59 2HG GLN 59 -0.098 -8.222 8.631 440 HE21 GLN 59 2HE2 GLN 59 0.588 -11.054 8.960 441 HE22 GLN 59 1HE2 GLN 59 -0.593 -11.943 8.060 442 H ALA 60 H ALA 60 0.152 -4.972 5.742 443 HA ALA 60 HA ALA 60 1.306 -5.094 3.166 444 HB1 ALA 60 3HB ALA 60 -0.400 -2.921 4.374 445 HB2 ALA 60 1HB ALA 60 -0.996 -4.368 3.560 446 HB3 ALA 60 2HB ALA 60 -0.081 -3.161 2.656 447 H ALA 61 H ALA 61 2.209 -3.401 6.013 448 HA ALA 61 HA ALA 61 3.720 -1.346 4.677 449 HB1 ALA 61 3HB ALA 61 4.483 -0.740 6.911 450 HB2 ALA 61 1HB ALA 61 3.764 -2.211 7.567 451 HB3 ALA 61 2HB ALA 61 2.732 -0.956 6.883 452 H GLY 62 H GLY 62 4.190 -4.568 4.919 453 HA2 GLY 62 1HA GLY 62 6.053 -5.751 4.167 454 HA3 GLY 62 2HA GLY 62 7.017 -4.291 4.325 455 H LEU 63 H LEU 63 5.347 -4.608 7.128 456 HA LEU 63 HA LEU 63 7.735 -5.465 8.525 457 HG LEU 63 HG LEU 63 6.097 -2.738 8.308 458 HB2 LEU 63 1HB LEU 63 5.074 -4.562 9.632 459 HB3 LEU 63 2HB LEU 63 6.569 -4.728 10.531 460 HD11 LEU 63 1HD1 LEU 63 6.222 -2.347 11.296 461 HD12 LEU 63 2HD1 LEU 63 4.779 -2.214 10.289 462 HD13 LEU 63 3HD1 LEU 63 6.103 -1.065 10.090 463 HD21 LEU 63 3HD2 LEU 63 8.217 -1.764 9.045 464 HD22 LEU 63 1HD2 LEU 63 8.431 -3.420 8.475 465 HD23 LEU 63 2HD2 LEU 63 8.418 -3.077 10.205 466 H ALA 64 H ALA 64 6.059 -7.381 6.978 467 HA ALA 64 HA ALA 64 4.719 -9.003 8.960 468 HB1 ALA 64 3HB ALA 64 5.164 -9.523 6.026 469 HB2 ALA 64 1HB ALA 64 3.758 -8.721 6.727 470 HB3 ALA 64 2HB ALA 64 4.081 -10.416 7.092 471 H GLU 65 H GLU 65 7.779 -9.037 7.244 472 HA GLU 65 HA GLU 65 8.366 -11.657 8.456 473 HB2 GLU 65 1HB GLU 65 9.561 -10.375 5.999 474 HB3 GLU 65 2HB GLU 65 10.148 -11.866 6.719 475 HG2 GLU 65 1HG GLU 65 7.818 -12.789 6.379 476 HG3 GLU 65 2HG GLU 65 7.508 -11.362 5.388 477 H VAL 66 H VAL 66 9.132 -8.366 8.610 478 HA VAL 66 HA VAL 66 11.851 -8.857 9.549 479 HB VAL 66 HB VAL 66 12.079 -6.391 9.638 480 HG11 VAL 66 1HG1 VAL 66 12.732 -7.606 7.636 481 HG12 VAL 66 2HG1 VAL 66 12.062 -6.030 7.213 482 HG13 VAL 66 3HG1 VAL 66 11.089 -7.486 7.008 483 HG21 VAL 66 3HG2 VAL 66 9.295 -6.390 8.475 484 HG22 VAL 66 1HG2 VAL 66 10.349 -4.983 8.622 485 HG23 VAL 66 2HG2 VAL 66 9.759 -5.798 10.070 486 H VAL 67 H VAL 67 12.542 -8.487 11.602 487 HA VAL 67 HA VAL 67 10.542 -7.716 13.608 488 HB VAL 67 HB VAL 67 11.461 -9.468 15.140 489 HG11 VAL 67 1HG1 VAL 67 9.345 -9.824 13.994 490 HG12 VAL 67 2HG1 VAL 67 10.233 -11.340 14.143 491 HG13 VAL 67 3HG1 VAL 67 10.196 -10.488 12.600 492 HG21 VAL 67 3HG2 VAL 67 13.595 -9.849 14.032 493 HG22 VAL 67 1HG2 VAL 67 12.762 -10.505 12.622 494 HG23 VAL 67 2HG2 VAL 67 12.687 -11.355 14.167 495 H ARG 68 H ARG 68 11.912 -7.743 15.866 496 HA ARG 68 HA ARG 68 14.147 -5.888 15.373 497 HE ARG 68 HE ARG 68 12.614 -2.675 18.464 498 HB2 ARG 68 1HB ARG 68 12.384 -6.277 17.803 499 HB3 ARG 68 2HB ARG 68 13.730 -5.149 17.718 500 HG2 ARG 68 1HG ARG 68 12.632 -3.805 16.120 501 HG3 ARG 68 2HG ARG 68 11.402 -5.035 15.824 502 HD2 ARG 68 1HD ARG 68 10.536 -3.207 17.201 503 HD3 ARG 68 2HD ARG 68 10.536 -4.736 18.077 504 HH11 ARG 68 1HH1 ARG 68 10.339 -5.019 19.719 505 HH12 ARG 68 2HH1 ARG 68 10.784 -4.765 21.379 506 HH21 ARG 68 1HH2 ARG 68 13.190 -2.305 20.656 507 HH22 ARG 68 2HH2 ARG 68 12.398 -3.222 21.906 508 H ASP 69 H ASP 69 14.308 -8.795 15.282 509 HA ASP 69 HA ASP 69 16.009 -9.350 17.618 510 HB2 ASP 69 1HB ASP 69 14.493 -11.272 15.832 511 HB3 ASP 69 2HB ASP 69 15.584 -11.756 17.126 512 HA PRO 70 HA PRO 70 19.642 -9.819 15.144 513 HB2 PRO 70 1HB PRO 70 19.964 -12.549 16.275 514 HB3 PRO 70 2HB PRO 70 21.092 -11.189 16.278 515 HG2 PRO 70 1HG PRO 70 19.790 -11.884 18.495 516 HG3 PRO 70 2HG PRO 70 20.070 -10.177 18.099 517 HD2 PRO 70 1HD PRO 70 17.575 -11.802 17.835 518 HD3 PRO 70 2HD PRO 70 17.771 -10.110 18.332 519 H LEU 71 H LEU 71 20.447 -10.838 13.287 520 HA LEU 71 HA LEU 71 18.387 -12.271 11.816 521 HG LEU 71 HG LEU 71 19.659 -9.344 11.562 522 HB2 LEU 71 1HB LEU 71 21.066 -11.235 10.889 523 HB3 LEU 71 2HB LEU 71 19.780 -11.836 9.860 524 HD11 LEU 71 1HD1 LEU 71 21.114 -9.098 9.629 525 HD12 LEU 71 2HD1 LEU 71 19.629 -8.170 9.418 526 HD13 LEU 71 3HD1 LEU 71 19.837 -9.705 8.575 527 HD21 LEU 71 3HD2 LEU 71 17.526 -8.929 10.439 528 HD22 LEU 71 1HD2 LEU 71 17.477 -10.415 11.388 529 HD23 LEU 71 2HD2 LEU 71 17.644 -10.494 9.635 530 H ALA 72 H ALA 72 20.091 -13.555 13.946 531 HA ALA 72 HA ALA 72 20.833 -15.904 12.389 532 HB1 ALA 72 3HB ALA 72 22.904 -14.602 12.547 533 HB2 ALA 72 1HB ALA 72 23.014 -16.105 13.463 534 HB3 ALA 72 2HB ALA 72 22.753 -14.578 14.304 535 H PHE 73 H PHE 73 21.657 -17.639 14.065 536 HA PHE 73 HA PHE 73 19.566 -18.002 16.009 537 HD1 PHE 73 HD2 PHE 73 18.494 -20.552 15.447 538 HD2 PHE 73 HD1 PHE 73 22.042 -20.757 17.787 539 HE1 PHE 73 HE2 PHE 73 17.413 -22.184 16.937 540 HE2 PHE 73 HE1 PHE 73 20.968 -22.392 19.278 541 HZ PHE 73 HZ PHE 73 18.650 -23.107 18.856 542 HB2 PHE 73 1HB PHE 73 20.712 -19.804 14.586 543 HB3 PHE 73 2HB PHE 73 22.068 -19.668 15.696 544 H LEU 74 H LEU 74 22.405 -16.319 15.985 545 HA LEU 74 HA LEU 74 22.898 -16.647 18.863 546 HG LEU 74 HG LEU 74 24.503 -17.900 16.519 547 HB2 LEU 74 1HB LEU 74 24.660 -15.414 16.739 548 HB3 LEU 74 2HB LEU 74 25.086 -15.633 18.426 549 HD11 LEU 74 1HD1 LEU 74 26.916 -18.280 16.519 550 HD12 LEU 74 2HD1 LEU 74 27.146 -16.817 17.476 551 HD13 LEU 74 3HD1 LEU 74 26.510 -16.706 15.835 552 HD21 LEU 74 3HD2 LEU 74 25.493 -19.290 18.262 553 HD22 LEU 74 1HD2 LEU 74 24.079 -18.426 18.867 554 HD23 LEU 74 2HD2 LEU 74 25.699 -17.869 19.287 555 H ASP 75 H ASP 75 23.649 -14.540 19.933 556 HA ASP 75 HA ASP 75 21.726 -12.456 19.165 557 HB2 ASP 75 1HB ASP 75 23.028 -13.161 21.785 558 HB3 ASP 75 2HB ASP 75 22.290 -11.582 21.534 559 H GLU 76 H GLU 76 22.538 -10.188 19.996 560 HA GLU 76 HA GLU 76 25.318 -9.810 19.130 561 HB2 GLU 76 1HB GLU 76 23.857 -9.275 17.239 562 HB3 GLU 76 2HB GLU 76 22.936 -8.168 18.247 563 HG2 GLU 76 1HG GLU 76 24.551 -7.069 16.718 564 HG3 GLU 76 2HG GLU 76 24.777 -6.671 18.421 565 HA PRO 77 HA PRO 77 24.809 -7.558 23.013 566 HB2 PRO 77 1HB PRO 77 27.153 -8.225 24.099 567 HB3 PRO 77 2HB PRO 77 25.831 -9.390 23.984 568 HG2 PRO 77 1HG PRO 77 28.299 -9.153 22.332 569 HG3 PRO 77 2HG PRO 77 27.435 -10.607 22.857 570 HD2 PRO 77 1HD PRO 77 27.235 -9.374 20.343 571 HD3 PRO 77 2HD PRO 77 26.134 -10.602 20.997 572 H GLU 78 H GLU 78 27.201 -7.178 20.514 573 HA GLU 78 HA GLU 78 28.400 -4.896 21.902 574 HB2 GLU 78 1HB GLU 78 29.247 -6.271 19.351 575 HB3 GLU 78 2HB GLU 78 30.096 -4.935 20.115 576 HG2 GLU 78 1HG GLU 78 30.242 -6.458 22.169 577 HG3 GLU 78 2HG GLU 78 29.807 -7.759 21.059 578 H ALA 79 H ALA 79 27.044 -5.663 18.691 579 HA ALA 79 HA ALA 79 26.890 -2.866 18.013 580 HB1 ALA 79 3HB ALA 79 25.708 -5.255 16.602 581 HB2 ALA 79 1HB ALA 79 27.291 -4.546 16.283 582 HB3 ALA 79 2HB ALA 79 25.828 -3.619 15.952 583 H GLY 80 H GLY 80 25.535 -1.742 19.312 584 HA2 GLY 80 1HA GLY 80 22.984 -2.882 20.116 585 HA3 GLY 80 2HA GLY 80 23.660 -1.352 20.648 586 H ALA 81 H ALA 81 23.208 -2.416 17.326 587 HA ALA 81 HA ALA 81 21.051 -0.450 17.018 588 HB1 ALA 81 3HB ALA 81 21.998 0.322 14.910 589 HB2 ALA 81 1HB ALA 81 23.380 -0.754 15.123 590 HB3 ALA 81 2HB ALA 81 23.129 0.590 16.238 591 H GLY 82 H GLY 82 19.523 -2.064 16.931 592 HA2 GLY 82 1HA GLY 82 19.750 -3.930 14.656 593 HA3 GLY 82 2HA GLY 82 18.849 -4.274 16.128 594 H ALA 83 H ALA 83 18.660 -3.175 12.985 595 HA ALA 83 HA ALA 83 16.983 -2.412 11.674 596 HB1 ALA 83 3HB ALA 83 15.202 -2.760 14.085 597 HB2 ALA 83 1HB ALA 83 15.544 -3.996 12.875 598 HB3 ALA 83 2HB ALA 83 14.674 -2.532 12.416 599 H ARG 84 H ARG 84 17.560 -0.396 11.200 600 HA ARG 84 HA ARG 84 17.555 1.734 13.091 601 HE ARG 84 HE ARG 84 19.469 4.095 9.205 602 HB2 ARG 84 1HB ARG 84 17.835 1.663 10.088 603 HB3 ARG 84 2HB ARG 84 17.867 3.166 11.000 604 HG2 ARG 84 1HG ARG 84 19.804 2.397 12.244 605 HG3 ARG 84 2HG ARG 84 19.756 0.852 11.394 606 HD2 ARG 84 1HD ARG 84 21.449 2.418 10.493 607 HD3 ARG 84 2HD ARG 84 20.247 1.925 9.302 608 HH11 ARG 84 1HH1 ARG 84 21.695 3.797 11.897 609 HH12 ARG 84 2HH1 ARG 84 21.892 5.514 12.082 610 HH21 ARG 84 1HH2 ARG 84 19.728 6.360 9.459 611 HH22 ARG 84 2HH2 ARG 84 20.786 6.956 10.709 612 HA PRO 85 HA PRO 85 13.259 2.742 13.009 613 HB2 PRO 85 1HB PRO 85 14.064 5.401 13.974 614 HB3 PRO 85 2HB PRO 85 13.100 4.159 14.778 615 HG2 PRO 85 1HG PRO 85 15.599 4.736 15.572 616 HG3 PRO 85 2HG PRO 85 14.953 3.085 15.637 617 HD2 PRO 85 1HD PRO 85 16.788 4.324 13.616 618 HD3 PRO 85 2HD PRO 85 16.864 2.715 14.366 619 H ALA 86 H ALA 86 15.478 3.974 10.933 620 HA ALA 86 HA ALA 86 13.529 5.772 9.658 621 HB1 ALA 86 3HB ALA 86 15.620 6.879 10.281 622 HB2 ALA 86 1HB ALA 86 15.419 6.825 8.530 623 HB3 ALA 86 2HB ALA 86 16.527 5.706 9.325 624 H ASN 87 H ASN 87 14.340 2.699 9.570 625 HA ASN 87 HA ASN 87 14.703 2.459 6.674 626 HB2 ASN 87 1HB ASN 87 15.963 1.088 8.548 627 HB3 ASN 87 2HB ASN 87 14.510 0.096 8.508 628 HD21 ASN 87 2HD2 ASN 87 14.019 -1.065 6.616 629 HD22 ASN 87 1HD2 ASN 87 15.224 -1.380 5.416 630 H ALA 88 H ALA 88 12.218 2.855 8.721 631 HA ALA 88 HA ALA 88 10.405 0.973 7.413 632 HB1 ALA 88 3HB ALA 88 8.774 1.650 9.101 633 HB2 ALA 88 1HB ALA 88 9.901 2.859 9.720 634 HB3 ALA 88 2HB ALA 88 10.283 1.142 9.859 635 HA PRO 89 HA PRO 89 8.744 3.837 4.533 636 HB2 PRO 89 1HB PRO 89 6.026 3.451 4.887 637 HB3 PRO 89 2HB PRO 89 7.075 2.443 3.890 638 HG2 PRO 89 1HG PRO 89 6.100 1.990 6.676 639 HG3 PRO 89 2HG PRO 89 6.305 0.825 5.353 640 HD2 PRO 89 1HD PRO 89 8.073 0.986 7.360 641 HD3 PRO 89 2HD PRO 89 8.593 0.652 5.694 642 H GLU 90 H GLU 90 8.539 5.970 4.621 643 HA GLU 90 HA GLU 90 7.534 7.343 6.937 644 HB2 GLU 90 1HB GLU 90 8.286 8.306 4.170 645 HB3 GLU 90 2HB GLU 90 7.750 9.374 5.457 646 HG2 GLU 90 1HG GLU 90 9.668 8.739 6.804 647 HG3 GLU 90 2HG GLU 90 10.197 7.627 5.539 648 H VAL 91 H VAL 91 6.381 6.381 3.793 649 HA VAL 91 HA VAL 91 3.677 7.198 4.582 650 HB VAL 91 HB VAL 91 4.429 8.927 3.076 651 HG11 VAL 91 1HG1 VAL 91 5.127 8.448 0.776 652 HG12 VAL 91 2HG1 VAL 91 5.063 6.720 1.124 653 HG13 VAL 91 3HG1 VAL 91 6.230 7.746 1.960 654 HG21 VAL 91 3HG2 VAL 91 2.104 8.243 2.857 655 HG22 VAL 91 1HG2 VAL 91 2.559 7.029 1.661 656 HG23 VAL 91 2HG2 VAL 91 2.754 8.744 1.297 657 H LEU 92 H LEU 92 2.156 5.728 4.229 658 HA LEU 92 HA LEU 92 2.841 3.370 2.598 659 HG LEU 92 HG LEU 92 0.201 1.843 3.359 660 HB2 LEU 92 1HB LEU 92 2.552 2.837 4.978 661 HB3 LEU 92 2HB LEU 92 0.964 3.577 4.960 662 HD11 LEU 92 1HD1 LEU 92 2.339 1.301 2.340 663 HD12 LEU 92 2HD1 LEU 92 1.581 -0.143 3.015 664 HD13 LEU 92 3HD1 LEU 92 2.914 0.634 3.869 665 HD21 LEU 92 3HD2 LEU 92 -0.183 1.571 5.748 666 HD22 LEU 92 1HD2 LEU 92 1.387 0.788 5.922 667 HD23 LEU 92 2HD2 LEU 92 0.116 0.014 4.976 668 H LEU 93 H LEU 93 1.822 3.413 0.713 669 HA LEU 93 HA LEU 93 -0.593 5.038 0.454 670 HG LEU 93 HG LEU 93 2.238 5.738 -0.523 671 HB2 LEU 93 1HB LEU 93 1.195 3.787 -1.629 672 HB3 LEU 93 2HB LEU 93 -0.217 4.763 -1.984 673 HD11 LEU 93 1HD1 LEU 93 2.677 7.011 -2.567 674 HD12 LEU 93 2HD1 LEU 93 1.310 6.219 -3.350 675 HD13 LEU 93 3HD1 LEU 93 2.716 5.273 -2.858 676 HD21 LEU 93 3HD2 LEU 93 0.200 6.896 0.159 677 HD22 LEU 93 1HD2 LEU 93 -0.189 7.218 -1.531 678 HD23 LEU 93 2HD2 LEU 93 1.239 7.951 -0.801 679 H VAL 94 H VAL 94 -2.477 4.064 0.675 680 HA VAL 94 HA VAL 94 -2.748 1.250 -0.094 681 HB VAL 94 HB VAL 94 -4.799 3.030 1.249 682 HG11 VAL 94 1HG1 VAL 94 -4.663 0.032 0.934 683 HG12 VAL 94 2HG1 VAL 94 -5.764 1.118 0.087 684 HG13 VAL 94 3HG1 VAL 94 -5.894 0.918 1.834 685 HG21 VAL 94 3HG2 VAL 94 -2.838 2.800 2.672 686 HG22 VAL 94 1HG2 VAL 94 -2.886 1.048 2.484 687 HG23 VAL 94 2HG2 VAL 94 -4.190 1.881 3.331 688 H GLY 95 H GLY 95 -2.997 1.097 -2.241 689 HA2 GLY 95 1HA GLY 95 -4.368 3.194 -3.716 690 HA3 GLY 95 2HA GLY 95 -3.498 1.829 -4.401 691 H THR 96 H THR 96 -6.465 2.721 -2.712 692 HA THR 96 HA THR 96 -7.763 0.303 -3.744 693 HB THR 96 HB THR 96 -9.321 2.162 -2.052 694 HG1 THR 96 HG1 THR 96 -6.814 1.348 -1.341 695 HG21 THR 96 3HG2 THR 96 -8.770 -0.808 -1.941 696 HG22 THR 96 1HG2 THR 96 -10.169 -0.041 -2.695 697 HG23 THR 96 2HG2 THR 96 -9.944 0.055 -0.947 698 H GLY 97 H GLY 97 -8.054 0.863 -5.900 699 HA2 GLY 97 1HA GLY 97 -9.201 3.441 -6.574 700 HA3 GLY 97 2HA GLY 97 -8.671 2.206 -7.702 701 H ARG 98 H ARG 98 -10.269 0.119 -6.373 702 HA ARG 98 HA ARG 98 -12.597 0.358 -7.944 703 HE ARG 98 HE ARG 98 -15.545 -3.676 -7.478 704 HB2 ARG 98 1HB ARG 98 -11.514 -1.786 -7.199 705 HB3 ARG 98 2HB ARG 98 -12.178 -1.498 -5.596 706 HG2 ARG 98 1HG ARG 98 -14.424 -1.642 -6.449 707 HG3 ARG 98 2HG ARG 98 -13.822 -1.782 -8.102 708 HD2 ARG 98 1HD ARG 98 -12.658 -3.873 -7.444 709 HD3 ARG 98 2HD ARG 98 -13.407 -3.748 -5.854 710 HH11 ARG 98 1HH1 ARG 98 -12.784 -5.836 -7.342 711 HH12 ARG 98 2HH1 ARG 98 -13.651 -7.187 -8.005 712 HH21 ARG 98 1HH2 ARG 98 -16.673 -5.466 -8.367 713 HH22 ARG 98 2HH2 ARG 98 -15.843 -6.979 -8.589 714 H ARG 99 H ARG 99 -12.158 0.511 -4.419 715 HA ARG 99 HA ARG 99 -14.266 2.518 -4.278 716 HE ARG 99 HE ARG 99 -18.021 -0.929 -4.765 717 HB2 ARG 99 1HB ARG 99 -14.277 -0.050 -2.683 718 HB3 ARG 99 2HB ARG 99 -15.157 1.383 -2.175 719 HG2 ARG 99 1HG ARG 99 -16.372 1.293 -4.369 720 HG3 ARG 99 2HG ARG 99 -15.614 -0.280 -4.635 721 HD2 ARG 99 1HD ARG 99 -16.613 -1.116 -2.570 722 HD3 ARG 99 2HD ARG 99 -17.356 0.457 -2.285 723 HH11 ARG 99 1HH1 ARG 99 -18.975 0.141 -1.567 724 HH12 ARG 99 2HH1 ARG 99 -20.658 -0.234 -1.809 725 HH21 ARG 99 1HH2 ARG 99 -20.224 -1.424 -5.086 726 HH22 ARG 99 2HH2 ARG 99 -21.367 -1.143 -3.805 727 H GLN 100 H GLN 100 -13.685 4.130 -2.914 728 HA GLN 100 HA GLN 100 -11.159 4.029 -1.622 729 HB2 GLN 100 1HB GLN 100 -13.394 6.049 -1.435 730 HB3 GLN 100 2HB GLN 100 -11.791 6.262 -0.765 731 HG2 GLN 100 1HG GLN 100 -10.853 6.070 -3.045 732 HG3 GLN 100 2HG GLN 100 -12.500 5.992 -3.670 733 HE21 GLN 100 2HE2 GLN 100 -10.410 7.953 -4.176 734 HE22 GLN 100 1HE2 GLN 100 -11.074 9.485 -3.724 735 H HIS 101 H HIS 101 -11.222 2.370 -0.122 736 HA HIS 101 HA HIS 101 -13.224 2.223 1.917 737 HD1 HIS 101 HD1 HIS 101 -10.184 1.123 4.393 738 HD2 HIS 101 HD2 HIS 101 -13.538 -0.994 3.153 739 HE1 HIS 101 HE1 HIS 101 -10.959 -0.155 6.413 740 HE2 HIS 101 HE2 HIS 101 -12.844 -1.604 5.575 741 HB2 HIS 101 1HB HIS 101 -11.977 0.222 1.207 742 HB3 HIS 101 2HB HIS 101 -10.480 0.944 1.781 743 H LEU 102 H LEU 102 -13.415 3.782 3.357 744 HA LEU 102 HA LEU 102 -11.409 5.619 4.048 745 HG LEU 102 HG LEU 102 -14.510 5.674 3.410 746 HB2 LEU 102 1HB LEU 102 -13.865 4.827 5.617 747 HB3 LEU 102 2HB LEU 102 -12.901 6.264 5.896 748 HD11 LEU 102 1HD1 LEU 102 -15.901 6.223 5.329 749 HD12 LEU 102 2HD1 LEU 102 -15.902 7.539 4.155 750 HD13 LEU 102 3HD1 LEU 102 -14.939 7.670 5.628 751 HD21 LEU 102 3HD2 LEU 102 -12.489 6.940 2.899 752 HD22 LEU 102 1HD2 LEU 102 -12.894 8.110 4.155 753 HD23 LEU 102 2HD2 LEU 102 -13.926 7.948 2.735 754 H LEU 103 H LEU 103 -9.653 5.334 5.209 755 HA LEU 103 HA LEU 103 -9.326 3.027 6.902 756 HG LEU 103 HG LEU 103 -7.812 4.229 4.361 757 HB2 LEU 103 1HB LEU 103 -7.499 5.402 6.506 758 HB3 LEU 103 2HB LEU 103 -7.070 3.883 7.269 759 HD11 LEU 103 1HD1 LEU 103 -5.146 3.719 5.667 760 HD12 LEU 103 2HD1 LEU 103 -5.651 5.213 4.878 761 HD13 LEU 103 3HD1 LEU 103 -5.458 3.737 3.932 762 HD21 LEU 103 3HD2 LEU 103 -7.106 1.909 4.114 763 HD22 LEU 103 1HD2 LEU 103 -8.457 2.040 5.241 764 HD23 LEU 103 2HD2 LEU 103 -6.819 1.802 5.851 765 H GLY 104 H GLY 104 -8.939 3.120 9.175 766 HA2 GLY 104 1HA GLY 104 -10.386 5.384 10.384 767 HA3 GLY 104 2HA GLY 104 -10.302 3.762 11.057 768 HA PRO 105 HA PRO 105 -6.878 6.967 12.459 769 HB2 PRO 105 1HB PRO 105 -8.611 7.140 14.870 770 HB3 PRO 105 2HB PRO 105 -7.682 8.403 14.057 771 HG2 PRO 105 1HG PRO 105 -10.329 8.289 13.802 772 HG3 PRO 105 2HG PRO 105 -9.297 8.730 12.427 773 HD2 PRO 105 1HD PRO 105 -10.683 6.146 13.007 774 HD3 PRO 105 2HD PRO 105 -10.431 6.968 11.454 775 H GLU 106 H GLU 106 -8.778 4.496 14.104 776 HA GLU 106 HA GLU 106 -6.660 3.798 15.926 777 HB2 GLU 106 1HB GLU 106 -9.270 2.426 15.264 778 HB3 GLU 106 2HB GLU 106 -8.173 1.919 16.541 779 HG2 GLU 106 1HG GLU 106 -8.523 3.961 17.738 780 HG3 GLU 106 2HG GLU 106 -9.465 4.632 16.406 781 H GLN 107 H GLN 107 -7.757 2.771 12.792 782 HA GLN 107 HA GLN 107 -6.432 0.236 12.808 783 HB2 GLN 107 1HB GLN 107 -7.564 1.901 10.555 784 HB3 GLN 107 2HB GLN 107 -6.891 0.291 10.340 785 HG2 GLN 107 1HG GLN 107 -8.586 -0.631 11.818 786 HG3 GLN 107 2HG GLN 107 -9.246 0.982 12.081 787 HE21 GLN 107 2HE2 GLN 107 -10.466 -1.441 10.957 788 HE22 GLN 107 1HE2 GLN 107 -11.048 -0.995 9.393 789 H VAL 108 H VAL 108 -5.690 3.449 11.541 790 HA VAL 108 HA VAL 108 -3.091 2.515 10.605 791 HB VAL 108 HB VAL 108 -2.799 4.810 9.735 792 HG11 VAL 108 1HG1 VAL 108 -3.831 3.116 8.327 793 HG12 VAL 108 2HG1 VAL 108 -4.541 4.699 8.012 794 HG13 VAL 108 3HG1 VAL 108 -5.418 3.517 8.983 795 HG21 VAL 108 3HG2 VAL 108 -4.679 6.382 9.795 796 HG22 VAL 108 1HG2 VAL 108 -4.076 6.026 11.414 797 HG23 VAL 108 2HG2 VAL 108 -5.566 5.275 10.843 798 H ARG 109 H ARG 109 -4.245 3.251 13.500 799 HA ARG 109 HA ARG 109 -2.687 5.334 14.513 800 HE ARG 109 HE ARG 109 -3.189 5.928 19.375 801 HB2 ARG 109 1HB ARG 109 -4.686 4.389 15.628 802 HB3 ARG 109 2HB ARG 109 -3.749 2.958 16.038 803 HG2 ARG 109 1HG ARG 109 -2.227 4.340 17.364 804 HG3 ARG 109 2HG ARG 109 -3.188 5.766 16.964 805 HD2 ARG 109 1HD ARG 109 -5.146 4.694 18.023 806 HD3 ARG 109 2HD ARG 109 -4.118 3.341 18.493 807 HH11 ARG 109 1HH1 ARG 109 -5.122 3.114 20.156 808 HH12 ARG 109 2HH1 ARG 109 -5.075 3.408 21.867 809 HH21 ARG 109 1HH2 ARG 109 -3.130 6.320 21.610 810 HH22 ARG 109 2HH2 ARG 109 -3.947 5.233 22.697 811 HA PRO 110 HA PRO 110 0.414 1.976 16.259 812 HB2 PRO 110 1HB PRO 110 0.589 -0.274 14.656 813 HB3 PRO 110 2HB PRO 110 -0.281 -0.190 16.191 814 HG2 PRO 110 1HG PRO 110 -1.329 0.041 13.401 815 HG3 PRO 110 2HG PRO 110 -2.033 -0.793 14.800 816 HD2 PRO 110 1HD PRO 110 -2.954 1.586 13.996 817 HD3 PRO 110 2HD PRO 110 -2.845 1.178 15.723 818 H LEU 111 H LEU 111 -0.277 2.429 12.868 819 HA LEU 111 HA LEU 111 2.498 2.250 12.085 820 HG LEU 111 HG LEU 111 -0.010 0.702 11.167 821 HB2 LEU 111 1HB LEU 111 0.053 3.095 10.527 822 HB3 LEU 111 2HB LEU 111 1.651 2.850 9.845 823 HD11 LEU 111 1HD1 LEU 111 -0.290 -0.195 8.917 824 HD12 LEU 111 2HD1 LEU 111 0.560 1.200 8.252 825 HD13 LEU 111 3HD1 LEU 111 -0.993 1.416 9.059 826 HD21 LEU 111 3HD2 LEU 111 1.667 -0.829 10.260 827 HD22 LEU 111 1HD2 LEU 111 2.384 0.317 11.393 828 HD23 LEU 111 2HD2 LEU 111 2.596 0.544 9.656 829 H LEU 112 H LEU 112 0.029 4.790 12.418 830 HA LEU 112 HA LEU 112 1.652 6.963 11.675 831 HG LEU 112 HG LEU 112 -1.355 6.341 11.284 832 HB2 LEU 112 1HB LEU 112 -0.679 6.845 13.589 833 HB3 LEU 112 2HB LEU 112 0.069 8.334 13.051 834 HD11 LEU 112 1HD1 LEU 112 -2.872 7.578 12.732 835 HD12 LEU 112 2HD1 LEU 112 -3.034 8.103 11.057 836 HD13 LEU 112 3HD1 LEU 112 -2.146 9.099 12.211 837 HD21 LEU 112 3HD2 LEU 112 -1.097 8.022 9.530 838 HD22 LEU 112 1HD2 LEU 112 0.470 7.460 10.108 839 HD23 LEU 112 2HD2 LEU 112 -0.148 9.029 10.626 840 H ALA 113 H ALA 113 1.239 5.268 14.715 841 HA ALA 113 HA ALA 113 2.647 7.061 16.374 842 HB1 ALA 113 3HB ALA 113 1.176 5.303 17.234 843 HB2 ALA 113 1HB ALA 113 2.787 5.208 17.947 844 HB3 ALA 113 2HB ALA 113 2.317 4.078 16.677 845 H MET 114 H MET 114 3.710 4.612 14.139 846 HA MET 114 HA MET 114 6.440 4.635 15.101 847 HB2 MET 114 1HB MET 114 5.231 3.442 12.597 848 HB3 MET 114 2HB MET 114 6.895 3.215 13.118 849 HG2 MET 114 1HG MET 114 6.139 2.068 15.114 850 HG3 MET 114 2HG MET 114 4.459 2.345 14.655 851 HE1 MET 114 3HE MET 114 4.826 -1.505 14.124 852 HE2 MET 114 1HE MET 114 3.882 -0.221 14.879 853 HE3 MET 114 2HE MET 114 5.538 -0.522 15.403 854 H GLY 115 H GLY 115 4.486 6.365 12.880 855 HA2 GLY 115 1HA GLY 115 5.331 8.519 12.093 856 HA3 GLY 115 2HA GLY 115 6.878 7.730 11.815 857 H VAL 116 H VAL 116 4.486 5.607 10.991 858 HA VAL 116 HA VAL 116 5.008 5.981 8.171 859 HB VAL 116 HB VAL 116 3.239 3.915 9.497 860 HG11 VAL 116 1HG1 VAL 116 3.600 2.636 7.438 861 HG12 VAL 116 2HG1 VAL 116 4.534 3.977 6.773 862 HG13 VAL 116 3HG1 VAL 116 2.816 4.183 7.116 863 HG21 VAL 116 3HG2 VAL 116 6.160 3.722 8.755 864 HG22 VAL 116 1HG2 VAL 116 5.156 2.392 9.334 865 HG23 VAL 116 2HG2 VAL 116 5.499 3.762 10.390 866 H GLY 117 H GLY 117 3.896 7.640 7.304 867 HA2 GLY 117 1HA GLY 117 1.194 8.261 8.087 868 HA3 GLY 117 2HA GLY 117 2.117 9.036 6.808 869 H VAL 118 H VAL 118 -0.233 6.677 7.586 870 HA VAL 118 HA VAL 118 -0.189 5.388 4.994 871 HB VAL 118 HB VAL 118 -2.277 5.122 7.160 872 HG11 VAL 118 1HG1 VAL 118 -2.697 2.939 6.125 873 HG12 VAL 118 2HG1 VAL 118 -1.498 3.306 4.885 874 HG13 VAL 118 3HG1 VAL 118 -2.972 4.268 4.998 875 HG21 VAL 118 3HG2 VAL 118 -1.038 3.157 7.931 876 HG22 VAL 118 1HG2 VAL 118 -0.083 4.632 8.095 877 HG23 VAL 118 2HG2 VAL 118 0.243 3.511 6.771 878 H GLU 119 H GLU 119 -1.329 5.998 3.269 879 HA GLU 119 HA GLU 119 -3.609 7.816 3.657 880 HB2 GLU 119 1HB GLU 119 -1.413 8.110 1.604 881 HB3 GLU 119 2HB GLU 119 -2.903 9.045 1.610 882 HG2 GLU 119 1HG GLU 119 -2.303 9.933 3.827 883 HG3 GLU 119 2HG GLU 119 -0.780 9.049 3.743 884 H ALA 120 H ALA 120 -5.370 7.393 2.460 885 HA ALA 120 HA ALA 120 -5.305 5.048 0.728 886 HB1 ALA 120 3HB ALA 120 -7.743 5.160 0.809 887 HB2 ALA 120 1HB ALA 120 -7.653 6.676 1.705 888 HB3 ALA 120 2HB ALA 120 -7.059 5.184 2.434 889 H MET 121 H MET 121 -5.253 5.202 -1.421 890 HA MET 121 HA MET 121 -6.120 7.675 -2.729 891 HB2 MET 121 1HB MET 121 -3.640 7.768 -2.120 892 HB3 MET 121 2HB MET 121 -3.407 6.457 -3.263 893 HG2 MET 121 1HG MET 121 -4.309 7.893 -5.049 894 HG3 MET 121 2HG MET 121 -4.439 9.213 -3.887 895 HE1 MET 121 3HE MET 121 -2.242 10.219 -2.583 896 HE2 MET 121 1HE MET 121 -0.609 9.631 -2.897 897 HE3 MET 121 2HE MET 121 -1.796 8.573 -2.131 898 H ASP 122 H ASP 122 -6.347 7.376 -5.090 899 HA ASP 122 HA ASP 122 -7.463 4.894 -5.823 900 HB2 ASP 122 1HB ASP 122 -6.396 7.075 -7.637 901 HB3 ASP 122 2HB ASP 122 -7.477 5.774 -8.121 902 H THR 123 H THR 123 -6.670 3.225 -7.124 903 HA THR 123 HA THR 123 -4.117 2.330 -6.603 904 HB THR 123 HB THR 123 -5.678 1.566 -9.075 905 HG1 THR 123 HG1 THR 123 -5.972 0.437 -6.472 906 HG21 THR 123 3HG2 THR 123 -4.676 -0.636 -8.683 907 HG22 THR 123 1HG2 THR 123 -3.828 -0.005 -7.272 908 HG23 THR 123 2HG2 THR 123 -3.432 0.598 -8.881 909 H GLN 124 H GLN 124 -5.282 3.974 -9.524 910 HA GLN 124 HA GLN 124 -2.924 3.874 -11.020 911 HB2 GLN 124 1HB GLN 124 -5.152 4.520 -11.901 912 HB3 GLN 124 2HB GLN 124 -5.034 6.040 -11.027 913 HG2 GLN 124 1HG GLN 124 -2.960 6.528 -12.348 914 HG3 GLN 124 2HG GLN 124 -3.339 5.109 -13.325 915 HE21 GLN 124 2HE2 GLN 124 -3.654 6.260 -15.206 916 HE22 GLN 124 1HE2 GLN 124 -5.017 7.320 -15.442 917 H ALA 125 H ALA 125 -4.127 6.407 -8.839 918 HA ALA 125 HA ALA 125 -1.910 8.139 -9.269 919 HB1 ALA 125 3HB ALA 125 -2.857 9.484 -7.476 920 HB2 ALA 125 1HB ALA 125 -3.946 8.166 -7.045 921 HB3 ALA 125 2HB ALA 125 -4.112 8.973 -8.604 922 H ALA 126 H ALA 126 -2.690 5.686 -6.876 923 HA ALA 126 HA ALA 126 -0.646 6.287 -5.029 924 HB1 ALA 126 3HB ALA 126 -1.924 3.612 -5.603 925 HB2 ALA 126 1HB ALA 126 -2.546 4.834 -4.492 926 HB3 ALA 126 2HB ALA 126 -1.006 4.042 -4.159 927 H ALA 127 H ALA 127 -0.758 4.045 -7.783 928 HA ALA 127 HA ALA 127 1.857 3.049 -7.524 929 HB1 ALA 127 3HB ALA 127 0.165 1.999 -8.945 930 HB2 ALA 127 1HB ALA 127 1.638 2.348 -9.851 931 HB3 ALA 127 2HB ALA 127 0.221 3.383 -10.037 932 H ARG 128 H ARG 128 0.569 5.790 -9.361 933 HA ARG 128 HA ARG 128 2.946 6.644 -10.554 934 HE ARG 128 HE ARG 128 1.635 11.950 -10.343 935 HB2 ARG 128 1HB ARG 128 0.906 7.582 -11.319 936 HB3 ARG 128 2HB ARG 128 0.457 8.117 -9.707 937 HG2 ARG 128 1HG ARG 128 2.193 9.801 -9.745 938 HG3 ARG 128 2HG ARG 128 2.744 9.228 -11.321 939 HD2 ARG 128 1HD ARG 128 0.846 10.024 -12.410 940 HD3 ARG 128 2HD ARG 128 -0.090 10.108 -10.918 941 HH11 ARG 128 1HH1 ARG 128 0.333 11.329 -13.548 942 HH12 ARG 128 2HH1 ARG 128 0.415 13.000 -14.024 943 HH21 ARG 128 1HH2 ARG 128 1.735 14.117 -10.970 944 HH22 ARG 128 2HH2 ARG 128 1.190 14.595 -12.553 945 H THR 129 H THR 129 1.489 7.640 -7.458 946 HA THR 129 HA THR 129 3.520 9.428 -6.701 947 HB THR 129 HB THR 129 1.767 7.795 -4.852 948 HG1 THR 129 HG1 THR 129 0.330 8.862 -6.093 949 HG21 THR 129 3HG2 THR 129 3.606 8.967 -3.724 950 HG22 THR 129 1HG2 THR 129 2.047 9.682 -3.315 951 HG23 THR 129 2HG2 THR 129 3.105 10.481 -4.477 952 H TYR 130 H TYR 130 3.074 5.973 -6.068 953 HA TYR 130 HA TYR 130 5.262 5.478 -4.438 954 HD1 TYR 130 HD1 TYR 130 5.782 3.001 -3.410 955 HD2 TYR 130 HD2 TYR 130 5.329 2.299 -7.583 956 HE1 TYR 130 HE1 TYR 130 7.446 1.196 -3.284 957 HE2 TYR 130 HE2 TYR 130 6.993 0.495 -7.468 958 HH TYR 130 HH TYR 130 8.817 -0.247 -6.083 959 HB2 TYR 130 1HB TYR 130 3.697 3.727 -4.784 960 HB3 TYR 130 2HB TYR 130 3.896 3.792 -6.531 961 H ASN 131 H ASN 131 5.123 5.356 -7.998 962 HA ASN 131 HA ASN 131 7.799 4.687 -8.433 963 HB2 ASN 131 1HB ASN 131 5.861 6.229 -10.162 964 HB3 ASN 131 2HB ASN 131 7.462 5.743 -10.708 965 HD21 ASN 131 2HD2 ASN 131 4.848 4.994 -11.740 966 HD22 ASN 131 1HD2 ASN 131 4.777 3.267 -11.634 967 H ILE 132 H ILE 132 6.266 7.854 -8.107 968 HA ILE 132 HA ILE 132 8.527 9.416 -8.705 969 HB ILE 132 HB ILE 132 6.191 10.074 -6.901 970 HG12 ILE 132 1HG1 ILE 132 6.705 10.779 -9.801 971 HG13 ILE 132 2HG1 ILE 132 5.591 9.534 -9.246 972 HG21 ILE 132 1HG2 ILE 132 6.811 12.422 -7.256 973 HG22 ILE 132 2HG2 ILE 132 8.247 11.903 -8.140 974 HG23 ILE 132 3HG2 ILE 132 8.083 11.527 -6.424 975 HD11 ILE 132 3HD1 ILE 132 4.413 11.566 -9.847 976 HD12 ILE 132 1HD1 ILE 132 5.368 12.482 -8.680 977 HD13 ILE 132 2HD1 ILE 132 4.251 11.237 -8.122 978 H LEU 133 H LEU 133 7.210 8.428 -5.538 979 HA LEU 133 HA LEU 133 9.257 9.656 -4.029 980 HG LEU 133 HG LEU 133 6.120 9.337 -3.846 981 HB2 LEU 133 1HB LEU 133 7.448 7.360 -3.276 982 HB3 LEU 133 2HB LEU 133 8.402 8.312 -2.154 983 HD11 LEU 133 1HD1 LEU 133 4.973 9.614 -1.708 984 HD12 LEU 133 2HD1 LEU 133 6.341 8.876 -0.876 985 HD13 LEU 133 3HD1 LEU 133 5.380 7.925 -2.010 986 HD21 LEU 133 3HD2 LEU 133 7.824 10.749 -1.798 987 HD22 LEU 133 1HD2 LEU 133 6.394 11.416 -2.587 988 HD23 LEU 133 2HD2 LEU 133 7.832 11.040 -3.538 989 H MET 134 H MET 134 8.938 6.462 -5.437 990 HA MET 134 HA MET 134 11.159 5.251 -4.195 991 HB2 MET 134 1HB MET 134 9.505 3.953 -5.422 992 HB3 MET 134 2HB MET 134 9.931 4.774 -6.917 993 HG2 MET 134 1HG MET 134 12.206 3.808 -6.736 994 HG3 MET 134 2HG MET 134 11.661 2.896 -5.329 995 HE1 MET 134 3HE MET 134 11.289 3.447 -9.189 996 HE2 MET 134 1HE MET 134 9.659 3.768 -8.595 997 HE3 MET 134 2HE MET 134 9.972 2.342 -9.584 998 H ALA 135 H ALA 135 10.824 7.137 -7.169 999 HA ALA 135 HA ALA 135 13.544 6.895 -7.965 1000 HB1 ALA 135 3HB ALA 135 11.750 7.405 -9.551 1001 HB2 ALA 135 1HB ALA 135 13.019 8.630 -9.592 1002 HB3 ALA 135 2HB ALA 135 11.499 8.963 -8.762 1003 H GLU 136 H GLU 136 11.862 8.977 -5.764 1004 HA GLU 136 HA GLU 136 14.059 10.870 -5.640 1005 HB2 GLU 136 1HB GLU 136 11.546 10.687 -3.976 1006 HB3 GLU 136 2HB GLU 136 12.720 11.992 -3.904 1007 HG2 GLU 136 1HG GLU 136 12.242 12.306 -6.395 1008 HG3 GLU 136 2HG GLU 136 10.822 11.299 -6.110 1009 H GLY 137 H GLY 137 13.497 7.862 -4.427 1010 HA2 GLY 137 1HA GLY 137 14.706 6.591 -2.951 1011 HA3 GLY 137 2HA GLY 137 15.803 7.952 -2.786 1012 H ARG 138 H ARG 138 12.342 7.742 -1.983 1013 HA ARG 138 HA ARG 138 13.112 8.204 0.823 1014 HE ARG 138 HE ARG 138 9.400 11.699 0.008 1015 HB2 ARG 138 1HB ARG 138 11.934 10.123 -0.366 1016 HB3 ARG 138 2HB ARG 138 10.505 9.097 -0.415 1017 HG2 ARG 138 1HG ARG 138 10.189 9.189 1.860 1018 HG3 ARG 138 2HG ARG 138 11.879 9.568 2.186 1019 HD2 ARG 138 1HD ARG 138 10.659 11.537 2.637 1020 HD3 ARG 138 2HD ARG 138 11.470 11.802 1.096 1021 HH11 ARG 138 1HH1 ARG 138 9.091 11.227 3.470 1022 HH12 ARG 138 2HH1 ARG 138 7.383 11.575 3.493 1023 HH21 ARG 138 1HH2 ARG 138 7.174 12.207 0.039 1024 HH22 ARG 138 2HH2 ARG 138 6.293 12.135 1.540 1025 H ARG 139 H ARG 139 11.563 7.317 2.435 1026 HA ARG 139 HA ARG 139 11.183 4.557 1.785 1027 HE ARG 139 HE ARG 139 14.669 6.211 5.138 1028 HB2 ARG 139 1HB ARG 139 10.339 5.973 4.319 1029 HB3 ARG 139 2HB ARG 139 10.552 4.244 4.101 1030 HG2 ARG 139 1HG ARG 139 12.509 4.732 5.142 1031 HG3 ARG 139 2HG ARG 139 13.012 4.992 3.470 1032 HD2 ARG 139 1HD ARG 139 12.398 7.410 3.776 1033 HD3 ARG 139 2HD ARG 139 12.189 7.066 5.491 1034 HH11 ARG 139 1HH1 ARG 139 13.091 9.182 4.124 1035 HH12 ARG 139 2HH1 ARG 139 14.590 10.062 3.983 1036 HH21 ARG 139 1HH2 ARG 139 16.617 7.393 5.002 1037 HH22 ARG 139 2HH2 ARG 139 16.582 9.053 4.477 1038 H VAL 140 H VAL 140 9.559 4.145 0.414 1039 HA VAL 140 HA VAL 140 6.852 4.870 1.294 1040 HB VAL 140 HB VAL 140 7.402 6.346 -0.563 1041 HG11 VAL 140 1HG1 VAL 140 7.912 5.477 -2.796 1042 HG12 VAL 140 2HG1 VAL 140 7.958 3.839 -2.143 1043 HG13 VAL 140 3HG1 VAL 140 9.151 5.029 -1.623 1044 HG21 VAL 140 3HG2 VAL 140 5.107 5.550 -0.409 1045 HG22 VAL 140 1HG2 VAL 140 5.510 4.152 -1.405 1046 HG23 VAL 140 2HG2 VAL 140 5.575 5.773 -2.095 1047 H VAL 141 H VAL 141 5.432 3.245 1.306 1048 HA VAL 141 HA VAL 141 6.035 0.809 -0.236 1049 HB VAL 141 HB VAL 141 4.838 0.891 2.550 1050 HG11 VAL 141 1HG1 VAL 141 4.917 -1.557 2.443 1051 HG12 VAL 141 2HG1 VAL 141 5.478 -1.464 0.774 1052 HG13 VAL 141 3HG1 VAL 141 3.866 -0.887 1.195 1053 HG21 VAL 141 3HG2 VAL 141 6.852 -0.228 3.289 1054 HG22 VAL 141 1HG2 VAL 141 7.271 1.295 2.505 1055 HG23 VAL 141 2HG2 VAL 141 7.489 -0.227 1.646 1056 H VAL 142 H VAL 142 4.217 -0.154 -1.212 1057 HA VAL 142 HA VAL 142 1.729 1.386 -0.948 1058 HB VAL 142 HB VAL 142 2.943 2.155 -2.945 1059 HG11 VAL 142 1HG1 VAL 142 2.656 -0.687 -3.906 1060 HG12 VAL 142 2HG1 VAL 142 4.163 0.131 -3.491 1061 HG13 VAL 142 3HG1 VAL 142 3.217 0.675 -4.877 1062 HG21 VAL 142 3HG2 VAL 142 0.436 0.601 -3.557 1063 HG22 VAL 142 1HG2 VAL 142 1.114 1.885 -4.557 1064 HG23 VAL 142 2HG2 VAL 142 0.519 2.250 -2.936 1065 H ALA 143 H ALA 143 -0.099 0.265 -0.896 1066 HA ALA 143 HA ALA 143 -0.019 -2.608 -1.565 1067 HB1 ALA 143 3HB ALA 143 -1.762 -1.219 0.475 1068 HB2 ALA 143 1HB ALA 143 -0.368 -2.238 0.833 1069 HB3 ALA 143 2HB ALA 143 -1.803 -2.937 0.080 1070 H LEU 144 H LEU 144 -1.100 -3.012 -3.389 1071 HA LEU 144 HA LEU 144 -2.992 -0.972 -4.315 1072 HG LEU 144 HG LEU 144 -0.068 -1.189 -5.195 1073 HB2 LEU 144 1HB LEU 144 -1.493 -3.108 -5.826 1074 HB3 LEU 144 2HB LEU 144 -2.640 -2.000 -6.555 1075 HD11 LEU 144 1HD1 LEU 144 0.703 -0.644 -7.449 1076 HD12 LEU 144 2HD1 LEU 144 -0.790 -1.302 -8.119 1077 HD13 LEU 144 3HD1 LEU 144 0.346 -2.364 -7.286 1078 HD21 LEU 144 3HD2 LEU 144 -0.535 1.020 -6.128 1079 HD22 LEU 144 1HD2 LEU 144 -1.805 0.513 -5.016 1080 HD23 LEU 144 2HD2 LEU 144 -2.074 0.433 -6.757 1081 H LEU 145 H LEU 145 -5.063 -1.327 -4.405 1082 HA LEU 145 HA LEU 145 -6.070 -4.089 -4.610 1083 HG LEU 145 HG LEU 145 -5.967 -3.556 -1.888 1084 HB2 LEU 145 1HB LEU 145 -7.101 -1.697 -3.138 1085 HB3 LEU 145 2HB LEU 145 -8.246 -2.876 -3.748 1086 HD11 LEU 145 1HD1 LEU 145 -7.644 -3.669 -0.133 1087 HD12 LEU 145 2HD1 LEU 145 -8.885 -3.127 -1.261 1088 HD13 LEU 145 3HD1 LEU 145 -7.569 -2.042 -0.810 1089 HD21 LEU 145 3HD2 LEU 145 -6.788 -5.392 -3.297 1090 HD22 LEU 145 1HD2 LEU 145 -8.423 -5.098 -2.711 1091 HD23 LEU 145 2HD2 LEU 145 -7.170 -5.642 -1.595 1092 HA PRO 146 HA PRO 146 -7.361 -2.111 -8.483 1093 HB2 PRO 146 1HB PRO 146 -6.648 -4.071 -10.125 1094 HB3 PRO 146 2HB PRO 146 -5.422 -3.059 -9.351 1095 HG2 PRO 146 1HG PRO 146 -6.266 -5.844 -8.701 1096 HG3 PRO 146 2HG PRO 146 -4.656 -5.109 -8.616 1097 HD2 PRO 146 1HD PRO 146 -6.455 -5.474 -6.474 1098 HD3 PRO 146 2HD PRO 146 -4.978 -4.490 -6.459 1099 H ASP 147 H ASP 147 -8.351 -3.704 -10.496 1100 HA ASP 147 HA ASP 147 -10.698 -5.011 -9.293 1101 HB2 ASP 147 1HB ASP 147 -11.376 -2.978 -10.425 1102 HB3 ASP 147 2HB ASP 147 -10.472 -3.429 -11.865 1103 H GLY 148 H GLY 148 -11.515 -6.867 -10.441 1104 HA2 GLY 148 1HA GLY 148 -10.274 -8.099 -12.616 1105 HA3 GLY 148 2HA GLY 148 -9.438 -8.645 -11.167 1106 H ASP 149 H ASP 149 -11.500 -8.798 -9.368 1107 HA ASP 149 HA ASP 149 -13.087 -11.001 -10.431 1108 HB2 ASP 149 1HB ASP 149 -11.891 -11.271 -8.251 1109 HB3 ASP 149 2HB ASP 149 -12.909 -10.003 -7.577 1110 H SER 150 H SER 150 -14.917 -10.475 -11.357 1111 HA SER 150 HA SER 150 -16.132 -7.917 -10.997 1112 HG SER 150 HG SER 150 -16.478 -11.149 -11.934 1113 HB2 SER 150 1HB SER 150 -17.874 -8.942 -12.578 1114 HB3 SER 150 2HB SER 150 -16.224 -8.797 -13.185 1115 H LEU 151 H LEU 151 -18.510 -7.684 -10.612 1116 HA LEU 151 HA LEU 151 -19.175 -8.923 -8.099 1117 HG LEU 151 HG LEU 151 -18.741 -5.937 -8.913 1118 HB2 LEU 151 1HB LEU 151 -20.742 -7.020 -9.846 1119 HB3 LEU 151 2HB LEU 151 -21.220 -7.525 -8.236 1120 HD11 LEU 151 1HD1 LEU 151 -20.784 -4.642 -9.191 1121 HD12 LEU 151 2HD1 LEU 151 -19.883 -4.100 -7.776 1122 HD13 LEU 151 3HD1 LEU 151 -21.315 -5.110 -7.575 1123 HD21 LEU 151 3HD2 LEU 151 -19.880 -6.764 -6.244 1124 HD22 LEU 151 1HD2 LEU 151 -18.505 -5.687 -6.488 1125 HD23 LEU 151 2HD2 LEU 151 -18.399 -7.379 -6.977 1126 H GLU 152 H GLU 152 -19.962 -9.350 -11.433 1127 HA GLU 152 HA GLU 152 -21.784 -11.531 -10.673 1128 HB2 GLU 152 1HB GLU 152 -23.013 -9.810 -11.887 1129 HB3 GLU 152 2HB GLU 152 -21.828 -9.849 -13.188 1130 HG2 GLU 152 1HG GLU 152 -22.439 -12.194 -13.631 1131 HG3 GLU 152 2HG GLU 152 -23.681 -12.081 -12.387 1132 H HIS 153 H HIS 153 -20.609 -13.339 -10.773 1133 HA HIS 153 HA HIS 153 -18.576 -13.729 -12.780 1134 HD1 HIS 153 HD1 HIS 153 -16.336 -15.247 -10.383 1135 HD2 HIS 153 HD2 HIS 153 -18.355 -17.288 -13.393 1136 HE1 HIS 153 HE1 HIS 153 -14.611 -16.710 -11.493 1137 HE2 HIS 153 HE2 HIS 153 -15.820 -17.793 -13.424 1138 HB2 HIS 153 1HB HIS 153 -18.764 -14.769 -10.372 1139 HB3 HIS 153 2HB HIS 153 -19.785 -15.961 -11.169 1140 H HIS 154 H HIS 154 -18.837 -14.736 -14.747 1141 HA HIS 154 HA HIS 154 -21.603 -14.906 -15.603 1142 HD1 HIS 154 HD1 HIS 154 -20.619 -12.187 -18.033 1143 HD2 HIS 154 HD2 HIS 154 -22.290 -15.960 -18.592 1144 HE1 HIS 154 HE1 HIS 154 -22.549 -11.854 -19.617 1145 HE2 HIS 154 HE2 HIS 154 -23.634 -14.120 -19.824 1146 HB2 HIS 154 1HB HIS 154 -19.386 -13.920 -16.812 1147 HB3 HIS 154 2HB HIS 154 -19.475 -15.515 -17.555 1148 H HIS 155 H HIS 155 -18.856 -17.003 -16.527 1149 HA HIS 155 HA HIS 155 -20.612 -19.295 -16.588 1150 HD1 HIS 155 HD1 HIS 155 -17.120 -18.442 -19.379 1151 HD2 HIS 155 HD2 HIS 155 -20.942 -20.022 -18.944 1152 HE1 HIS 155 HE1 HIS 155 -18.176 -18.307 -21.660 1153 HE2 HIS 155 HE2 HIS 155 -20.542 -19.121 -21.335 1154 HB2 HIS 155 1HB HIS 155 -17.638 -18.994 -17.019 1155 HB3 HIS 155 2HB HIS 155 -18.450 -20.555 -17.047 1156 H HIS 156 H HIS 156 -21.070 -20.559 -14.936 1157 HA HIS 156 HA HIS 156 -21.159 -21.386 -12.824 1158 HD1 HIS 156 HD1 HIS 156 -17.135 -21.797 -14.265 1159 HD2 HIS 156 HD2 HIS 156 -19.831 -23.960 -11.947 1160 HE1 HIS 156 HE1 HIS 156 -16.758 -24.213 -14.855 1161 HE2 HIS 156 HE2 HIS 156 -18.217 -25.502 -13.257 1162 HB2 HIS 156 1HB HIS 156 -18.314 -20.379 -12.587 1163 HB3 HIS 156 2HB HIS 156 -19.165 -21.208 -11.289 1164 H HIS 157 H HIS 157 -22.757 -19.694 -12.818 1165 HA HIS 157 HA HIS 157 -22.052 -17.170 -11.589 1166 HD1 HIS 157 HD1 HIS 157 -23.106 -14.792 -12.441 1167 HD2 HIS 157 HD2 HIS 157 -26.515 -16.725 -11.056 1168 HE1 HIS 157 HE1 HIS 157 -24.525 -12.998 -11.388 1169 HE2 HIS 157 HE2 HIS 157 -26.462 -14.239 -10.359 1170 HB2 HIS 157 1HB HIS 157 -23.659 -17.268 -13.471 1171 HB3 HIS 157 2HB HIS 157 -24.753 -18.216 -12.470 1172 H HIS 158 H HIS 158 -23.132 -20.233 -10.606 1173 HA HIS 158 HA HIS 158 -23.701 -19.143 -7.934 1174 HD1 HIS 158 HD1 HIS 158 -27.252 -20.251 -7.146 1175 HD2 HIS 158 HD2 HIS 158 -23.763 -22.273 -6.130 1176 HE1 HIS 158 HE1 HIS 158 -27.563 -20.992 -4.763 1177 HE2 HIS 158 HE2 HIS 158 -25.340 -21.980 -4.104 1178 HB2 HIS 158 1HB HIS 158 -25.661 -20.308 -9.017 1179 HB3 HIS 158 2HB HIS 158 -24.704 -21.786 -9.022 Start of MODEL 18 1 HA MET 1 HA MET 1 13.281 -20.084 -4.149 2 H1 MET 1 1H MET 1 12.660 -20.155 -7.048 3 H2 MET 1 2H MET 1 11.975 -21.141 -5.852 4 H3 MET 1 3H MET 1 13.621 -21.282 -6.220 5 HB2 MET 1 1HB MET 1 14.300 -18.371 -6.426 6 HB3 MET 1 2HB MET 1 14.606 -18.071 -4.722 7 HG2 MET 1 1HG MET 1 15.810 -20.197 -4.574 8 HG3 MET 1 2HG MET 1 15.520 -20.469 -6.293 9 HE1 MET 1 3HE MET 1 15.806 -17.377 -7.298 10 HE2 MET 1 1HE MET 1 16.427 -18.764 -8.195 11 HE3 MET 1 2HE MET 1 17.483 -17.395 -7.842 12 H LYS 2 H LYS 2 12.865 -17.742 -3.379 13 HA LYS 2 HA LYS 2 10.175 -16.986 -4.042 14 HB2 LYS 2 1HB LYS 2 12.216 -15.444 -2.425 15 HB3 LYS 2 2HB LYS 2 10.476 -15.195 -2.423 16 HG2 LYS 2 1HG LYS 2 10.179 -17.442 -1.466 17 HG3 LYS 2 2HG LYS 2 11.932 -17.629 -1.414 18 HD2 LYS 2 1HD LYS 2 12.029 -15.589 0.028 19 HD3 LYS 2 2HD LYS 2 10.266 -15.612 0.082 20 HE2 LYS 2 1HE LYS 2 10.364 -17.890 1.038 21 HE3 LYS 2 2HE LYS 2 12.124 -17.779 1.060 22 HZ1 LYS 2 3HZ LYS 2 11.373 -17.226 3.213 23 HZ2 LYS 2 1HZ LYS 2 10.185 -16.167 2.623 24 HZ3 LYS 2 2HZ LYS 2 11.828 -15.760 2.494 25 H LEU 3 H LEU 3 13.399 -15.859 -4.816 26 HA LEU 3 HA LEU 3 12.606 -13.439 -6.074 27 HG LEU 3 HG LEU 3 14.835 -14.183 -4.033 28 HB2 LEU 3 1HB LEU 3 15.159 -15.026 -6.322 29 HB3 LEU 3 2HB LEU 3 14.920 -13.407 -6.952 30 HD11 LEU 3 1HD1 LEU 3 17.084 -14.301 -4.913 31 HD12 LEU 3 2HD1 LEU 3 16.917 -12.873 -3.890 32 HD13 LEU 3 3HD1 LEU 3 16.911 -12.706 -5.646 33 HD21 LEU 3 3HD2 LEU 3 14.742 -11.779 -3.618 34 HD22 LEU 3 1HD2 LEU 3 13.344 -12.316 -4.549 35 HD23 LEU 3 2HD2 LEU 3 14.669 -11.474 -5.353 36 H HIS 4 H HIS 4 10.984 -14.013 -7.469 37 HA HIS 4 HA HIS 4 11.712 -14.373 -10.147 38 HD1 HIS 4 HD1 HIS 4 12.583 -17.295 -11.759 39 HD2 HIS 4 HD2 HIS 4 8.539 -16.398 -11.367 40 HE1 HIS 4 HE1 HIS 4 11.559 -17.756 -14.013 41 HE2 HIS 4 HE2 HIS 4 9.162 -16.993 -13.804 42 HB2 HIS 4 1HB HIS 4 11.932 -16.780 -9.392 43 HB3 HIS 4 2HB HIS 4 10.211 -16.755 -9.019 44 H THR 5 H THR 5 9.241 -14.723 -7.674 45 HA THR 5 HA THR 5 7.167 -13.592 -9.332 46 HB THR 5 HB THR 5 7.238 -13.946 -6.318 47 HG1 THR 5 HG1 THR 5 6.826 -15.724 -8.414 48 HG21 THR 5 3HG2 THR 5 4.923 -13.578 -8.224 49 HG22 THR 5 1HG2 THR 5 5.518 -12.381 -7.074 50 HG23 THR 5 2HG2 THR 5 4.792 -13.879 -6.491 51 H ASP 6 H ASP 6 9.261 -12.579 -6.677 52 HA ASP 6 HA ASP 6 8.574 -9.821 -6.787 53 HB2 ASP 6 1HB ASP 6 11.063 -11.177 -5.712 54 HB3 ASP 6 2HB ASP 6 10.597 -9.509 -5.402 55 HA PRO 7 HA PRO 7 10.722 -8.539 -10.387 56 HB2 PRO 7 1HB PRO 7 11.607 -6.057 -9.630 57 HB3 PRO 7 2HB PRO 7 9.943 -6.412 -10.100 58 HG2 PRO 7 1HG PRO 7 11.130 -6.165 -7.369 59 HG3 PRO 7 2HG PRO 7 9.570 -5.576 -7.974 60 HD2 PRO 7 1HD PRO 7 9.775 -7.811 -6.482 61 HD3 PRO 7 2HD PRO 7 8.566 -7.646 -7.772 62 H ALA 8 H ALA 8 12.725 -8.480 -11.315 63 HA ALA 8 HA ALA 8 14.922 -9.361 -9.658 64 HB1 ALA 8 3HB ALA 8 14.472 -10.402 -11.834 65 HB2 ALA 8 1HB ALA 8 16.098 -9.720 -11.751 66 HB3 ALA 8 2HB ALA 8 14.828 -8.869 -12.631 67 H THR 9 H THR 9 13.737 -6.398 -10.307 68 HA THR 9 HA THR 9 16.388 -5.128 -10.263 69 HB THR 9 HB THR 9 15.123 -3.047 -10.985 70 HG1 THR 9 HG1 THR 9 13.094 -3.644 -12.118 71 HG21 THR 9 3HG2 THR 9 15.028 -3.718 -13.345 72 HG22 THR 9 1HG2 THR 9 15.119 -5.411 -12.865 73 HG23 THR 9 2HG2 THR 9 16.482 -4.334 -12.557 74 H ALA 10 H ALA 10 16.870 -3.714 -8.623 75 HA ALA 10 HA ALA 10 15.251 -3.983 -6.246 76 HB1 ALA 10 3HB ALA 10 17.822 -2.456 -6.648 77 HB2 ALA 10 1HB ALA 10 17.699 -4.133 -6.118 78 HB3 ALA 10 2HB ALA 10 17.066 -2.837 -5.102 79 H LEU 11 H LEU 11 13.506 -2.835 -7.513 80 HA LEU 11 HA LEU 11 13.384 -0.070 -6.625 81 HG LEU 11 HG LEU 11 15.386 -0.072 -8.812 82 HB2 LEU 11 1HB LEU 11 13.140 -0.888 -9.518 83 HB3 LEU 11 2HB LEU 11 12.441 0.595 -8.904 84 HD11 LEU 11 1HD1 LEU 11 13.862 1.750 -10.669 85 HD12 LEU 11 2HD1 LEU 11 14.601 0.211 -11.107 86 HD13 LEU 11 3HD1 LEU 11 15.615 1.566 -10.608 87 HD21 LEU 11 3HD2 LEU 11 15.638 2.303 -8.256 88 HD22 LEU 11 1HD2 LEU 11 14.683 1.449 -7.043 89 HD23 LEU 11 2HD2 LEU 11 13.883 2.480 -8.230 90 H ASN 12 H ASN 12 11.878 -2.871 -8.093 91 HA ASN 12 HA ASN 12 9.819 -3.790 -7.948 92 HB2 ASN 12 1HB ASN 12 9.632 -1.973 -5.542 93 HB3 ASN 12 2HB ASN 12 8.381 -3.132 -5.974 94 HD21 ASN 12 2HD2 ASN 12 8.606 -4.351 -4.146 95 HD22 ASN 12 1HD2 ASN 12 9.996 -5.318 -3.809 96 H THR 13 H THR 13 10.315 -1.276 -9.460 97 HA THR 13 HA THR 13 8.081 0.410 -9.412 98 HB THR 13 HB THR 13 9.589 -0.252 -11.931 99 HG1 THR 13 HG1 THR 13 10.476 1.296 -9.698 100 HG21 THR 13 3HG2 THR 13 8.457 2.319 -10.816 101 HG22 THR 13 1HG2 THR 13 7.748 1.346 -12.105 102 HG23 THR 13 2HG2 THR 13 9.298 2.149 -12.357 103 H VAL 14 H VAL 14 6.096 0.314 -10.361 104 HA VAL 14 HA VAL 14 5.036 -2.125 -11.319 105 HB VAL 14 HB VAL 14 3.955 0.675 -11.717 106 HG11 VAL 14 1HG1 VAL 14 2.583 -2.002 -11.893 107 HG12 VAL 14 2HG1 VAL 14 2.938 -0.922 -13.239 108 HG13 VAL 14 3HG1 VAL 14 1.786 -0.434 -11.996 109 HG21 VAL 14 3HG2 VAL 14 3.379 -1.335 -9.543 110 HG22 VAL 14 1HG2 VAL 14 2.572 0.220 -9.748 111 HG23 VAL 14 2HG2 VAL 14 4.291 0.162 -9.357 112 H THR 15 H THR 15 5.915 -3.010 -13.098 113 HA THR 15 HA THR 15 7.026 -1.486 -15.212 114 HB THR 15 HB THR 15 6.847 -3.911 -16.338 115 HG1 THR 15 HG1 THR 15 5.589 -4.741 -14.563 116 HG21 THR 15 3HG2 THR 15 8.913 -2.707 -15.798 117 HG22 THR 15 1HG2 THR 15 9.028 -4.408 -15.343 118 HG23 THR 15 2HG2 THR 15 8.751 -3.181 -14.108 119 H ALA 16 H ALA 16 3.899 -3.057 -14.756 120 HA ALA 16 HA ALA 16 2.844 -1.479 -16.939 121 HB1 ALA 16 3HB ALA 16 3.628 -3.465 -18.120 122 HB2 ALA 16 1HB ALA 16 1.868 -3.363 -18.143 123 HB3 ALA 16 2HB ALA 16 2.673 -4.486 -17.049 124 H TYR 17 H TYR 17 0.614 -1.244 -16.883 125 HA TYR 17 HA TYR 17 -0.735 -2.376 -14.520 126 HD1 TYR 17 HD1 TYR 17 -1.352 -0.633 -12.244 127 HD2 TYR 17 HD2 TYR 17 -3.649 0.294 -15.703 128 HE1 TYR 17 HE1 TYR 17 -3.363 -0.435 -10.849 129 HE2 TYR 17 HE2 TYR 17 -5.669 0.495 -14.313 130 HH TYR 17 HH TYR 17 -6.479 -0.358 -12.099 131 HB2 TYR 17 1HB TYR 17 -0.279 0.082 -14.347 132 HB3 TYR 17 2HB TYR 17 -1.246 0.328 -15.796 133 H GLY 18 H GLY 18 -2.654 -3.403 -14.913 134 HA2 GLY 18 1HA GLY 18 -3.760 -3.143 -17.631 135 HA3 GLY 18 2HA GLY 18 -3.399 -4.730 -16.972 136 H ASP 19 H ASP 19 -5.827 -4.591 -17.736 137 HA ASP 19 HA ASP 19 -7.703 -3.399 -16.000 138 HB2 ASP 19 1HB ASP 19 -7.990 -5.686 -17.958 139 HB3 ASP 19 2HB ASP 19 -9.328 -4.862 -17.174 140 H GLY 20 H GLY 20 -7.452 -3.956 -13.875 141 HA2 GLY 20 1HA GLY 20 -8.206 -5.210 -12.074 142 HA3 GLY 20 2HA GLY 20 -8.535 -6.540 -13.173 143 H TYR 21 H TYR 21 -5.381 -5.229 -13.440 144 HA TYR 21 HA TYR 21 -4.233 -6.882 -11.382 145 HD1 TYR 21 HD1 TYR 21 -1.366 -7.310 -14.235 146 HD2 TYR 21 HD2 TYR 21 -5.401 -7.863 -15.457 147 HE1 TYR 21 HE1 TYR 21 -0.706 -6.902 -16.563 148 HE2 TYR 21 HE2 TYR 21 -4.751 -7.453 -17.794 149 HH TYR 21 HH TYR 21 -3.054 -6.549 -19.114 150 HB2 TYR 21 1HB TYR 21 -3.011 -8.403 -12.766 151 HB3 TYR 21 2HB TYR 21 -4.701 -8.507 -13.243 152 H ILE 22 H ILE 22 -2.053 -6.489 -11.018 153 HA ILE 22 HA ILE 22 -0.881 -4.281 -12.576 154 HB ILE 22 HB ILE 22 -0.455 -5.048 -9.681 155 HG12 ILE 22 1HG1 ILE 22 -0.979 -2.546 -9.406 156 HG13 ILE 22 2HG1 ILE 22 -1.555 -2.605 -11.067 157 HG21 ILE 22 1HG2 ILE 22 1.708 -4.569 -10.685 158 HG22 ILE 22 2HG2 ILE 22 1.238 -3.295 -9.559 159 HG23 ILE 22 3HG2 ILE 22 1.093 -3.033 -11.297 160 HD11 ILE 22 3HD1 ILE 22 -3.208 -4.284 -10.429 161 HD12 ILE 22 1HD1 ILE 22 -3.384 -2.800 -9.491 162 HD13 ILE 22 2HD1 ILE 22 -2.628 -4.218 -8.764 163 H GLU 23 H GLU 23 0.811 -4.834 -13.815 164 HA GLU 23 HA GLU 23 1.951 -7.502 -13.412 165 HB2 GLU 23 1HB GLU 23 1.038 -7.041 -15.637 166 HB3 GLU 23 2HB GLU 23 2.106 -5.655 -15.801 167 HG2 GLU 23 1HG GLU 23 4.045 -7.172 -15.650 168 HG3 GLU 23 2HG GLU 23 2.936 -8.540 -15.595 169 H VAL 24 H VAL 24 3.690 -7.538 -12.194 170 HA VAL 24 HA VAL 24 5.764 -5.497 -12.671 171 HB VAL 24 HB VAL 24 5.268 -6.987 -10.083 172 HG11 VAL 24 1HG1 VAL 24 7.624 -6.482 -10.442 173 HG12 VAL 24 2HG1 VAL 24 6.963 -5.487 -9.144 174 HG13 VAL 24 3HG1 VAL 24 7.227 -4.790 -10.742 175 HG21 VAL 24 3HG2 VAL 24 3.530 -5.328 -10.489 176 HG22 VAL 24 1HG2 VAL 24 4.760 -4.095 -10.771 177 HG23 VAL 24 2HG2 VAL 24 4.588 -4.817 -9.171 178 H ASN 25 H ASN 25 7.460 -6.310 -13.666 179 HA ASN 25 HA ASN 25 9.137 -7.699 -14.332 180 HB2 ASN 25 1HB ASN 25 9.342 -7.909 -11.765 181 HB3 ASN 25 2HB ASN 25 8.545 -9.464 -11.955 182 HD21 ASN 25 2HD2 ASN 25 9.665 -11.165 -12.909 183 HD22 ASN 25 1HD2 ASN 25 11.372 -11.113 -13.181 184 H GLN 26 H GLN 26 6.659 -8.035 -15.482 185 HA GLN 26 HA GLN 26 5.558 -9.387 -16.914 186 HB2 GLN 26 1HB GLN 26 7.995 -11.057 -16.419 187 HB3 GLN 26 2HB GLN 26 6.671 -11.685 -17.391 188 HG2 GLN 26 1HG GLN 26 8.105 -9.097 -17.937 189 HG3 GLN 26 2HG GLN 26 8.477 -10.635 -18.717 190 HE21 GLN 26 2HE2 GLN 26 6.124 -8.081 -18.389 191 HE22 GLN 26 1HE2 GLN 26 5.192 -8.493 -19.787 192 H VAL 27 H VAL 27 5.512 -9.773 -13.782 193 HA VAL 27 HA VAL 27 3.831 -12.183 -13.845 194 HB VAL 27 HB VAL 27 4.881 -10.707 -11.421 195 HG11 VAL 27 1HG1 VAL 27 3.537 -13.394 -11.679 196 HG12 VAL 27 2HG1 VAL 27 2.820 -11.933 -11.000 197 HG13 VAL 27 3HG1 VAL 27 4.184 -12.704 -10.191 198 HG21 VAL 27 3HG2 VAL 27 6.449 -12.575 -11.168 199 HG22 VAL 27 1HG2 VAL 27 6.721 -11.697 -12.675 200 HG23 VAL 27 2HG2 VAL 27 5.885 -13.250 -12.697 201 H ARG 28 H ARG 28 1.735 -11.786 -14.114 202 HA ARG 28 HA ARG 28 0.643 -9.165 -13.548 203 HE ARG 28 HE ARG 28 -0.401 -12.039 -18.562 204 HB2 ARG 28 1HB ARG 28 -0.870 -11.639 -14.398 205 HB3 ARG 28 2HB ARG 28 -1.396 -9.967 -14.534 206 HG2 ARG 28 1HG ARG 28 0.501 -9.601 -16.132 207 HG3 ARG 28 2HG ARG 28 0.769 -11.346 -16.100 208 HD2 ARG 28 1HD ARG 28 -1.705 -11.550 -16.720 209 HD3 ARG 28 2HD ARG 28 -1.622 -9.834 -17.111 210 HH11 ARG 28 1HH1 ARG 28 -0.646 -8.570 -18.142 211 HH12 ARG 28 2HH1 ARG 28 -0.010 -8.197 -19.708 212 HH21 ARG 28 1HH2 ARG 28 0.411 -11.554 -20.652 213 HH22 ARG 28 2HH2 ARG 28 0.580 -9.896 -21.137 214 H PHE 29 H PHE 29 0.452 -8.756 -11.421 215 HA PHE 29 HA PHE 29 -0.412 -10.810 -9.589 216 HD1 PHE 29 HD1 PHE 29 1.184 -10.707 -7.090 217 HD2 PHE 29 HD2 PHE 29 2.414 -8.008 -10.139 218 HE1 PHE 29 HE1 PHE 29 3.524 -11.371 -6.728 219 HE2 PHE 29 HE2 PHE 29 4.756 -8.671 -9.784 220 HZ PHE 29 HZ PHE 29 5.313 -10.351 -8.076 221 HB2 PHE 29 1HB PHE 29 0.205 -7.880 -9.192 222 HB3 PHE 29 2HB PHE 29 -0.295 -8.956 -7.893 223 H SER 30 H SER 30 -2.471 -11.315 -10.355 224 HA SER 30 HA SER 30 -4.545 -9.300 -10.244 225 HG SER 30 HG SER 30 -5.260 -10.882 -12.825 226 HB2 SER 30 1HB SER 30 -4.765 -12.299 -10.624 227 HB3 SER 30 2HB SER 30 -6.044 -11.117 -10.903 228 H HIS 31 H HIS 31 -3.399 -9.249 -7.870 229 HA HIS 31 HA HIS 31 -5.517 -9.833 -6.091 230 HD1 HIS 31 HD1 HIS 31 -2.574 -12.983 -7.317 231 HD2 HIS 31 HD2 HIS 31 -1.606 -10.598 -4.050 232 HE1 HIS 31 HE1 HIS 31 -0.088 -13.227 -7.009 233 HE2 HIS 31 HE2 HIS 31 0.409 -12.000 -4.862 234 HB2 HIS 31 1HB HIS 31 -4.340 -11.356 -4.551 235 HB3 HIS 31 2HB HIS 31 -4.597 -12.108 -6.119 236 H ALA 32 H ALA 32 -5.075 -8.960 -3.937 237 HA ALA 32 HA ALA 32 -3.829 -6.475 -4.071 238 HB1 ALA 32 3HB ALA 32 -5.566 -6.896 -2.479 239 HB2 ALA 32 1HB ALA 32 -4.111 -6.423 -1.606 240 HB3 ALA 32 2HB ALA 32 -4.592 -8.119 -1.668 241 H ILE 33 H ILE 33 -1.830 -5.751 -3.738 242 HA ILE 33 HA ILE 33 0.178 -7.529 -2.543 243 HB ILE 33 HB ILE 33 1.792 -6.795 -4.352 244 HG12 ILE 33 1HG1 ILE 33 -0.773 -6.133 -5.815 245 HG13 ILE 33 2HG1 ILE 33 0.393 -4.949 -5.235 246 HG21 ILE 33 1HG2 ILE 33 -0.510 -8.568 -5.143 247 HG22 ILE 33 2HG2 ILE 33 0.922 -9.054 -4.237 248 HG23 ILE 33 3HG2 ILE 33 1.075 -8.536 -5.917 249 HD11 ILE 33 3HD1 ILE 33 0.913 -7.065 -7.310 250 HD12 ILE 33 1HD1 ILE 33 2.075 -5.868 -6.738 251 HD13 ILE 33 2HD1 ILE 33 0.637 -5.349 -7.617 252 H ALA 34 H ALA 34 1.603 -6.526 -1.283 253 HA ALA 34 HA ALA 34 1.768 -3.584 -1.412 254 HB1 ALA 34 3HB ALA 34 0.618 -4.336 0.611 255 HB2 ALA 34 1HB ALA 34 2.173 -3.596 1.001 256 HB3 ALA 34 2HB ALA 34 1.998 -5.352 1.025 257 H PHE 35 H PHE 35 3.715 -2.946 -2.126 258 HA PHE 35 HA PHE 35 6.062 -4.527 -1.389 259 HD1 PHE 35 HD1 PHE 35 3.281 -4.842 -4.326 260 HD2 PHE 35 HD2 PHE 35 6.726 -2.476 -5.136 261 HE1 PHE 35 HE1 PHE 35 2.063 -3.687 -6.124 262 HE2 PHE 35 HE2 PHE 35 5.510 -1.316 -6.934 263 HZ PHE 35 HZ PHE 35 3.175 -1.922 -7.429 264 HB2 PHE 35 1HB PHE 35 6.883 -4.421 -3.759 265 HB3 PHE 35 2HB PHE 35 5.504 -5.480 -3.502 266 H ALA 36 H ALA 36 8.060 -3.464 -1.593 267 HA ALA 36 HA ALA 36 7.986 -0.565 -2.026 268 HB1 ALA 36 3HB ALA 36 9.215 -1.840 0.416 269 HB2 ALA 36 1HB ALA 36 7.649 -1.031 0.393 270 HB3 ALA 36 2HB ALA 36 9.117 -0.117 0.046 271 HA PRO 37 HA PRO 37 11.781 -1.189 -4.180 272 HB2 PRO 37 1HB PRO 37 12.922 1.153 -2.766 273 HB3 PRO 37 2HB PRO 37 12.701 0.880 -4.497 274 HG2 PRO 37 1HG PRO 37 11.132 2.581 -3.175 275 HG3 PRO 37 2HG PRO 37 10.479 1.539 -4.454 276 HD2 PRO 37 1HD PRO 37 10.287 1.238 -1.479 277 HD3 PRO 37 2HD PRO 37 9.051 0.953 -2.723 278 H GLU 38 H GLU 38 11.752 -1.110 -0.751 279 HA GLU 38 HA GLU 38 14.384 -2.427 -0.693 280 HB2 GLU 38 1HB GLU 38 13.158 -0.710 1.473 281 HB3 GLU 38 2HB GLU 38 14.703 -1.543 1.577 282 HG2 GLU 38 1HG GLU 38 15.321 -0.173 -0.519 283 HG3 GLU 38 2HG GLU 38 13.951 0.838 -0.064 284 H GLY 39 H GLY 39 11.572 -3.466 -0.948 285 HA2 GLY 39 1HA GLY 39 11.812 -5.485 1.144 286 HA3 GLY 39 2HA GLY 39 10.328 -4.544 1.135 287 HA PRO 40 HA PRO 40 10.046 -8.103 -1.942 288 HB2 PRO 40 1HB PRO 40 8.650 -9.915 -0.531 289 HB3 PRO 40 2HB PRO 40 10.412 -9.820 -0.435 290 HG2 PRO 40 1HG PRO 40 8.353 -8.774 1.464 291 HG3 PRO 40 2HG PRO 40 9.889 -9.585 1.815 292 HD2 PRO 40 1HD PRO 40 9.524 -6.864 1.918 293 HD3 PRO 40 2HD PRO 40 11.089 -7.647 1.626 294 H VAL 41 H VAL 41 7.977 -9.044 -2.811 295 HA VAL 41 HA VAL 41 5.847 -7.065 -2.605 296 HB VAL 41 HB VAL 41 5.986 -9.528 -4.356 297 HG11 VAL 41 1HG1 VAL 41 4.221 -7.087 -4.528 298 HG12 VAL 41 2HG1 VAL 41 3.716 -8.694 -4.004 299 HG13 VAL 41 3HG1 VAL 41 4.244 -8.434 -5.667 300 HG21 VAL 41 3HG2 VAL 41 7.824 -8.028 -4.868 301 HG22 VAL 41 1HG2 VAL 41 6.709 -6.667 -4.980 302 HG23 VAL 41 2HG2 VAL 41 6.622 -7.977 -6.157 303 H ALA 42 H ALA 42 4.822 -7.367 -0.677 304 HA ALA 42 HA ALA 42 4.162 -9.969 0.328 305 HB1 ALA 42 3HB ALA 42 3.202 -7.242 1.198 306 HB2 ALA 42 1HB ALA 42 4.593 -8.111 1.848 307 HB3 ALA 42 2HB ALA 42 2.965 -8.747 2.085 308 H SER 43 H SER 43 2.692 -11.163 -0.678 309 HA SER 43 HA SER 43 0.475 -9.931 -2.064 310 HG SER 43 HG SER 43 2.561 -11.294 -3.111 311 HB2 SER 43 1HB SER 43 1.302 -12.824 -1.753 312 HB3 SER 43 2HB SER 43 -0.069 -12.279 -2.721 313 H TRP 44 H TRP 44 -1.518 -9.764 -1.359 314 HA TRP 44 HA TRP 44 -2.172 -10.761 1.318 315 HD1 TRP 44 HD1 TRP 44 -0.776 -9.091 2.049 316 HE1 TRP 44 HE1 TRP 44 -0.431 -6.945 3.438 317 HE3 TRP 44 HE3 TRP 44 -5.023 -6.600 0.723 318 HZ2 TRP 44 HZ2 TRP 44 -1.809 -4.500 3.900 319 HZ3 TRP 44 HZ3 TRP 44 -5.449 -4.379 1.670 320 HH2 TRP 44 HH2 TRP 44 -3.883 -3.350 3.224 321 HB2 TRP 44 1HB TRP 44 -3.281 -8.628 -0.479 322 HB3 TRP 44 2HB TRP 44 -4.254 -9.265 0.834 323 HA PRO 45 HA PRO 45 -5.274 -13.525 -0.502 324 HB2 PRO 45 1HB PRO 45 -6.403 -13.892 2.117 325 HB3 PRO 45 2HB PRO 45 -5.389 -15.014 1.210 326 HG2 PRO 45 1HG PRO 45 -4.624 -13.751 3.535 327 HG3 PRO 45 2HG PRO 45 -3.501 -14.390 2.321 328 HD2 PRO 45 1HD PRO 45 -4.418 -11.576 2.766 329 HD3 PRO 45 2HD PRO 45 -2.807 -12.181 2.319 330 H VAL 46 H VAL 46 -5.625 -10.713 -0.540 331 HA VAL 46 HA VAL 46 -8.295 -10.253 0.590 332 HB VAL 46 HB VAL 46 -6.018 -8.362 0.004 333 HG11 VAL 46 1HG1 VAL 46 -7.975 -7.184 -0.694 334 HG12 VAL 46 2HG1 VAL 46 -7.502 -6.566 0.892 335 HG13 VAL 46 3HG1 VAL 46 -8.855 -7.691 0.746 336 HG21 VAL 46 3HG2 VAL 46 -7.497 -9.027 2.542 337 HG22 VAL 46 1HG2 VAL 46 -6.172 -7.874 2.389 338 HG23 VAL 46 2HG2 VAL 46 -5.884 -9.591 2.102 339 H GLN 47 H GLN 47 -9.912 -10.098 -0.773 340 HA GLN 47 HA GLN 47 -9.369 -9.317 -3.562 341 HB2 GLN 47 1HB GLN 47 -11.333 -11.306 -2.438 342 HB3 GLN 47 2HB GLN 47 -11.485 -10.654 -4.064 343 HG2 GLN 47 1HG GLN 47 -9.333 -11.569 -4.667 344 HG3 GLN 47 2HG GLN 47 -9.095 -12.150 -3.020 345 HE21 GLN 47 2HE2 GLN 47 -9.291 -13.491 -5.679 346 HE22 GLN 47 1HE2 GLN 47 -10.473 -14.745 -5.451 347 H ARG 48 H ARG 48 -10.885 -8.463 -0.703 348 HA ARG 48 HA ARG 48 -12.681 -6.634 -2.153 349 HE ARG 48 HE ARG 48 -12.727 -9.592 0.834 350 HB2 ARG 48 1HB ARG 48 -13.126 -7.893 0.568 351 HB3 ARG 48 2HB ARG 48 -14.136 -6.637 -0.124 352 HG2 ARG 48 1HG ARG 48 -15.320 -8.609 -0.483 353 HG3 ARG 48 2HG ARG 48 -14.563 -8.271 -2.038 354 HD2 ARG 48 1HD ARG 48 -14.459 -10.666 -1.302 355 HD3 ARG 48 2HD ARG 48 -12.900 -9.938 -1.683 356 HH11 ARG 48 1HH1 ARG 48 -14.431 -12.292 -0.634 357 HH12 ARG 48 2HH1 ARG 48 -14.205 -13.332 0.739 358 HH21 ARG 48 1HH2 ARG 48 -12.449 -10.940 2.629 359 HH22 ARG 48 2HH2 ARG 48 -13.062 -12.576 2.596 360 HA PRO 49 HA PRO 49 -10.230 -3.456 -0.210 361 HB2 PRO 49 1HB PRO 49 -12.066 -1.425 -0.378 362 HB3 PRO 49 2HB PRO 49 -11.031 -1.937 -1.716 363 HG2 PRO 49 1HG PRO 49 -13.886 -2.614 -1.158 364 HG3 PRO 49 2HG PRO 49 -13.102 -2.248 -2.704 365 HD2 PRO 49 1HD PRO 49 -13.695 -4.770 -1.944 366 HD3 PRO 49 2HD PRO 49 -12.266 -4.389 -2.929 367 H ALA 50 H ALA 50 -13.042 -4.820 1.001 368 HA ALA 50 HA ALA 50 -13.108 -3.178 3.411 369 HB1 ALA 50 3HB ALA 50 -15.127 -4.407 3.968 370 HB2 ALA 50 1HB ALA 50 -14.884 -5.468 2.581 371 HB3 ALA 50 2HB ALA 50 -15.229 -3.757 2.332 372 H ASP 51 H ASP 51 -11.229 -5.623 2.395 373 HA ASP 51 HA ASP 51 -11.329 -7.226 4.830 374 HB2 ASP 51 1HB ASP 51 -9.584 -7.427 2.374 375 HB3 ASP 51 2HB ASP 51 -9.440 -8.494 3.762 376 H ILE 52 H ILE 52 -9.882 -4.406 3.813 377 HA ILE 52 HA ILE 52 -7.251 -4.667 4.765 378 HB ILE 52 HB ILE 52 -8.880 -2.130 4.568 379 HG12 ILE 52 1HG1 ILE 52 -7.058 -3.422 2.522 380 HG13 ILE 52 2HG1 ILE 52 -8.817 -3.418 2.448 381 HG21 ILE 52 1HG2 ILE 52 -6.694 -1.028 4.347 382 HG22 ILE 52 2HG2 ILE 52 -5.895 -2.580 4.603 383 HG23 ILE 52 3HG2 ILE 52 -6.857 -1.859 5.894 384 HD11 ILE 52 3HD1 ILE 52 -7.039 -0.992 2.343 385 HD12 ILE 52 1HD1 ILE 52 -8.801 -0.985 2.267 386 HD13 ILE 52 2HD1 ILE 52 -7.866 -1.740 0.977 387 H THR 53 H THR 53 -6.885 -5.328 6.778 388 HA THR 53 HA THR 53 -8.259 -3.951 8.983 389 HB THR 53 HB THR 53 -7.533 -5.864 10.389 390 HG1 THR 53 HG1 THR 53 -6.840 -7.778 9.062 391 HG21 THR 53 3HG2 THR 53 -9.760 -5.903 9.385 392 HG22 THR 53 1HG2 THR 53 -9.083 -7.530 9.463 393 HG23 THR 53 2HG2 THR 53 -9.104 -6.654 7.931 394 H ALA 54 H ALA 54 -6.887 -3.625 10.943 395 HA ALA 54 HA ALA 54 -4.490 -2.272 10.382 396 HB1 ALA 54 3HB ALA 54 -5.452 -3.389 13.015 397 HB2 ALA 54 1HB ALA 54 -5.834 -1.796 12.365 398 HB3 ALA 54 2HB ALA 54 -4.173 -2.193 12.806 399 H SER 55 H SER 55 -5.200 -5.576 11.261 400 HA SER 55 HA SER 55 -2.647 -6.481 11.939 401 HG SER 55 HG SER 55 -5.468 -8.544 12.664 402 HB2 SER 55 1HB SER 55 -4.727 -8.091 10.450 403 HB3 SER 55 2HB SER 55 -3.522 -8.675 11.599 404 H LEU 56 H LEU 56 -4.311 -6.406 8.798 405 HA LEU 56 HA LEU 56 -2.212 -7.553 7.302 406 HG LEU 56 HG LEU 56 -5.286 -7.864 7.281 407 HB2 LEU 56 1HB LEU 56 -4.442 -5.709 6.448 408 HB3 LEU 56 2HB LEU 56 -3.380 -6.555 5.339 409 HD11 LEU 56 1HD1 LEU 56 -6.448 -6.756 5.459 410 HD12 LEU 56 2HD1 LEU 56 -6.517 -8.508 5.264 411 HD13 LEU 56 3HD1 LEU 56 -5.401 -7.555 4.286 412 HD21 LEU 56 3HD2 LEU 56 -3.287 -9.208 6.886 413 HD22 LEU 56 1HD2 LEU 56 -3.526 -9.059 5.145 414 HD23 LEU 56 2HD2 LEU 56 -4.704 -9.932 6.125 415 H LEU 57 H LEU 57 -2.945 -4.260 8.247 416 HA LEU 57 HA LEU 57 -1.116 -2.955 6.539 417 HG LEU 57 HG LEU 57 -3.979 -2.337 7.560 418 HB2 LEU 57 1HB LEU 57 -2.188 -2.122 9.235 419 HB3 LEU 57 2HB LEU 57 -1.302 -1.073 8.145 420 HD11 LEU 57 1HD1 LEU 57 -3.238 0.511 8.218 421 HD12 LEU 57 2HD1 LEU 57 -4.132 -0.600 9.256 422 HD13 LEU 57 3HD1 LEU 57 -4.837 -0.052 7.736 423 HD21 LEU 57 3HD2 LEU 57 -2.355 -0.345 5.979 424 HD22 LEU 57 1HD2 LEU 57 -3.984 -0.897 5.584 425 HD23 LEU 57 2HD2 LEU 57 -2.635 -2.032 5.545 426 H GLN 58 H GLN 58 -0.798 -4.326 9.775 427 HA GLN 58 HA GLN 58 1.826 -3.404 10.293 428 HB2 GLN 58 1HB GLN 58 0.425 -5.877 11.330 429 HB3 GLN 58 2HB GLN 58 1.889 -5.176 12.006 430 HG2 GLN 58 1HG GLN 58 0.702 -3.193 12.657 431 HG3 GLN 58 2HG GLN 58 -0.758 -3.756 11.845 432 HE21 GLN 58 2HE2 GLN 58 -0.353 -3.030 14.629 433 HE22 GLN 58 1HE2 GLN 58 -0.796 -4.417 15.554 434 H GLN 59 H GLN 59 0.552 -6.292 8.735 435 HA GLN 59 HA GLN 59 3.081 -7.576 8.433 436 HB2 GLN 59 1HB GLN 59 0.506 -8.016 6.912 437 HB3 GLN 59 2HB GLN 59 1.891 -9.102 6.925 438 HG2 GLN 59 1HG GLN 59 1.591 -9.490 9.302 439 HG3 GLN 59 2HG GLN 59 0.239 -8.359 9.329 440 HE21 GLN 59 2HE2 GLN 59 0.323 -11.165 10.049 441 HE22 GLN 59 1HE2 GLN 59 -0.867 -11.945 9.061 442 H ALA 60 H ALA 60 1.085 -5.509 6.390 443 HA ALA 60 HA ALA 60 2.731 -5.650 4.079 444 HB1 ALA 60 3HB ALA 60 0.798 -3.490 4.916 445 HB2 ALA 60 1HB ALA 60 0.389 -4.935 3.992 446 HB3 ALA 60 2HB ALA 60 1.462 -3.719 3.298 447 H ALA 61 H ALA 61 3.018 -4.004 7.059 448 HA ALA 61 HA ALA 61 4.778 -1.931 6.154 449 HB1 ALA 61 3HB ALA 61 3.430 -1.683 8.189 450 HB2 ALA 61 1HB ALA 61 5.152 -1.492 8.520 451 HB3 ALA 61 2HB ALA 61 4.334 -2.997 8.941 452 H GLY 62 H GLY 62 5.133 -5.226 6.471 453 HA2 GLY 62 1HA GLY 62 7.076 -6.435 5.989 454 HA3 GLY 62 2HA GLY 62 8.028 -4.990 6.299 455 H LEU 63 H LEU 63 5.874 -5.318 8.783 456 HA LEU 63 HA LEU 63 7.919 -6.001 10.648 457 HG LEU 63 HG LEU 63 5.899 -3.630 10.285 458 HB2 LEU 63 1HB LEU 63 4.936 -5.771 11.058 459 HB3 LEU 63 2HB LEU 63 6.135 -5.836 12.333 460 HD11 LEU 63 1HD1 LEU 63 4.025 -3.652 11.849 461 HD12 LEU 63 2HD1 LEU 63 5.086 -2.274 12.137 462 HD13 LEU 63 3HD1 LEU 63 5.151 -3.677 13.204 463 HD21 LEU 63 3HD2 LEU 63 8.189 -3.963 11.060 464 HD22 LEU 63 1HD2 LEU 63 7.642 -3.878 12.734 465 HD23 LEU 63 2HD2 LEU 63 7.517 -2.461 11.692 466 H ALA 64 H ALA 64 6.137 -7.899 8.629 467 HA ALA 64 HA ALA 64 5.643 -10.128 10.361 468 HB1 ALA 64 3HB ALA 64 5.052 -11.323 8.319 469 HB2 ALA 64 1HB ALA 64 5.692 -9.998 7.348 470 HB3 ALA 64 2HB ALA 64 4.277 -9.740 8.369 471 H GLU 65 H GLU 65 8.306 -8.983 8.455 472 HA GLU 65 HA GLU 65 9.689 -11.538 8.494 473 HB2 GLU 65 1HB GLU 65 10.622 -8.813 7.577 474 HB3 GLU 65 2HB GLU 65 11.535 -10.302 7.407 475 HG2 GLU 65 1HG GLU 65 9.698 -11.184 5.979 476 HG3 GLU 65 2HG GLU 65 8.945 -9.589 6.061 477 H VAL 66 H VAL 66 11.866 -11.698 9.402 478 HA VAL 66 HA VAL 66 12.255 -9.951 11.739 479 HB VAL 66 HB VAL 66 13.340 -12.752 11.366 480 HG11 VAL 66 1HG1 VAL 66 13.921 -12.594 13.742 481 HG12 VAL 66 2HG1 VAL 66 13.347 -10.926 13.768 482 HG13 VAL 66 3HG1 VAL 66 14.744 -11.363 12.785 483 HG21 VAL 66 3HG2 VAL 66 11.717 -13.428 13.079 484 HG22 VAL 66 1HG2 VAL 66 10.926 -12.824 11.622 485 HG23 VAL 66 2HG2 VAL 66 11.030 -11.804 13.057 486 H VAL 67 H VAL 67 13.450 -8.381 10.733 487 HA VAL 67 HA VAL 67 15.818 -9.127 9.217 488 HB VAL 67 HB VAL 67 16.118 -6.690 8.882 489 HG11 VAL 67 1HG1 VAL 67 13.365 -7.736 8.227 490 HG12 VAL 67 2HG1 VAL 67 14.831 -7.980 7.278 491 HG13 VAL 67 3HG1 VAL 67 14.152 -6.363 7.450 492 HG21 VAL 67 3HG2 VAL 67 13.546 -6.448 10.445 493 HG22 VAL 67 1HG2 VAL 67 14.356 -5.140 9.581 494 HG23 VAL 67 2HG2 VAL 67 15.136 -5.894 10.970 495 H ARG 68 H ARG 68 17.831 -7.681 9.760 496 HA ARG 68 HA ARG 68 19.568 -7.269 11.186 497 HE ARG 68 HE ARG 68 20.570 -4.463 15.431 498 HB2 ARG 68 1HB ARG 68 17.884 -5.734 12.254 499 HB3 ARG 68 2HB ARG 68 17.435 -7.046 13.329 500 HG2 ARG 68 1HG ARG 68 19.785 -7.065 14.166 501 HG3 ARG 68 2HG ARG 68 20.078 -5.615 13.199 502 HD2 ARG 68 1HD ARG 68 18.282 -4.462 14.398 503 HD3 ARG 68 2HD ARG 68 18.001 -5.907 15.365 504 HH11 ARG 68 1HH1 ARG 68 17.844 -5.940 17.041 505 HH12 ARG 68 2HH1 ARG 68 18.463 -5.667 18.640 506 HH21 ARG 68 1HH2 ARG 68 21.388 -4.060 17.533 507 HH22 ARG 68 2HH2 ARG 68 20.461 -4.563 18.920 508 H ASP 69 H ASP 69 18.872 -9.859 10.536 509 HA ASP 69 HA ASP 69 19.145 -11.375 13.047 510 HB2 ASP 69 1HB ASP 69 17.067 -11.757 11.691 511 HB3 ASP 69 2HB ASP 69 18.088 -12.368 10.394 512 HA PRO 70 HA PRO 70 23.032 -12.600 11.077 513 HB2 PRO 70 1HB PRO 70 24.553 -12.466 13.267 514 HB3 PRO 70 2HB PRO 70 24.035 -11.000 12.429 515 HG2 PRO 70 1HG PRO 70 23.081 -12.146 14.991 516 HG3 PRO 70 2HG PRO 70 23.137 -10.457 14.466 517 HD2 PRO 70 1HD PRO 70 20.894 -12.218 14.425 518 HD3 PRO 70 2HD PRO 70 20.980 -10.562 13.794 519 H LEU 71 H LEU 71 20.791 -14.208 12.605 520 HA LEU 71 HA LEU 71 22.452 -16.388 13.661 521 HG LEU 71 HG LEU 71 20.042 -18.255 14.254 522 HB2 LEU 71 1HB LEU 71 20.715 -15.448 15.134 523 HB3 LEU 71 2HB LEU 71 19.492 -15.849 13.946 524 HD11 LEU 71 1HD1 LEU 71 21.745 -17.237 16.524 525 HD12 LEU 71 2HD1 LEU 71 22.339 -17.984 15.041 526 HD13 LEU 71 3HD1 LEU 71 21.373 -18.926 16.178 527 HD21 LEU 71 3HD2 LEU 71 18.177 -17.211 15.439 528 HD22 LEU 71 1HD2 LEU 71 19.260 -16.771 16.761 529 HD23 LEU 71 2HD2 LEU 71 18.934 -18.470 16.416 530 H ALA 72 H ALA 72 19.803 -15.686 11.437 531 HA ALA 72 HA ALA 72 19.532 -18.359 10.475 532 HB1 ALA 72 3HB ALA 72 18.664 -15.776 9.182 533 HB2 ALA 72 1HB ALA 72 17.720 -16.707 10.345 534 HB3 ALA 72 2HB ALA 72 18.100 -17.394 8.766 535 H PHE 73 H PHE 73 21.634 -15.732 9.713 536 HA PHE 73 HA PHE 73 22.770 -17.313 7.512 537 HD1 PHE 73 HD2 PHE 73 22.447 -16.586 4.738 538 HD2 PHE 73 HD1 PHE 73 20.024 -14.315 7.400 539 HE1 PHE 73 HE2 PHE 73 20.512 -16.923 3.258 540 HE2 PHE 73 HE1 PHE 73 18.084 -14.651 5.925 541 HZ PHE 73 HZ PHE 73 18.328 -15.958 3.851 542 HB2 PHE 73 1HB PHE 73 22.396 -14.316 7.629 543 HB3 PHE 73 2HB PHE 73 23.430 -15.122 6.454 544 H LEU 74 H LEU 74 25.059 -16.856 7.103 545 HA LEU 74 HA LEU 74 26.489 -16.783 9.610 546 HG LEU 74 HG LEU 74 26.080 -18.998 7.377 547 HB2 LEU 74 1HB LEU 74 27.507 -17.095 6.784 548 HB3 LEU 74 2HB LEU 74 28.453 -17.338 8.240 549 HD11 LEU 74 1HD1 LEU 74 29.029 -19.614 7.467 550 HD12 LEU 74 2HD1 LEU 74 28.040 -19.425 6.018 551 HD13 LEU 74 3HD1 LEU 74 27.752 -20.779 7.112 552 HD21 LEU 74 3HD2 LEU 74 26.214 -18.803 9.806 553 HD22 LEU 74 1HD2 LEU 74 27.907 -19.296 9.758 554 HD23 LEU 74 2HD2 LEU 74 26.645 -20.428 9.272 555 H ASP 75 H ASP 75 25.416 -14.430 7.592 556 HA ASP 75 HA ASP 75 27.406 -12.550 8.600 557 HB2 ASP 75 1HB ASP 75 28.056 -13.225 6.265 558 HB3 ASP 75 2HB ASP 75 26.527 -12.555 5.705 559 H GLU 76 H GLU 76 26.512 -10.660 9.258 560 HA GLU 76 HA GLU 76 23.623 -10.555 9.237 561 HB2 GLU 76 1HB GLU 76 23.972 -8.603 10.790 562 HB3 GLU 76 2HB GLU 76 24.610 -10.140 11.353 563 HG2 GLU 76 1HG GLU 76 26.856 -9.410 10.528 564 HG3 GLU 76 2HG GLU 76 26.154 -7.822 10.224 565 HA PRO 77 HA PRO 77 23.691 -7.784 5.769 566 HB2 PRO 77 1HB PRO 77 20.813 -7.837 5.810 567 HB3 PRO 77 2HB PRO 77 21.910 -8.660 4.700 568 HG2 PRO 77 1HG PRO 77 20.328 -9.949 6.534 569 HG3 PRO 77 2HG PRO 77 21.836 -10.612 5.881 570 HD2 PRO 77 1HD PRO 77 21.341 -9.243 8.498 571 HD3 PRO 77 2HD PRO 77 22.352 -10.661 8.139 572 H GLU 78 H GLU 78 22.642 -5.736 5.134 573 HA GLU 78 HA GLU 78 22.347 -3.977 7.444 574 HB2 GLU 78 1HB GLU 78 22.555 -3.341 4.492 575 HB3 GLU 78 2HB GLU 78 22.542 -2.159 5.791 576 HG2 GLU 78 1HG GLU 78 24.653 -2.923 6.599 577 HG3 GLU 78 2HG GLU 78 24.639 -4.291 5.484 578 H ALA 79 H ALA 79 20.756 -2.018 6.754 579 HA ALA 79 HA ALA 79 18.140 -3.204 6.348 580 HB1 ALA 79 3HB ALA 79 18.924 -0.338 6.889 581 HB2 ALA 79 1HB ALA 79 18.407 -1.516 8.095 582 HB3 ALA 79 2HB ALA 79 17.277 -0.965 6.857 583 H GLY 80 H GLY 80 19.914 -0.453 4.937 584 HA2 GLY 80 1HA GLY 80 19.958 -1.110 2.325 585 HA3 GLY 80 2HA GLY 80 18.306 -0.549 2.542 586 H ALA 81 H ALA 81 17.992 1.491 2.052 587 HA ALA 81 HA ALA 81 20.279 3.328 2.030 588 HB1 ALA 81 3HB ALA 81 18.927 3.173 -0.004 589 HB2 ALA 81 1HB ALA 81 18.851 4.790 0.695 590 HB3 ALA 81 2HB ALA 81 17.500 3.674 0.903 591 H GLY 82 H GLY 82 17.708 2.480 4.010 592 HA2 GLY 82 1HA GLY 82 17.451 5.160 5.168 593 HA3 GLY 82 2HA GLY 82 16.415 3.784 5.514 594 H ALA 83 H ALA 83 18.153 5.701 7.158 595 HA ALA 83 HA ALA 83 20.108 4.082 8.445 596 HB1 ALA 83 3HB ALA 83 18.732 6.581 9.426 597 HB2 ALA 83 1HB ALA 83 20.219 6.523 8.478 598 HB3 ALA 83 2HB ALA 83 20.189 5.862 10.114 599 H ARG 84 H ARG 84 16.703 4.598 8.856 600 HA ARG 84 HA ARG 84 16.678 2.950 11.273 601 HE ARG 84 HE ARG 84 12.117 3.925 10.803 602 HB2 ARG 84 1HB ARG 84 14.259 3.566 11.380 603 HB3 ARG 84 2HB ARG 84 15.342 4.946 11.468 604 HG2 ARG 84 1HG ARG 84 14.910 5.434 9.110 605 HG3 ARG 84 2HG ARG 84 13.821 4.047 9.027 606 HD2 ARG 84 1HD ARG 84 13.469 6.419 10.860 607 HD3 ARG 84 2HD ARG 84 12.638 6.204 9.321 608 HH11 ARG 84 1HH1 ARG 84 11.570 7.373 11.167 609 HH12 ARG 84 2HH1 ARG 84 10.085 7.172 12.048 610 HH21 ARG 84 1HH2 ARG 84 10.183 3.660 11.984 611 HH22 ARG 84 2HH2 ARG 84 9.298 5.050 12.524 612 HA PRO 85 HA PRO 85 15.585 -0.929 9.585 613 HB2 PRO 85 1HB PRO 85 12.894 -0.552 10.848 614 HB3 PRO 85 2HB PRO 85 13.952 -1.968 10.866 615 HG2 PRO 85 1HG PRO 85 13.827 -0.336 12.968 616 HG3 PRO 85 2HG PRO 85 15.364 -1.061 12.461 617 HD2 PRO 85 1HD PRO 85 14.422 1.735 12.213 618 HD3 PRO 85 2HD PRO 85 16.077 1.103 12.310 619 H ALA 86 H ALA 86 15.091 -1.373 7.558 620 HA ALA 86 HA ALA 86 13.567 0.365 5.934 621 HB1 ALA 86 3HB ALA 86 15.441 -0.943 5.066 622 HB2 ALA 86 1HB ALA 86 13.962 -1.253 4.154 623 HB3 ALA 86 2HB ALA 86 14.531 -2.430 5.339 624 H ASN 87 H ASN 87 12.858 -2.670 7.541 625 HA ASN 87 HA ASN 87 10.272 -2.946 6.318 626 HB2 ASN 87 1HB ASN 87 11.616 -4.399 8.592 627 HB3 ASN 87 2HB ASN 87 9.943 -4.709 8.141 628 HD21 ASN 87 2HD2 ASN 87 10.151 -6.737 7.393 629 HD22 ASN 87 1HD2 ASN 87 11.082 -7.177 5.994 630 H ALA 88 H ALA 88 10.056 -0.601 6.962 631 HA ALA 88 HA ALA 88 7.831 -0.440 8.665 632 HB1 ALA 88 3HB ALA 88 8.667 1.075 10.385 633 HB2 ALA 88 1HB ALA 88 10.303 0.927 9.745 634 HB3 ALA 88 2HB ALA 88 9.507 -0.473 10.467 635 HA PRO 89 HA PRO 89 7.973 2.228 4.974 636 HB2 PRO 89 1HB PRO 89 5.264 2.890 5.373 637 HB3 PRO 89 2HB PRO 89 5.898 1.643 4.300 638 HG2 PRO 89 1HG PRO 89 4.783 1.394 7.044 639 HG3 PRO 89 2HG PRO 89 4.697 0.260 5.682 640 HD2 PRO 89 1HD PRO 89 6.331 -0.178 7.750 641 HD3 PRO 89 2HD PRO 89 6.819 -0.584 6.090 642 H GLU 90 H GLU 90 8.449 4.293 4.826 643 HA GLU 90 HA GLU 90 8.083 6.105 7.025 644 HB2 GLU 90 1HB GLU 90 10.012 6.126 5.370 645 HB3 GLU 90 2HB GLU 90 8.880 6.750 4.181 646 HG2 GLU 90 1HG GLU 90 8.486 8.705 5.598 647 HG3 GLU 90 2HG GLU 90 9.651 8.080 6.768 648 H VAL 91 H VAL 91 6.843 5.747 3.734 649 HA VAL 91 HA VAL 91 4.311 6.910 4.656 650 HB VAL 91 HB VAL 91 5.397 8.620 3.303 651 HG11 VAL 91 1HG1 VAL 91 5.922 8.263 0.948 652 HG12 VAL 91 2HG1 VAL 91 5.490 6.561 1.107 653 HG13 VAL 91 3HG1 VAL 91 6.877 7.205 1.987 654 HG21 VAL 91 3HG2 VAL 91 3.664 8.956 1.602 655 HG22 VAL 91 1HG2 VAL 91 2.978 8.442 3.145 656 HG23 VAL 91 2HG2 VAL 91 3.134 7.289 1.820 657 H LEU 92 H LEU 92 2.535 5.779 4.098 658 HA LEU 92 HA LEU 92 2.968 3.380 2.443 659 HG LEU 92 HG LEU 92 0.212 2.087 3.189 660 HB2 LEU 92 1HB LEU 92 2.636 2.856 4.822 661 HB3 LEU 92 2HB LEU 92 1.120 3.733 4.807 662 HD11 LEU 92 1HD1 LEU 92 2.814 0.649 3.689 663 HD12 LEU 92 2HD1 LEU 92 2.284 1.357 2.162 664 HD13 LEU 92 3HD1 LEU 92 1.418 -0.019 2.844 665 HD21 LEU 92 3HD2 LEU 92 -0.066 0.278 4.787 666 HD22 LEU 92 1HD2 LEU 92 -0.173 1.841 5.594 667 HD23 LEU 92 2HD2 LEU 92 1.299 0.878 5.728 668 H LEU 93 H LEU 93 1.882 3.407 0.608 669 HA LEU 93 HA LEU 93 -0.486 5.134 0.385 670 HG LEU 93 HG LEU 93 2.486 5.632 -0.726 671 HB2 LEU 93 1HB LEU 93 1.174 3.868 -1.798 672 HB3 LEU 93 2HB LEU 93 -0.157 4.984 -2.034 673 HD11 LEU 93 1HD1 LEU 93 2.675 5.352 -3.124 674 HD12 LEU 93 2HD1 LEU 93 2.816 7.057 -2.693 675 HD13 LEU 93 3HD1 LEU 93 1.313 6.442 -3.379 676 HD21 LEU 93 3HD2 LEU 93 0.660 6.902 0.280 677 HD22 LEU 93 1HD2 LEU 93 0.127 7.414 -1.322 678 HD23 LEU 93 2HD2 LEU 93 1.692 7.940 -0.702 679 H VAL 94 H VAL 94 -2.261 4.018 0.898 680 HA VAL 94 HA VAL 94 -2.485 1.220 0.072 681 HB VAL 94 HB VAL 94 -4.336 2.860 1.819 682 HG11 VAL 94 1HG1 VAL 94 -5.340 0.716 2.422 683 HG12 VAL 94 2HG1 VAL 94 -4.264 -0.112 1.295 684 HG13 VAL 94 3HG1 VAL 94 -5.478 1.016 0.689 685 HG21 VAL 94 3HG2 VAL 94 -3.387 1.576 3.682 686 HG22 VAL 94 1HG2 VAL 94 -2.156 2.538 2.864 687 HG23 VAL 94 2HG2 VAL 94 -2.258 0.803 2.569 688 H GLY 95 H GLY 95 -3.385 0.785 -1.811 689 HA2 GLY 95 1HA GLY 95 -5.251 2.691 -3.016 690 HA3 GLY 95 2HA GLY 95 -4.505 1.312 -3.817 691 H THR 96 H THR 96 -7.353 2.462 -2.695 692 HA THR 96 HA THR 96 -8.399 0.180 -1.361 693 HB THR 96 HB THR 96 -10.635 1.434 -2.016 694 HG1 THR 96 HG1 THR 96 -9.627 2.898 -3.464 695 HG21 THR 96 3HG2 THR 96 -10.325 2.855 -0.033 696 HG22 THR 96 1HG2 THR 96 -8.597 2.508 -0.063 697 HG23 THR 96 2HG2 THR 96 -9.750 1.212 0.248 698 H GLY 97 H GLY 97 -7.720 0.661 -4.590 699 HA2 GLY 97 1HA GLY 97 -7.951 -0.835 -6.320 700 HA3 GLY 97 2HA GLY 97 -8.833 -1.887 -5.227 701 H ARG 98 H ARG 98 -11.102 -1.418 -4.875 702 HA ARG 98 HA ARG 98 -12.530 -1.263 -7.255 703 HE ARG 98 HE ARG 98 -15.463 -2.952 -3.749 704 HB2 ARG 98 1HB ARG 98 -13.409 -2.304 -5.201 705 HB3 ARG 98 2HB ARG 98 -13.531 -0.716 -4.450 706 HG2 ARG 98 1HG ARG 98 -15.074 -0.080 -6.338 707 HG3 ARG 98 2HG ARG 98 -15.098 -1.786 -6.774 708 HD2 ARG 98 1HD ARG 98 -15.905 -0.670 -4.094 709 HD3 ARG 98 2HD ARG 98 -17.022 -1.091 -5.389 710 HH11 ARG 98 1HH1 ARG 98 -17.799 -2.457 -6.334 711 HH12 ARG 98 2HH1 ARG 98 -18.488 -4.041 -6.161 712 HH21 ARG 98 1HH2 ARG 98 -16.378 -5.031 -3.543 713 HH22 ARG 98 2HH2 ARG 98 -17.699 -5.500 -4.567 714 H ARG 99 H ARG 99 -12.366 1.148 -4.665 715 HA ARG 99 HA ARG 99 -12.001 3.334 -6.366 716 HE ARG 99 HE ARG 99 -17.453 4.132 -3.912 717 HB2 ARG 99 1HB ARG 99 -14.132 4.487 -6.164 718 HB3 ARG 99 2HB ARG 99 -14.361 2.941 -6.964 719 HG2 ARG 99 1HG ARG 99 -15.100 2.027 -4.742 720 HG3 ARG 99 2HG ARG 99 -15.099 3.691 -4.152 721 HD2 ARG 99 1HD ARG 99 -16.566 4.168 -6.236 722 HD3 ARG 99 2HD ARG 99 -16.833 2.425 -6.239 723 HH11 ARG 99 1HH1 ARG 99 -18.361 1.595 -6.195 724 HH12 ARG 99 2HH1 ARG 99 -19.852 1.243 -5.370 725 HH21 ARG 99 1HH2 ARG 99 -19.435 3.681 -2.887 726 HH22 ARG 99 2HH2 ARG 99 -20.458 2.409 -3.498 727 H GLN 100 H GLN 100 -11.877 5.336 -5.151 728 HA GLN 100 HA GLN 100 -10.286 4.856 -2.922 729 HB2 GLN 100 1HB GLN 100 -10.209 6.816 -4.527 730 HB3 GLN 100 2HB GLN 100 -11.525 7.516 -3.594 731 HG2 GLN 100 1HG GLN 100 -10.122 7.506 -1.599 732 HG3 GLN 100 2HG GLN 100 -8.804 6.794 -2.528 733 HE21 GLN 100 2HE2 GLN 100 -8.813 9.280 -1.088 734 HE22 GLN 100 1HE2 GLN 100 -8.488 10.532 -2.241 735 H HIS 101 H HIS 101 -10.647 4.640 -0.851 736 HA HIS 101 HA HIS 101 -13.119 5.746 0.306 737 HD1 HIS 101 HD1 HIS 101 -12.907 1.075 0.090 738 HD2 HIS 101 HD2 HIS 101 -15.111 4.521 -0.635 739 HE1 HIS 101 HE1 HIS 101 -14.786 0.366 -1.426 740 HE2 HIS 101 HE2 HIS 101 -16.204 2.433 -1.697 741 HB2 HIS 101 1HB HIS 101 -11.814 3.105 1.007 742 HB3 HIS 101 2HB HIS 101 -13.140 3.833 1.900 743 H LEU 102 H LEU 102 -12.914 6.599 2.388 744 HA LEU 102 HA LEU 102 -10.198 7.306 3.148 745 HG LEU 102 HG LEU 102 -11.077 8.421 5.972 746 HB2 LEU 102 1HB LEU 102 -11.926 9.036 3.137 747 HB3 LEU 102 2HB LEU 102 -12.869 8.123 4.297 748 HD11 LEU 102 1HD1 LEU 102 -9.819 10.182 3.872 749 HD12 LEU 102 2HD1 LEU 102 -9.185 8.642 4.454 750 HD13 LEU 102 3HD1 LEU 102 -9.284 10.023 5.545 751 HD21 LEU 102 3HD2 LEU 102 -12.955 9.973 5.897 752 HD22 LEU 102 1HD2 LEU 102 -12.085 10.983 4.742 753 HD23 LEU 102 2HD2 LEU 102 -11.474 10.796 6.385 754 H LEU 103 H LEU 103 -9.079 6.295 4.684 755 HA LEU 103 HA LEU 103 -10.276 4.119 6.138 756 HG LEU 103 HG LEU 103 -7.843 4.357 4.068 757 HB2 LEU 103 1HB LEU 103 -7.482 5.257 6.302 758 HB3 LEU 103 2HB LEU 103 -8.014 3.749 7.020 759 HD11 LEU 103 1HD1 LEU 103 -6.100 2.639 4.076 760 HD12 LEU 103 2HD1 LEU 103 -6.243 2.508 5.829 761 HD13 LEU 103 3HD1 LEU 103 -5.674 4.010 5.099 762 HD21 LEU 103 3HD2 LEU 103 -8.449 2.005 3.740 763 HD22 LEU 103 1HD2 LEU 103 -9.743 2.903 4.535 764 HD23 LEU 103 2HD2 LEU 103 -8.705 1.830 5.477 765 H GLY 104 H GLY 104 -9.609 3.948 8.567 766 HA2 GLY 104 1HA GLY 104 -10.631 6.427 9.793 767 HA3 GLY 104 2HA GLY 104 -10.859 4.810 10.442 768 HA PRO 105 HA PRO 105 -7.057 7.296 12.109 769 HB2 PRO 105 1HB PRO 105 -8.706 7.555 14.551 770 HB3 PRO 105 2HB PRO 105 -7.704 8.759 13.734 771 HG2 PRO 105 1HG PRO 105 -10.371 8.871 13.615 772 HG3 PRO 105 2HG PRO 105 -9.366 9.313 12.222 773 HD2 PRO 105 1HD PRO 105 -10.901 6.793 12.731 774 HD3 PRO 105 2HD PRO 105 -10.702 7.705 11.220 775 H GLU 106 H GLU 106 -9.253 4.936 13.557 776 HA GLU 106 HA GLU 106 -7.252 4.022 15.433 777 HB2 GLU 106 1HB GLU 106 -9.621 4.036 16.062 778 HB3 GLU 106 2HB GLU 106 -9.981 2.908 14.764 779 HG2 GLU 106 1HG GLU 106 -8.662 1.192 15.837 780 HG3 GLU 106 2HG GLU 106 -8.180 2.323 17.101 781 H GLN 107 H GLN 107 -8.337 3.219 12.257 782 HA GLN 107 HA GLN 107 -7.427 0.531 12.180 783 HB2 GLN 107 1HB GLN 107 -7.819 2.498 9.916 784 HB3 GLN 107 2HB GLN 107 -7.611 0.760 9.734 785 HG2 GLN 107 1HG GLN 107 -9.680 0.361 10.934 786 HG3 GLN 107 2HG GLN 107 -9.881 2.093 11.197 787 HE21 GLN 107 2HE2 GLN 107 -11.635 0.214 9.842 788 HE22 GLN 107 1HE2 GLN 107 -11.836 0.814 8.236 789 H VAL 108 H VAL 108 -5.960 3.608 11.216 790 HA VAL 108 HA VAL 108 -3.431 2.236 10.652 791 HB VAL 108 HB VAL 108 -2.685 4.385 9.711 792 HG11 VAL 108 1HG1 VAL 108 -4.186 4.425 7.776 793 HG12 VAL 108 2HG1 VAL 108 -5.366 3.472 8.676 794 HG13 VAL 108 3HG1 VAL 108 -3.798 2.775 8.263 795 HG21 VAL 108 3HG2 VAL 108 -3.952 5.895 11.150 796 HG22 VAL 108 1HG2 VAL 108 -5.457 5.355 10.406 797 HG23 VAL 108 2HG2 VAL 108 -4.267 6.239 9.448 798 H ARG 109 H ARG 109 -4.774 3.055 13.324 799 HA ARG 109 HA ARG 109 -3.416 5.123 14.567 800 HE ARG 109 HE ARG 109 -4.866 5.371 19.582 801 HB2 ARG 109 1HB ARG 109 -5.472 3.789 15.327 802 HB3 ARG 109 2HB ARG 109 -4.326 2.662 16.035 803 HG2 ARG 109 1HG ARG 109 -3.450 4.394 17.469 804 HG3 ARG 109 2HG ARG 109 -4.497 5.593 16.702 805 HD2 ARG 109 1HD ARG 109 -6.446 4.149 17.403 806 HD3 ARG 109 2HD ARG 109 -5.304 3.237 18.386 807 HH11 ARG 109 1HH1 ARG 109 -7.838 4.939 17.792 808 HH12 ARG 109 2HH1 ARG 109 -8.749 6.062 18.749 809 HH21 ARG 109 1HH2 ARG 109 -6.075 6.837 20.890 810 HH22 ARG 109 2HH2 ARG 109 -7.754 7.125 20.522 811 HA PRO 110 HA PRO 110 -0.305 1.874 16.486 812 HB2 PRO 110 1HB PRO 110 -0.283 -0.195 14.361 813 HB3 PRO 110 2HB PRO 110 -0.218 -0.382 16.117 814 HG2 PRO 110 1HG PRO 110 -2.431 -0.972 14.758 815 HG3 PRO 110 2HG PRO 110 -2.514 -0.199 16.352 816 HD2 PRO 110 1HD PRO 110 -2.863 1.012 13.638 817 HD3 PRO 110 2HD PRO 110 -3.757 1.331 15.138 818 H LEU 111 H LEU 111 -0.589 2.188 12.980 819 HA LEU 111 HA LEU 111 2.239 2.126 12.535 820 HG LEU 111 HG LEU 111 -0.117 0.560 11.182 821 HB2 LEU 111 1HB LEU 111 -0.038 2.948 10.736 822 HB3 LEU 111 2HB LEU 111 1.633 2.824 10.221 823 HD11 LEU 111 1HD1 LEU 111 0.186 -0.266 8.886 824 HD12 LEU 111 2HD1 LEU 111 1.048 1.219 8.482 825 HD13 LEU 111 3HD1 LEU 111 -0.655 1.282 8.938 826 HD21 LEU 111 3HD2 LEU 111 2.760 0.531 10.276 827 HD22 LEU 111 1HD2 LEU 111 1.775 -0.890 10.626 828 HD23 LEU 111 2HD2 LEU 111 2.184 0.239 11.918 829 H LEU 112 H LEU 112 -0.205 4.648 12.869 830 HA LEU 112 HA LEU 112 1.326 6.851 12.094 831 HG LEU 112 HG LEU 112 -1.697 6.117 11.998 832 HB2 LEU 112 1HB LEU 112 -0.813 6.667 14.217 833 HB3 LEU 112 2HB LEU 112 -0.163 8.171 13.594 834 HD11 LEU 112 1HD1 LEU 112 -3.072 7.377 13.597 835 HD12 LEU 112 2HD1 LEU 112 -3.452 7.791 11.926 836 HD13 LEU 112 3HD1 LEU 112 -2.477 8.885 12.906 837 HD21 LEU 112 3HD2 LEU 112 -0.036 7.236 10.621 838 HD22 LEU 112 1HD2 LEU 112 -0.592 8.809 11.196 839 HD23 LEU 112 2HD2 LEU 112 -1.655 7.803 10.213 840 H ALA 113 H ALA 113 1.057 5.241 15.226 841 HA ALA 113 HA ALA 113 2.733 7.028 16.644 842 HB1 ALA 113 3HB ALA 113 1.142 5.565 17.765 843 HB2 ALA 113 1HB ALA 113 2.777 5.301 18.371 844 HB3 ALA 113 2HB ALA 113 2.059 4.152 17.242 845 H MET 114 H MET 114 3.381 4.342 14.547 846 HA MET 114 HA MET 114 6.092 3.959 15.462 847 HB2 MET 114 1HB MET 114 4.609 2.887 13.054 848 HB3 MET 114 2HB MET 114 6.264 2.453 13.465 849 HG2 MET 114 1HG MET 114 5.524 1.464 15.541 850 HG3 MET 114 2HG MET 114 3.868 1.977 15.221 851 HE1 MET 114 3HE MET 114 4.717 -1.025 15.951 852 HE2 MET 114 1HE MET 114 3.711 -1.925 14.816 853 HE3 MET 114 2HE MET 114 3.051 -0.523 15.660 854 H GLY 115 H GLY 115 4.448 5.955 13.200 855 HA2 GLY 115 1HA GLY 115 5.590 7.922 12.372 856 HA3 GLY 115 2HA GLY 115 7.050 6.952 12.234 857 H VAL 116 H VAL 116 4.154 5.424 11.265 858 HA VAL 116 HA VAL 116 5.052 5.498 8.489 859 HB VAL 116 HB VAL 116 2.834 3.855 9.731 860 HG11 VAL 116 1HG1 VAL 116 3.002 2.500 7.705 861 HG12 VAL 116 2HG1 VAL 116 4.236 3.589 7.074 862 HG13 VAL 116 3HG1 VAL 116 2.590 4.172 7.323 863 HG21 VAL 116 3HG2 VAL 116 4.412 1.987 9.682 864 HG22 VAL 116 1HG2 VAL 116 4.990 3.290 10.720 865 HG23 VAL 116 2HG2 VAL 116 5.681 3.071 9.112 866 H GLY 117 H GLY 117 4.309 7.199 7.365 867 HA2 GLY 117 1HA GLY 117 1.762 8.424 7.949 868 HA3 GLY 117 2HA GLY 117 2.865 8.871 6.655 869 H VAL 118 H VAL 118 0.262 6.739 7.602 870 HA VAL 118 HA VAL 118 0.113 5.448 5.024 871 HB VAL 118 HB VAL 118 -1.901 5.347 7.274 872 HG11 VAL 118 1HG1 VAL 118 -2.742 4.572 5.115 873 HG12 VAL 118 2HG1 VAL 118 -2.582 3.238 6.256 874 HG13 VAL 118 3HG1 VAL 118 -1.383 3.455 4.982 875 HG21 VAL 118 3HG2 VAL 118 0.290 4.669 8.095 876 HG22 VAL 118 1HG2 VAL 118 0.453 3.535 6.754 877 HG23 VAL 118 2HG2 VAL 118 -0.792 3.280 7.977 878 H GLU 119 H GLU 119 -0.958 6.178 3.312 879 HA GLU 119 HA GLU 119 -3.274 7.943 3.746 880 HB2 GLU 119 1HB GLU 119 -1.238 8.196 1.523 881 HB3 GLU 119 2HB GLU 119 -2.695 9.167 1.692 882 HG2 GLU 119 1HG GLU 119 -1.762 9.861 3.960 883 HG3 GLU 119 2HG GLU 119 -0.238 9.166 3.409 884 H ALA 120 H ALA 120 -5.003 7.670 2.321 885 HA ALA 120 HA ALA 120 -4.939 5.097 0.882 886 HB1 ALA 120 3HB ALA 120 -7.309 6.473 2.141 887 HB2 ALA 120 1HB ALA 120 -6.421 5.115 2.835 888 HB3 ALA 120 2HB ALA 120 -7.319 4.906 1.331 889 H MET 121 H MET 121 -5.313 5.082 -1.218 890 HA MET 121 HA MET 121 -6.850 7.204 -2.494 891 HB2 MET 121 1HB MET 121 -3.966 6.595 -3.167 892 HB3 MET 121 2HB MET 121 -5.048 7.423 -4.276 893 HG2 MET 121 1HG MET 121 -5.340 9.224 -2.665 894 HG3 MET 121 2HG MET 121 -4.285 8.387 -1.529 895 HE1 MET 121 3HE MET 121 -1.693 8.002 -1.924 896 HE2 MET 121 1HE MET 121 -0.837 8.506 -3.382 897 HE3 MET 121 2HE MET 121 -2.040 7.218 -3.465 898 H ASP 122 H ASP 122 -6.673 6.621 -5.066 899 HA ASP 122 HA ASP 122 -7.621 3.890 -5.257 900 HB2 ASP 122 1HB ASP 122 -7.614 6.265 -7.044 901 HB3 ASP 122 2HB ASP 122 -7.638 4.681 -7.815 902 H THR 123 H THR 123 -6.835 2.458 -6.981 903 HA THR 123 HA THR 123 -4.128 1.872 -6.761 904 HB THR 123 HB THR 123 -5.815 1.111 -9.147 905 HG1 THR 123 HG1 THR 123 -6.889 -0.312 -7.895 906 HG21 THR 123 3HG2 THR 123 -4.549 -0.976 -9.020 907 HG22 THR 123 1HG2 THR 123 -3.684 -0.375 -7.605 908 HG23 THR 123 2HG2 THR 123 -3.461 0.405 -9.172 909 H GLN 124 H GLN 124 -5.873 3.720 -9.194 910 HA GLN 124 HA GLN 124 -3.855 4.126 -11.070 911 HB2 GLN 124 1HB GLN 124 -6.184 4.689 -11.487 912 HB3 GLN 124 2HB GLN 124 -6.138 5.925 -10.240 913 HG2 GLN 124 1HG GLN 124 -4.510 7.188 -11.580 914 HG3 GLN 124 2HG GLN 124 -4.616 5.957 -12.840 915 HE21 GLN 124 2HE2 GLN 124 -5.284 8.822 -12.925 916 HE22 GLN 124 1HE2 GLN 124 -6.936 8.897 -13.424 917 H ALA 125 H ALA 125 -4.794 6.189 -8.326 918 HA ALA 125 HA ALA 125 -2.749 8.106 -8.779 919 HB1 ALA 125 3HB ALA 125 -3.414 9.040 -6.628 920 HB2 ALA 125 1HB ALA 125 -4.371 7.599 -6.286 921 HB3 ALA 125 2HB ALA 125 -4.826 8.666 -7.616 922 H ALA 126 H ALA 126 -3.071 5.328 -6.617 923 HA ALA 126 HA ALA 126 -0.785 5.766 -5.061 924 HB1 ALA 126 3HB ALA 126 -2.043 3.126 -5.803 925 HB2 ALA 126 1HB ALA 126 -2.540 4.163 -4.465 926 HB3 ALA 126 2HB ALA 126 -0.944 3.414 -4.454 927 H ALA 127 H ALA 127 -1.192 3.949 -8.088 928 HA ALA 127 HA ALA 127 1.428 2.939 -8.240 929 HB1 ALA 127 3HB ALA 127 -0.428 2.074 -9.584 930 HB2 ALA 127 1HB ALA 127 0.951 2.519 -10.589 931 HB3 ALA 127 2HB ALA 127 -0.457 3.578 -10.506 932 H ARG 128 H ARG 128 -0.010 5.870 -9.663 933 HA ARG 128 HA ARG 128 2.325 6.735 -10.982 934 HE ARG 128 HE ARG 128 0.833 9.684 -13.135 935 HB2 ARG 128 1HB ARG 128 -0.024 8.341 -9.965 936 HB3 ARG 128 2HB ARG 128 1.232 8.976 -11.017 937 HG2 ARG 128 1HG ARG 128 0.607 7.269 -12.706 938 HG3 ARG 128 2HG ARG 128 -0.733 6.789 -11.662 939 HD2 ARG 128 1HD ARG 128 -1.489 8.334 -13.388 940 HD3 ARG 128 2HD ARG 128 -1.644 9.058 -11.788 941 HH11 ARG 128 1HH1 ARG 128 -2.528 10.630 -12.757 942 HH12 ARG 128 2HH1 ARG 128 -2.234 12.291 -13.167 943 HH21 ARG 128 1HH2 ARG 128 1.215 11.874 -13.635 944 HH22 ARG 128 2HH2 ARG 128 -0.102 13.010 -13.628 945 H THR 129 H THR 129 1.025 7.507 -7.777 946 HA THR 129 HA THR 129 2.994 9.420 -7.099 947 HB THR 129 HB THR 129 1.407 7.699 -5.183 948 HG1 THR 129 HG1 THR 129 -0.066 8.698 -6.537 949 HG21 THR 129 3HG2 THR 129 1.624 9.622 -3.680 950 HG22 THR 129 1HG2 THR 129 2.588 10.464 -4.894 951 HG23 THR 129 2HG2 THR 129 3.205 8.993 -4.142 952 H TYR 130 H TYR 130 2.824 5.933 -6.819 953 HA TYR 130 HA TYR 130 4.954 5.491 -5.060 954 HD1 TYR 130 HD1 TYR 130 4.951 3.285 -3.778 955 HD2 TYR 130 HD2 TYR 130 5.719 2.174 -7.812 956 HE1 TYR 130 HE1 TYR 130 6.500 1.545 -2.999 957 HE2 TYR 130 HE2 TYR 130 7.273 0.431 -7.041 958 HH TYR 130 HH TYR 130 7.397 -0.619 -3.859 959 HB2 TYR 130 1HB TYR 130 3.324 3.763 -5.793 960 HB3 TYR 130 2HB TYR 130 4.083 3.753 -7.380 961 H ASN 131 H ASN 131 4.921 5.599 -8.622 962 HA ASN 131 HA ASN 131 7.664 5.233 -9.019 963 HB2 ASN 131 1HB ASN 131 5.561 6.627 -10.663 964 HB3 ASN 131 2HB ASN 131 7.241 6.573 -11.183 965 HD21 ASN 131 2HD2 ASN 131 6.833 5.365 -12.978 966 HD22 ASN 131 1HD2 ASN 131 6.360 3.701 -12.915 967 H ILE 132 H ILE 132 5.806 8.175 -8.438 968 HA ILE 132 HA ILE 132 7.886 10.017 -8.894 969 HB ILE 132 HB ILE 132 5.498 10.301 -7.060 970 HG12 ILE 132 1HG1 ILE 132 5.886 11.188 -9.931 971 HG13 ILE 132 2HG1 ILE 132 4.924 9.804 -9.421 972 HG21 ILE 132 1HG2 ILE 132 7.240 11.931 -6.549 973 HG22 ILE 132 2HG2 ILE 132 5.846 12.713 -7.296 974 HG23 ILE 132 3HG2 ILE 132 7.302 12.411 -8.246 975 HD11 ILE 132 3HD1 ILE 132 4.387 12.678 -8.711 976 HD12 ILE 132 1HD1 ILE 132 3.419 11.292 -8.213 977 HD13 ILE 132 2HD1 ILE 132 3.525 11.727 -9.919 978 H LEU 133 H LEU 133 6.671 8.628 -5.836 979 HA LEU 133 HA LEU 133 8.644 9.928 -4.251 980 HG LEU 133 HG LEU 133 7.240 10.352 -2.242 981 HB2 LEU 133 1HB LEU 133 6.594 7.823 -3.768 982 HB3 LEU 133 2HB LEU 133 7.881 8.010 -2.592 983 HD11 LEU 133 1HD1 LEU 133 5.185 11.242 -3.196 984 HD12 LEU 133 2HD1 LEU 133 4.986 9.775 -4.154 985 HD13 LEU 133 3HD1 LEU 133 6.353 10.847 -4.458 986 HD21 LEU 133 3HD2 LEU 133 5.091 9.939 -1.133 987 HD22 LEU 133 1HD2 LEU 133 6.260 8.655 -0.822 988 HD23 LEU 133 2HD2 LEU 133 4.961 8.400 -1.985 989 H MET 134 H MET 134 8.584 6.947 -6.018 990 HA MET 134 HA MET 134 10.828 5.719 -4.805 991 HB2 MET 134 1HB MET 134 9.322 4.499 -6.305 992 HB3 MET 134 2HB MET 134 9.807 5.523 -7.647 993 HG2 MET 134 1HG MET 134 12.142 4.669 -7.330 994 HG3 MET 134 2HG MET 134 11.485 3.508 -6.178 995 HE1 MET 134 3HE MET 134 11.490 4.739 -9.894 996 HE2 MET 134 1HE MET 134 9.780 4.834 -9.470 997 HE3 MET 134 2HE MET 134 10.333 3.639 -10.645 998 H ALA 135 H ALA 135 10.468 7.965 -7.511 999 HA ALA 135 HA ALA 135 13.227 8.093 -8.178 1000 HB1 ALA 135 3HB ALA 135 11.483 8.725 -9.763 1001 HB2 ALA 135 1HB ALA 135 12.608 10.059 -9.501 1002 HB3 ALA 135 2HB ALA 135 11.021 10.076 -8.730 1003 H GLU 136 H GLU 136 11.267 9.608 -5.778 1004 HA GLU 136 HA GLU 136 12.983 11.780 -5.131 1005 HB2 GLU 136 1HB GLU 136 10.922 10.298 -3.489 1006 HB3 GLU 136 2HB GLU 136 11.739 11.757 -2.952 1007 HG2 GLU 136 1HG GLU 136 10.068 11.608 -5.445 1008 HG3 GLU 136 2HG GLU 136 9.440 12.085 -3.870 1009 H GLY 137 H GLY 137 13.270 8.426 -4.701 1010 HA2 GLY 137 1HA GLY 137 14.806 7.135 -3.572 1011 HA3 GLY 137 2HA GLY 137 15.653 8.618 -3.140 1012 H ARG 138 H ARG 138 12.315 7.751 -2.471 1013 HA ARG 138 HA ARG 138 12.887 8.073 0.401 1014 HE ARG 138 HE ARG 138 9.536 10.421 3.039 1015 HB2 ARG 138 1HB ARG 138 11.524 9.861 -0.783 1016 HB3 ARG 138 2HB ARG 138 10.275 8.645 -1.000 1017 HG2 ARG 138 1HG ARG 138 10.003 8.429 1.377 1018 HG3 ARG 138 2HG ARG 138 11.358 9.525 1.663 1019 HD2 ARG 138 1HD ARG 138 10.071 11.265 0.378 1020 HD3 ARG 138 2HD ARG 138 8.692 10.168 0.423 1021 HH11 ARG 138 1HH1 ARG 138 8.443 12.606 0.527 1022 HH12 ARG 138 2HH1 ARG 138 7.725 13.732 1.639 1023 HH21 ARG 138 1HH2 ARG 138 8.591 11.893 4.498 1024 HH22 ARG 138 2HH2 ARG 138 7.798 13.317 3.898 1025 H ARG 139 H ARG 139 11.641 6.753 1.863 1026 HA ARG 139 HA ARG 139 11.240 4.111 0.787 1027 HE ARG 139 HE ARG 139 12.305 5.610 5.410 1028 HB2 ARG 139 1HB ARG 139 10.864 5.103 3.613 1029 HB3 ARG 139 2HB ARG 139 10.903 3.420 3.104 1030 HG2 ARG 139 1HG ARG 139 13.220 3.709 2.364 1031 HG3 ARG 139 2HG ARG 139 13.179 5.383 2.923 1032 HD2 ARG 139 1HD ARG 139 12.975 2.869 4.561 1033 HD3 ARG 139 2HD ARG 139 14.222 4.113 4.635 1034 HH11 ARG 139 1HH1 ARG 139 12.552 2.194 6.082 1035 HH12 ARG 139 2HH1 ARG 139 11.524 2.250 7.476 1036 HH21 ARG 139 1HH2 ARG 139 10.948 5.706 7.264 1037 HH22 ARG 139 2HH2 ARG 139 10.604 4.253 8.148 1038 H VAL 140 H VAL 140 9.462 4.472 -0.560 1039 HA VAL 140 HA VAL 140 6.904 4.922 0.798 1040 HB VAL 140 HB VAL 140 7.242 6.379 -1.104 1041 HG11 VAL 140 1HG1 VAL 140 7.636 3.875 -2.737 1042 HG12 VAL 140 2HG1 VAL 140 8.867 5.078 -2.349 1043 HG13 VAL 140 3HG1 VAL 140 7.507 5.511 -3.384 1044 HG21 VAL 140 3HG2 VAL 140 4.973 5.613 -0.728 1045 HG22 VAL 140 1HG2 VAL 140 5.258 4.199 -1.744 1046 HG23 VAL 140 2HG2 VAL 140 5.269 5.815 -2.455 1047 H VAL 141 H VAL 141 5.532 3.293 1.110 1048 HA VAL 141 HA VAL 141 5.988 0.787 -0.382 1049 HB VAL 141 HB VAL 141 4.607 1.042 2.297 1050 HG11 VAL 141 1HG1 VAL 141 4.901 -1.392 2.391 1051 HG12 VAL 141 2HG1 VAL 141 5.612 -1.359 0.776 1052 HG13 VAL 141 3HG1 VAL 141 3.926 -0.898 1.007 1053 HG21 VAL 141 3HG2 VAL 141 6.914 1.660 2.612 1054 HG22 VAL 141 1HG2 VAL 141 7.453 0.253 1.702 1055 HG23 VAL 141 2HG2 VAL 141 6.658 0.040 3.258 1056 H VAL 142 H VAL 142 4.333 0.099 -1.646 1057 HA VAL 142 HA VAL 142 1.799 1.574 -1.377 1058 HB VAL 142 HB VAL 142 3.102 2.104 -3.441 1059 HG11 VAL 142 1HG1 VAL 142 2.481 -0.750 -4.183 1060 HG12 VAL 142 2HG1 VAL 142 4.079 -0.071 -3.874 1061 HG13 VAL 142 3HG1 VAL 142 3.144 0.474 -5.266 1062 HG21 VAL 142 3HG2 VAL 142 0.418 0.796 -3.846 1063 HG22 VAL 142 1HG2 VAL 142 1.189 1.918 -4.969 1064 HG23 VAL 142 2HG2 VAL 142 0.710 2.467 -3.363 1065 H ALA 143 H ALA 143 -0.061 0.472 -1.307 1066 HA ALA 143 HA ALA 143 0.066 -2.456 -1.637 1067 HB1 ALA 143 3HB ALA 143 -0.320 -1.780 0.701 1068 HB2 ALA 143 1HB ALA 143 -1.698 -2.649 0.024 1069 HB3 ALA 143 2HB ALA 143 -1.759 -0.896 0.193 1070 H LEU 144 H LEU 144 -0.772 -2.873 -3.574 1071 HA LEU 144 HA LEU 144 -3.026 -1.250 -4.533 1072 HG LEU 144 HG LEU 144 0.006 -1.154 -5.368 1073 HB2 LEU 144 1HB LEU 144 -1.253 -3.178 -6.043 1074 HB3 LEU 144 2HB LEU 144 -2.490 -2.152 -6.745 1075 HD11 LEU 144 1HD1 LEU 144 0.535 -2.251 -7.467 1076 HD12 LEU 144 2HD1 LEU 144 0.724 -0.503 -7.614 1077 HD13 LEU 144 3HD1 LEU 144 -0.697 -1.296 -8.294 1078 HD21 LEU 144 3HD2 LEU 144 -0.639 1.020 -6.247 1079 HD22 LEU 144 1HD2 LEU 144 -1.893 0.380 -5.183 1080 HD23 LEU 144 2HD2 LEU 144 -2.104 0.322 -6.933 1081 H LEU 145 H LEU 145 -5.009 -2.143 -4.873 1082 HA LEU 145 HA LEU 145 -5.280 -4.976 -4.115 1083 HG LEU 145 HG LEU 145 -6.481 -5.363 -2.010 1084 HB2 LEU 145 1HB LEU 145 -6.085 -2.966 -2.580 1085 HB3 LEU 145 2HB LEU 145 -7.480 -3.022 -3.636 1086 HD11 LEU 145 1HD1 LEU 145 -7.246 -3.563 -0.567 1087 HD12 LEU 145 2HD1 LEU 145 -8.383 -4.911 -0.544 1088 HD13 LEU 145 3HD1 LEU 145 -8.753 -3.457 -1.474 1089 HD21 LEU 145 3HD2 LEU 145 -8.652 -6.348 -2.516 1090 HD22 LEU 145 1HD2 LEU 145 -7.751 -6.017 -3.997 1091 HD23 LEU 145 2HD2 LEU 145 -9.068 -4.950 -3.508 1092 HA PRO 146 HA PRO 146 -7.578 -4.856 -8.047 1093 HB2 PRO 146 1HB PRO 146 -6.183 -6.732 -9.362 1094 HB3 PRO 146 2HB PRO 146 -5.627 -5.058 -9.276 1095 HG2 PRO 146 1HG PRO 146 -4.605 -7.457 -7.884 1096 HG3 PRO 146 2HG PRO 146 -3.759 -5.969 -8.336 1097 HD2 PRO 146 1HD PRO 146 -4.836 -6.662 -5.784 1098 HD3 PRO 146 2HD PRO 146 -4.066 -5.137 -6.258 1099 H ASP 147 H ASP 147 -7.936 -7.313 -9.298 1100 HA ASP 147 HA ASP 147 -9.087 -9.280 -9.215 1101 HB2 ASP 147 1HB ASP 147 -7.129 -9.832 -7.612 1102 HB3 ASP 147 2HB ASP 147 -8.297 -9.593 -6.318 1103 H GLY 148 H GLY 148 -10.227 -6.732 -8.463 1104 HA2 GLY 148 1HA GLY 148 -12.825 -7.461 -7.761 1105 HA3 GLY 148 2HA GLY 148 -12.016 -6.931 -6.288 1106 H ASP 149 H ASP 149 -10.347 -5.221 -8.221 1107 HA ASP 149 HA ASP 149 -11.619 -2.754 -7.869 1108 HB2 ASP 149 1HB ASP 149 -9.881 -1.915 -9.426 1109 HB3 ASP 149 2HB ASP 149 -9.206 -2.974 -8.190 1110 H SER 150 H SER 150 -11.425 -4.904 -10.672 1111 HA SER 150 HA SER 150 -12.776 -3.081 -12.418 1112 HG SER 150 HG SER 150 -10.451 -4.055 -12.509 1113 HB2 SER 150 1HB SER 150 -12.153 -6.013 -12.814 1114 HB3 SER 150 2HB SER 150 -12.570 -4.852 -14.074 1115 H LEU 151 H LEU 151 -14.119 -4.379 -9.923 1116 HA LEU 151 HA LEU 151 -16.402 -5.685 -11.131 1117 HG LEU 151 HG LEU 151 -18.371 -5.387 -8.756 1118 HB2 LEU 151 1HB LEU 151 -15.492 -6.294 -8.872 1119 HB3 LEU 151 2HB LEU 151 -16.055 -4.744 -8.282 1120 HD11 LEU 151 1HD1 LEU 151 -17.963 -6.849 -10.667 1121 HD12 LEU 151 2HD1 LEU 151 -18.909 -7.674 -9.428 1122 HD13 LEU 151 3HD1 LEU 151 -17.191 -8.028 -9.609 1123 HD21 LEU 151 3HD2 LEU 151 -16.883 -7.469 -7.162 1124 HD22 LEU 151 1HD2 LEU 151 -18.601 -7.091 -7.037 1125 HD23 LEU 151 2HD2 LEU 151 -17.398 -5.891 -6.567 1126 H GLU 152 H GLU 152 -15.341 -2.560 -10.647 1127 HA GLU 152 HA GLU 152 -18.038 -1.402 -10.722 1128 HB2 GLU 152 1HB GLU 152 -15.357 -0.003 -10.587 1129 HB3 GLU 152 2HB GLU 152 -16.934 0.749 -10.410 1130 HG2 GLU 152 1HG GLU 152 -15.862 -1.337 -8.540 1131 HG3 GLU 152 2HG GLU 152 -15.664 0.396 -8.296 1132 H HIS 153 H HIS 153 -18.326 0.402 -12.329 1133 HA HIS 153 HA HIS 153 -16.618 0.133 -14.690 1134 HD1 HIS 153 HD1 HIS 153 -19.353 -2.700 -14.200 1135 HD2 HIS 153 HD2 HIS 153 -17.120 -1.314 -17.428 1136 HE1 HIS 153 HE1 HIS 153 -18.492 -4.756 -15.367 1137 HE2 HIS 153 HE2 HIS 153 -17.005 -3.889 -17.212 1138 HB2 HIS 153 1HB HIS 153 -19.596 -0.185 -14.612 1139 HB3 HIS 153 2HB HIS 153 -18.824 0.484 -16.048 1140 H HIS 154 H HIS 154 -15.623 1.988 -14.543 1141 HA HIS 154 HA HIS 154 -17.201 4.462 -14.293 1142 HD1 HIS 154 HD1 HIS 154 -16.697 6.648 -12.534 1143 HD2 HIS 154 HD2 HIS 154 -12.899 6.108 -14.152 1144 HE1 HIS 154 HE1 HIS 154 -15.663 8.942 -12.634 1145 HE2 HIS 154 HE2 HIS 154 -13.315 8.575 -13.485 1146 HB2 HIS 154 1HB HIS 154 -15.634 4.131 -12.448 1147 HB3 HIS 154 2HB HIS 154 -14.315 3.870 -13.578 1148 H HIS 155 H HIS 155 -16.969 6.033 -15.871 1149 HA HIS 155 HA HIS 155 -15.879 5.099 -18.376 1150 HD1 HIS 155 HD1 HIS 155 -18.137 5.755 -20.675 1151 HD2 HIS 155 HD2 HIS 155 -19.481 6.099 -16.751 1152 HE1 HIS 155 HE1 HIS 155 -20.408 4.678 -20.637 1153 HE2 HIS 155 HE2 HIS 155 -21.282 5.076 -18.307 1154 HB2 HIS 155 1HB HIS 155 -17.276 7.669 -17.624 1155 HB3 HIS 155 2HB HIS 155 -16.713 7.309 -19.251 1156 H HIS 156 H HIS 156 -14.488 6.460 -19.723 1157 HA HIS 156 HA HIS 156 -12.235 7.397 -18.112 1158 HD1 HIS 156 HD1 HIS 156 -12.901 4.149 -20.483 1159 HD2 HIS 156 HD2 HIS 156 -9.518 5.756 -18.664 1160 HE1 HIS 156 HE1 HIS 156 -11.609 2.187 -19.593 1161 HE2 HIS 156 HE2 HIS 156 -9.477 3.166 -18.675 1162 HB2 HIS 156 1HB HIS 156 -12.512 6.630 -21.017 1163 HB3 HIS 156 2HB HIS 156 -11.060 7.389 -20.375 1164 H HIS 157 H HIS 157 -12.199 9.478 -17.639 1165 HA HIS 157 HA HIS 157 -13.326 11.415 -19.517 1166 HD1 HIS 157 HD1 HIS 157 -14.472 11.211 -15.167 1167 HD2 HIS 157 HD2 HIS 157 -15.584 12.481 -18.972 1168 HE1 HIS 157 HE1 HIS 157 -16.983 11.195 -15.183 1169 HE2 HIS 157 HE2 HIS 157 -17.631 12.146 -17.419 1170 HB2 HIS 157 1HB HIS 157 -12.507 11.600 -16.623 1171 HB3 HIS 157 2HB HIS 157 -12.816 13.040 -17.587 1172 H HIS 158 H HIS 158 -12.092 13.411 -19.935 1173 HA HIS 158 HA HIS 158 -9.204 12.862 -20.013 1174 HD1 HIS 158 HD1 HIS 158 -12.579 12.545 -22.585 1175 HD2 HIS 158 HD2 HIS 158 -10.717 16.257 -22.895 1176 HE1 HIS 158 HE1 HIS 158 -14.267 14.068 -23.656 1177 HE2 HIS 158 HE2 HIS 158 -13.174 16.338 -23.711 1178 HB2 HIS 158 1HB HIS 158 -9.152 14.052 -22.230 1179 HB3 HIS 158 2HB HIS 158 -9.978 12.503 -22.250 Start of MODEL 19 1 HA MET 1 HA MET 1 24.204 -4.123 -21.521 2 H1 MET 1 1H MET 1 23.576 -4.235 -23.830 3 H2 MET 1 2H MET 1 25.202 -4.659 -23.636 4 H3 MET 1 3H MET 1 24.789 -3.128 -24.249 5 HB2 MET 1 1HB MET 1 26.164 -2.027 -22.488 6 HB3 MET 1 2HB MET 1 25.794 -2.359 -20.802 7 HG2 MET 1 1HG MET 1 26.630 -4.672 -21.137 8 HG3 MET 1 2HG MET 1 27.123 -4.209 -22.765 9 HE1 MET 1 3HE MET 1 28.109 -1.184 -22.259 10 HE2 MET 1 1HE MET 1 28.971 -2.342 -23.272 11 HE3 MET 1 2HE MET 1 29.832 -1.458 -22.011 12 H LYS 2 H LYS 2 22.554 -3.136 -20.583 13 HA LYS 2 HA LYS 2 20.941 -1.219 -21.813 14 HB2 LYS 2 1HB LYS 2 21.256 -1.774 -18.855 15 HB3 LYS 2 2HB LYS 2 19.913 -0.911 -19.591 16 HG2 LYS 2 1HG LYS 2 19.164 -2.886 -20.702 17 HG3 LYS 2 2HG LYS 2 20.614 -3.770 -20.215 18 HD2 LYS 2 1HD LYS 2 19.942 -3.445 -17.843 19 HD3 LYS 2 2HD LYS 2 18.440 -2.712 -18.410 20 HE2 LYS 2 1HE LYS 2 17.770 -4.757 -19.465 21 HE3 LYS 2 2HE LYS 2 19.339 -5.495 -19.137 22 HZ1 LYS 2 3HZ LYS 2 17.676 -6.254 -17.565 23 HZ2 LYS 2 1HZ LYS 2 17.356 -4.661 -17.090 24 HZ3 LYS 2 2HZ LYS 2 18.869 -5.346 -16.766 25 H LEU 3 H LEU 3 20.795 0.988 -21.697 26 HA LEU 3 HA LEU 3 23.025 2.584 -21.239 27 HG LEU 3 HG LEU 3 20.696 2.513 -23.287 28 HB2 LEU 3 1HB LEU 3 20.104 3.337 -21.034 29 HB3 LEU 3 2HB LEU 3 21.427 4.484 -21.117 30 HD11 LEU 3 1HD1 LEU 3 20.297 5.497 -23.124 31 HD12 LEU 3 2HD1 LEU 3 19.031 4.273 -23.041 32 HD13 LEU 3 3HD1 LEU 3 19.957 4.482 -24.526 33 HD21 LEU 3 3HD2 LEU 3 23.083 3.013 -23.244 34 HD22 LEU 3 1HD2 LEU 3 22.730 4.740 -23.240 35 HD23 LEU 3 2HD2 LEU 3 22.309 3.759 -24.642 36 H HIS 4 H HIS 4 20.333 1.772 -19.092 37 HA HIS 4 HA HIS 4 21.967 2.671 -16.812 38 HD1 HIS 4 HD1 HIS 4 17.591 3.439 -17.905 39 HD2 HIS 4 HD2 HIS 4 20.910 5.257 -16.182 40 HE1 HIS 4 HE1 HIS 4 17.298 5.902 -18.307 41 HE2 HIS 4 HE2 HIS 4 19.213 6.993 -17.081 42 HB2 HIS 4 1HB HIS 4 19.063 1.805 -16.820 43 HB3 HIS 4 2HB HIS 4 19.949 2.466 -15.454 44 H THR 5 H THR 5 23.405 0.963 -16.696 45 HA THR 5 HA THR 5 22.679 -1.752 -16.934 46 HB THR 5 HB THR 5 25.043 -0.644 -15.407 47 HG1 THR 5 HG1 THR 5 24.401 -0.617 -18.091 48 HG21 THR 5 3HG2 THR 5 24.655 -3.050 -15.117 49 HG22 THR 5 1HG2 THR 5 26.109 -2.754 -16.070 50 HG23 THR 5 2HG2 THR 5 24.620 -3.258 -16.868 51 H ASP 6 H ASP 6 21.242 -2.682 -15.659 52 HA ASP 6 HA ASP 6 20.433 -1.459 -13.231 53 HB2 ASP 6 1HB ASP 6 18.742 -3.245 -13.148 54 HB3 ASP 6 2HB ASP 6 18.811 -2.476 -14.729 55 HA PRO 7 HA PRO 7 22.686 -4.146 -10.427 56 HB2 PRO 7 1HB PRO 7 22.492 -2.531 -8.304 57 HB3 PRO 7 2HB PRO 7 23.597 -2.146 -9.629 58 HG2 PRO 7 1HG PRO 7 20.952 -0.956 -8.959 59 HG3 PRO 7 2HG PRO 7 22.385 -0.190 -9.667 60 HD2 PRO 7 1HD PRO 7 20.110 -1.111 -11.055 61 HD3 PRO 7 2HD PRO 7 21.654 -0.612 -11.769 62 H ALA 8 H ALA 8 20.415 -5.157 -11.092 63 HA ALA 8 HA ALA 8 18.543 -6.275 -10.472 64 HB1 ALA 8 3HB ALA 8 19.463 -6.640 -8.232 65 HB2 ALA 8 1HB ALA 8 17.732 -6.310 -8.168 66 HB3 ALA 8 2HB ALA 8 18.885 -5.050 -7.731 67 H THR 9 H THR 9 16.410 -5.192 -8.798 68 HA THR 9 HA THR 9 15.127 -3.745 -10.809 69 HB THR 9 HB THR 9 13.395 -3.258 -9.020 70 HG1 THR 9 HG1 THR 9 14.130 -3.457 -7.041 71 HG21 THR 9 3HG2 THR 9 14.302 -6.115 -9.400 72 HG22 THR 9 1HG2 THR 9 13.243 -5.207 -10.480 73 HG23 THR 9 2HG2 THR 9 12.702 -5.614 -8.851 74 H ALA 10 H ALA 10 16.472 -2.611 -7.715 75 HA ALA 10 HA ALA 10 17.088 -0.576 -6.941 76 HB1 ALA 10 3HB ALA 10 17.826 1.144 -8.493 77 HB2 ALA 10 1HB ALA 10 17.077 0.278 -9.833 78 HB3 ALA 10 2HB ALA 10 18.443 -0.435 -8.975 79 H LEU 11 H LEU 11 15.014 0.318 -9.683 80 HA LEU 11 HA LEU 11 13.245 1.723 -7.795 81 HG LEU 11 HG LEU 11 15.500 3.113 -9.484 82 HB2 LEU 11 1HB LEU 11 13.622 2.162 -10.764 83 HB3 LEU 11 2HB LEU 11 12.493 3.038 -9.748 84 HD11 LEU 11 1HD1 LEU 11 13.558 5.159 -10.547 85 HD12 LEU 11 2HD1 LEU 11 14.708 4.223 -11.502 86 HD13 LEU 11 3HD1 LEU 11 15.292 5.396 -10.321 87 HD21 LEU 11 3HD2 LEU 11 13.349 4.667 -8.046 88 HD22 LEU 11 1HD2 LEU 11 15.085 4.938 -7.900 89 HD23 LEU 11 2HD2 LEU 11 14.379 3.422 -7.341 90 H ASN 12 H ASN 12 11.661 0.356 -7.282 91 HA ASN 12 HA ASN 12 10.768 -1.751 -8.969 92 HB2 ASN 12 1HB ASN 12 10.667 -1.638 -6.410 93 HB3 ASN 12 2HB ASN 12 9.243 -0.625 -6.620 94 HD21 ASN 12 2HD2 ASN 12 9.529 -3.239 -5.383 95 HD22 ASN 12 1HD2 ASN 12 8.431 -4.281 -6.226 96 H THR 13 H THR 13 9.718 -1.348 -10.808 97 HA THR 13 HA THR 13 7.871 0.948 -10.868 98 HB THR 13 HB THR 13 9.543 -0.028 -13.191 99 HG1 THR 13 HG1 THR 13 10.740 0.910 -11.329 100 HG21 THR 13 3HG2 THR 13 7.519 1.200 -13.814 101 HG22 THR 13 1HG2 THR 13 8.965 2.146 -14.169 102 HG23 THR 13 2HG2 THR 13 7.988 2.526 -12.750 103 H VAL 14 H VAL 14 5.844 0.451 -11.353 104 HA VAL 14 HA VAL 14 4.981 -2.103 -12.216 105 HB VAL 14 HB VAL 14 3.498 0.531 -12.384 106 HG11 VAL 14 1HG1 VAL 14 2.482 -1.175 -13.781 107 HG12 VAL 14 2HG1 VAL 14 1.474 -0.864 -12.367 108 HG13 VAL 14 3HG1 VAL 14 2.482 -2.309 -12.430 109 HG21 VAL 14 3HG2 VAL 14 2.495 -0.088 -10.251 110 HG22 VAL 14 1HG2 VAL 14 4.249 0.036 -10.107 111 HG23 VAL 14 2HG2 VAL 14 3.481 -1.549 -10.200 112 H THR 15 H THR 15 5.088 -2.945 -14.200 113 HA THR 15 HA THR 15 5.852 -1.169 -16.385 114 HB THR 15 HB THR 15 6.288 -3.464 -17.524 115 HG1 THR 15 HG1 THR 15 5.870 -5.136 -16.311 116 HG21 THR 15 3HG2 THR 15 8.060 -1.944 -16.794 117 HG22 THR 15 1HG2 THR 15 8.488 -3.619 -16.439 118 HG23 THR 15 2HG2 THR 15 7.921 -2.561 -15.147 119 H ALA 16 H ALA 16 3.197 -3.135 -15.341 120 HA ALA 16 HA ALA 16 1.716 -2.255 -17.698 121 HB1 ALA 16 3HB ALA 16 2.532 -4.535 -18.205 122 HB2 ALA 16 1HB ALA 16 0.772 -4.421 -18.148 123 HB3 ALA 16 2HB ALA 16 1.654 -5.129 -16.794 124 H TYR 17 H TYR 17 0.362 -0.940 -16.658 125 HA TYR 17 HA TYR 17 -1.421 -2.174 -14.663 126 HD1 TYR 17 HD1 TYR 17 -1.903 -1.445 -12.130 127 HD2 TYR 17 HD2 TYR 17 -2.365 2.088 -14.453 128 HE1 TYR 17 HE1 TYR 17 -3.792 -0.767 -10.711 129 HE2 TYR 17 HE2 TYR 17 -4.258 2.777 -13.041 130 HH TYR 17 HH TYR 17 -5.900 1.806 -11.535 131 HB2 TYR 17 1HB TYR 17 -0.030 -0.455 -13.605 132 HB3 TYR 17 2HB TYR 17 -0.515 0.713 -14.826 133 H GLY 18 H GLY 18 -3.539 -2.146 -15.166 134 HA2 GLY 18 1HA GLY 18 -5.467 -0.974 -16.048 135 HA3 GLY 18 2HA GLY 18 -4.422 -0.304 -17.291 136 H ASP 19 H ASP 19 -3.384 -3.339 -17.095 137 HA ASP 19 HA ASP 19 -5.016 -4.219 -19.334 138 HB2 ASP 19 1HB ASP 19 -2.425 -5.132 -18.117 139 HB3 ASP 19 2HB ASP 19 -3.299 -6.165 -19.235 140 H GLY 20 H GLY 20 -5.841 -4.195 -16.388 141 HA2 GLY 20 1HA GLY 20 -7.500 -5.568 -15.398 142 HA3 GLY 20 2HA GLY 20 -6.893 -6.929 -16.334 143 H TYR 21 H TYR 21 -4.208 -6.751 -15.781 144 HA TYR 21 HA TYR 21 -4.114 -7.341 -12.900 145 HD1 TYR 21 HD2 TYR 21 -3.775 -8.911 -16.765 146 HD2 TYR 21 HD1 TYR 21 -0.255 -8.023 -14.543 147 HE1 TYR 21 HE2 TYR 21 -2.488 -8.798 -18.856 148 HE2 TYR 21 HE1 TYR 21 1.039 -7.908 -16.630 149 HH TYR 21 HH TYR 21 -0.457 -7.826 -19.718 150 HB2 TYR 21 1HB TYR 21 -2.236 -8.843 -13.425 151 HB3 TYR 21 2HB TYR 21 -3.672 -9.295 -14.335 152 H ILE 22 H ILE 22 -1.719 -7.120 -12.096 153 HA ILE 22 HA ILE 22 -0.568 -4.653 -13.229 154 HB ILE 22 HB ILE 22 -0.615 -5.529 -10.337 155 HG12 ILE 22 1HG1 ILE 22 -1.735 -3.104 -11.760 156 HG13 ILE 22 2HG1 ILE 22 -2.661 -4.422 -11.052 157 HG21 ILE 22 1HG2 ILE 22 1.587 -4.642 -10.886 158 HG22 ILE 22 2HG2 ILE 22 0.702 -3.521 -9.851 159 HG23 ILE 22 3HG2 ILE 22 0.847 -3.201 -11.579 160 HD11 ILE 22 3HD1 ILE 22 -2.705 -2.449 -9.639 161 HD12 ILE 22 1HD1 ILE 22 -0.944 -2.464 -9.542 162 HD13 ILE 22 2HD1 ILE 22 -1.878 -3.781 -8.832 163 H GLU 23 H GLU 23 1.217 -5.145 -14.309 164 HA GLU 23 HA GLU 23 2.854 -7.398 -13.457 165 HB2 GLU 23 1HB GLU 23 2.392 -7.022 -15.877 166 HB3 GLU 23 2HB GLU 23 3.277 -5.505 -15.777 167 HG2 GLU 23 1HG GLU 23 5.278 -6.801 -15.060 168 HG3 GLU 23 2HG GLU 23 4.369 -8.278 -15.379 169 H VAL 24 H VAL 24 4.417 -7.146 -12.061 170 HA VAL 24 HA VAL 24 5.491 -4.452 -11.591 171 HB VAL 24 HB VAL 24 5.498 -6.887 -9.794 172 HG11 VAL 24 1HG1 VAL 24 7.484 -5.539 -9.426 173 HG12 VAL 24 2HG1 VAL 24 6.370 -5.376 -8.070 174 HG13 VAL 24 3HG1 VAL 24 6.492 -4.090 -9.271 175 HG21 VAL 24 3HG2 VAL 24 3.947 -4.305 -9.643 176 HG22 VAL 24 1HG2 VAL 24 3.963 -5.558 -8.402 177 HG23 VAL 24 2HG2 VAL 24 3.293 -5.905 -9.996 178 H ASN 25 H ASN 25 7.202 -4.206 -12.864 179 HA ASN 25 HA ASN 25 9.320 -4.359 -13.628 180 HB2 ASN 25 1HB ASN 25 9.617 -6.358 -11.383 181 HB3 ASN 25 2HB ASN 25 10.954 -5.775 -12.369 182 HD21 ASN 25 2HD2 ASN 25 10.271 -5.531 -9.478 183 HD22 ASN 25 1HD2 ASN 25 10.352 -3.840 -9.139 184 H GLN 26 H GLN 26 9.024 -7.760 -12.658 185 HA GLN 26 HA GLN 26 9.099 -8.505 -15.504 186 HB2 GLN 26 1HB GLN 26 10.777 -9.782 -13.337 187 HB3 GLN 26 2HB GLN 26 10.774 -10.205 -15.043 188 HG2 GLN 26 1HG GLN 26 11.729 -8.077 -15.625 189 HG3 GLN 26 2HG GLN 26 11.607 -7.526 -13.954 190 HE21 GLN 26 2HE2 GLN 26 13.946 -7.718 -15.648 191 HE22 GLN 26 1HE2 GLN 26 15.055 -8.762 -14.818 192 H VAL 27 H VAL 27 7.361 -8.696 -12.762 193 HA VAL 27 HA VAL 27 6.420 -11.419 -13.390 194 HB VAL 27 HB VAL 27 6.497 -10.187 -10.630 195 HG11 VAL 27 1HG1 VAL 27 5.668 -12.942 -11.538 196 HG12 VAL 27 2HG1 VAL 27 4.598 -11.678 -10.933 197 HG13 VAL 27 3HG1 VAL 27 5.793 -12.407 -9.861 198 HG21 VAL 27 3HG2 VAL 27 8.185 -11.885 -10.116 199 HG22 VAL 27 1HG2 VAL 27 8.734 -10.794 -11.389 200 HG23 VAL 27 2HG2 VAL 27 8.166 -12.413 -11.799 201 H ARG 28 H ARG 28 4.346 -11.569 -13.889 202 HA ARG 28 HA ARG 28 2.642 -9.222 -13.702 203 HE ARG 28 HE ARG 28 2.726 -10.124 -19.093 204 HB2 ARG 28 1HB ARG 28 2.100 -11.961 -14.875 205 HB3 ARG 28 2HB ARG 28 1.072 -10.546 -15.050 206 HG2 ARG 28 1HG ARG 28 2.653 -9.446 -16.416 207 HG3 ARG 28 2HG ARG 28 3.913 -10.618 -16.022 208 HD2 ARG 28 1HD ARG 28 2.698 -12.358 -17.193 209 HD3 ARG 28 2HD ARG 28 1.374 -11.244 -17.522 210 HH11 ARG 28 1HH1 ARG 28 4.312 -12.922 -17.702 211 HH12 ARG 28 2HH1 ARG 28 5.496 -13.033 -18.961 212 HH21 ARG 28 1HH2 ARG 28 4.273 -10.271 -20.759 213 HH22 ARG 28 2HH2 ARG 28 5.483 -11.520 -20.700 214 H PHE 29 H PHE 29 1.531 -8.888 -11.864 215 HA PHE 29 HA PHE 29 0.768 -11.208 -10.243 216 HD1 PHE 29 HD2 PHE 29 1.671 -11.229 -7.526 217 HD2 PHE 29 HD1 PHE 29 3.319 -8.080 -9.865 218 HE1 PHE 29 HE2 PHE 29 3.906 -11.744 -6.636 219 HE2 PHE 29 HE1 PHE 29 5.557 -8.589 -8.980 220 HZ PHE 29 HZ PHE 29 5.853 -10.422 -7.363 221 HB2 PHE 29 1HB PHE 29 0.965 -8.270 -9.590 222 HB3 PHE 29 2HB PHE 29 0.262 -9.453 -8.493 223 H SER 30 H SER 30 -1.324 -11.449 -9.450 224 HA SER 30 HA SER 30 -3.327 -10.647 -11.377 225 HG SER 30 HG SER 30 -3.405 -13.713 -8.706 226 HB2 SER 30 1HB SER 30 -4.705 -12.313 -9.973 227 HB3 SER 30 2HB SER 30 -3.343 -12.950 -10.898 228 H HIS 31 H HIS 31 -3.340 -10.879 -7.810 229 HA HIS 31 HA HIS 31 -5.276 -8.663 -7.814 230 HD1 HIS 31 HD1 HIS 31 -4.333 -12.759 -6.173 231 HD2 HIS 31 HD2 HIS 31 -5.644 -9.799 -3.556 232 HE1 HIS 31 HE1 HIS 31 -3.529 -13.452 -3.894 233 HE2 HIS 31 HE2 HIS 31 -4.199 -11.569 -2.359 234 HB2 HIS 31 1HB HIS 31 -6.547 -9.713 -6.158 235 HB3 HIS 31 2HB HIS 31 -6.064 -11.052 -7.186 236 H ALA 32 H ALA 32 -5.440 -8.148 -5.139 237 HA ALA 32 HA ALA 32 -3.699 -6.216 -4.578 238 HB1 ALA 32 3HB ALA 32 -5.615 -6.777 -3.189 239 HB2 ALA 32 1HB ALA 32 -4.170 -6.495 -2.217 240 HB3 ALA 32 2HB ALA 32 -4.728 -8.142 -2.509 241 H ILE 33 H ILE 33 -1.675 -5.870 -4.128 242 HA ILE 33 HA ILE 33 0.041 -7.933 -2.953 243 HB ILE 33 HB ILE 33 1.833 -7.360 -4.632 244 HG12 ILE 33 1HG1 ILE 33 -0.521 -6.278 -6.202 245 HG13 ILE 33 2HG1 ILE 33 0.766 -5.305 -5.500 246 HG21 ILE 33 1HG2 ILE 33 0.994 -8.918 -6.339 247 HG22 ILE 33 2HG2 ILE 33 -0.624 -8.785 -5.649 248 HG23 ILE 33 3HG2 ILE 33 0.683 -9.491 -4.701 249 HD11 ILE 33 3HD1 ILE 33 2.384 -6.382 -6.964 250 HD12 ILE 33 1HD1 ILE 33 1.084 -5.629 -7.886 251 HD13 ILE 33 2HD1 ILE 33 1.102 -7.377 -7.654 252 H ALA 34 H ALA 34 2.125 -7.036 -2.260 253 HA ALA 34 HA ALA 34 2.156 -4.121 -1.919 254 HB1 ALA 34 3HB ALA 34 2.780 -4.359 0.437 255 HB2 ALA 34 1HB ALA 34 2.585 -6.108 0.316 256 HB3 ALA 34 2HB ALA 34 1.186 -5.050 0.130 257 H PHE 35 H PHE 35 4.173 -3.249 -2.162 258 HA PHE 35 HA PHE 35 6.532 -4.880 -1.902 259 HD1 PHE 35 HD1 PHE 35 3.670 -5.066 -4.814 260 HD2 PHE 35 HD2 PHE 35 6.958 -2.434 -5.417 261 HE1 PHE 35 HE1 PHE 35 2.356 -3.812 -6.472 262 HE2 PHE 35 HE2 PHE 35 5.649 -1.173 -7.073 263 HZ PHE 35 HZ PHE 35 3.344 -1.861 -7.602 264 HB2 PHE 35 1HB PHE 35 7.253 -4.530 -4.281 265 HB3 PHE 35 2HB PHE 35 5.918 -5.653 -4.070 266 H ALA 36 H ALA 36 8.519 -3.716 -2.428 267 HA ALA 36 HA ALA 36 8.268 -0.794 -2.215 268 HB1 ALA 36 3HB ALA 36 10.128 -2.544 -0.597 269 HB2 ALA 36 1HB ALA 36 8.703 -1.706 0.016 270 HB3 ALA 36 2HB ALA 36 10.087 -0.781 -0.569 271 HA PRO 37 HA PRO 37 11.313 -0.265 -5.400 272 HB2 PRO 37 1HB PRO 37 13.083 1.024 -3.369 273 HB3 PRO 37 2HB PRO 37 12.605 1.599 -4.971 274 HG2 PRO 37 1HG PRO 37 11.490 2.613 -2.780 275 HG3 PRO 37 2HG PRO 37 10.526 2.317 -4.240 276 HD2 PRO 37 1HD PRO 37 10.604 0.799 -1.681 277 HD3 PRO 37 2HD PRO 37 9.252 1.066 -2.798 278 H GLU 38 H GLU 38 13.068 -0.801 -2.356 279 HA GLU 38 HA GLU 38 14.301 -3.181 -3.546 280 HB2 GLU 38 1HB GLU 38 15.938 -1.310 -3.558 281 HB3 GLU 38 2HB GLU 38 15.738 -1.149 -1.819 282 HG2 GLU 38 1HG GLU 38 16.501 -3.551 -1.639 283 HG3 GLU 38 2HG GLU 38 16.953 -3.437 -3.339 284 H GLY 39 H GLY 39 13.021 -4.600 -2.433 285 HA2 GLY 39 1HA GLY 39 13.637 -5.308 0.178 286 HA3 GLY 39 2HA GLY 39 12.233 -4.252 0.264 287 HA PRO 40 HA PRO 40 10.634 -8.493 -0.385 288 HB2 PRO 40 1HB PRO 40 8.616 -8.369 1.387 289 HB3 PRO 40 2HB PRO 40 10.286 -8.669 1.884 290 HG2 PRO 40 1HG PRO 40 8.699 -6.137 1.994 291 HG3 PRO 40 2HG PRO 40 9.832 -6.804 3.184 292 HD2 PRO 40 1HD PRO 40 10.463 -4.820 1.388 293 HD3 PRO 40 2HD PRO 40 11.649 -5.913 2.126 294 H VAL 41 H VAL 41 9.261 -9.004 -1.945 295 HA VAL 41 HA VAL 41 6.945 -7.260 -2.477 296 HB VAL 41 HB VAL 41 8.301 -9.172 -4.397 297 HG11 VAL 41 1HG1 VAL 41 6.108 -7.153 -4.855 298 HG12 VAL 41 2HG1 VAL 41 5.918 -8.906 -4.836 299 HG13 VAL 41 3HG1 VAL 41 6.879 -8.138 -6.099 300 HG21 VAL 41 3HG2 VAL 41 9.733 -7.256 -3.925 301 HG22 VAL 41 1HG2 VAL 41 8.405 -6.157 -4.298 302 HG23 VAL 41 2HG2 VAL 41 9.095 -7.168 -5.567 303 H ALA 42 H ALA 42 4.999 -8.148 -1.968 304 HA ALA 42 HA ALA 42 4.731 -11.060 -2.028 305 HB1 ALA 42 3HB ALA 42 5.494 -10.545 0.245 306 HB2 ALA 42 1HB ALA 42 3.842 -11.162 0.237 307 HB3 ALA 42 2HB ALA 42 4.138 -9.436 0.446 308 H SER 43 H SER 43 2.433 -11.703 -1.561 309 HA SER 43 HA SER 43 0.633 -9.777 -2.818 310 HG SER 43 HG SER 43 1.328 -13.487 -2.903 311 HB2 SER 43 1HB SER 43 -0.859 -11.845 -3.034 312 HB3 SER 43 2HB SER 43 0.619 -11.836 -3.997 313 H TRP 44 H TRP 44 -1.432 -9.374 -1.917 314 HA TRP 44 HA TRP 44 -1.424 -9.589 1.007 315 HD1 TRP 44 HD1 TRP 44 -1.263 -8.420 2.630 316 HE1 TRP 44 HE1 TRP 44 -2.072 -6.809 4.471 317 HE3 TRP 44 HE3 TRP 44 -4.578 -5.660 -0.111 318 HZ2 TRP 44 HZ2 TRP 44 -3.872 -4.650 4.721 319 HZ3 TRP 44 HZ3 TRP 44 -5.800 -3.838 1.003 320 HH2 TRP 44 HH2 TRP 44 -5.454 -3.345 3.369 321 HB2 TRP 44 1HB TRP 44 -1.766 -7.416 -0.525 322 HB3 TRP 44 2HB TRP 44 -3.438 -7.957 -0.467 323 HA PRO 45 HA PRO 45 -4.515 -12.797 0.662 324 HB2 PRO 45 1HB PRO 45 -5.399 -12.732 3.244 325 HB3 PRO 45 2HB PRO 45 -3.893 -13.510 2.747 326 HG2 PRO 45 1HG PRO 45 -4.319 -10.806 3.956 327 HG3 PRO 45 2HG PRO 45 -3.072 -12.014 4.324 328 HD2 PRO 45 1HD PRO 45 -2.572 -9.870 2.770 329 HD3 PRO 45 2HD PRO 45 -1.799 -11.442 2.480 330 H VAL 46 H VAL 46 -5.106 -9.539 1.352 331 HA VAL 46 HA VAL 46 -7.984 -9.766 1.626 332 HB VAL 46 HB VAL 46 -6.381 -7.239 1.232 333 HG11 VAL 46 1HG1 VAL 46 -8.783 -6.974 1.026 334 HG12 VAL 46 2HG1 VAL 46 -8.208 -6.209 2.507 335 HG13 VAL 46 3HG1 VAL 46 -9.023 -7.771 2.583 336 HG21 VAL 46 3HG2 VAL 46 -6.941 -8.676 3.818 337 HG22 VAL 46 1HG2 VAL 46 -6.233 -7.067 3.669 338 HG23 VAL 46 2HG2 VAL 46 -5.366 -8.474 3.052 339 H GLN 47 H GLN 47 -9.479 -9.093 0.064 340 HA GLN 47 HA GLN 47 -8.373 -8.450 -2.598 341 HB2 GLN 47 1HB GLN 47 -10.740 -10.258 -2.050 342 HB3 GLN 47 2HB GLN 47 -10.102 -9.831 -3.632 343 HG2 GLN 47 1HG GLN 47 -7.961 -10.936 -2.975 344 HG3 GLN 47 2HG GLN 47 -8.774 -11.501 -1.515 345 HE21 GLN 47 2HE2 GLN 47 -7.612 -13.037 -3.678 346 HE22 GLN 47 1HE2 GLN 47 -8.881 -14.020 -4.313 347 H ARG 48 H ARG 48 -10.178 -7.361 -0.091 348 HA ARG 48 HA ARG 48 -11.789 -5.640 -1.844 349 HE ARG 48 HE ARG 48 -15.348 -9.834 -1.767 350 HB2 ARG 48 1HB ARG 48 -12.806 -6.873 0.725 351 HB3 ARG 48 2HB ARG 48 -13.706 -5.822 -0.358 352 HG2 ARG 48 1HG ARG 48 -13.771 -7.493 -2.050 353 HG3 ARG 48 2HG ARG 48 -12.643 -8.518 -1.158 354 HD2 ARG 48 1HD ARG 48 -14.374 -8.550 0.697 355 HD3 ARG 48 2HD ARG 48 -15.491 -7.842 -0.470 356 HH11 ARG 48 1HH1 ARG 48 -13.727 -10.001 1.337 357 HH12 ARG 48 2HH1 ARG 48 -13.694 -11.744 1.370 358 HH21 ARG 48 1HH2 ARG 48 -15.312 -12.110 -1.730 359 HH22 ARG 48 2HH2 ARG 48 -14.612 -12.947 -0.382 360 HA PRO 49 HA PRO 49 -10.031 -2.418 0.659 361 HB2 PRO 49 1HB PRO 49 -11.743 -0.427 -0.057 362 HB3 PRO 49 2HB PRO 49 -10.447 -1.007 -1.108 363 HG2 PRO 49 1HG PRO 49 -13.359 -1.700 -1.138 364 HG3 PRO 49 2HG PRO 49 -12.283 -1.332 -2.500 365 HD2 PRO 49 1HD PRO 49 -12.949 -3.860 -1.838 366 HD3 PRO 49 2HD PRO 49 -11.353 -3.446 -2.497 367 H ALA 50 H ALA 50 -13.071 -3.813 1.082 368 HA ALA 50 HA ALA 50 -13.806 -2.113 3.338 369 HB1 ALA 50 3HB ALA 50 -15.292 -4.417 2.081 370 HB2 ALA 50 1HB ALA 50 -15.556 -2.707 1.739 371 HB3 ALA 50 2HB ALA 50 -15.908 -3.350 3.343 372 H ASP 51 H ASP 51 -12.095 -4.972 2.732 373 HA ASP 51 HA ASP 51 -12.753 -6.133 5.339 374 HB2 ASP 51 1HB ASP 51 -11.314 -7.202 2.924 375 HB3 ASP 51 2HB ASP 51 -11.154 -7.988 4.491 376 H ILE 52 H ILE 52 -10.799 -3.798 4.390 377 HA ILE 52 HA ILE 52 -8.248 -4.668 5.337 378 HB ILE 52 HB ILE 52 -9.249 -1.862 4.825 379 HG12 ILE 52 1HG1 ILE 52 -7.653 -3.739 3.065 380 HG13 ILE 52 2HG1 ILE 52 -9.346 -3.313 2.834 381 HG21 ILE 52 1HG2 ILE 52 -6.442 -2.916 5.153 382 HG22 ILE 52 2HG2 ILE 52 -7.306 -1.875 6.284 383 HG23 ILE 52 3HG2 ILE 52 -6.871 -1.270 4.685 384 HD11 ILE 52 3HD1 ILE 52 -7.900 -2.082 1.320 385 HD12 ILE 52 1HD1 ILE 52 -7.015 -1.414 2.691 386 HD13 ILE 52 2HD1 ILE 52 -8.711 -0.994 2.446 387 H THR 53 H THR 53 -7.621 -4.842 7.368 388 HA THR 53 HA THR 53 -8.879 -3.142 9.419 389 HB THR 53 HB THR 53 -8.315 -4.963 11.043 390 HG1 THR 53 HG1 THR 53 -8.194 -7.076 9.574 391 HG21 THR 53 3HG2 THR 53 -10.171 -5.778 8.806 392 HG22 THR 53 1HG2 THR 53 -10.590 -4.740 10.170 393 HG23 THR 53 2HG2 THR 53 -10.169 -6.431 10.446 394 H ALA 54 H ALA 54 -7.359 -3.124 11.455 395 HA ALA 54 HA ALA 54 -4.926 -1.886 10.737 396 HB1 ALA 54 3HB ALA 54 -5.726 -3.018 13.417 397 HB2 ALA 54 1HB ALA 54 -6.132 -1.406 12.828 398 HB3 ALA 54 2HB ALA 54 -4.447 -1.841 13.117 399 H SER 55 H SER 55 -5.763 -5.129 11.794 400 HA SER 55 HA SER 55 -3.238 -6.209 12.224 401 HG SER 55 HG SER 55 -5.754 -7.477 13.571 402 HB2 SER 55 1HB SER 55 -5.365 -7.832 10.878 403 HB3 SER 55 2HB SER 55 -4.324 -8.259 12.237 404 H LEU 56 H LEU 56 -5.166 -6.042 9.270 405 HA LEU 56 HA LEU 56 -3.280 -7.409 7.643 406 HG LEU 56 HG LEU 56 -6.197 -7.672 8.239 407 HB2 LEU 56 1HB LEU 56 -5.587 -5.621 6.872 408 HB3 LEU 56 2HB LEU 56 -4.731 -6.707 5.790 409 HD11 LEU 56 1HD1 LEU 56 -7.994 -8.347 6.703 410 HD12 LEU 56 2HD1 LEU 56 -7.192 -7.464 5.407 411 HD13 LEU 56 3HD1 LEU 56 -7.813 -6.598 6.809 412 HD21 LEU 56 3HD2 LEU 56 -6.106 -9.828 7.094 413 HD22 LEU 56 1HD2 LEU 56 -4.491 -9.179 7.374 414 HD23 LEU 56 2HD2 LEU 56 -5.211 -9.087 5.767 415 H LEU 57 H LEU 57 -3.846 -4.042 8.435 416 HA LEU 57 HA LEU 57 -2.133 -2.925 6.476 417 HG LEU 57 HG LEU 57 -4.817 -1.980 7.484 418 HB2 LEU 57 1HB LEU 57 -3.028 -1.918 9.173 419 HB3 LEU 57 2HB LEU 57 -2.034 -0.973 8.080 420 HD11 LEU 57 1HD1 LEU 57 -4.816 -0.216 9.161 421 HD12 LEU 57 2HD1 LEU 57 -5.458 0.375 7.628 422 HD13 LEU 57 3HD1 LEU 57 -3.815 0.792 8.116 423 HD21 LEU 57 3HD2 LEU 57 -2.980 -0.191 5.898 424 HD22 LEU 57 1HD2 LEU 57 -4.661 -0.548 5.501 425 HD23 LEU 57 2HD2 LEU 57 -3.456 -1.836 5.474 426 H GLN 58 H GLN 58 -1.604 -4.085 9.772 427 HA GLN 58 HA GLN 58 1.085 -3.379 10.069 428 HB2 GLN 58 1HB GLN 58 -0.377 -5.817 11.098 429 HB3 GLN 58 2HB GLN 58 1.212 -5.308 11.646 430 HG2 GLN 58 1HG GLN 58 0.283 -3.243 12.506 431 HG3 GLN 58 2HG GLN 58 -1.309 -3.685 11.895 432 HE21 GLN 58 2HE2 GLN 58 -0.991 -6.501 12.652 433 HE22 GLN 58 1HE2 GLN 58 -1.182 -6.550 14.366 434 H GLN 59 H GLN 59 -0.414 -6.177 8.531 435 HA GLN 59 HA GLN 59 1.998 -7.517 7.867 436 HB2 GLN 59 1HB GLN 59 -0.682 -7.663 6.476 437 HB3 GLN 59 2HB GLN 59 0.621 -8.836 6.343 438 HG2 GLN 59 1HG GLN 59 0.380 -9.392 8.697 439 HG3 GLN 59 2HG GLN 59 -0.900 -8.191 8.858 440 HE21 GLN 59 2HE2 GLN 59 -0.985 -11.050 9.346 441 HE22 GLN 59 1HE2 GLN 59 -2.214 -11.680 8.303 442 H ALA 60 H ALA 60 -0.043 -5.198 6.159 443 HA ALA 60 HA ALA 60 1.329 -5.348 3.680 444 HB1 ALA 60 3HB ALA 60 -0.991 -4.587 3.870 445 HB2 ALA 60 1HB ALA 60 0.024 -3.401 3.049 446 HB3 ALA 60 2HB ALA 60 -0.442 -3.148 4.731 447 H ALA 61 H ALA 61 2.128 -3.853 6.617 448 HA ALA 61 HA ALA 61 3.615 -1.642 5.633 449 HB1 ALA 61 3HB ALA 61 3.932 -3.138 8.232 450 HB2 ALA 61 1HB ALA 61 2.847 -1.777 7.952 451 HB3 ALA 61 2HB ALA 61 4.593 -1.546 7.862 452 H GLY 62 H GLY 62 4.179 -4.987 5.537 453 HA2 GLY 62 1HA GLY 62 5.903 -6.046 4.381 454 HA3 GLY 62 2HA GLY 62 6.778 -4.522 4.343 455 H LEU 63 H LEU 63 5.873 -4.865 7.448 456 HA LEU 63 HA LEU 63 8.524 -5.740 8.231 457 HG LEU 63 HG LEU 63 7.095 -2.967 8.446 458 HB2 LEU 63 1HB LEU 63 6.200 -4.759 9.896 459 HB3 LEU 63 2HB LEU 63 7.820 -5.063 10.495 460 HD11 LEU 63 1HD1 LEU 63 7.828 -2.690 11.356 461 HD12 LEU 63 2HD1 LEU 63 6.228 -2.432 10.662 462 HD13 LEU 63 3HD1 LEU 63 7.562 -1.366 10.223 463 HD21 LEU 63 3HD2 LEU 63 9.352 -3.824 8.140 464 HD22 LEU 63 1HD2 LEU 63 9.697 -3.560 9.850 465 HD23 LEU 63 2HD2 LEU 63 9.391 -2.184 8.790 466 H ALA 64 H ALA 64 5.872 -7.368 7.418 467 HA ALA 64 HA ALA 64 5.697 -9.169 9.671 468 HB1 ALA 64 3HB ALA 64 3.672 -8.549 8.432 469 HB2 ALA 64 1HB ALA 64 3.950 -10.291 8.415 470 HB3 ALA 64 2HB ALA 64 4.328 -9.324 6.990 471 H GLU 65 H GLU 65 8.023 -9.714 9.462 472 HA GLU 65 HA GLU 65 8.611 -11.682 7.397 473 HB2 GLU 65 1HB GLU 65 10.247 -10.475 9.623 474 HB3 GLU 65 2HB GLU 65 10.819 -11.849 8.687 475 HG2 GLU 65 1HG GLU 65 10.082 -9.152 7.574 476 HG3 GLU 65 2HG GLU 65 11.720 -9.740 7.860 477 H VAL 66 H VAL 66 7.690 -13.590 7.697 478 HA VAL 66 HA VAL 66 7.019 -14.602 10.286 479 HB VAL 66 HB VAL 66 7.069 -16.088 7.652 480 HG11 VAL 66 1HG1 VAL 66 5.622 -16.680 10.232 481 HG12 VAL 66 2HG1 VAL 66 6.997 -17.571 9.581 482 HG13 VAL 66 3HG1 VAL 66 5.454 -17.584 8.726 483 HG21 VAL 66 3HG2 VAL 66 5.647 -14.129 7.485 484 HG22 VAL 66 1HG2 VAL 66 4.827 -14.570 8.983 485 HG23 VAL 66 2HG2 VAL 66 4.658 -15.588 7.554 486 H VAL 67 H VAL 67 9.583 -15.195 7.946 487 HA VAL 67 HA VAL 67 10.749 -17.293 9.556 488 HB VAL 67 HB VAL 67 11.919 -15.904 7.139 489 HG11 VAL 67 1HG1 VAL 67 13.592 -17.039 8.491 490 HG12 VAL 67 2HG1 VAL 67 13.335 -17.899 6.973 491 HG13 VAL 67 3HG1 VAL 67 12.629 -18.517 8.466 492 HG21 VAL 67 3HG2 VAL 67 11.140 -17.856 5.866 493 HG22 VAL 67 1HG2 VAL 67 9.801 -16.948 6.568 494 HG23 VAL 67 2HG2 VAL 67 10.325 -18.459 7.309 495 H ARG 68 H ARG 68 11.637 -16.691 11.403 496 HA ARG 68 HA ARG 68 13.376 -14.310 11.420 497 HE ARG 68 HE ARG 68 9.191 -14.955 13.978 498 HB2 ARG 68 1HB ARG 68 11.709 -15.467 13.662 499 HB3 ARG 68 2HB ARG 68 12.868 -14.160 13.859 500 HG2 ARG 68 1HG ARG 68 11.576 -12.758 12.357 501 HG3 ARG 68 2HG ARG 68 10.431 -14.076 12.093 502 HD2 ARG 68 1HD ARG 68 11.013 -12.821 14.771 503 HD3 ARG 68 2HD ARG 68 9.656 -12.379 13.736 504 HH11 ARG 68 1HH1 ARG 68 10.300 -12.747 16.445 505 HH12 ARG 68 2HH1 ARG 68 9.484 -13.566 17.741 506 HH21 ARG 68 1HH2 ARG 68 8.101 -16.041 15.671 507 HH22 ARG 68 2HH2 ARG 68 8.219 -15.427 17.294 508 H ASP 69 H ASP 69 15.088 -15.708 10.714 509 HA ASP 69 HA ASP 69 16.334 -17.094 12.974 510 HB2 ASP 69 1HB ASP 69 16.105 -18.218 10.176 511 HB3 ASP 69 2HB ASP 69 17.231 -18.833 11.379 512 HA PRO 70 HA PRO 70 19.847 -15.755 9.912 513 HB2 PRO 70 1HB PRO 70 19.136 -14.075 7.873 514 HB3 PRO 70 2HB PRO 70 19.266 -15.829 7.704 515 HG2 PRO 70 1HG PRO 70 16.834 -14.140 8.124 516 HG3 PRO 70 2HG PRO 70 17.060 -15.533 7.049 517 HD2 PRO 70 1HD PRO 70 15.786 -15.745 9.410 518 HD3 PRO 70 2HD PRO 70 16.790 -17.059 8.762 519 H LEU 71 H LEU 71 17.307 -13.805 11.084 520 HA LEU 71 HA LEU 71 18.764 -11.321 11.076 521 HG LEU 71 HG LEU 71 17.337 -9.967 13.403 522 HB2 LEU 71 1HB LEU 71 16.280 -11.451 10.995 523 HB3 LEU 71 2HB LEU 71 16.289 -12.093 12.625 524 HD11 LEU 71 1HD1 LEU 71 18.361 -9.254 11.326 525 HD12 LEU 71 2HD1 LEU 71 17.241 -8.021 11.906 526 HD13 LEU 71 3HD1 LEU 71 16.774 -9.081 10.577 527 HD21 LEU 71 3HD2 LEU 71 14.937 -10.333 13.600 528 HD22 LEU 71 1HD2 LEU 71 14.695 -9.698 11.972 529 HD23 LEU 71 2HD2 LEU 71 15.288 -8.640 13.253 530 H ALA 72 H ALA 72 18.709 -14.123 12.994 531 HA ALA 72 HA ALA 72 19.670 -12.758 15.391 532 HB1 ALA 72 3HB ALA 72 19.088 -15.681 14.918 533 HB2 ALA 72 1HB ALA 72 17.997 -14.521 15.674 534 HB3 ALA 72 2HB ALA 72 19.516 -14.948 16.464 535 H PHE 73 H PHE 73 21.707 -13.073 16.244 536 HA PHE 73 HA PHE 73 23.658 -14.407 14.484 537 HD1 PHE 73 HD1 PHE 73 24.653 -12.963 12.578 538 HD2 PHE 73 HD2 PHE 73 22.833 -10.156 15.206 539 HE1 PHE 73 HE1 PHE 73 23.941 -11.621 10.644 540 HE2 PHE 73 HE2 PHE 73 22.114 -8.810 13.277 541 HZ PHE 73 HZ PHE 73 22.669 -9.542 10.992 542 HB2 PHE 73 1HB PHE 73 24.083 -11.873 16.088 543 HB3 PHE 73 2HB PHE 73 25.288 -12.673 15.086 544 H LEU 74 H LEU 74 25.869 -14.473 15.894 545 HA LEU 74 HA LEU 74 25.164 -15.940 18.333 546 HG LEU 74 HG LEU 74 27.999 -16.588 19.282 547 HB2 LEU 74 1HB LEU 74 26.681 -16.938 16.584 548 HB3 LEU 74 2HB LEU 74 27.859 -15.704 16.988 549 HD11 LEU 74 1HD1 LEU 74 25.735 -17.496 19.453 550 HD12 LEU 74 2HD1 LEU 74 26.948 -18.714 19.843 551 HD13 LEU 74 3HD1 LEU 74 26.144 -18.743 18.274 552 HD21 LEU 74 3HD2 LEU 74 28.430 -18.631 17.107 553 HD22 LEU 74 1HD2 LEU 74 29.136 -18.696 18.722 554 HD23 LEU 74 2HD2 LEU 74 29.570 -17.388 17.622 555 H ASP 75 H ASP 75 25.863 -12.912 17.433 556 HA ASP 75 HA ASP 75 26.569 -12.132 20.141 557 HB2 ASP 75 1HB ASP 75 28.287 -10.548 19.389 558 HB3 ASP 75 2HB ASP 75 28.739 -12.194 18.962 559 H GLU 76 H GLU 76 26.656 -9.399 19.812 560 HA GLU 76 HA GLU 76 24.250 -8.742 18.292 561 HB2 GLU 76 1HB GLU 76 23.172 -7.711 20.230 562 HB3 GLU 76 2HB GLU 76 23.432 -9.431 20.484 563 HG2 GLU 76 1HG GLU 76 25.452 -8.878 21.808 564 HG3 GLU 76 2HG GLU 76 25.047 -7.170 21.634 565 HA PRO 77 HA PRO 77 26.457 -4.874 17.974 566 HB2 PRO 77 1HB PRO 77 24.751 -3.605 16.351 567 HB3 PRO 77 2HB PRO 77 25.713 -4.973 15.784 568 HG2 PRO 77 1HG PRO 77 22.830 -4.854 16.504 569 HG3 PRO 77 2HG PRO 77 23.643 -5.828 15.268 570 HD2 PRO 77 1HD PRO 77 22.854 -6.689 17.829 571 HD3 PRO 77 2HD PRO 77 23.931 -7.552 16.713 572 H GLU 78 H GLU 78 23.621 -5.423 19.633 573 HA GLU 78 HA GLU 78 22.432 -4.353 21.213 574 HB2 GLU 78 1HB GLU 78 24.707 -2.376 21.157 575 HB3 GLU 78 2HB GLU 78 23.437 -2.412 22.370 576 HG2 GLU 78 1HG GLU 78 24.164 -4.780 22.868 577 HG3 GLU 78 2HG GLU 78 25.580 -4.449 21.868 578 H ALA 79 H ALA 79 23.793 -1.510 19.549 579 HA ALA 79 HA ALA 79 21.226 -0.220 19.584 580 HB1 ALA 79 3HB ALA 79 23.303 1.045 19.889 581 HB2 ALA 79 1HB ALA 79 22.366 1.647 18.522 582 HB3 ALA 79 2HB ALA 79 23.787 0.641 18.242 583 H GLY 80 H GLY 80 23.051 -2.085 17.305 584 HA2 GLY 80 1HA GLY 80 21.414 -1.242 15.047 585 HA3 GLY 80 2HA GLY 80 22.759 -2.373 14.998 586 H ALA 81 H ALA 81 19.903 -2.448 17.085 587 HA ALA 81 HA ALA 81 19.358 -5.158 16.114 588 HB1 ALA 81 3HB ALA 81 19.668 -4.875 18.525 589 HB2 ALA 81 1HB ALA 81 18.036 -5.430 18.144 590 HB3 ALA 81 2HB ALA 81 18.319 -3.740 18.564 591 H GLY 82 H GLY 82 18.377 -2.106 15.426 592 HA2 GLY 82 1HA GLY 82 16.646 -1.530 13.951 593 HA3 GLY 82 2HA GLY 82 15.859 -3.060 14.317 594 H ALA 83 H ALA 83 16.946 -0.292 16.267 595 HA ALA 83 HA ALA 83 14.320 -0.318 17.600 596 HB1 ALA 83 3HB ALA 83 16.228 -0.662 19.080 597 HB2 ALA 83 1HB ALA 83 15.421 0.863 19.439 598 HB3 ALA 83 2HB ALA 83 16.937 0.858 18.537 599 H ARG 84 H ARG 84 15.949 1.249 15.230 600 HA ARG 84 HA ARG 84 14.673 3.842 15.790 601 HE ARG 84 HE ARG 84 19.356 4.527 17.499 602 HB2 ARG 84 1HB ARG 84 17.033 3.207 14.001 603 HB3 ARG 84 2HB ARG 84 16.340 4.805 14.241 604 HG2 ARG 84 1HG ARG 84 16.943 4.715 16.607 605 HG3 ARG 84 2HG ARG 84 17.641 3.112 16.364 606 HD2 ARG 84 1HD ARG 84 19.232 4.074 14.755 607 HD3 ARG 84 2HD ARG 84 18.553 5.672 15.058 608 HH11 ARG 84 1HH1 ARG 84 20.737 5.817 14.556 609 HH12 ARG 84 2HH1 ARG 84 22.206 6.349 15.324 610 HH21 ARG 84 1HH2 ARG 84 21.271 5.203 18.519 611 HH22 ARG 84 2HH2 ARG 84 22.503 6.017 17.588 612 HA PRO 85 HA PRO 85 12.022 3.344 12.276 613 HB2 PRO 85 1HB PRO 85 12.487 6.133 11.479 614 HB3 PRO 85 2HB PRO 85 11.015 5.372 12.087 615 HG2 PRO 85 1HG PRO 85 12.414 7.119 13.567 616 HG3 PRO 85 2HG PRO 85 11.582 5.731 14.296 617 HD2 PRO 85 1HD PRO 85 14.489 6.059 13.621 618 HD3 PRO 85 2HD PRO 85 13.744 5.385 15.088 619 H ALA 86 H ALA 86 14.787 2.671 11.747 620 HA ALA 86 HA ALA 86 15.174 3.634 9.003 621 HB1 ALA 86 3HB ALA 86 17.113 3.759 10.498 622 HB2 ALA 86 1HB ALA 86 17.403 2.646 9.161 623 HB3 ALA 86 2HB ALA 86 17.019 2.018 10.764 624 H ASN 87 H ASN 87 13.547 1.300 10.536 625 HA ASN 87 HA ASN 87 13.875 -0.616 8.323 626 HB2 ASN 87 1HB ASN 87 13.048 -1.135 11.189 627 HB3 ASN 87 2HB ASN 87 12.928 -2.330 9.905 628 HD21 ASN 87 2HD2 ASN 87 15.412 -1.423 8.636 629 HD22 ASN 87 1HD2 ASN 87 16.691 -2.026 9.630 630 H ALA 88 H ALA 88 11.678 1.217 10.312 631 HA ALA 88 HA ALA 88 9.321 0.131 9.037 632 HB1 ALA 88 3HB ALA 88 9.248 0.740 11.409 633 HB2 ALA 88 1HB ALA 88 8.086 1.678 10.469 634 HB3 ALA 88 2HB ALA 88 9.600 2.417 10.991 635 HA PRO 89 HA PRO 89 9.445 3.023 5.661 636 HB2 PRO 89 1HB PRO 89 6.572 2.457 5.381 637 HB3 PRO 89 2HB PRO 89 7.889 2.145 4.249 638 HG2 PRO 89 1HG PRO 89 6.648 0.159 5.568 639 HG3 PRO 89 2HG PRO 89 8.375 0.091 5.174 640 HD2 PRO 89 1HD PRO 89 7.046 0.746 7.774 641 HD3 PRO 89 2HD PRO 89 8.501 -0.225 7.463 642 H GLU 90 H GLU 90 8.603 5.077 5.086 643 HA GLU 90 HA GLU 90 7.553 6.545 7.350 644 HB2 GLU 90 1HB GLU 90 9.361 7.540 6.067 645 HB3 GLU 90 2HB GLU 90 8.403 7.446 4.595 646 HG2 GLU 90 1HG GLU 90 6.797 9.027 5.538 647 HG3 GLU 90 2HG GLU 90 7.763 9.125 7.010 648 H VAL 91 H VAL 91 6.568 5.759 4.043 649 HA VAL 91 HA VAL 91 3.829 6.468 4.802 650 HB VAL 91 HB VAL 91 4.598 8.362 3.547 651 HG11 VAL 91 1HG1 VAL 91 5.404 6.433 1.377 652 HG12 VAL 91 2HG1 VAL 91 6.494 7.353 2.414 653 HG13 VAL 91 3HG1 VAL 91 5.452 8.192 1.264 654 HG21 VAL 91 3HG2 VAL 91 2.310 7.660 3.107 655 HG22 VAL 91 1HG2 VAL 91 2.867 6.616 1.800 656 HG23 VAL 91 2HG2 VAL 91 3.035 8.367 1.664 657 H LEU 92 H LEU 92 2.325 5.085 4.224 658 HA LEU 92 HA LEU 92 3.059 2.855 2.441 659 HG LEU 92 HG LEU 92 0.348 1.355 2.887 660 HB2 LEU 92 1HB LEU 92 2.577 2.176 4.755 661 HB3 LEU 92 2HB LEU 92 1.014 2.965 4.668 662 HD11 LEU 92 1HD1 LEU 92 2.571 0.794 2.061 663 HD12 LEU 92 2HD1 LEU 92 1.693 -0.655 2.555 664 HD13 LEU 92 3HD1 LEU 92 2.951 0.012 3.597 665 HD21 LEU 92 3HD2 LEU 92 0.050 -0.550 4.392 666 HD22 LEU 92 1HD2 LEU 92 -0.276 0.976 5.211 667 HD23 LEU 92 2HD2 LEU 92 1.246 0.133 5.493 668 H LEU 93 H LEU 93 2.227 3.163 0.486 669 HA LEU 93 HA LEU 93 -0.176 4.788 0.172 670 HG LEU 93 HG LEU 93 2.751 5.447 -0.628 671 HB2 LEU 93 1HB LEU 93 1.696 3.597 -1.879 672 HB3 LEU 93 2HB LEU 93 0.333 4.639 -2.246 673 HD11 LEU 93 1HD1 LEU 93 3.284 5.106 -2.980 674 HD12 LEU 93 2HD1 LEU 93 3.324 6.818 -2.557 675 HD13 LEU 93 3HD1 LEU 93 1.947 6.160 -3.440 676 HD21 LEU 93 3HD2 LEU 93 0.759 6.642 0.063 677 HD22 LEU 93 1HD2 LEU 93 0.394 7.045 -1.615 678 HD23 LEU 93 2HD2 LEU 93 1.831 7.711 -0.838 679 H VAL 94 H VAL 94 -2.078 3.818 0.251 680 HA VAL 94 HA VAL 94 -2.245 1.010 -0.615 681 HB VAL 94 HB VAL 94 -4.055 2.483 1.311 682 HG11 VAL 94 1HG1 VAL 94 -5.236 0.746 0.068 683 HG12 VAL 94 2HG1 VAL 94 -5.030 0.281 1.757 684 HG13 VAL 94 3HG1 VAL 94 -3.999 -0.429 0.515 685 HG21 VAL 94 3HG2 VAL 94 -3.059 1.043 3.030 686 HG22 VAL 94 1HG2 VAL 94 -1.855 2.085 2.273 687 HG23 VAL 94 2HG2 VAL 94 -1.951 0.382 1.827 688 H GLY 95 H GLY 95 -3.169 0.739 -2.501 689 HA2 GLY 95 1HA GLY 95 -5.137 2.671 -3.490 690 HA3 GLY 95 2HA GLY 95 -4.410 1.358 -4.413 691 H THR 96 H THR 96 -7.088 2.357 -2.591 692 HA THR 96 HA THR 96 -7.836 -0.207 -1.569 693 HB THR 96 HB THR 96 -10.015 1.070 -1.029 694 HG1 THR 96 HG1 THR 96 -9.761 2.807 -2.446 695 HG21 THR 96 3HG2 THR 96 -8.287 0.571 0.626 696 HG22 THR 96 1HG2 THR 96 -8.949 2.187 0.879 697 HG23 THR 96 2HG2 THR 96 -7.374 1.989 0.110 698 H GLY 97 H GLY 97 -7.576 -0.769 -4.130 699 HA2 GLY 97 1HA GLY 97 -8.724 -2.185 -5.535 700 HA3 GLY 97 2HA GLY 97 -10.189 -1.841 -4.631 701 H ARG 98 H ARG 98 -11.618 -0.380 -5.399 702 HA ARG 98 HA ARG 98 -11.178 0.277 -8.211 703 HE ARG 98 HE ARG 98 -14.628 -1.094 -11.058 704 HB2 ARG 98 1HB ARG 98 -13.188 -1.071 -7.158 705 HB3 ARG 98 2HB ARG 98 -13.832 0.538 -6.868 706 HG2 ARG 98 1HG ARG 98 -13.732 1.045 -9.227 707 HG3 ARG 98 2HG ARG 98 -12.971 -0.514 -9.555 708 HD2 ARG 98 1HD ARG 98 -15.043 -1.557 -8.499 709 HD3 ARG 98 2HD ARG 98 -15.776 0.042 -8.633 710 HH11 ARG 98 1HH1 ARG 98 -17.502 -0.429 -9.158 711 HH12 ARG 98 2HH1 ARG 98 -18.588 -0.678 -10.496 712 HH21 ARG 98 1HH2 ARG 98 -16.061 -1.411 -12.814 713 HH22 ARG 98 2HH2 ARG 98 -17.774 -1.222 -12.561 714 H ARG 99 H ARG 99 -11.988 1.763 -5.139 715 HA ARG 99 HA ARG 99 -11.538 4.400 -6.307 716 HE ARG 99 HE ARG 99 -15.519 5.683 -8.570 717 HB2 ARG 99 1HB ARG 99 -14.048 3.525 -4.907 718 HB3 ARG 99 2HB ARG 99 -13.521 5.200 -4.833 719 HG2 ARG 99 1HG ARG 99 -13.575 5.296 -7.291 720 HG3 ARG 99 2HG ARG 99 -14.185 3.639 -7.316 721 HD2 ARG 99 1HD ARG 99 -16.186 4.264 -6.213 722 HD3 ARG 99 2HD ARG 99 -15.548 5.858 -5.813 723 HH11 ARG 99 1HH1 ARG 99 -17.926 5.476 -6.040 724 HH12 ARG 99 2HH1 ARG 99 -19.171 6.236 -6.988 725 HH21 ARG 99 1HH2 ARG 99 -17.158 6.674 -9.827 726 HH22 ARG 99 2HH2 ARG 99 -18.753 6.870 -9.152 727 H GLN 100 H GLN 100 -11.094 6.037 -4.716 728 HA GLN 100 HA GLN 100 -9.500 5.218 -2.561 729 HB2 GLN 100 1HB GLN 100 -9.215 7.389 -3.607 730 HB3 GLN 100 2HB GLN 100 -10.833 7.872 -3.120 731 HG2 GLN 100 1HG GLN 100 -10.202 7.899 -0.813 732 HG3 GLN 100 2HG GLN 100 -8.625 7.203 -1.191 733 HE21 GLN 100 2HE2 GLN 100 -9.281 9.699 0.157 734 HE22 GLN 100 1HE2 GLN 100 -8.509 10.949 -0.753 735 H HIS 101 H HIS 101 -10.239 4.131 -0.860 736 HA HIS 101 HA HIS 101 -12.699 5.118 0.426 737 HD1 HIS 101 HD1 HIS 101 -11.978 1.256 2.756 738 HD2 HIS 101 HD2 HIS 101 -14.880 4.041 1.712 739 HE1 HIS 101 HE1 HIS 101 -13.670 1.197 4.615 740 HE2 HIS 101 HE2 HIS 101 -15.285 3.054 4.067 741 HB2 HIS 101 1HB HIS 101 -12.923 2.785 -0.288 742 HB3 HIS 101 2HB HIS 101 -11.459 2.359 0.595 743 H LEU 102 H LEU 102 -12.297 6.329 2.124 744 HA LEU 102 HA LEU 102 -9.820 6.396 3.480 745 HG LEU 102 HG LEU 102 -11.854 8.514 2.308 746 HB2 LEU 102 1HB LEU 102 -12.524 7.393 4.385 747 HB3 LEU 102 2HB LEU 102 -10.989 7.818 5.114 748 HD11 LEU 102 1HD1 LEU 102 -13.050 9.771 4.018 749 HD12 LEU 102 2HD1 LEU 102 -11.922 10.805 3.141 750 HD13 LEU 102 3HD1 LEU 102 -11.518 10.233 4.761 751 HD21 LEU 102 3HD2 LEU 102 -9.819 9.854 2.219 752 HD22 LEU 102 1HD2 LEU 102 -9.438 8.151 2.469 753 HD23 LEU 102 2HD2 LEU 102 -9.356 9.280 3.822 754 H LEU 103 H LEU 103 -9.204 5.534 5.431 755 HA LEU 103 HA LEU 103 -10.802 3.256 6.345 756 HG LEU 103 HG LEU 103 -8.220 3.223 4.541 757 HB2 LEU 103 1HB LEU 103 -7.908 3.957 6.870 758 HB3 LEU 103 2HB LEU 103 -8.718 2.507 7.435 759 HD11 LEU 103 1HD1 LEU 103 -6.633 1.371 4.583 760 HD12 LEU 103 2HD1 LEU 103 -6.933 1.144 6.305 761 HD13 LEU 103 3HD1 LEU 103 -6.176 2.630 5.731 762 HD21 LEU 103 3HD2 LEU 103 -9.007 0.946 4.079 763 HD22 LEU 103 1HD2 LEU 103 -10.267 1.936 4.814 764 HD23 LEU 103 2HD2 LEU 103 -9.406 0.741 5.784 765 H GLY 104 H GLY 104 -9.726 2.982 8.906 766 HA2 GLY 104 1HA GLY 104 -10.960 5.311 10.224 767 HA3 GLY 104 2HA GLY 104 -10.867 3.691 10.904 768 HA PRO 105 HA PRO 105 -7.193 6.767 11.879 769 HB2 PRO 105 1HB PRO 105 -8.004 7.382 14.459 770 HB3 PRO 105 2HB PRO 105 -8.211 8.425 13.049 771 HG2 PRO 105 1HG PRO 105 -10.166 6.577 14.347 772 HG3 PRO 105 2HG PRO 105 -10.431 8.191 13.658 773 HD2 PRO 105 1HD PRO 105 -11.157 5.980 12.336 774 HD3 PRO 105 2HD PRO 105 -10.488 7.386 11.480 775 H GLU 106 H GLU 106 -8.979 4.575 14.037 776 HA GLU 106 HA GLU 106 -6.613 3.879 15.504 777 HB2 GLU 106 1HB GLU 106 -9.393 2.702 15.533 778 HB3 GLU 106 2HB GLU 106 -8.106 2.246 16.643 779 HG2 GLU 106 1HG GLU 106 -9.253 5.016 16.363 780 HG3 GLU 106 2HG GLU 106 -9.680 3.856 17.620 781 H GLN 107 H GLN 107 -7.542 3.064 12.492 782 HA GLN 107 HA GLN 107 -6.455 0.357 12.611 783 HB2 GLN 107 1HB GLN 107 -7.627 1.949 10.329 784 HB3 GLN 107 2HB GLN 107 -6.964 0.332 10.159 785 HG2 GLN 107 1HG GLN 107 -8.655 -0.549 11.648 786 HG3 GLN 107 2HG GLN 107 -9.291 1.074 11.915 787 HE21 GLN 107 2HE2 GLN 107 -10.547 -1.347 10.797 788 HE22 GLN 107 1HE2 GLN 107 -11.134 -0.879 9.234 789 H VAL 108 H VAL 108 -5.782 3.562 11.343 790 HA VAL 108 HA VAL 108 -3.297 2.662 10.136 791 HB VAL 108 HB VAL 108 -3.096 4.950 9.262 792 HG11 VAL 108 1HG1 VAL 108 -4.340 3.290 7.983 793 HG12 VAL 108 2HG1 VAL 108 -5.035 4.896 7.769 794 HG13 VAL 108 3HG1 VAL 108 -5.822 3.729 8.833 795 HG21 VAL 108 3HG2 VAL 108 -4.126 6.172 11.102 796 HG22 VAL 108 1HG2 VAL 108 -5.691 5.456 10.718 797 HG23 VAL 108 2HG2 VAL 108 -4.922 6.560 9.576 798 H ARG 109 H ARG 109 -4.372 4.272 13.008 799 HA ARG 109 HA ARG 109 -2.034 5.709 13.591 800 HE ARG 109 HE ARG 109 -5.215 6.064 17.275 801 HB2 ARG 109 1HB ARG 109 -4.202 6.126 14.700 802 HB3 ARG 109 2HB ARG 109 -4.015 4.617 15.589 803 HG2 ARG 109 1HG ARG 109 -2.370 5.449 16.936 804 HG3 ARG 109 2HG ARG 109 -1.825 6.618 15.735 805 HD2 ARG 109 1HD ARG 109 -2.849 7.823 17.518 806 HD3 ARG 109 2HD ARG 109 -3.925 7.894 16.126 807 HH11 ARG 109 1HH1 ARG 109 -3.200 8.295 19.081 808 HH12 ARG 109 2HH1 ARG 109 -4.147 8.182 20.531 809 HH21 ARG 109 1HH2 ARG 109 -6.472 5.927 19.159 810 HH22 ARG 109 2HH2 ARG 109 -6.039 6.866 20.566 811 HA PRO 110 HA PRO 110 -0.710 1.527 16.039 812 HB2 PRO 110 1HB PRO 110 -1.518 -0.036 13.613 813 HB3 PRO 110 2HB PRO 110 -1.349 -0.574 15.290 814 HG2 PRO 110 1HG PRO 110 -3.753 -0.083 14.272 815 HG3 PRO 110 2HG PRO 110 -3.361 0.377 15.940 816 HD2 PRO 110 1HD PRO 110 -3.673 2.086 13.528 817 HD3 PRO 110 2HD PRO 110 -3.980 2.468 15.232 818 H LEU 111 H LEU 111 -0.747 1.966 12.497 819 HA LEU 111 HA LEU 111 2.031 1.317 12.226 820 HG LEU 111 HG LEU 111 -0.489 0.277 10.693 821 HB2 LEU 111 1HB LEU 111 0.095 2.608 10.304 822 HB3 LEU 111 2HB LEU 111 1.739 2.151 9.894 823 HD11 LEU 111 1HD1 LEU 111 -0.722 1.137 8.438 824 HD12 LEU 111 2HD1 LEU 111 -0.245 -0.561 8.403 825 HD13 LEU 111 3HD1 LEU 111 0.947 0.697 8.078 826 HD21 LEU 111 3HD2 LEU 111 1.111 -1.516 10.206 827 HD22 LEU 111 1HD2 LEU 111 1.644 -0.514 11.556 828 HD23 LEU 111 2HD2 LEU 111 2.379 -0.314 9.965 829 H LEU 112 H LEU 112 0.134 4.275 12.448 830 HA LEU 112 HA LEU 112 2.164 6.135 11.921 831 HG LEU 112 HG LEU 112 -0.818 6.064 11.329 832 HB2 LEU 112 1HB LEU 112 -0.242 6.346 13.731 833 HB3 LEU 112 2HB LEU 112 0.781 7.701 13.299 834 HD11 LEU 112 1HD1 LEU 112 -2.264 8.034 11.186 835 HD12 LEU 112 2HD1 LEU 112 -1.348 8.798 12.486 836 HD13 LEU 112 3HD1 LEU 112 -2.276 7.332 12.805 837 HD21 LEU 112 3HD2 LEU 112 1.178 7.051 10.350 838 HD22 LEU 112 1HD2 LEU 112 0.741 8.626 11.012 839 HD23 LEU 112 2HD2 LEU 112 -0.270 7.879 9.775 840 H ALA 113 H ALA 113 1.375 4.310 14.791 841 HA ALA 113 HA ALA 113 3.042 5.728 16.604 842 HB1 ALA 113 3HB ALA 113 2.737 3.822 18.080 843 HB2 ALA 113 1HB ALA 113 2.104 2.864 16.742 844 HB3 ALA 113 2HB ALA 113 1.204 4.264 17.327 845 H MET 114 H MET 114 3.635 3.338 14.186 846 HA MET 114 HA MET 114 6.324 2.768 15.141 847 HB2 MET 114 1HB MET 114 4.912 1.959 12.587 848 HB3 MET 114 2HB MET 114 6.509 1.412 13.071 849 HG2 MET 114 1HG MET 114 5.552 0.307 15.017 850 HG3 MET 114 2HG MET 114 3.948 0.878 14.559 851 HE1 MET 114 3HE MET 114 4.667 -2.185 15.141 852 HE2 MET 114 1HE MET 114 3.789 -2.975 13.833 853 HE3 MET 114 2HE MET 114 3.052 -1.628 14.700 854 H GLY 115 H GLY 115 4.651 4.777 12.863 855 HA2 GLY 115 1HA GLY 115 5.854 6.888 12.316 856 HA3 GLY 115 2HA GLY 115 7.233 5.867 11.931 857 H VAL 116 H VAL 116 4.330 4.420 11.039 858 HA VAL 116 HA VAL 116 4.931 4.960 8.223 859 HB VAL 116 HB VAL 116 3.073 2.850 9.326 860 HG11 VAL 116 1HG1 VAL 116 3.466 1.759 7.164 861 HG12 VAL 116 2HG1 VAL 116 4.469 3.123 6.667 862 HG13 VAL 116 3HG1 VAL 116 2.749 3.359 6.979 863 HG21 VAL 116 3HG2 VAL 116 4.908 1.250 9.101 864 HG22 VAL 116 1HG2 VAL 116 5.295 2.506 10.277 865 HG23 VAL 116 2HG2 VAL 116 6.003 2.561 8.662 866 H GLY 117 H GLY 117 3.805 6.627 7.416 867 HA2 GLY 117 1HA GLY 117 1.086 7.173 8.313 868 HA3 GLY 117 2HA GLY 117 2.023 8.125 7.168 869 H VAL 118 H VAL 118 -0.678 6.379 7.367 870 HA VAL 118 HA VAL 118 -0.333 4.859 4.902 871 HB VAL 118 HB VAL 118 -2.718 4.945 6.755 872 HG11 VAL 118 1HG1 VAL 118 -2.010 3.032 4.534 873 HG12 VAL 118 2HG1 VAL 118 -3.291 4.244 4.494 874 HG13 VAL 118 3HG1 VAL 118 -3.395 2.888 5.618 875 HG21 VAL 118 3HG2 VAL 118 -1.913 2.779 7.584 876 HG22 VAL 118 1HG2 VAL 118 -0.758 4.073 7.905 877 HG23 VAL 118 2HG2 VAL 118 -0.470 2.941 6.584 878 H GLU 119 H GLU 119 -0.960 5.597 3.013 879 HA GLU 119 HA GLU 119 -2.944 7.775 2.887 880 HB2 GLU 119 1HB GLU 119 -0.865 6.929 0.857 881 HB3 GLU 119 2HB GLU 119 -2.014 8.238 0.642 882 HG2 GLU 119 1HG GLU 119 0.052 8.165 2.824 883 HG3 GLU 119 2HG GLU 119 0.292 8.945 1.261 884 H ALA 120 H ALA 120 -4.889 6.794 2.646 885 HA ALA 120 HA ALA 120 -5.127 4.467 0.896 886 HB1 ALA 120 3HB ALA 120 -6.209 4.364 3.090 887 HB2 ALA 120 1HB ALA 120 -7.390 4.259 1.785 888 HB3 ALA 120 2HB ALA 120 -7.190 5.769 2.675 889 H MET 121 H MET 121 -5.404 4.877 -1.197 890 HA MET 121 HA MET 121 -7.314 6.941 -2.018 891 HB2 MET 121 1HB MET 121 -4.453 6.779 -2.982 892 HB3 MET 121 2HB MET 121 -5.699 7.737 -3.767 893 HG2 MET 121 1HG MET 121 -5.932 9.115 -1.803 894 HG3 MET 121 2HG MET 121 -4.789 8.104 -0.922 895 HE1 MET 121 3HE MET 121 -1.437 8.821 -2.810 896 HE2 MET 121 1HE MET 121 -2.581 7.518 -3.137 897 HE3 MET 121 2HE MET 121 -2.204 7.965 -1.473 898 H ASP 122 H ASP 122 -7.347 6.851 -4.605 899 HA ASP 122 HA ASP 122 -8.193 4.325 -5.464 900 HB2 ASP 122 1HB ASP 122 -7.372 6.833 -6.899 901 HB3 ASP 122 2HB ASP 122 -7.661 5.363 -7.820 902 H THR 123 H THR 123 -7.192 2.744 -6.758 903 HA THR 123 HA THR 123 -4.585 2.072 -6.099 904 HB THR 123 HB THR 123 -6.155 1.161 -8.521 905 HG1 THR 123 HG1 THR 123 -7.264 -0.012 -7.138 906 HG21 THR 123 3HG2 THR 123 -4.776 -0.864 -8.382 907 HG22 THR 123 1HG2 THR 123 -3.859 -0.151 -7.056 908 HG23 THR 123 2HG2 THR 123 -3.781 0.564 -8.667 909 H GLN 124 H GLN 124 -5.791 3.634 -9.061 910 HA GLN 124 HA GLN 124 -3.302 3.828 -10.356 911 HB2 GLN 124 1HB GLN 124 -5.443 4.161 -11.515 912 HB3 GLN 124 2HB GLN 124 -5.713 5.636 -10.598 913 HG2 GLN 124 1HG GLN 124 -3.709 6.620 -11.623 914 HG3 GLN 124 2HG GLN 124 -3.494 5.152 -12.574 915 HE21 GLN 124 2HE2 GLN 124 -3.683 6.240 -14.512 916 HE22 GLN 124 1HE2 GLN 124 -5.203 6.858 -15.084 917 H ALA 125 H ALA 125 -5.007 6.033 -8.180 918 HA ALA 125 HA ALA 125 -3.217 8.195 -8.383 919 HB1 ALA 125 3HB ALA 125 -5.472 8.429 -7.474 920 HB2 ALA 125 1HB ALA 125 -4.262 9.013 -6.331 921 HB3 ALA 125 2HB ALA 125 -5.021 7.441 -6.085 922 H ALA 126 H ALA 126 -3.371 5.448 -6.163 923 HA ALA 126 HA ALA 126 -1.224 6.248 -4.512 924 HB1 ALA 126 3HB ALA 126 -1.234 3.958 -3.692 925 HB2 ALA 126 1HB ALA 126 -2.253 3.464 -5.045 926 HB3 ALA 126 2HB ALA 126 -2.880 4.579 -3.830 927 H ALA 127 H ALA 127 -1.372 4.071 -7.327 928 HA ALA 127 HA ALA 127 1.357 3.365 -7.332 929 HB1 ALA 127 3HB ALA 127 0.985 2.603 -9.605 930 HB2 ALA 127 1HB ALA 127 -0.525 3.511 -9.686 931 HB3 ALA 127 2HB ALA 127 -0.376 2.145 -8.581 932 H ARG 128 H ARG 128 -0.402 6.001 -8.871 933 HA ARG 128 HA ARG 128 1.678 7.082 -10.410 934 HE ARG 128 HE ARG 128 0.116 10.927 -12.920 935 HB2 ARG 128 1HB ARG 128 -0.831 7.641 -10.391 936 HB3 ARG 128 2HB ARG 128 -0.464 8.704 -9.044 937 HG2 ARG 128 1HG ARG 128 1.076 9.966 -10.474 938 HG3 ARG 128 2HG ARG 128 0.667 8.907 -11.828 939 HD2 ARG 128 1HD ARG 128 -1.756 9.566 -11.395 940 HD3 ARG 128 2HD ARG 128 -1.109 10.842 -10.367 941 HH11 ARG 128 1HH1 ARG 128 -2.869 11.671 -11.256 942 HH12 ARG 128 2HH1 ARG 128 -3.385 12.856 -12.411 943 HH21 ARG 128 1HH2 ARG 128 -0.551 12.508 -14.458 944 HH22 ARG 128 2HH2 ARG 128 -2.076 13.324 -14.236 945 H THR 129 H THR 129 0.567 7.889 -7.136 946 HA THR 129 HA THR 129 2.551 9.815 -6.583 947 HB THR 129 HB THR 129 1.084 8.079 -4.584 948 HG1 THR 129 HG1 THR 129 -0.458 9.091 -5.860 949 HG21 THR 129 3HG2 THR 129 2.300 10.835 -4.338 950 HG22 THR 129 1HG2 THR 129 2.930 9.353 -3.617 951 HG23 THR 129 2HG2 THR 129 1.380 10.004 -3.084 952 H TYR 130 H TYR 130 2.421 6.326 -6.209 953 HA TYR 130 HA TYR 130 4.688 5.951 -4.600 954 HD1 TYR 130 HD2 TYR 130 4.787 3.766 -3.229 955 HD2 TYR 130 HD1 TYR 130 5.166 2.534 -7.282 956 HE1 TYR 130 HE2 TYR 130 6.396 2.036 -2.546 957 HE2 TYR 130 HE1 TYR 130 6.773 0.797 -6.612 958 HH TYR 130 HH TYR 130 7.170 -0.196 -3.451 959 HB2 TYR 130 1HB TYR 130 2.994 4.211 -5.082 960 HB3 TYR 130 2HB TYR 130 3.574 4.123 -6.739 961 H ASN 131 H ASN 131 4.324 5.968 -8.125 962 HA ASN 131 HA ASN 131 6.958 5.458 -8.852 963 HB2 ASN 131 1HB ASN 131 5.128 5.500 -10.474 964 HB3 ASN 131 2HB ASN 131 4.919 7.230 -10.225 965 HD21 ASN 131 2HD2 ASN 131 6.835 4.753 -11.701 966 HD22 ASN 131 1HD2 ASN 131 7.803 5.797 -12.680 967 H ILE 132 H ILE 132 5.370 8.537 -8.125 968 HA ILE 132 HA ILE 132 7.654 10.156 -8.603 969 HB ILE 132 HB ILE 132 5.264 10.772 -6.856 970 HG12 ILE 132 1HG1 ILE 132 5.728 11.410 -9.781 971 HG13 ILE 132 2HG1 ILE 132 4.662 10.142 -9.187 972 HG21 ILE 132 1HG2 ILE 132 7.274 12.593 -8.180 973 HG22 ILE 132 2HG2 ILE 132 7.137 12.270 -6.453 974 HG23 ILE 132 3HG2 ILE 132 5.841 13.117 -7.296 975 HD11 ILE 132 3HD1 ILE 132 3.272 11.816 -8.092 976 HD12 ILE 132 1HD1 ILE 132 3.417 12.130 -9.821 977 HD13 ILE 132 2HD1 ILE 132 4.346 13.091 -8.670 978 H LEU 133 H LEU 133 6.150 9.016 -5.575 979 HA LEU 133 HA LEU 133 7.892 10.282 -3.802 980 HG LEU 133 HG LEU 133 5.888 8.783 -1.105 981 HB2 LEU 133 1HB LEU 133 5.642 8.923 -3.484 982 HB3 LEU 133 2HB LEU 133 6.744 7.612 -3.116 983 HD11 LEU 133 1HD1 LEU 133 8.028 9.043 0.033 984 HD12 LEU 133 2HD1 LEU 133 8.859 9.060 -1.523 985 HD13 LEU 133 3HD1 LEU 133 8.014 7.606 -0.990 986 HD21 LEU 133 3HD2 LEU 133 5.704 11.023 -2.019 987 HD22 LEU 133 1HD2 LEU 133 7.459 11.121 -2.179 988 HD23 LEU 133 2HD2 LEU 133 6.723 11.023 -0.579 989 H MET 134 H MET 134 8.116 7.094 -5.320 990 HA MET 134 HA MET 134 10.343 6.126 -3.934 991 HB2 MET 134 1HB MET 134 9.041 4.669 -5.339 992 HB3 MET 134 2HB MET 134 9.424 5.624 -6.763 993 HG2 MET 134 1HG MET 134 11.752 4.962 -6.612 994 HG3 MET 134 2HG MET 134 11.414 4.055 -5.140 995 HE1 MET 134 3HE MET 134 9.036 4.287 -8.251 996 HE2 MET 134 1HE MET 134 9.595 2.931 -9.231 997 HE3 MET 134 2HE MET 134 10.634 4.338 -8.997 998 H ALA 135 H ALA 135 10.131 8.297 -6.694 999 HA ALA 135 HA ALA 135 12.995 8.283 -7.123 1000 HB1 ALA 135 3HB ALA 135 12.538 9.877 -8.902 1001 HB2 ALA 135 1HB ALA 135 10.863 10.017 -8.367 1002 HB3 ALA 135 2HB ALA 135 11.454 8.489 -9.020 1003 H GLU 136 H GLU 136 10.824 9.892 -5.107 1004 HA GLU 136 HA GLU 136 12.395 12.318 -4.856 1005 HB2 GLU 136 1HB GLU 136 9.938 11.333 -3.403 1006 HB3 GLU 136 2HB GLU 136 10.709 12.881 -3.090 1007 HG2 GLU 136 1HG GLU 136 9.561 12.035 -5.737 1008 HG3 GLU 136 2HG GLU 136 8.740 13.050 -4.552 1009 H GLY 137 H GLY 137 11.896 9.303 -3.142 1010 HA2 GLY 137 1HA GLY 137 14.153 9.344 -1.582 1011 HA3 GLY 137 2HA GLY 137 12.924 10.184 -0.641 1012 H ARG 138 H ARG 138 14.068 7.208 -1.793 1013 HA ARG 138 HA ARG 138 11.914 5.495 -1.593 1014 HE ARG 138 HE ARG 138 16.061 5.118 -4.836 1015 HB2 ARG 138 1HB ARG 138 14.724 4.788 -0.770 1016 HB3 ARG 138 2HB ARG 138 13.493 3.717 -1.406 1017 HG2 ARG 138 1HG ARG 138 13.640 4.771 -3.575 1018 HG3 ARG 138 2HG ARG 138 14.809 5.939 -2.947 1019 HD2 ARG 138 1HD ARG 138 16.270 3.998 -2.333 1020 HD3 ARG 138 2HD ARG 138 15.153 2.958 -3.212 1021 HH11 ARG 138 1HH1 ARG 138 17.020 2.023 -3.508 1022 HH12 ARG 138 2HH1 ARG 138 18.161 1.682 -4.774 1023 HH21 ARG 138 1HH2 ARG 138 17.586 4.676 -6.511 1024 HH22 ARG 138 2HH2 ARG 138 18.488 3.191 -6.470 1025 H ARG 139 H ARG 139 10.706 6.270 0.283 1026 HA ARG 139 HA ARG 139 11.374 4.552 2.546 1027 HE ARG 139 HE ARG 139 11.006 9.100 5.007 1028 HB2 ARG 139 1HB ARG 139 10.509 7.441 2.877 1029 HB3 ARG 139 2HB ARG 139 10.667 6.275 4.183 1030 HG2 ARG 139 1HG ARG 139 13.094 6.083 3.589 1031 HG3 ARG 139 2HG ARG 139 12.859 7.437 2.484 1032 HD2 ARG 139 1HD ARG 139 12.500 7.426 5.476 1033 HD3 ARG 139 2HD ARG 139 13.731 8.281 4.550 1034 HH11 ARG 139 1HH1 ARG 139 13.815 9.472 2.942 1035 HH12 ARG 139 2HH1 ARG 139 13.324 11.036 2.357 1036 HH21 ARG 139 1HH2 ARG 139 10.379 11.139 4.265 1037 HH22 ARG 139 2HH2 ARG 139 11.377 11.992 3.120 1038 H VAL 140 H VAL 140 9.680 4.186 0.399 1039 HA VAL 140 HA VAL 140 7.003 4.480 1.586 1040 HB VAL 140 HB VAL 140 7.242 6.178 -0.142 1041 HG11 VAL 140 1HG1 VAL 140 7.884 3.904 -2.015 1042 HG12 VAL 140 2HG1 VAL 140 8.996 5.161 -1.474 1043 HG13 VAL 140 3HG1 VAL 140 7.616 5.584 -2.488 1044 HG21 VAL 140 3HG2 VAL 140 5.057 5.133 0.122 1045 HG22 VAL 140 1HG2 VAL 140 5.492 3.901 -1.063 1046 HG23 VAL 140 2HG2 VAL 140 5.340 5.587 -1.560 1047 H VAL 141 H VAL 141 5.678 2.777 1.442 1048 HA VAL 141 HA VAL 141 6.419 0.541 -0.332 1049 HB VAL 141 HB VAL 141 5.122 0.328 2.402 1050 HG11 VAL 141 1HG1 VAL 141 4.264 -1.361 0.876 1051 HG12 VAL 141 2HG1 VAL 141 5.312 -2.099 2.087 1052 HG13 VAL 141 3HG1 VAL 141 5.908 -1.834 0.448 1053 HG21 VAL 141 3HG2 VAL 141 7.863 -0.524 1.479 1054 HG22 VAL 141 1HG2 VAL 141 7.170 -0.837 3.070 1055 HG23 VAL 141 2HG2 VAL 141 7.501 0.819 2.562 1056 H VAL 142 H VAL 142 4.646 -0.426 -1.428 1057 HA VAL 142 HA VAL 142 2.160 1.141 -1.219 1058 HB VAL 142 HB VAL 142 3.485 1.669 -3.264 1059 HG11 VAL 142 1HG1 VAL 142 3.533 0.030 -5.092 1060 HG12 VAL 142 2HG1 VAL 142 2.884 -1.189 -3.996 1061 HG13 VAL 142 3HG1 VAL 142 4.475 -0.490 -3.694 1062 HG21 VAL 142 3HG2 VAL 142 0.820 0.353 -3.766 1063 HG22 VAL 142 1HG2 VAL 142 1.613 1.519 -4.825 1064 HG23 VAL 142 2HG2 VAL 142 1.075 2.010 -3.220 1065 H ALA 143 H ALA 143 0.267 0.089 -1.222 1066 HA ALA 143 HA ALA 143 0.251 -2.808 -1.759 1067 HB1 ALA 143 3HB ALA 143 -1.237 -1.409 0.470 1068 HB2 ALA 143 1HB ALA 143 0.172 -2.451 0.670 1069 HB3 ALA 143 2HB ALA 143 -1.343 -3.123 0.070 1070 H LEU 144 H LEU 144 -0.925 -3.044 -3.550 1071 HA LEU 144 HA LEU 144 -3.202 -1.215 -3.984 1072 HG LEU 144 HG LEU 144 -0.298 -0.614 -4.965 1073 HB2 LEU 144 1HB LEU 144 -1.431 -2.543 -6.042 1074 HB3 LEU 144 2HB LEU 144 -2.801 -1.511 -6.397 1075 HD11 LEU 144 1HD1 LEU 144 0.174 -1.174 -7.281 1076 HD12 LEU 144 2HD1 LEU 144 0.211 0.573 -7.046 1077 HD13 LEU 144 3HD1 LEU 144 -1.184 -0.184 -7.815 1078 HD21 LEU 144 3HD2 LEU 144 -2.273 0.668 -4.337 1079 HD22 LEU 144 1HD2 LEU 144 -2.651 0.939 -6.038 1080 HD23 LEU 144 2HD2 LEU 144 -1.189 1.634 -5.339 1081 H LEU 145 H LEU 145 -5.158 -2.088 -4.481 1082 HA LEU 145 HA LEU 145 -5.267 -5.009 -4.841 1083 HG LEU 145 HG LEU 145 -5.671 -4.897 -2.397 1084 HB2 LEU 145 1HB LEU 145 -7.467 -3.127 -3.961 1085 HB3 LEU 145 2HB LEU 145 -7.653 -4.850 -4.208 1086 HD11 LEU 145 1HD1 LEU 145 -7.297 -2.470 -1.672 1087 HD12 LEU 145 2HD1 LEU 145 -5.615 -2.447 -2.205 1088 HD13 LEU 145 3HD1 LEU 145 -6.049 -3.233 -0.687 1089 HD21 LEU 145 3HD2 LEU 145 -7.764 -6.111 -2.239 1090 HD22 LEU 145 1HD2 LEU 145 -8.614 -4.627 -1.806 1091 HD23 LEU 145 2HD2 LEU 145 -7.406 -5.302 -0.713 1092 HA PRO 146 HA PRO 146 -6.613 -3.625 -8.964 1093 HB2 PRO 146 1HB PRO 146 -5.110 -5.290 -10.394 1094 HB3 PRO 146 2HB PRO 146 -4.388 -3.877 -9.615 1095 HG2 PRO 146 1HG PRO 146 -4.283 -6.745 -8.813 1096 HG3 PRO 146 2HG PRO 146 -3.041 -5.490 -8.665 1097 HD2 PRO 146 1HD PRO 146 -4.797 -6.363 -6.638 1098 HD3 PRO 146 2HD PRO 146 -3.770 -4.917 -6.594 1099 H ASP 147 H ASP 147 -7.519 -5.854 -7.007 1100 HA ASP 147 HA ASP 147 -8.039 -8.247 -8.212 1101 HB2 ASP 147 1HB ASP 147 -9.440 -6.689 -6.082 1102 HB3 ASP 147 2HB ASP 147 -10.144 -8.197 -6.657 1103 H GLY 148 H GLY 148 -8.963 -8.718 -10.022 1104 HA2 GLY 148 1HA GLY 148 -11.521 -8.411 -10.856 1105 HA3 GLY 148 2HA GLY 148 -10.774 -6.892 -11.342 1106 H ASP 149 H ASP 149 -8.296 -8.824 -11.389 1107 HA ASP 149 HA ASP 149 -7.858 -9.055 -14.093 1108 HB2 ASP 149 1HB ASP 149 -6.117 -10.679 -13.471 1109 HB3 ASP 149 2HB ASP 149 -6.137 -9.320 -12.348 1110 H SER 150 H SER 150 -9.576 -11.231 -11.956 1111 HA SER 150 HA SER 150 -9.489 -13.466 -13.752 1112 HG SER 150 HG SER 150 -8.517 -13.186 -11.481 1113 HB2 SER 150 1HB SER 150 -11.151 -13.070 -11.256 1114 HB3 SER 150 2HB SER 150 -10.778 -14.605 -12.041 1115 H LEU 151 H LEU 151 -10.857 -10.891 -14.558 1116 HA LEU 151 HA LEU 151 -12.526 -10.313 -15.977 1117 HG LEU 151 HG LEU 151 -11.156 -12.955 -16.899 1118 HB2 LEU 151 1HB LEU 151 -13.353 -13.210 -15.810 1119 HB3 LEU 151 2HB LEU 151 -14.033 -12.031 -16.914 1120 HD11 LEU 151 1HD1 LEU 151 -12.678 -14.694 -17.664 1121 HD12 LEU 151 2HD1 LEU 151 -11.735 -14.051 -19.007 1122 HD13 LEU 151 3HD1 LEU 151 -13.417 -13.564 -18.798 1123 HD21 LEU 151 3HD2 LEU 151 -10.967 -11.706 -18.987 1124 HD22 LEU 151 1HD2 LEU 151 -11.397 -10.641 -17.648 1125 HD23 LEU 151 2HD2 LEU 151 -12.629 -11.142 -18.807 1126 H GLU 152 H GLU 152 -13.776 -12.577 -13.537 1127 HA GLU 152 HA GLU 152 -16.222 -11.120 -13.191 1128 HB2 GLU 152 1HB GLU 152 -15.500 -13.655 -12.660 1129 HB3 GLU 152 2HB GLU 152 -15.209 -12.956 -11.075 1130 HG2 GLU 152 1HG GLU 152 -17.820 -12.670 -12.531 1131 HG3 GLU 152 2HG GLU 152 -17.465 -14.007 -11.440 1132 H HIS 153 H HIS 153 -16.707 -9.620 -11.590 1133 HA HIS 153 HA HIS 153 -14.301 -8.332 -10.529 1134 HD1 HIS 153 HD1 HIS 153 -17.401 -6.678 -13.376 1135 HD2 HIS 153 HD2 HIS 153 -13.380 -6.593 -12.301 1136 HE1 HIS 153 HE1 HIS 153 -16.148 -6.077 -15.470 1137 HE2 HIS 153 HE2 HIS 153 -13.714 -6.257 -14.848 1138 HB2 HIS 153 1HB HIS 153 -17.080 -7.246 -11.001 1139 HB3 HIS 153 2HB HIS 153 -15.753 -6.317 -10.312 1140 H HIS 154 H HIS 154 -15.935 -10.600 -9.291 1141 HA HIS 154 HA HIS 154 -15.964 -9.386 -6.611 1142 HD1 HIS 154 HD1 HIS 154 -18.934 -10.082 -9.469 1143 HD2 HIS 154 HD2 HIS 154 -19.016 -8.235 -5.738 1144 HE1 HIS 154 HE1 HIS 154 -20.497 -8.122 -9.712 1145 HE2 HIS 154 HE2 HIS 154 -20.537 -7.012 -7.446 1146 HB2 HIS 154 1HB HIS 154 -17.923 -11.495 -7.561 1147 HB3 HIS 154 2HB HIS 154 -17.859 -10.781 -5.955 1148 H HIS 155 H HIS 155 -15.992 -12.453 -8.396 1149 HA HIS 155 HA HIS 155 -14.425 -13.782 -6.343 1150 HD1 HIS 155 HD1 HIS 155 -17.789 -13.937 -8.511 1151 HD2 HIS 155 HD2 HIS 155 -16.192 -16.740 -5.883 1152 HE1 HIS 155 HE1 HIS 155 -19.748 -14.867 -7.230 1153 HE2 HIS 155 HE2 HIS 155 -18.763 -16.561 -5.643 1154 HB2 HIS 155 1HB HIS 155 -15.349 -14.734 -9.066 1155 HB3 HIS 155 2HB HIS 155 -14.547 -15.737 -7.863 1156 H HIS 156 H HIS 156 -12.329 -14.685 -6.722 1157 HA HIS 156 HA HIS 156 -10.869 -13.603 -9.024 1158 HD1 HIS 156 HD1 HIS 156 -11.210 -11.675 -5.006 1159 HD2 HIS 156 HD2 HIS 156 -10.495 -10.668 -8.976 1160 HE1 HIS 156 HE1 HIS 156 -12.228 -9.400 -5.318 1161 HE2 HIS 156 HE2 HIS 156 -11.584 -8.728 -7.656 1162 HB2 HIS 156 1HB HIS 156 -9.872 -13.397 -6.169 1163 HB3 HIS 156 2HB HIS 156 -9.018 -12.858 -7.612 1164 H HIS 157 H HIS 157 -8.934 -14.775 -9.535 1165 HA HIS 157 HA HIS 157 -8.824 -17.432 -8.254 1166 HD1 HIS 157 HD1 HIS 157 -10.437 -17.190 -12.540 1167 HD2 HIS 157 HD2 HIS 157 -10.581 -19.088 -8.839 1168 HE1 HIS 157 HE1 HIS 157 -12.694 -18.298 -12.428 1169 HE2 HIS 157 HE2 HIS 157 -12.658 -19.626 -10.282 1170 HB2 HIS 157 1HB HIS 157 -8.441 -16.703 -11.160 1171 HB3 HIS 157 2HB HIS 157 -7.961 -18.257 -10.488 1172 H HIS 158 H HIS 158 -7.218 -16.906 -6.817 1173 HA HIS 158 HA HIS 158 -5.095 -16.805 -6.047 1174 HD1 HIS 158 HD1 HIS 158 -3.033 -18.686 -5.418 1175 HD2 HIS 158 HD2 HIS 158 -1.781 -17.191 -9.094 1176 HE1 HIS 158 HE1 HIS 158 -0.525 -18.581 -5.291 1177 HE2 HIS 158 HE2 HIS 158 0.219 -17.852 -7.587 1178 HB2 HIS 158 1HB HIS 158 -4.818 -18.794 -7.445 1179 HB3 HIS 158 2HB HIS 158 -4.429 -17.783 -8.831 Start of MODEL 20 1 HA MET 1 HA MET 1 32.649 0.206 2.080 2 H1 MET 1 1H MET 1 33.758 1.741 3.493 3 H2 MET 1 2H MET 1 35.196 1.617 2.605 4 H3 MET 1 3H MET 1 34.628 0.287 3.491 5 HB2 MET 1 1HB MET 1 34.184 2.317 0.546 6 HB3 MET 1 2HB MET 1 32.822 1.425 -0.116 7 HG2 MET 1 1HG MET 1 31.435 2.317 1.762 8 HG3 MET 1 2HG MET 1 32.801 3.340 2.201 9 HE1 MET 1 3HE MET 1 33.779 5.261 0.612 10 HE2 MET 1 1HE MET 1 33.154 5.595 -1.003 11 HE3 MET 1 2HE MET 1 33.984 4.075 -0.676 12 H LYS 2 H LYS 2 33.476 0.059 -0.741 13 HA LYS 2 HA LYS 2 34.428 -1.412 -2.170 14 HB2 LYS 2 1HB LYS 2 36.585 -0.514 -1.216 15 HB3 LYS 2 2HB LYS 2 36.580 -1.869 -0.098 16 HG2 LYS 2 1HG LYS 2 36.594 -3.411 -2.040 17 HG3 LYS 2 2HG LYS 2 36.748 -2.006 -3.099 18 HD2 LYS 2 1HD LYS 2 38.821 -1.393 -1.840 19 HD3 LYS 2 2HD LYS 2 38.691 -2.933 -0.988 20 HE2 LYS 2 1HE LYS 2 38.746 -4.081 -3.197 21 HE3 LYS 2 2HE LYS 2 39.052 -2.519 -3.952 22 HZ1 LYS 2 3HZ LYS 2 41.030 -2.389 -2.373 23 HZ2 LYS 2 1HZ LYS 2 41.149 -3.473 -3.676 24 HZ3 LYS 2 2HZ LYS 2 40.798 -4.050 -2.120 25 H LEU 3 H LEU 3 32.653 -2.746 -1.935 26 HA LEU 3 HA LEU 3 33.091 -5.171 -0.318 27 HG LEU 3 HG LEU 3 31.925 -2.514 0.928 28 HB2 LEU 3 1HB LEU 3 30.445 -3.754 -0.668 29 HB3 LEU 3 2HB LEU 3 30.730 -5.208 0.268 30 HD11 LEU 3 1HD1 LEU 3 30.262 -2.395 2.703 31 HD12 LEU 3 2HD1 LEU 3 29.540 -3.904 2.145 32 HD13 LEU 3 3HD1 LEU 3 29.485 -2.468 1.121 33 HD21 LEU 3 3HD2 LEU 3 33.215 -4.400 1.777 34 HD22 LEU 3 1HD2 LEU 3 31.758 -5.083 2.501 35 HD23 LEU 3 2HD2 LEU 3 32.403 -3.553 3.095 36 H HIS 4 H HIS 4 31.317 -6.869 -1.051 37 HA HIS 4 HA HIS 4 31.533 -7.190 -3.895 38 HD1 HIS 4 HD1 HIS 4 31.811 -10.699 -4.240 39 HD2 HIS 4 HD2 HIS 4 28.006 -9.007 -4.224 40 HE1 HIS 4 HE1 HIS 4 30.542 -11.846 -6.090 41 HE2 HIS 4 HE2 HIS 4 28.215 -10.872 -6.011 42 HB2 HIS 4 1HB HIS 4 31.479 -9.130 -2.330 43 HB3 HIS 4 2HB HIS 4 29.814 -8.728 -1.925 44 H THR 5 H THR 5 28.981 -6.358 -1.603 45 HA THR 5 HA THR 5 27.408 -5.328 -3.871 46 HB THR 5 HB THR 5 26.272 -6.473 -1.310 47 HG1 THR 5 HG1 THR 5 26.630 -7.592 -3.913 48 HG21 THR 5 3HG2 THR 5 24.847 -4.781 -2.366 49 HG22 THR 5 1HG2 THR 5 24.137 -6.389 -2.516 50 HG23 THR 5 2HG2 THR 5 24.945 -5.648 -3.899 51 H ASP 6 H ASP 6 27.935 -3.204 -3.741 52 HA ASP 6 HA ASP 6 27.852 -1.741 -1.259 53 HB2 ASP 6 1HB ASP 6 28.168 0.245 -2.708 54 HB3 ASP 6 2HB ASP 6 29.355 -1.008 -3.051 55 HA PRO 7 HA PRO 7 23.610 -0.660 -0.961 56 HB2 PRO 7 1HB PRO 7 24.206 2.234 -1.227 57 HB3 PRO 7 2HB PRO 7 23.401 1.364 0.083 58 HG2 PRO 7 1HG PRO 7 25.894 2.271 0.367 59 HG3 PRO 7 2HG PRO 7 25.397 0.717 1.061 60 HD2 PRO 7 1HD PRO 7 27.002 1.269 -1.401 61 HD3 PRO 7 2HD PRO 7 27.197 -0.015 -0.192 62 H ALA 8 H ALA 8 22.876 -1.465 -2.919 63 HA ALA 8 HA ALA 8 21.557 0.376 -4.607 64 HB1 ALA 8 3HB ALA 8 22.689 -0.107 -6.719 65 HB2 ALA 8 1HB ALA 8 23.885 -1.080 -5.864 66 HB3 ALA 8 2HB ALA 8 23.792 0.657 -5.576 67 H THR 9 H THR 9 19.761 -0.875 -4.204 68 HA THR 9 HA THR 9 19.853 -3.645 -5.171 69 HB THR 9 HB THR 9 17.512 -3.707 -4.027 70 HG1 THR 9 HG1 THR 9 17.771 -2.196 -2.072 71 HG21 THR 9 3HG2 THR 9 19.455 -4.964 -3.248 72 HG22 THR 9 1HG2 THR 9 18.557 -4.301 -1.883 73 HG23 THR 9 2HG2 THR 9 20.057 -3.535 -2.407 74 H ALA 10 H ALA 10 17.856 -4.408 -6.303 75 HA ALA 10 HA ALA 10 17.352 -2.690 -8.529 76 HB1 ALA 10 3HB ALA 10 16.116 -5.352 -7.836 77 HB2 ALA 10 1HB ALA 10 17.577 -5.111 -8.794 78 HB3 ALA 10 2HB ALA 10 16.023 -4.536 -9.396 79 H LEU 11 H LEU 11 15.695 -1.368 -8.881 80 HA LEU 11 HA LEU 11 13.776 -0.903 -6.794 81 HG LEU 11 HG LEU 11 15.969 0.913 -8.130 82 HB2 LEU 11 1HB LEU 11 14.040 0.333 -9.538 83 HB3 LEU 11 2HB LEU 11 12.952 0.889 -8.282 84 HD11 LEU 11 1HD1 LEU 11 15.087 2.563 -9.690 85 HD12 LEU 11 2HD1 LEU 11 15.728 3.343 -8.243 86 HD13 LEU 11 3HD1 LEU 11 13.985 3.162 -8.451 87 HD21 LEU 11 3HD2 LEU 11 15.635 2.192 -6.066 88 HD22 LEU 11 1HD2 LEU 11 14.962 0.567 -5.942 89 HD23 LEU 11 2HD2 LEU 11 13.893 1.946 -6.199 90 H ASN 12 H ASN 12 11.973 -2.013 -6.588 91 HA ASN 12 HA ASN 12 10.932 -3.662 -8.691 92 HB2 ASN 12 1HB ASN 12 10.872 -4.076 -6.127 93 HB3 ASN 12 2HB ASN 12 9.475 -3.005 -6.140 94 HD21 ASN 12 2HD2 ASN 12 8.012 -4.553 -5.555 95 HD22 ASN 12 1HD2 ASN 12 7.559 -5.866 -6.582 96 H THR 13 H THR 13 10.159 -2.458 -10.380 97 HA THR 13 HA THR 13 8.393 -0.186 -9.751 98 HB THR 13 HB THR 13 9.879 -0.635 -12.342 99 HG1 THR 13 HG1 THR 13 10.964 -0.127 -10.008 100 HG21 THR 13 3HG2 THR 13 9.539 1.773 -12.632 101 HG22 THR 13 1HG2 THR 13 8.689 1.843 -11.089 102 HG23 THR 13 2HG2 THR 13 7.998 0.937 -12.436 103 H VAL 14 H VAL 14 6.362 -0.113 -10.566 104 HA VAL 14 HA VAL 14 5.212 -2.375 -11.866 105 HB VAL 14 HB VAL 14 4.063 0.417 -11.643 106 HG11 VAL 14 1HG1 VAL 14 2.917 -0.973 -13.278 107 HG12 VAL 14 2HG1 VAL 14 1.898 -0.703 -11.865 108 HG13 VAL 14 3HG1 VAL 14 2.721 -2.248 -12.076 109 HG21 VAL 14 3HG2 VAL 14 2.906 -0.387 -9.639 110 HG22 VAL 14 1HG2 VAL 14 4.657 -0.425 -9.439 111 HG23 VAL 14 2HG2 VAL 14 3.773 -1.918 -9.755 112 H THR 15 H THR 15 5.091 -2.802 -13.998 113 HA THR 15 HA THR 15 6.166 -0.760 -15.809 114 HB THR 15 HB THR 15 6.450 -2.824 -17.344 115 HG1 THR 15 HG1 THR 15 6.768 -4.752 -16.001 116 HG21 THR 15 3HG2 THR 15 8.620 -3.332 -16.320 117 HG22 THR 15 1HG2 THR 15 8.113 -2.523 -14.838 118 HG23 THR 15 2HG2 THR 15 8.311 -1.596 -16.325 119 H ALA 16 H ALA 16 3.770 -3.418 -15.852 120 HA ALA 16 HA ALA 16 2.229 -1.810 -17.782 121 HB1 ALA 16 3HB ALA 16 1.319 -3.881 -18.666 122 HB2 ALA 16 1HB ALA 16 2.241 -4.811 -17.486 123 HB3 ALA 16 2HB ALA 16 3.081 -3.898 -18.739 124 H TYR 17 H TYR 17 0.157 -1.350 -17.358 125 HA TYR 17 HA TYR 17 -0.839 -2.122 -14.719 126 HD1 TYR 17 HD1 TYR 17 -1.332 0.174 -12.950 127 HD2 TYR 17 HD2 TYR 17 0.424 1.217 -16.681 128 HE1 TYR 17 HE1 TYR 17 0.264 1.633 -11.783 129 HE2 TYR 17 HE2 TYR 17 2.029 2.678 -15.523 130 HH TYR 17 HH TYR 17 2.211 3.894 -13.408 131 HB2 TYR 17 1HB TYR 17 -1.701 0.079 -16.605 132 HB3 TYR 17 2HB TYR 17 -2.488 -0.274 -15.072 133 H GLY 18 H GLY 18 -3.243 -2.408 -14.568 134 HA2 GLY 18 1HA GLY 18 -4.684 -3.284 -16.866 135 HA3 GLY 18 2HA GLY 18 -4.101 -4.639 -15.905 136 H ASP 19 H ASP 19 -6.581 -4.837 -15.874 137 HA ASP 19 HA ASP 19 -7.781 -3.187 -13.804 138 HB2 ASP 19 1HB ASP 19 -8.825 -5.130 -15.820 139 HB3 ASP 19 2HB ASP 19 -9.786 -4.778 -14.390 140 H GLY 20 H GLY 20 -7.628 -6.659 -14.485 141 HA2 GLY 20 1HA GLY 20 -8.052 -7.193 -11.656 142 HA3 GLY 20 2HA GLY 20 -8.112 -8.373 -12.956 143 H TYR 21 H TYR 21 -5.397 -6.727 -13.586 144 HA TYR 21 HA TYR 21 -3.720 -8.229 -11.728 145 HD1 TYR 21 HD2 TYR 21 -5.016 -7.950 -15.726 146 HD2 TYR 21 HD1 TYR 21 -0.884 -8.334 -14.788 147 HE1 TYR 21 HE2 TYR 21 -4.432 -6.948 -17.895 148 HE2 TYR 21 HE1 TYR 21 -0.291 -7.331 -16.948 149 HH TYR 21 HH TYR 21 -2.471 -5.680 -18.858 150 HB2 TYR 21 1HB TYR 21 -2.467 -9.331 -13.391 151 HB3 TYR 21 2HB TYR 21 -4.135 -9.533 -13.916 152 H ILE 22 H ILE 22 -1.700 -7.344 -11.402 153 HA ILE 22 HA ILE 22 -1.091 -4.843 -12.840 154 HB ILE 22 HB ILE 22 -0.515 -5.452 -9.929 155 HG12 ILE 22 1HG1 ILE 22 -2.411 -3.443 -11.171 156 HG13 ILE 22 2HG1 ILE 22 -2.896 -4.953 -10.412 157 HG21 ILE 22 1HG2 ILE 22 0.299 -3.140 -9.822 158 HG22 ILE 22 2HG2 ILE 22 0.040 -2.971 -11.558 159 HG23 ILE 22 3HG2 ILE 22 1.244 -4.108 -10.952 160 HD11 ILE 22 3HD1 ILE 22 -2.027 -4.166 -8.281 161 HD12 ILE 22 1HD1 ILE 22 -3.236 -3.061 -8.935 162 HD13 ILE 22 2HD1 ILE 22 -1.522 -2.656 -9.043 163 H GLU 23 H GLU 23 0.762 -4.984 -13.950 164 HA GLU 23 HA GLU 23 2.460 -7.306 -13.426 165 HB2 GLU 23 1HB GLU 23 1.501 -6.890 -15.720 166 HB3 GLU 23 2HB GLU 23 2.532 -5.470 -15.819 167 HG2 GLU 23 1HG GLU 23 4.507 -6.877 -15.584 168 HG3 GLU 23 2HG GLU 23 3.475 -8.303 -15.468 169 H VAL 24 H VAL 24 4.154 -7.010 -12.207 170 HA VAL 24 HA VAL 24 5.468 -4.382 -12.176 171 HB VAL 24 HB VAL 24 5.710 -6.645 -10.180 172 HG11 VAL 24 1HG1 VAL 24 6.754 -3.818 -10.092 173 HG12 VAL 24 2HG1 VAL 24 7.720 -5.282 -10.275 174 HG13 VAL 24 3HG1 VAL 24 6.844 -4.985 -8.774 175 HG21 VAL 24 3HG2 VAL 24 4.203 -4.039 -9.986 176 HG22 VAL 24 1HG2 VAL 24 4.402 -5.211 -8.684 177 HG23 VAL 24 2HG2 VAL 24 3.488 -5.644 -10.130 178 H ASN 25 H ASN 25 7.409 -4.168 -13.054 179 HA ASN 25 HA ASN 25 9.238 -4.604 -14.298 180 HB2 ASN 25 1HB ASN 25 9.359 -7.087 -12.571 181 HB3 ASN 25 2HB ASN 25 10.642 -6.574 -13.662 182 HD21 ASN 25 2HD2 ASN 25 10.710 -6.932 -10.791 183 HD22 ASN 25 1HD2 ASN 25 11.165 -5.401 -10.124 184 H GLN 26 H GLN 26 8.533 -8.044 -14.005 185 HA GLN 26 HA GLN 26 7.417 -8.078 -16.708 186 HB2 GLN 26 1HB GLN 26 9.824 -9.688 -15.841 187 HB3 GLN 26 2HB GLN 26 8.921 -9.983 -17.319 188 HG2 GLN 26 1HG GLN 26 9.494 -7.726 -18.096 189 HG3 GLN 26 2HG GLN 26 10.437 -7.474 -16.628 190 HE21 GLN 26 2HE2 GLN 26 11.284 -7.444 -19.411 191 HE22 GLN 26 1HE2 GLN 26 12.513 -8.653 -19.566 192 H VAL 27 H VAL 27 6.688 -8.676 -13.767 193 HA VAL 27 HA VAL 27 5.695 -11.417 -14.223 194 HB VAL 27 HB VAL 27 6.167 -10.123 -11.531 195 HG11 VAL 27 1HG1 VAL 27 5.914 -12.409 -10.679 196 HG12 VAL 27 2HG1 VAL 27 5.566 -12.975 -12.312 197 HG13 VAL 27 3HG1 VAL 27 4.463 -11.856 -11.512 198 HG21 VAL 27 3HG2 VAL 27 7.891 -12.122 -12.994 199 HG22 VAL 27 1HG2 VAL 27 8.128 -11.578 -11.332 200 HG23 VAL 27 2HG2 VAL 27 8.300 -10.438 -12.668 201 H ARG 28 H ARG 28 3.561 -11.714 -14.198 202 HA ARG 28 HA ARG 28 1.858 -9.374 -13.903 203 HE ARG 28 HE ARG 28 -0.339 -10.362 -18.059 204 HB2 ARG 28 1HB ARG 28 1.049 -12.176 -14.693 205 HB3 ARG 28 2HB ARG 28 0.153 -10.689 -14.964 206 HG2 ARG 28 1HG ARG 28 1.778 -9.943 -16.570 207 HG3 ARG 28 2HG ARG 28 2.801 -11.342 -16.232 208 HD2 ARG 28 1HD ARG 28 1.596 -11.781 -18.251 209 HD3 ARG 28 2HD ARG 28 0.921 -12.804 -16.983 210 HH11 ARG 28 1HH1 ARG 28 -0.547 -13.432 -16.378 211 HH12 ARG 28 2HH1 ARG 28 -2.285 -13.474 -16.388 212 HH21 ARG 28 1HH2 ARG 28 -2.636 -10.404 -18.049 213 HH22 ARG 28 2HH2 ARG 28 -3.477 -11.733 -17.313 214 H PHE 29 H PHE 29 1.048 -8.931 -11.937 215 HA PHE 29 HA PHE 29 0.468 -11.194 -10.151 216 HD1 PHE 29 HD1 PHE 29 2.080 -11.364 -7.842 217 HD2 PHE 29 HD2 PHE 29 3.147 -7.990 -10.202 218 HE1 PHE 29 HE1 PHE 29 4.460 -11.871 -7.479 219 HE2 PHE 29 HE2 PHE 29 5.529 -8.492 -9.852 220 HZ PHE 29 HZ PHE 29 6.187 -10.436 -8.487 221 HB2 PHE 29 1HB PHE 29 0.924 -8.279 -9.493 222 HB3 PHE 29 2HB PHE 29 0.487 -9.513 -8.320 223 H SER 30 H SER 30 -1.604 -11.756 -10.715 224 HA SER 30 HA SER 30 -3.706 -9.773 -10.790 225 HG SER 30 HG SER 30 -4.519 -11.807 -13.093 226 HB2 SER 30 1HB SER 30 -3.877 -12.801 -10.735 227 HB3 SER 30 2HB SER 30 -5.196 -11.696 -11.118 228 H HIS 31 H HIS 31 -2.215 -9.721 -8.412 229 HA HIS 31 HA HIS 31 -4.093 -10.791 -6.393 230 HD1 HIS 31 HD1 HIS 31 -0.238 -12.751 -4.771 231 HD2 HIS 31 HD2 HIS 31 -2.435 -12.628 -8.296 232 HE1 HIS 31 HE1 HIS 31 0.421 -14.808 -6.046 233 HE2 HIS 31 HE2 HIS 31 -0.766 -14.609 -8.259 234 HB2 HIS 31 1HB HIS 31 -1.158 -10.221 -5.921 235 HB3 HIS 31 2HB HIS 31 -2.271 -11.018 -4.831 236 H ALA 32 H ALA 32 -4.104 -9.442 -4.370 237 HA ALA 32 HA ALA 32 -3.591 -6.622 -4.833 238 HB1 ALA 32 3HB ALA 32 -4.464 -8.080 -2.332 239 HB2 ALA 32 1HB ALA 32 -5.528 -7.269 -3.481 240 HB3 ALA 32 2HB ALA 32 -4.382 -6.329 -2.527 241 H ILE 33 H ILE 33 -1.490 -6.023 -4.809 242 HA ILE 33 HA ILE 33 0.326 -7.623 -3.134 243 HB ILE 33 HB ILE 33 2.110 -6.964 -4.791 244 HG12 ILE 33 1HG1 ILE 33 -0.300 -6.192 -6.457 245 HG13 ILE 33 2HG1 ILE 33 0.892 -5.070 -5.809 246 HG21 ILE 33 1HG2 ILE 33 1.443 -8.691 -6.413 247 HG22 ILE 33 2HG2 ILE 33 -0.193 -8.658 -5.758 248 HG23 ILE 33 3HG2 ILE 33 1.151 -9.192 -4.748 249 HD11 ILE 33 3HD1 ILE 33 2.616 -6.101 -7.181 250 HD12 ILE 33 1HD1 ILE 33 1.272 -5.525 -8.164 251 HD13 ILE 33 2HD1 ILE 33 1.433 -7.246 -7.815 252 H ALA 34 H ALA 34 1.535 -6.694 -1.677 253 HA ALA 34 HA ALA 34 1.875 -3.765 -1.739 254 HB1 ALA 34 3HB ALA 34 1.977 -5.628 0.636 255 HB2 ALA 34 1HB ALA 34 0.638 -4.557 0.222 256 HB3 ALA 34 2HB ALA 34 2.200 -3.879 0.679 257 H PHE 35 H PHE 35 3.891 -3.078 -2.148 258 HA PHE 35 HA PHE 35 6.156 -4.763 -1.457 259 HD1 PHE 35 HD2 PHE 35 3.483 -4.912 -4.536 260 HD2 PHE 35 HD1 PHE 35 7.058 -2.675 -5.105 261 HE1 PHE 35 HE2 PHE 35 2.407 -3.660 -6.357 262 HE2 PHE 35 HE1 PHE 35 5.985 -1.419 -6.927 263 HZ PHE 35 HZ PHE 35 3.658 -1.912 -7.557 264 HB2 PHE 35 1HB PHE 35 7.063 -4.672 -3.785 265 HB3 PHE 35 2HB PHE 35 5.620 -5.663 -3.616 266 H ALA 36 H ALA 36 8.181 -3.743 -1.642 267 HA ALA 36 HA ALA 36 8.116 -0.819 -1.948 268 HB1 ALA 36 3HB ALA 36 8.147 -1.398 0.444 269 HB2 ALA 36 1HB ALA 36 9.645 -0.612 -0.051 270 HB3 ALA 36 2HB ALA 36 9.603 -2.358 0.188 271 HA PRO 37 HA PRO 37 11.673 -1.306 -4.569 272 HB2 PRO 37 1HB PRO 37 13.338 0.693 -3.671 273 HB3 PRO 37 2HB PRO 37 11.968 0.954 -4.755 274 HG2 PRO 37 1HG PRO 37 12.148 1.357 -1.799 275 HG3 PRO 37 2HG PRO 37 11.349 2.361 -3.023 276 HD2 PRO 37 1HD PRO 37 9.958 0.690 -1.441 277 HD3 PRO 37 2HD PRO 37 9.491 0.984 -3.128 278 H GLU 38 H GLU 38 12.113 -1.161 -1.124 279 HA GLU 38 HA GLU 38 14.389 -3.000 -1.379 280 HB2 GLU 38 1HB GLU 38 15.082 -0.744 -0.554 281 HB3 GLU 38 2HB GLU 38 13.996 -0.950 0.813 282 HG2 GLU 38 1HG GLU 38 16.248 -1.443 1.484 283 HG3 GLU 38 2HG GLU 38 15.284 -2.920 1.513 284 H GLY 39 H GLY 39 13.562 -4.936 -0.881 285 HA2 GLY 39 1HA GLY 39 13.049 -6.110 1.346 286 HA3 GLY 39 2HA GLY 39 11.613 -5.097 1.319 287 HA PRO 40 HA PRO 40 10.612 -8.973 -0.997 288 HB2 PRO 40 1HB PRO 40 8.909 -10.118 0.708 289 HB3 PRO 40 2HB PRO 40 10.656 -10.234 0.948 290 HG2 PRO 40 1HG PRO 40 8.659 -8.517 2.347 291 HG3 PRO 40 2HG PRO 40 10.110 -9.305 2.989 292 HD2 PRO 40 1HD PRO 40 9.887 -6.620 2.203 293 HD3 PRO 40 2HD PRO 40 11.396 -7.499 2.514 294 H VAL 41 H VAL 41 8.277 -9.878 -1.436 295 HA VAL 41 HA VAL 41 6.461 -7.577 -1.777 296 HB VAL 41 HB VAL 41 6.567 -10.098 -3.449 297 HG11 VAL 41 1HG1 VAL 41 4.350 -9.091 -3.365 298 HG12 VAL 41 2HG1 VAL 41 5.069 -8.892 -4.963 299 HG13 VAL 41 3HG1 VAL 41 5.028 -7.534 -3.839 300 HG21 VAL 41 3HG2 VAL 41 7.500 -8.670 -5.222 301 HG22 VAL 41 1HG2 VAL 41 8.568 -8.774 -3.823 302 HG23 VAL 41 2HG2 VAL 41 7.588 -7.330 -4.079 303 H ALA 42 H ALA 42 4.648 -7.653 -0.618 304 HA ALA 42 HA ALA 42 3.878 -10.205 0.608 305 HB1 ALA 42 3HB ALA 42 3.032 -7.395 1.309 306 HB2 ALA 42 1HB ALA 42 4.269 -8.340 2.139 307 HB3 ALA 42 2HB ALA 42 2.584 -8.859 2.183 308 H SER 43 H SER 43 2.280 -11.303 -0.255 309 HA SER 43 HA SER 43 0.421 -9.976 -2.073 310 HG SER 43 HG SER 43 -0.912 -13.095 -2.718 311 HB2 SER 43 1HB SER 43 1.587 -12.075 -2.761 312 HB3 SER 43 2HB SER 43 0.751 -12.928 -1.465 313 H TRP 44 H TRP 44 -1.642 -9.585 -1.589 314 HA TRP 44 HA TRP 44 -2.650 -10.399 1.036 315 HD1 TRP 44 HD1 TRP 44 -1.306 -8.869 1.959 316 HE1 TRP 44 HE1 TRP 44 -1.313 -7.001 3.734 317 HE3 TRP 44 HE3 TRP 44 -5.443 -6.305 0.411 318 HZ2 TRP 44 HZ2 TRP 44 -2.867 -4.723 4.375 319 HZ3 TRP 44 HZ3 TRP 44 -6.122 -4.290 1.649 320 HH2 TRP 44 HH2 TRP 44 -4.860 -3.517 3.590 321 HB2 TRP 44 1HB TRP 44 -3.188 -8.169 -0.841 322 HB3 TRP 44 2HB TRP 44 -4.569 -8.768 0.065 323 HA PRO 45 HA PRO 45 -5.601 -13.135 -0.969 324 HB2 PRO 45 1HB PRO 45 -6.844 -13.974 1.248 325 HB3 PRO 45 2HB PRO 45 -5.197 -14.499 0.873 326 HG2 PRO 45 1HG PRO 45 -6.126 -12.392 2.783 327 HG3 PRO 45 2HG PRO 45 -4.848 -13.602 2.987 328 HD2 PRO 45 1HD PRO 45 -4.410 -10.974 2.283 329 HD3 PRO 45 2HD PRO 45 -3.296 -12.305 1.924 330 H VAL 46 H VAL 46 -6.019 -10.162 0.380 331 HA VAL 46 HA VAL 46 -8.912 -10.148 0.584 332 HB VAL 46 HB VAL 46 -7.000 -7.814 0.761 333 HG11 VAL 46 1HG1 VAL 46 -9.305 -7.160 0.373 334 HG12 VAL 46 2HG1 VAL 46 -8.811 -6.740 2.013 335 HG13 VAL 46 3HG1 VAL 46 -9.834 -8.149 1.733 336 HG21 VAL 46 3HG2 VAL 46 -6.397 -9.480 2.414 337 HG22 VAL 46 1HG2 VAL 46 -8.069 -9.566 2.968 338 HG23 VAL 46 2HG2 VAL 46 -7.141 -8.083 3.193 339 H GLN 47 H GLN 47 -10.079 -10.039 -1.217 340 HA GLN 47 HA GLN 47 -9.039 -8.423 -3.451 341 HB2 GLN 47 1HB GLN 47 -11.053 -10.680 -3.534 342 HB3 GLN 47 2HB GLN 47 -10.451 -9.779 -4.921 343 HG2 GLN 47 1HG GLN 47 -8.177 -10.592 -4.420 344 HG3 GLN 47 2HG GLN 47 -8.845 -11.562 -3.109 345 HE21 GLN 47 2HE2 GLN 47 -7.413 -12.407 -5.473 346 HE22 GLN 47 1HE2 GLN 47 -8.457 -13.506 -6.307 347 H ARG 48 H ARG 48 -10.985 -8.048 -0.947 348 HA ARG 48 HA ARG 48 -12.744 -6.254 -2.468 349 HE ARG 48 HE ARG 48 -15.054 -7.708 1.405 350 HB2 ARG 48 1HB ARG 48 -14.037 -8.164 -1.566 351 HB3 ARG 48 2HB ARG 48 -13.501 -7.746 0.055 352 HG2 ARG 48 1HG ARG 48 -14.667 -5.634 -0.064 353 HG3 ARG 48 2HG ARG 48 -15.132 -5.953 -1.735 354 HD2 ARG 48 1HD ARG 48 -16.977 -6.417 -0.225 355 HD3 ARG 48 2HD ARG 48 -16.423 -7.899 -1.001 356 HH11 ARG 48 1HH1 ARG 48 -18.385 -7.988 0.355 357 HH12 ARG 48 2HH1 ARG 48 -18.901 -8.843 1.775 358 HH21 ARG 48 1HH2 ARG 48 -15.714 -8.809 3.276 359 HH22 ARG 48 2HH2 ARG 48 -17.366 -9.342 3.430 360 HA PRO 49 HA PRO 49 -10.277 -3.372 -0.202 361 HB2 PRO 49 1HB PRO 49 -12.228 -1.403 -1.228 362 HB3 PRO 49 2HB PRO 49 -10.480 -1.491 -1.467 363 HG2 PRO 49 1HG PRO 49 -12.167 -2.089 -3.444 364 HG3 PRO 49 2HG PRO 49 -10.660 -2.997 -3.214 365 HD2 PRO 49 1HD PRO 49 -13.459 -3.750 -2.450 366 HD3 PRO 49 2HD PRO 49 -12.187 -4.747 -3.188 367 H ALA 50 H ALA 50 -13.575 -4.003 0.426 368 HA ALA 50 HA ALA 50 -13.803 -1.963 2.485 369 HB1 ALA 50 3HB ALA 50 -15.736 -2.464 1.066 370 HB2 ALA 50 1HB ALA 50 -16.078 -2.753 2.772 371 HB3 ALA 50 2HB ALA 50 -15.761 -4.112 1.694 372 H ASP 51 H ASP 51 -12.368 -4.929 2.326 373 HA ASP 51 HA ASP 51 -13.108 -5.707 5.054 374 HB2 ASP 51 1HB ASP 51 -11.454 -7.149 2.969 375 HB3 ASP 51 2HB ASP 51 -11.773 -7.766 4.586 376 H ILE 52 H ILE 52 -10.934 -3.715 3.642 377 HA ILE 52 HA ILE 52 -8.460 -4.406 4.768 378 HB ILE 52 HB ILE 52 -9.510 -1.668 4.034 379 HG12 ILE 52 1HG1 ILE 52 -7.787 -3.628 2.499 380 HG13 ILE 52 2HG1 ILE 52 -9.480 -3.275 2.166 381 HG21 ILE 52 1HG2 ILE 52 -7.152 -0.999 3.930 382 HG22 ILE 52 2HG2 ILE 52 -6.680 -2.586 4.535 383 HG23 ILE 52 3HG2 ILE 52 -7.616 -1.496 5.557 384 HD11 ILE 52 3HD1 ILE 52 -8.877 -0.964 1.631 385 HD12 ILE 52 1HD1 ILE 52 -8.035 -2.125 0.606 386 HD13 ILE 52 2HD1 ILE 52 -7.182 -1.345 1.938 387 H THR 53 H THR 53 -7.882 -4.518 6.812 388 HA THR 53 HA THR 53 -9.060 -2.651 8.753 389 HB THR 53 HB THR 53 -8.373 -5.474 9.543 390 HG1 THR 53 HG1 THR 53 -10.067 -5.093 7.682 391 HG21 THR 53 3HG2 THR 53 -10.279 -3.374 10.584 392 HG22 THR 53 1HG2 THR 53 -8.824 -3.981 11.371 393 HG23 THR 53 2HG2 THR 53 -10.226 -5.032 11.181 394 H ALA 54 H ALA 54 -7.680 -2.697 10.844 395 HA ALA 54 HA ALA 54 -5.286 -1.493 10.317 396 HB1 ALA 54 3HB ALA 54 -4.817 -1.641 12.682 397 HB2 ALA 54 1HB ALA 54 -6.016 -2.922 12.862 398 HB3 ALA 54 2HB ALA 54 -6.525 -1.292 12.415 399 H SER 55 H SER 55 -5.637 -4.874 11.486 400 HA SER 55 HA SER 55 -2.870 -5.323 11.714 401 HG SER 55 HG SER 55 -5.650 -6.333 13.039 402 HB2 SER 55 1HB SER 55 -5.024 -7.393 11.248 403 HB3 SER 55 2HB SER 55 -3.429 -7.674 11.948 404 H LEU 56 H LEU 56 -5.068 -5.721 9.005 405 HA LEU 56 HA LEU 56 -3.304 -7.137 7.310 406 HG LEU 56 HG LEU 56 -6.354 -7.233 7.848 407 HB2 LEU 56 1HB LEU 56 -5.557 -5.245 6.629 408 HB3 LEU 56 2HB LEU 56 -4.747 -6.286 5.473 409 HD11 LEU 56 1HD1 LEU 56 -6.998 -7.243 4.903 410 HD12 LEU 56 2HD1 LEU 56 -7.760 -6.230 6.131 411 HD13 LEU 56 3HD1 LEU 56 -7.973 -7.980 6.175 412 HD21 LEU 56 3HD2 LEU 56 -6.117 -9.448 6.821 413 HD22 LEU 56 1HD2 LEU 56 -4.559 -8.773 7.294 414 HD23 LEU 56 2HD2 LEU 56 -5.047 -8.761 5.600 415 H LEU 57 H LEU 57 -3.961 -3.692 7.748 416 HA LEU 57 HA LEU 57 -2.156 -2.727 5.810 417 HG LEU 57 HG LEU 57 -4.954 -1.898 6.665 418 HB2 LEU 57 1HB LEU 57 -3.181 -1.451 8.345 419 HB3 LEU 57 2HB LEU 57 -2.266 -0.601 7.114 420 HD11 LEU 57 1HD1 LEU 57 -4.219 1.002 7.034 421 HD12 LEU 57 2HD1 LEU 57 -5.122 0.007 8.177 422 HD13 LEU 57 3HD1 LEU 57 -5.813 0.389 6.599 423 HD21 LEU 57 3HD2 LEU 57 -4.915 -0.668 4.554 424 HD22 LEU 57 1HD2 LEU 57 -3.571 -1.804 4.658 425 HD23 LEU 57 2HD2 LEU 57 -3.293 -0.081 4.920 426 H GLN 58 H GLN 58 -1.796 -3.581 9.196 427 HA GLN 58 HA GLN 58 0.764 -2.510 9.624 428 HB2 GLN 58 1HB GLN 58 -0.848 -3.354 11.369 429 HB3 GLN 58 2HB GLN 58 -0.376 -4.987 10.923 430 HG2 GLN 58 1HG GLN 58 1.920 -4.514 11.571 431 HG3 GLN 58 2HG GLN 58 1.472 -2.858 11.982 432 HE21 GLN 58 2HE2 GLN 58 2.626 -4.942 13.659 433 HE22 GLN 58 1HE2 GLN 58 1.529 -5.155 14.981 434 H GLN 59 H GLN 59 -0.289 -5.631 8.339 435 HA GLN 59 HA GLN 59 2.338 -6.729 8.131 436 HB2 GLN 59 1HB GLN 59 -0.239 -7.443 6.723 437 HB3 GLN 59 2HB GLN 59 1.252 -8.356 6.552 438 HG2 GLN 59 1HG GLN 59 1.223 -8.803 8.971 439 HG3 GLN 59 2HG GLN 59 -0.318 -7.954 9.087 440 HE21 GLN 59 2HE2 GLN 59 0.386 -10.743 9.658 441 HE22 GLN 59 1HE2 GLN 59 -0.657 -11.710 8.681 442 H ALA 60 H ALA 60 0.225 -4.936 5.960 443 HA ALA 60 HA ALA 60 1.953 -5.267 3.684 444 HB1 ALA 60 3HB ALA 60 -0.471 -5.102 3.414 445 HB2 ALA 60 1HB ALA 60 0.368 -3.836 2.519 446 HB3 ALA 60 2HB ALA 60 -0.429 -3.455 4.045 447 H ALA 61 H ALA 61 2.147 -3.332 6.365 448 HA ALA 61 HA ALA 61 3.009 -0.888 5.163 449 HB1 ALA 61 3HB ALA 61 3.447 -1.886 7.973 450 HB2 ALA 61 1HB ALA 61 2.044 -0.974 7.414 451 HB3 ALA 61 2HB ALA 61 3.641 -0.226 7.409 452 H GLY 62 H GLY 62 4.450 -3.863 5.286 453 HA2 GLY 62 1HA GLY 62 6.565 -4.513 4.629 454 HA3 GLY 62 2HA GLY 62 6.971 -2.815 4.425 455 H LEU 63 H LEU 63 5.774 -4.280 7.378 456 HA LEU 63 HA LEU 63 8.141 -3.328 8.779 457 HG LEU 63 HG LEU 63 5.124 -2.416 8.819 458 HB2 LEU 63 1HB LEU 63 5.626 -4.612 9.854 459 HB3 LEU 63 2HB LEU 63 6.883 -3.853 10.811 460 HD11 LEU 63 1HD1 LEU 63 4.069 -1.422 10.785 461 HD12 LEU 63 2HD1 LEU 63 5.057 -2.439 11.832 462 HD13 LEU 63 3HD1 LEU 63 3.863 -3.174 10.762 463 HD21 LEU 63 3HD2 LEU 63 7.318 -1.380 9.054 464 HD22 LEU 63 1HD2 LEU 63 7.135 -1.367 10.809 465 HD23 LEU 63 2HD2 LEU 63 6.070 -0.385 9.803 466 H ALA 64 H ALA 64 7.836 -5.849 7.002 467 HA ALA 64 HA ALA 64 8.428 -7.948 8.921 468 HB1 ALA 64 3HB ALA 64 6.882 -8.416 7.074 469 HB2 ALA 64 1HB ALA 64 8.293 -9.473 7.039 470 HB3 ALA 64 2HB ALA 64 8.180 -8.115 5.921 471 H GLU 65 H GLU 65 10.450 -6.795 9.536 472 HA GLU 65 HA GLU 65 12.693 -7.029 7.747 473 HB2 GLU 65 1HB GLU 65 12.672 -5.331 9.524 474 HB3 GLU 65 2HB GLU 65 12.581 -6.592 10.743 475 HG2 GLU 65 1HG GLU 65 14.824 -5.729 10.604 476 HG3 GLU 65 2HG GLU 65 14.784 -7.406 10.063 477 H VAL 66 H VAL 66 13.525 -8.958 7.219 478 HA VAL 66 HA VAL 66 13.284 -11.135 9.181 479 HB VAL 66 HB VAL 66 11.500 -11.351 7.519 480 HG11 VAL 66 1HG1 VAL 66 13.718 -11.512 5.485 481 HG12 VAL 66 2HG1 VAL 66 12.538 -10.211 5.650 482 HG13 VAL 66 3HG1 VAL 66 12.010 -11.825 5.174 483 HG21 VAL 66 3HG2 VAL 66 11.940 -13.649 6.811 484 HG22 VAL 66 1HG2 VAL 66 12.431 -13.375 8.483 485 HG23 VAL 66 2HG2 VAL 66 13.646 -13.443 7.206 486 H VAL 67 H VAL 67 14.986 -12.469 9.382 487 HA VAL 67 HA VAL 67 17.479 -11.853 8.122 488 HB VAL 67 HB VAL 67 16.731 -14.292 9.761 489 HG11 VAL 67 1HG1 VAL 67 19.423 -13.076 9.157 490 HG12 VAL 67 2HG1 VAL 67 18.796 -14.595 8.515 491 HG13 VAL 67 3HG1 VAL 67 19.130 -14.435 10.240 492 HG21 VAL 67 3HG2 VAL 67 16.268 -12.283 11.027 493 HG22 VAL 67 1HG2 VAL 67 17.865 -11.643 10.647 494 HG23 VAL 67 2HG2 VAL 67 17.709 -13.072 11.668 495 H ARG 68 H ARG 68 18.655 -13.226 6.666 496 HA ARG 68 HA ARG 68 16.917 -14.272 4.624 497 HE ARG 68 HE ARG 68 19.257 -10.157 2.918 498 HB2 ARG 68 1HB ARG 68 19.934 -14.134 4.759 499 HB3 ARG 68 2HB ARG 68 18.997 -14.545 3.330 500 HG2 ARG 68 1HG ARG 68 18.052 -12.339 3.244 501 HG3 ARG 68 2HG ARG 68 18.820 -11.913 4.777 502 HD2 ARG 68 1HD ARG 68 21.017 -12.186 3.764 503 HD3 ARG 68 2HD ARG 68 20.269 -12.660 2.240 504 HH11 ARG 68 1HH1 ARG 68 22.350 -11.574 2.130 505 HH12 ARG 68 2HH1 ARG 68 22.975 -10.140 1.373 506 HH21 ARG 68 1HH2 ARG 68 20.064 -8.245 1.944 507 HH22 ARG 68 2HH2 ARG 68 21.674 -8.247 1.282 508 H ASP 69 H ASP 69 17.394 -15.711 7.272 509 HA ASP 69 HA ASP 69 17.475 -17.823 8.071 510 HB2 ASP 69 1HB ASP 69 15.929 -18.294 6.162 511 HB3 ASP 69 2HB ASP 69 17.326 -18.722 5.185 512 HA PRO 70 HA PRO 70 21.941 -17.815 7.571 513 HB2 PRO 70 1HB PRO 70 21.955 -18.917 10.276 514 HB3 PRO 70 2HB PRO 70 22.602 -17.385 9.687 515 HG2 PRO 70 1HG PRO 70 20.427 -17.519 11.280 516 HG3 PRO 70 2HG PRO 70 20.632 -16.258 10.051 517 HD2 PRO 70 1HD PRO 70 18.989 -18.761 9.944 518 HD3 PRO 70 2HD PRO 70 18.586 -17.124 9.381 519 H LEU 71 H LEU 71 21.629 -19.632 6.046 520 HA LEU 71 HA LEU 71 22.292 -22.222 7.253 521 HG LEU 71 HG LEU 71 19.613 -21.662 6.040 522 HB2 LEU 71 1HB LEU 71 21.509 -21.444 4.447 523 HB3 LEU 71 2HB LEU 71 22.031 -23.058 4.891 524 HD11 LEU 71 1HD1 LEU 71 18.324 -23.238 4.682 525 HD12 LEU 71 2HD1 LEU 71 19.818 -23.835 3.959 526 HD13 LEU 71 3HD1 LEU 71 19.306 -22.171 3.678 527 HD21 LEU 71 3HD2 LEU 71 20.590 -23.263 7.577 528 HD22 LEU 71 1HD2 LEU 71 20.636 -24.488 6.309 529 HD23 LEU 71 2HD2 LEU 71 19.087 -23.903 6.915 530 H ALA 72 H ALA 72 23.699 -19.534 5.741 531 HA ALA 72 HA ALA 72 25.941 -20.804 4.535 532 HB1 ALA 72 3HB ALA 72 26.873 -18.556 4.376 533 HB2 ALA 72 1HB ALA 72 25.621 -17.951 5.461 534 HB3 ALA 72 2HB ALA 72 25.183 -18.572 3.870 535 H PHE 73 H PHE 73 25.919 -18.606 7.335 536 HA PHE 73 HA PHE 73 27.820 -20.426 8.666 537 HD1 PHE 73 HD1 PHE 73 30.576 -19.672 8.348 538 HD2 PHE 73 HD2 PHE 73 28.074 -16.616 6.762 539 HE1 PHE 73 HE1 PHE 73 32.133 -19.377 6.471 540 HE2 PHE 73 HE2 PHE 73 29.631 -16.320 4.876 541 HZ PHE 73 HZ PHE 73 31.665 -17.703 4.733 542 HB2 PHE 73 1HB PHE 73 27.721 -17.410 8.945 543 HB3 PHE 73 2HB PHE 73 28.864 -18.491 9.731 544 H LEU 74 H LEU 74 26.398 -17.508 9.882 545 HA LEU 74 HA LEU 74 24.001 -18.370 10.930 546 HG LEU 74 HG LEU 74 24.794 -20.809 12.104 547 HB2 LEU 74 1HB LEU 74 26.304 -19.012 12.659 548 HB3 LEU 74 2HB LEU 74 25.022 -18.119 13.454 549 HD11 LEU 74 1HD1 LEU 74 24.427 -19.940 14.965 550 HD12 LEU 74 2HD1 LEU 74 25.778 -20.874 14.322 551 HD13 LEU 74 3HD1 LEU 74 24.156 -21.567 14.340 552 HD21 LEU 74 3HD2 LEU 74 22.440 -20.774 12.808 553 HD22 LEU 74 1HD2 LEU 74 22.798 -19.524 11.615 554 HD23 LEU 74 2HD2 LEU 74 22.631 -19.096 13.318 555 H ASP 75 H ASP 75 23.120 -16.445 10.651 556 HA ASP 75 HA ASP 75 24.552 -14.012 11.153 557 HB2 ASP 75 1HB ASP 75 21.651 -14.500 10.441 558 HB3 ASP 75 2HB ASP 75 22.404 -12.910 10.536 559 H GLU 76 H GLU 76 24.997 -13.640 13.209 560 HA GLU 76 HA GLU 76 23.139 -14.300 15.324 561 HB2 GLU 76 1HB GLU 76 25.857 -12.972 15.464 562 HB3 GLU 76 2HB GLU 76 24.969 -13.679 16.810 563 HG2 GLU 76 1HG GLU 76 25.343 -15.851 16.087 564 HG3 GLU 76 2HG GLU 76 25.694 -15.346 14.436 565 HA PRO 77 HA PRO 77 21.620 -10.117 14.785 566 HB2 PRO 77 1HB PRO 77 19.143 -10.532 15.689 567 HB3 PRO 77 2HB PRO 77 19.679 -11.192 14.142 568 HG2 PRO 77 1HG PRO 77 19.323 -12.555 16.766 569 HG3 PRO 77 2HG PRO 77 19.018 -13.167 15.131 570 HD2 PRO 77 1HD PRO 77 21.294 -13.672 16.683 571 HD3 PRO 77 2HD PRO 77 21.138 -13.952 14.938 572 H GLU 78 H GLU 78 22.221 -11.754 17.694 573 HA GLU 78 HA GLU 78 21.090 -9.978 19.569 574 HB2 GLU 78 1HB GLU 78 23.583 -11.671 19.813 575 HB3 GLU 78 2HB GLU 78 22.759 -10.887 21.152 576 HG2 GLU 78 1HG GLU 78 20.742 -12.231 20.609 577 HG3 GLU 78 2HG GLU 78 21.709 -13.100 19.415 578 H ALA 79 H ALA 79 24.377 -10.171 18.243 579 HA ALA 79 HA ALA 79 25.009 -7.538 19.277 580 HB1 ALA 79 3HB ALA 79 27.243 -7.937 18.377 581 HB2 ALA 79 1HB ALA 79 26.677 -9.423 17.612 582 HB3 ALA 79 2HB ALA 79 26.709 -9.294 19.370 583 H GLY 80 H GLY 80 23.257 -6.572 18.004 584 HA2 GLY 80 1HA GLY 80 23.896 -6.270 15.151 585 HA3 GLY 80 2HA GLY 80 22.355 -5.881 15.900 586 H ALA 81 H ALA 81 25.614 -4.981 16.916 587 HA ALA 81 HA ALA 81 24.834 -2.285 17.383 588 HB1 ALA 81 3HB ALA 81 27.593 -3.496 17.283 589 HB2 ALA 81 1HB ALA 81 26.566 -3.380 18.712 590 HB3 ALA 81 2HB ALA 81 27.176 -1.915 17.942 591 H GLY 82 H GLY 82 24.351 -0.986 15.762 592 HA2 GLY 82 1HA GLY 82 25.415 0.433 14.033 593 HA3 GLY 82 2HA GLY 82 26.083 -1.050 13.365 594 H ALA 83 H ALA 83 23.146 -1.928 14.407 595 HA ALA 83 HA ALA 83 21.912 -1.415 11.785 596 HB1 ALA 83 3HB ALA 83 21.313 -3.598 13.781 597 HB2 ALA 83 1HB ALA 83 22.264 -3.779 12.308 598 HB3 ALA 83 2HB ALA 83 20.546 -3.397 12.206 599 H ARG 84 H ARG 84 19.914 -0.487 11.649 600 HA ARG 84 HA ARG 84 18.851 0.596 14.170 601 HE ARG 84 HE ARG 84 15.956 4.753 13.310 602 HB2 ARG 84 1HB ARG 84 19.574 2.215 12.415 603 HB3 ARG 84 2HB ARG 84 18.347 1.554 11.346 604 HG2 ARG 84 1HG ARG 84 16.600 2.277 12.876 605 HG3 ARG 84 2HG ARG 84 17.820 2.898 13.990 606 HD2 ARG 84 1HD ARG 84 18.614 4.395 12.159 607 HD3 ARG 84 2HD ARG 84 17.238 3.864 11.197 608 HH11 ARG 84 1HH1 ARG 84 18.723 6.159 11.692 609 HH12 ARG 84 2HH1 ARG 84 18.322 7.791 12.150 610 HH21 ARG 84 1HH2 ARG 84 15.413 6.888 13.900 611 HH22 ARG 84 2HH2 ARG 84 16.422 8.211 13.376 612 HA PRO 85 HA PRO 85 15.520 -2.358 13.353 613 HB2 PRO 85 1HB PRO 85 14.664 -1.625 16.053 614 HB3 PRO 85 2HB PRO 85 15.165 -3.200 15.431 615 HG2 PRO 85 1HG PRO 85 16.676 -1.787 17.170 616 HG3 PRO 85 2HG PRO 85 17.383 -2.840 15.932 617 HD2 PRO 85 1HD PRO 85 17.079 0.141 15.937 618 HD3 PRO 85 2HD PRO 85 18.453 -0.851 15.403 619 H ALA 86 H ALA 86 15.208 0.779 14.947 620 HA ALA 86 HA ALA 86 12.421 1.053 14.243 621 HB1 ALA 86 3HB ALA 86 14.313 3.063 15.471 622 HB2 ALA 86 1HB ALA 86 13.295 1.937 16.369 623 HB3 ALA 86 2HB ALA 86 12.557 3.199 15.383 624 H ASN 87 H ASN 87 13.939 0.656 11.972 625 HA ASN 87 HA ASN 87 14.585 3.132 10.687 626 HB2 ASN 87 1HB ASN 87 15.679 1.017 10.062 627 HB3 ASN 87 2HB ASN 87 14.133 0.376 9.518 628 HD21 ASN 87 2HD2 ASN 87 14.990 0.026 7.462 629 HD22 ASN 87 1HD2 ASN 87 15.254 1.328 6.354 630 H ALA 88 H ALA 88 12.232 0.703 9.661 631 HA ALA 88 HA ALA 88 10.096 0.777 8.941 632 HB1 ALA 88 3HB ALA 88 8.598 2.464 9.846 633 HB2 ALA 88 1HB ALA 88 9.977 3.417 10.394 634 HB3 ALA 88 2HB ALA 88 9.662 1.832 11.101 635 HA PRO 89 HA PRO 89 9.910 3.377 5.284 636 HB2 PRO 89 1HB PRO 89 7.029 3.011 5.164 637 HB3 PRO 89 2HB PRO 89 8.273 2.337 4.110 638 HG2 PRO 89 1HG PRO 89 6.803 0.827 5.825 639 HG3 PRO 89 2HG PRO 89 8.458 0.413 5.341 640 HD2 PRO 89 1HD PRO 89 7.493 1.728 7.859 641 HD3 PRO 89 2HD PRO 89 8.730 0.468 7.649 642 H GLU 90 H GLU 90 8.766 5.333 4.495 643 HA GLU 90 HA GLU 90 8.154 7.066 6.767 644 HB2 GLU 90 1HB GLU 90 8.688 7.760 3.875 645 HB3 GLU 90 2HB GLU 90 8.514 8.907 5.197 646 HG2 GLU 90 1HG GLU 90 10.506 8.047 6.254 647 HG3 GLU 90 2HG GLU 90 10.659 6.806 5.012 648 H VAL 91 H VAL 91 6.764 5.884 3.760 649 HA VAL 91 HA VAL 91 4.148 6.787 4.668 650 HB VAL 91 HB VAL 91 4.859 8.642 3.308 651 HG11 VAL 91 1HG1 VAL 91 5.467 8.391 0.948 652 HG12 VAL 91 2HG1 VAL 91 5.392 6.638 1.125 653 HG13 VAL 91 3HG1 VAL 91 6.601 7.562 2.014 654 HG21 VAL 91 3HG2 VAL 91 2.516 7.984 3.120 655 HG22 VAL 91 1HG2 VAL 91 2.915 6.927 1.766 656 HG23 VAL 91 2HG2 VAL 91 3.107 8.673 1.608 657 H LEU 92 H LEU 92 2.533 5.461 4.152 658 HA LEU 92 HA LEU 92 3.112 3.156 2.404 659 HG LEU 92 HG LEU 92 0.285 1.878 3.078 660 HB2 LEU 92 1HB LEU 92 2.757 2.479 4.705 661 HB3 LEU 92 2HB LEU 92 1.270 3.402 4.788 662 HD11 LEU 92 1HD1 LEU 92 1.394 -0.243 2.617 663 HD12 LEU 92 2HD1 LEU 92 2.810 0.295 3.522 664 HD13 LEU 92 3HD1 LEU 92 2.346 1.122 2.034 665 HD21 LEU 92 3HD2 LEU 92 -0.155 1.538 5.439 666 HD22 LEU 92 1HD2 LEU 92 1.315 0.575 5.593 667 HD23 LEU 92 2HD2 LEU 92 -0.025 -0.011 4.607 668 H LEU 93 H LEU 93 2.109 3.294 0.518 669 HA LEU 93 HA LEU 93 -0.283 4.971 0.285 670 HG LEU 93 HG LEU 93 2.613 5.645 -0.681 671 HB2 LEU 93 1HB LEU 93 1.499 3.783 -1.845 672 HB3 LEU 93 2HB LEU 93 0.112 4.808 -2.153 673 HD11 LEU 93 1HD1 LEU 93 3.021 7.038 -2.650 674 HD12 LEU 93 2HD1 LEU 93 1.610 6.331 -3.439 675 HD13 LEU 93 3HD1 LEU 93 3.005 5.322 -3.055 676 HD21 LEU 93 3HD2 LEU 93 0.637 6.807 0.142 677 HD22 LEU 93 1HD2 LEU 93 0.189 7.238 -1.508 678 HD23 LEU 93 2HD2 LEU 93 1.662 7.897 -0.793 679 H VAL 94 H VAL 94 -2.178 4.016 0.398 680 HA VAL 94 HA VAL 94 -2.389 1.177 -0.325 681 HB VAL 94 HB VAL 94 -4.396 2.882 1.165 682 HG11 VAL 94 1HG1 VAL 94 -5.406 0.968 0.066 683 HG12 VAL 94 2HG1 VAL 94 -5.385 0.730 1.813 684 HG13 VAL 94 3HG1 VAL 94 -4.211 -0.106 0.795 685 HG21 VAL 94 3HG2 VAL 94 -3.620 1.740 3.188 686 HG22 VAL 94 1HG2 VAL 94 -2.336 2.694 2.446 687 HG23 VAL 94 2HG2 VAL 94 -2.358 0.941 2.251 688 H GLY 95 H GLY 95 -3.249 0.659 -2.223 689 HA2 GLY 95 1HA GLY 95 -4.687 2.706 -3.741 690 HA3 GLY 95 2HA GLY 95 -4.054 1.195 -4.374 691 H THR 96 H THR 96 -6.678 2.743 -2.720 692 HA THR 96 HA THR 96 -8.259 0.263 -2.732 693 HB THR 96 HB THR 96 -9.230 2.838 -1.532 694 HG1 THR 96 HG1 THR 96 -6.938 1.527 -0.824 695 HG21 THR 96 3HG2 THR 96 -10.238 1.331 0.097 696 HG22 THR 96 1HG2 THR 96 -9.438 -0.046 -0.661 697 HG23 THR 96 2HG2 THR 96 -10.675 0.849 -1.542 698 H GLY 97 H GLY 97 -7.707 1.443 -5.213 699 HA2 GLY 97 1HA GLY 97 -9.684 3.434 -5.885 700 HA3 GLY 97 2HA GLY 97 -8.480 2.752 -6.959 701 H ARG 98 H ARG 98 -11.353 1.667 -5.189 702 HA ARG 98 HA ARG 98 -12.737 1.003 -7.617 703 HE ARG 98 HE ARG 98 -11.560 -3.469 -6.861 704 HB2 ARG 98 1HB ARG 98 -11.229 -1.015 -7.185 705 HB3 ARG 98 2HB ARG 98 -12.168 -1.289 -5.723 706 HG2 ARG 98 1HG ARG 98 -14.116 -1.047 -7.627 707 HG3 ARG 98 2HG ARG 98 -12.823 -1.858 -8.510 708 HD2 ARG 98 1HD ARG 98 -14.116 -2.749 -5.940 709 HD3 ARG 98 2HD ARG 98 -14.266 -3.506 -7.522 710 HH11 ARG 98 1HH1 ARG 98 -14.538 -4.985 -5.781 711 HH12 ARG 98 2HH1 ARG 98 -13.723 -6.368 -5.110 712 HH21 ARG 98 1HH2 ARG 98 -10.499 -5.290 -5.964 713 HH22 ARG 98 2HH2 ARG 98 -11.446 -6.541 -5.204 714 H ARG 99 H ARG 99 -12.531 0.273 -4.182 715 HA ARG 99 HA ARG 99 -15.143 1.503 -3.726 716 HE ARG 99 HE ARG 99 -16.154 1.993 -1.592 717 HB2 ARG 99 1HB ARG 99 -15.110 -1.141 -3.904 718 HB3 ARG 99 2HB ARG 99 -14.432 -1.040 -2.290 719 HG2 ARG 99 1HG ARG 99 -17.029 0.276 -3.010 720 HG3 ARG 99 2HG ARG 99 -16.935 -1.410 -2.508 721 HD2 ARG 99 1HD ARG 99 -17.369 -0.389 -0.506 722 HD3 ARG 99 2HD ARG 99 -15.608 -0.406 -0.486 723 HH11 ARG 99 1HH1 ARG 99 -17.352 0.411 1.285 724 HH12 ARG 99 2HH1 ARG 99 -17.633 1.895 2.139 725 HH21 ARG 99 1HH2 ARG 99 -16.492 3.944 -0.464 726 HH22 ARG 99 2HH2 ARG 99 -17.102 3.902 1.166 727 H GLN 100 H GLN 100 -14.163 3.249 -2.756 728 HA GLN 100 HA GLN 100 -11.773 2.974 -1.232 729 HB2 GLN 100 1HB GLN 100 -12.331 4.948 -2.636 730 HB3 GLN 100 2HB GLN 100 -13.579 5.380 -1.476 731 HG2 GLN 100 1HG GLN 100 -11.890 5.647 0.256 732 HG3 GLN 100 2HG GLN 100 -10.634 5.190 -0.893 733 HE21 GLN 100 2HE2 GLN 100 -10.958 7.651 0.617 734 HE22 GLN 100 1HE2 GLN 100 -11.031 8.935 -0.545 735 H HIS 101 H HIS 101 -12.147 1.710 0.525 736 HA HIS 101 HA HIS 101 -14.225 2.244 2.422 737 HD1 HIS 101 HD1 HIS 101 -15.095 0.130 4.300 738 HD2 HIS 101 HD2 HIS 101 -11.028 0.354 5.132 739 HE1 HIS 101 HE1 HIS 101 -14.880 -0.357 6.752 740 HE2 HIS 101 HE2 HIS 101 -12.400 -0.422 7.184 741 HB2 HIS 101 1HB HIS 101 -13.408 -0.016 2.184 742 HB3 HIS 101 2HB HIS 101 -11.757 0.495 2.510 743 H LEU 102 H LEU 102 -14.153 4.129 3.487 744 HA LEU 102 HA LEU 102 -11.807 5.514 4.203 745 HG LEU 102 HG LEU 102 -14.751 6.224 3.130 746 HB2 LEU 102 1HB LEU 102 -14.541 5.653 5.484 747 HB3 LEU 102 2HB LEU 102 -13.259 6.834 5.682 748 HD11 LEU 102 1HD1 LEU 102 -16.043 7.517 4.733 749 HD12 LEU 102 2HD1 LEU 102 -15.568 8.513 3.358 750 HD13 LEU 102 3HD1 LEU 102 -14.714 8.665 4.892 751 HD21 LEU 102 3HD2 LEU 102 -12.521 8.191 3.644 752 HD22 LEU 102 1HD2 LEU 102 -13.471 8.078 2.161 753 HD23 LEU 102 2HD2 LEU 102 -12.425 6.742 2.642 754 H LEU 103 H LEU 103 -10.419 5.221 5.822 755 HA LEU 103 HA LEU 103 -10.807 2.893 7.506 756 HG LEU 103 HG LEU 103 -8.820 3.553 5.104 757 HB2 LEU 103 1HB LEU 103 -8.410 4.707 7.227 758 HB3 LEU 103 2HB LEU 103 -8.447 3.173 8.075 759 HD11 LEU 103 1HD1 LEU 103 -6.671 2.405 4.920 760 HD12 LEU 103 2HD1 LEU 103 -6.534 2.379 6.679 761 HD13 LEU 103 3HD1 LEU 103 -6.524 3.917 5.815 762 HD21 LEU 103 3HD2 LEU 103 -8.734 1.098 5.010 763 HD22 LEU 103 1HD2 LEU 103 -10.139 1.686 5.901 764 HD23 LEU 103 2HD2 LEU 103 -8.746 1.044 6.773 765 H GLY 104 H GLY 104 -10.049 3.017 9.798 766 HA2 GLY 104 1HA GLY 104 -11.278 5.398 11.029 767 HA3 GLY 104 2HA GLY 104 -11.205 3.801 11.759 768 HA PRO 105 HA PRO 105 -7.637 6.874 12.918 769 HB2 PRO 105 1HB PRO 105 -9.019 6.811 15.546 770 HB3 PRO 105 2HB PRO 105 -8.270 8.169 14.700 771 HG2 PRO 105 1HG PRO 105 -10.918 7.941 14.826 772 HG3 PRO 105 2HG PRO 105 -10.123 8.518 13.349 773 HD2 PRO 105 1HD PRO 105 -11.275 5.823 13.955 774 HD3 PRO 105 2HD PRO 105 -11.336 6.762 12.448 775 H GLU 106 H GLU 106 -9.233 4.219 14.604 776 HA GLU 106 HA GLU 106 -7.021 3.530 16.261 777 HB2 GLU 106 1HB GLU 106 -9.344 1.806 15.386 778 HB3 GLU 106 2HB GLU 106 -8.280 1.504 16.752 779 HG2 GLU 106 1HG GLU 106 -9.119 3.413 17.914 780 HG3 GLU 106 2HG GLU 106 -10.053 3.917 16.503 781 H GLN 107 H GLN 107 -7.761 2.982 12.972 782 HA GLN 107 HA GLN 107 -6.269 0.501 12.782 783 HB2 GLN 107 1HB GLN 107 -7.611 2.136 10.625 784 HB3 GLN 107 2HB GLN 107 -6.967 0.510 10.438 785 HG2 GLN 107 1HG GLN 107 -8.591 -0.336 12.032 786 HG3 GLN 107 2HG GLN 107 -9.216 1.293 12.278 787 HE21 GLN 107 2HE2 GLN 107 -10.584 -1.093 11.374 788 HE22 GLN 107 1HE2 GLN 107 -11.240 -0.723 9.810 789 H VAL 108 H VAL 108 -5.903 3.884 11.922 790 HA VAL 108 HA VAL 108 -3.408 3.324 10.527 791 HB VAL 108 HB VAL 108 -3.378 5.754 10.023 792 HG11 VAL 108 1HG1 VAL 108 -5.291 5.732 8.489 793 HG12 VAL 108 2HG1 VAL 108 -5.943 4.327 9.334 794 HG13 VAL 108 3HG1 VAL 108 -4.412 4.204 8.469 795 HG21 VAL 108 3HG2 VAL 108 -5.370 7.107 10.518 796 HG22 VAL 108 1HG2 VAL 108 -4.554 6.581 11.990 797 HG23 VAL 108 2HG2 VAL 108 -6.032 5.775 11.465 798 H ARG 109 H ARG 109 -4.471 4.300 13.638 799 HA ARG 109 HA ARG 109 -2.426 6.035 14.396 800 HE ARG 109 HE ARG 109 -4.682 4.610 18.500 801 HB2 ARG 109 1HB ARG 109 -4.528 5.733 15.653 802 HB3 ARG 109 2HB ARG 109 -3.961 4.161 16.196 803 HG2 ARG 109 1HG ARG 109 -2.053 6.285 16.740 804 HG3 ARG 109 2HG ARG 109 -3.621 6.559 17.500 805 HD2 ARG 109 1HD ARG 109 -2.063 3.987 17.720 806 HD3 ARG 109 2HD ARG 109 -1.993 5.289 18.908 807 HH11 ARG 109 1HH1 ARG 109 -1.765 3.204 19.858 808 HH12 ARG 109 2HH1 ARG 109 -2.627 2.253 21.036 809 HH21 ARG 109 1HH2 ARG 109 -5.801 3.364 20.027 810 HH22 ARG 109 2HH2 ARG 109 -4.930 2.332 21.120 811 HA PRO 110 HA PRO 110 -0.152 2.055 16.312 812 HB2 PRO 110 1HB PRO 110 -0.336 0.015 14.386 813 HB3 PRO 110 2HB PRO 110 -1.092 0.023 15.981 814 HG2 PRO 110 1HG PRO 110 -2.253 0.715 13.328 815 HG3 PRO 110 2HG PRO 110 -3.017 -0.071 14.721 816 HD2 PRO 110 1HD PRO 110 -3.523 2.487 14.137 817 HD3 PRO 110 2HD PRO 110 -3.372 1.947 15.824 818 H LEU 111 H LEU 111 -0.525 2.402 12.789 819 HA LEU 111 HA LEU 111 2.267 2.039 12.285 820 HG LEU 111 HG LEU 111 -0.331 0.763 11.099 821 HB2 LEU 111 1HB LEU 111 0.078 3.111 10.505 822 HB3 LEU 111 2HB LEU 111 1.697 2.698 9.973 823 HD11 LEU 111 1HD1 LEU 111 -0.386 -0.149 8.836 824 HD12 LEU 111 2HD1 LEU 111 0.706 1.125 8.294 825 HD13 LEU 111 3HD1 LEU 111 -0.910 1.535 8.866 826 HD21 LEU 111 3HD2 LEU 111 1.279 -0.965 10.448 827 HD22 LEU 111 1HD2 LEU 111 1.940 0.114 11.677 828 HD23 LEU 111 2HD2 LEU 111 2.433 0.288 9.994 829 H LEU 112 H LEU 112 0.118 4.820 12.605 830 HA LEU 112 HA LEU 112 1.995 6.790 11.837 831 HG LEU 112 HG LEU 112 -1.017 6.465 11.323 832 HB2 LEU 112 1HB LEU 112 -0.406 6.973 13.655 833 HB3 LEU 112 2HB LEU 112 0.517 8.358 13.106 834 HD11 LEU 112 1HD1 LEU 112 -1.611 9.296 12.174 835 HD12 LEU 112 2HD1 LEU 112 -2.492 7.850 12.670 836 HD13 LEU 112 3HD1 LEU 112 -2.520 8.364 10.984 837 HD21 LEU 112 3HD2 LEU 112 -0.533 8.102 9.561 838 HD22 LEU 112 1HD2 LEU 112 0.940 7.380 10.206 839 HD23 LEU 112 2HD2 LEU 112 0.473 9.011 10.689 840 H ALA 113 H ALA 113 1.277 5.215 14.890 841 HA ALA 113 HA ALA 113 2.901 6.818 16.555 842 HB1 ALA 113 3HB ALA 113 1.211 5.265 17.430 843 HB2 ALA 113 1HB ALA 113 2.797 4.965 18.140 844 HB3 ALA 113 2HB ALA 113 2.182 3.902 16.874 845 H MET 114 H MET 114 3.570 4.118 14.444 846 HA MET 114 HA MET 114 6.290 3.784 15.283 847 HB2 MET 114 1HB MET 114 4.887 2.913 12.748 848 HB3 MET 114 2HB MET 114 6.506 2.420 13.220 849 HG2 MET 114 1HG MET 114 5.629 1.289 15.168 850 HG3 MET 114 2HG MET 114 4.002 1.845 14.784 851 HE1 MET 114 3HE MET 114 3.113 -0.651 14.958 852 HE2 MET 114 1HE MET 114 4.744 -1.206 15.338 853 HE3 MET 114 2HE MET 114 3.814 -2.001 14.068 854 H GLY 115 H GLY 115 4.600 5.554 12.765 855 HA2 GLY 115 1HA GLY 115 5.724 7.785 12.359 856 HA3 GLY 115 2HA GLY 115 7.154 6.824 12.005 857 H VAL 116 H VAL 116 4.947 4.872 10.878 858 HA VAL 116 HA VAL 116 5.438 5.630 8.158 859 HB VAL 116 HB VAL 116 3.622 3.432 9.158 860 HG11 VAL 116 1HG1 VAL 116 3.326 3.978 6.804 861 HG12 VAL 116 2HG1 VAL 116 4.088 2.399 6.988 862 HG13 VAL 116 3HG1 VAL 116 5.060 3.797 6.529 863 HG21 VAL 116 3HG2 VAL 116 5.811 3.146 10.154 864 HG22 VAL 116 1HG2 VAL 116 6.583 3.330 8.579 865 HG23 VAL 116 2HG2 VAL 116 5.558 1.932 8.902 866 H GLY 117 H GLY 117 4.324 7.250 7.270 867 HA2 GLY 117 1HA GLY 117 1.681 7.971 8.125 868 HA3 GLY 117 2HA GLY 117 2.574 8.681 6.787 869 H VAL 118 H VAL 118 -0.103 6.932 7.560 870 HA VAL 118 HA VAL 118 -0.102 5.247 5.182 871 HB VAL 118 HB VAL 118 -2.260 5.548 7.277 872 HG11 VAL 118 1HG1 VAL 118 -3.091 4.648 5.184 873 HG12 VAL 118 2HG1 VAL 118 -3.053 3.386 6.417 874 HG13 VAL 118 3HG1 VAL 118 -1.807 3.440 5.169 875 HG21 VAL 118 3HG2 VAL 118 -0.215 4.751 8.310 876 HG22 VAL 118 1HG2 VAL 118 -0.049 3.507 7.070 877 HG23 VAL 118 2HG2 VAL 118 -1.394 3.444 8.209 878 H GLU 119 H GLU 119 -0.921 5.910 3.313 879 HA GLU 119 HA GLU 119 -3.096 7.891 3.351 880 HB2 GLU 119 1HB GLU 119 -0.720 7.828 1.487 881 HB3 GLU 119 2HB GLU 119 -2.147 8.821 1.224 882 HG2 GLU 119 1HG GLU 119 -1.707 9.937 3.393 883 HG3 GLU 119 2HG GLU 119 -0.211 9.011 3.520 884 H ALA 120 H ALA 120 -4.865 7.102 2.454 885 HA ALA 120 HA ALA 120 -4.627 4.847 0.593 886 HB1 ALA 120 3HB ALA 120 -6.000 4.450 2.575 887 HB2 ALA 120 1HB ALA 120 -6.976 4.395 1.106 888 HB3 ALA 120 2HB ALA 120 -7.025 5.819 2.146 889 H MET 121 H MET 121 -4.952 5.174 -1.491 890 HA MET 121 HA MET 121 -6.761 7.298 -2.385 891 HB2 MET 121 1HB MET 121 -3.919 6.944 -3.371 892 HB3 MET 121 2HB MET 121 -5.120 7.963 -4.149 893 HG2 MET 121 1HG MET 121 -5.268 9.312 -2.095 894 HG3 MET 121 2HG MET 121 -4.000 8.317 -1.379 895 HE1 MET 121 3HE MET 121 -2.117 7.823 -3.947 896 HE2 MET 121 1HE MET 121 -1.512 8.193 -2.333 897 HE3 MET 121 2HE MET 121 -0.949 9.125 -3.722 898 H ASP 122 H ASP 122 -6.575 7.058 -5.053 899 HA ASP 122 HA ASP 122 -7.696 4.516 -5.626 900 HB2 ASP 122 1HB ASP 122 -6.794 6.812 -7.344 901 HB3 ASP 122 2HB ASP 122 -7.302 5.293 -8.073 902 H THR 123 H THR 123 -6.874 2.840 -6.907 903 HA THR 123 HA THR 123 -4.334 1.958 -6.249 904 HB THR 123 HB THR 123 -5.869 1.072 -8.693 905 HG1 THR 123 HG1 THR 123 -6.654 -0.490 -6.884 906 HG21 THR 123 3HG2 THR 123 -4.895 -1.110 -8.186 907 HG22 THR 123 1HG2 THR 123 -4.079 -0.433 -6.777 908 HG23 THR 123 2HG2 THR 123 -3.626 0.097 -8.397 909 H GLN 124 H GLN 124 -5.447 3.562 -9.205 910 HA GLN 124 HA GLN 124 -2.927 3.378 -10.528 911 HB2 GLN 124 1HB GLN 124 -5.000 3.583 -11.789 912 HB3 GLN 124 2HB GLN 124 -5.317 5.149 -11.056 913 HG2 GLN 124 1HG GLN 124 -3.410 6.109 -12.174 914 HG3 GLN 124 2HG GLN 124 -2.961 4.532 -12.821 915 HE21 GLN 124 2HE2 GLN 124 -3.651 7.066 -14.173 916 HE22 GLN 124 1HE2 GLN 124 -4.960 6.683 -15.237 917 H ALA 125 H ALA 125 -4.496 5.780 -8.499 918 HA ALA 125 HA ALA 125 -2.698 7.907 -8.995 919 HB1 ALA 125 3HB ALA 125 -4.395 7.393 -6.552 920 HB2 ALA 125 1HB ALA 125 -4.910 8.256 -8.002 921 HB3 ALA 125 2HB ALA 125 -3.635 8.925 -6.984 922 H ALA 126 H ALA 126 -2.875 5.476 -6.421 923 HA ALA 126 HA ALA 126 -0.620 6.330 -4.981 924 HB1 ALA 126 3HB ALA 126 -1.782 3.553 -5.169 925 HB2 ALA 126 1HB ALA 126 -2.305 4.818 -4.057 926 HB3 ALA 126 2HB ALA 126 -0.684 4.138 -3.919 927 H ALA 127 H ALA 127 -0.963 4.141 -7.717 928 HA ALA 127 HA ALA 127 1.623 3.048 -7.695 929 HB1 ALA 127 3HB ALA 127 -0.173 3.543 -10.065 930 HB2 ALA 127 1HB ALA 127 -0.214 2.122 -9.020 931 HB3 ALA 127 2HB ALA 127 1.205 2.443 -10.017 932 H ARG 128 H ARG 128 0.335 5.983 -9.195 933 HA ARG 128 HA ARG 128 2.677 6.700 -10.604 934 HE ARG 128 HE ARG 128 -1.200 9.290 -9.922 935 HB2 ARG 128 1HB ARG 128 0.561 8.539 -9.471 936 HB3 ARG 128 2HB ARG 128 1.732 8.950 -10.714 937 HG2 ARG 128 1HG ARG 128 0.713 7.249 -12.186 938 HG3 ARG 128 2HG ARG 128 -0.512 6.959 -10.948 939 HD2 ARG 128 1HD ARG 128 -0.008 9.505 -12.480 940 HD3 ARG 128 2HD ARG 128 -1.433 8.471 -12.560 941 HH11 ARG 128 1HH1 ARG 128 -1.677 10.806 -13.045 942 HH12 ARG 128 2HH1 ARG 128 -2.579 12.141 -12.391 943 HH21 ARG 128 1HH2 ARG 128 -2.350 11.057 -9.065 944 HH22 ARG 128 2HH2 ARG 128 -2.948 12.299 -10.135 945 H THR 129 H THR 129 1.392 7.876 -7.510 946 HA THR 129 HA THR 129 3.528 9.542 -6.843 947 HB THR 129 HB THR 129 1.737 8.076 -4.897 948 HG1 THR 129 HG1 THR 129 1.084 10.660 -5.721 949 HG21 THR 129 3HG2 THR 129 3.120 10.759 -4.726 950 HG22 THR 129 1HG2 THR 129 3.607 9.293 -3.871 951 HG23 THR 129 2HG2 THR 129 2.062 10.059 -3.500 952 H TYR 130 H TYR 130 3.045 6.096 -6.344 953 HA TYR 130 HA TYR 130 5.105 5.579 -4.533 954 HD1 TYR 130 HD1 TYR 130 5.145 3.320 -3.257 955 HD2 TYR 130 HD2 TYR 130 5.590 2.223 -7.342 956 HE1 TYR 130 HE1 TYR 130 6.653 1.493 -2.596 957 HE2 TYR 130 HE2 TYR 130 7.095 0.393 -6.694 958 HH TYR 130 HH TYR 130 7.382 -0.702 -3.536 959 HB2 TYR 130 1HB TYR 130 3.428 3.912 -5.133 960 HB3 TYR 130 2HB TYR 130 4.046 3.852 -6.780 961 H ASN 131 H ASN 131 5.167 5.384 -8.096 962 HA ASN 131 HA ASN 131 7.914 4.840 -8.329 963 HB2 ASN 131 1HB ASN 131 6.288 4.512 -10.158 964 HB3 ASN 131 2HB ASN 131 6.107 6.257 -10.304 965 HD21 ASN 131 2HD2 ASN 131 6.813 6.306 -12.408 966 HD22 ASN 131 1HD2 ASN 131 8.463 6.031 -12.850 967 H ILE 132 H ILE 132 6.129 7.840 -8.068 968 HA ILE 132 HA ILE 132 8.163 9.666 -8.678 969 HB ILE 132 HB ILE 132 5.870 9.943 -6.724 970 HG12 ILE 132 1HG1 ILE 132 5.122 9.524 -9.004 971 HG13 ILE 132 2HG1 ILE 132 4.788 11.193 -8.560 972 HG21 ILE 132 1HG2 ILE 132 6.198 12.368 -6.949 973 HG22 ILE 132 2HG2 ILE 132 7.658 12.067 -7.892 974 HG23 ILE 132 3HG2 ILE 132 7.583 11.567 -6.202 975 HD11 ILE 132 3HD1 ILE 132 7.085 10.249 -10.255 976 HD12 ILE 132 1HD1 ILE 132 6.735 11.923 -9.826 977 HD13 ILE 132 2HD1 ILE 132 5.608 11.018 -10.837 978 H LEU 133 H LEU 133 7.129 8.406 -5.509 979 HA LEU 133 HA LEU 133 9.207 9.760 -4.102 980 HG LEU 133 HG LEU 133 6.040 9.336 -3.826 981 HB2 LEU 133 1HB LEU 133 7.473 7.465 -3.185 982 HB3 LEU 133 2HB LEU 133 8.418 8.524 -2.154 983 HD11 LEU 133 1HD1 LEU 133 5.429 8.028 -1.871 984 HD12 LEU 133 2HD1 LEU 133 4.957 9.716 -1.669 985 HD13 LEU 133 3HD1 LEU 133 6.385 9.094 -0.843 986 HD21 LEU 133 3HD2 LEU 133 6.261 11.515 -2.746 987 HD22 LEU 133 1HD2 LEU 133 7.690 11.127 -3.702 988 HD23 LEU 133 2HD2 LEU 133 7.736 10.975 -1.946 989 H MET 134 H MET 134 8.864 6.556 -5.480 990 HA MET 134 HA MET 134 11.036 5.314 -4.200 991 HB2 MET 134 1HB MET 134 9.383 4.057 -5.511 992 HB3 MET 134 2HB MET 134 9.954 4.827 -6.985 993 HG2 MET 134 1HG MET 134 12.153 3.788 -6.657 994 HG3 MET 134 2HG MET 134 11.542 2.982 -5.215 995 HE1 MET 134 3HE MET 134 11.247 3.322 -9.108 996 HE2 MET 134 1HE MET 134 9.597 3.637 -8.572 997 HE3 MET 134 2HE MET 134 9.965 2.166 -9.473 998 H ALA 135 H ALA 135 10.881 7.034 -7.313 999 HA ALA 135 HA ALA 135 13.678 6.845 -7.821 1000 HB1 ALA 135 3HB ALA 135 12.046 7.185 -9.616 1001 HB2 ALA 135 1HB ALA 135 13.270 8.455 -9.608 1002 HB3 ALA 135 2HB ALA 135 11.661 8.777 -8.963 1003 H GLU 136 H GLU 136 11.730 8.933 -5.915 1004 HA GLU 136 HA GLU 136 13.540 11.133 -5.767 1005 HB2 GLU 136 1HB GLU 136 11.116 11.322 -5.317 1006 HB3 GLU 136 2HB GLU 136 11.308 10.305 -3.899 1007 HG2 GLU 136 1HG GLU 136 12.597 11.976 -2.786 1008 HG3 GLU 136 2HG GLU 136 12.681 12.956 -4.250 1009 H GLY 137 H GLY 137 13.507 8.013 -4.415 1010 HA2 GLY 137 1HA GLY 137 15.147 7.023 -3.082 1011 HA3 GLY 137 2HA GLY 137 15.817 8.620 -2.763 1012 H ARG 138 H ARG 138 12.467 7.775 -2.379 1013 HA ARG 138 HA ARG 138 12.686 8.453 0.471 1014 HE ARG 138 HE ARG 138 8.490 10.816 2.151 1015 HB2 ARG 138 1HB ARG 138 11.267 9.786 -1.222 1016 HB3 ARG 138 2HB ARG 138 10.173 8.414 -1.181 1017 HG2 ARG 138 1HG ARG 138 9.742 8.750 1.150 1018 HG3 ARG 138 2HG ARG 138 10.977 10.014 1.234 1019 HD2 ARG 138 1HD ARG 138 9.684 11.286 -0.475 1020 HD3 ARG 138 2HD ARG 138 8.410 10.079 -0.344 1021 HH11 ARG 138 1HH1 ARG 138 9.012 12.862 -0.640 1022 HH12 ARG 138 2HH1 ARG 138 8.272 14.264 0.084 1023 HH21 ARG 138 1HH2 ARG 138 7.508 12.638 3.119 1024 HH22 ARG 138 2HH2 ARG 138 7.405 14.128 2.227 1025 H ARG 139 H ARG 139 11.604 7.163 2.022 1026 HA ARG 139 HA ARG 139 11.460 4.376 1.256 1027 HE ARG 139 HE ARG 139 13.680 6.797 4.776 1028 HB2 ARG 139 1HB ARG 139 11.232 5.815 3.892 1029 HB3 ARG 139 2HB ARG 139 10.945 4.087 3.746 1030 HG2 ARG 139 1HG ARG 139 13.188 3.699 3.033 1031 HG3 ARG 139 2HG ARG 139 13.498 5.429 2.886 1032 HD2 ARG 139 1HD ARG 139 12.745 4.129 5.493 1033 HD3 ARG 139 2HD ARG 139 14.417 4.270 4.952 1034 HH11 ARG 139 1HH1 ARG 139 12.920 4.485 7.303 1035 HH12 ARG 139 2HH1 ARG 139 12.901 5.673 8.561 1036 HH21 ARG 139 1HH2 ARG 139 13.640 8.375 6.437 1037 HH22 ARG 139 2HH2 ARG 139 13.309 7.886 8.069 1038 H VAL 140 H VAL 140 9.678 4.239 -0.063 1039 HA VAL 140 HA VAL 140 7.077 4.692 1.242 1040 HB VAL 140 HB VAL 140 7.381 6.276 -0.574 1041 HG11 VAL 140 1HG1 VAL 140 7.803 3.885 -2.360 1042 HG12 VAL 140 2HG1 VAL 140 9.031 5.058 -1.888 1043 HG13 VAL 140 3HG1 VAL 140 7.671 5.562 -2.891 1044 HG21 VAL 140 3HG2 VAL 140 5.414 5.725 -1.945 1045 HG22 VAL 140 1HG2 VAL 140 5.134 5.439 -0.227 1046 HG23 VAL 140 2HG2 VAL 140 5.448 4.081 -1.306 1047 H VAL 141 H VAL 141 5.649 3.065 1.258 1048 HA VAL 141 HA VAL 141 6.235 0.657 -0.348 1049 HB VAL 141 HB VAL 141 4.811 0.715 2.328 1050 HG11 VAL 141 1HG1 VAL 141 4.106 -1.108 0.873 1051 HG12 VAL 141 2HG1 VAL 141 5.032 -1.719 2.244 1052 HG13 VAL 141 3HG1 VAL 141 5.786 -1.596 0.654 1053 HG21 VAL 141 3HG2 VAL 141 6.819 -0.366 3.244 1054 HG22 VAL 141 1HG2 VAL 141 7.153 1.261 2.652 1055 HG23 VAL 141 2HG2 VAL 141 7.634 -0.140 1.696 1056 H VAL 142 H VAL 142 4.477 -0.219 -1.479 1057 HA VAL 142 HA VAL 142 1.986 1.334 -1.268 1058 HB VAL 142 HB VAL 142 3.329 1.911 -3.309 1059 HG11 VAL 142 1HG1 VAL 142 3.332 0.331 -5.181 1060 HG12 VAL 142 2HG1 VAL 142 2.648 -0.909 -4.131 1061 HG13 VAL 142 3HG1 VAL 142 4.261 -0.271 -3.809 1062 HG21 VAL 142 3HG2 VAL 142 1.424 1.821 -4.849 1063 HG22 VAL 142 1HG2 VAL 142 0.942 2.320 -3.227 1064 HG23 VAL 142 2HG2 VAL 142 0.621 0.675 -3.775 1065 H ALA 143 H ALA 143 0.120 0.237 -1.254 1066 HA ALA 143 HA ALA 143 0.216 -2.676 -1.739 1067 HB1 ALA 143 3HB ALA 143 -1.563 -1.190 0.202 1068 HB2 ALA 143 1HB ALA 143 -0.158 -2.164 0.634 1069 HB3 ALA 143 2HB ALA 143 -1.572 -2.930 -0.089 1070 H LEU 144 H LEU 144 -0.633 -2.952 -3.713 1071 HA LEU 144 HA LEU 144 -2.769 -1.137 -4.582 1072 HG LEU 144 HG LEU 144 0.204 -0.917 -5.372 1073 HB2 LEU 144 1HB LEU 144 -0.950 -2.954 -6.159 1074 HB3 LEU 144 2HB LEU 144 -2.210 -1.958 -6.859 1075 HD11 LEU 144 1HD1 LEU 144 0.794 -1.890 -7.526 1076 HD12 LEU 144 2HD1 LEU 144 0.952 -0.133 -7.557 1077 HD13 LEU 144 3HD1 LEU 144 -0.439 -0.907 -8.317 1078 HD21 LEU 144 3HD2 LEU 144 -1.752 0.524 -5.129 1079 HD22 LEU 144 1HD2 LEU 144 -1.963 0.539 -6.880 1080 HD23 LEU 144 2HD2 LEU 144 -0.530 1.272 -6.158 1081 H LEU 145 H LEU 145 -4.780 -1.824 -4.656 1082 HA LEU 145 HA LEU 145 -5.291 -4.722 -4.703 1083 HG LEU 145 HG LEU 145 -6.151 -5.286 -2.476 1084 HB2 LEU 145 1HB LEU 145 -6.099 -2.818 -2.867 1085 HB3 LEU 145 2HB LEU 145 -7.505 -2.989 -3.895 1086 HD11 LEU 145 1HD1 LEU 145 -8.051 -5.223 -0.946 1087 HD12 LEU 145 2HD1 LEU 145 -8.655 -3.772 -1.748 1088 HD13 LEU 145 3HD1 LEU 145 -7.122 -3.725 -0.876 1089 HD21 LEU 145 3HD2 LEU 145 -7.364 -5.956 -4.480 1090 HD22 LEU 145 1HD2 LEU 145 -8.799 -5.106 -3.906 1091 HD23 LEU 145 2HD2 LEU 145 -8.192 -6.508 -3.023 1092 HA PRO 146 HA PRO 146 -7.235 -3.663 -8.673 1093 HB2 PRO 146 1HB PRO 146 -7.020 -6.477 -9.278 1094 HB3 PRO 146 2HB PRO 146 -6.141 -5.133 -10.007 1095 HG2 PRO 146 1HG PRO 146 -4.970 -7.048 -8.441 1096 HG3 PRO 146 2HG PRO 146 -4.336 -5.404 -8.637 1097 HD2 PRO 146 1HD PRO 146 -5.960 -6.555 -6.398 1098 HD3 PRO 146 2HD PRO 146 -4.573 -5.444 -6.331 1099 H ASP 147 H ASP 147 -8.876 -5.648 -9.830 1100 HA ASP 147 HA ASP 147 -11.013 -5.772 -7.877 1101 HB2 ASP 147 1HB ASP 147 -12.417 -6.654 -9.730 1102 HB3 ASP 147 2HB ASP 147 -11.700 -5.088 -10.071 1103 H GLY 148 H GLY 148 -9.340 -8.135 -9.930 1104 HA2 GLY 148 1HA GLY 148 -8.801 -10.079 -8.120 1105 HA3 GLY 148 2HA GLY 148 -10.505 -10.336 -8.465 1106 H ASP 149 H ASP 149 -9.388 -9.055 -11.179 1107 HA ASP 149 HA ASP 149 -8.674 -9.767 -13.220 1108 HB2 ASP 149 1HB ASP 149 -7.075 -11.355 -11.902 1109 HB3 ASP 149 2HB ASP 149 -8.273 -12.592 -12.256 1110 H SER 150 H SER 150 -10.998 -9.284 -13.178 1111 HA SER 150 HA SER 150 -12.770 -11.587 -13.308 1112 HG SER 150 HG SER 150 -12.401 -8.977 -11.567 1113 HB2 SER 150 1HB SER 150 -13.477 -8.658 -13.539 1114 HB3 SER 150 2HB SER 150 -14.556 -9.995 -13.137 1115 H LEU 151 H LEU 151 -13.020 -12.551 -15.204 1116 HA LEU 151 HA LEU 151 -12.550 -11.186 -17.698 1117 HG LEU 151 HG LEU 151 -11.283 -13.722 -16.355 1118 HB2 LEU 151 1HB LEU 151 -13.610 -13.965 -17.153 1119 HB3 LEU 151 2HB LEU 151 -13.122 -13.350 -18.721 1120 HD11 LEU 151 1HD1 LEU 151 -11.588 -15.331 -18.886 1121 HD12 LEU 151 2HD1 LEU 151 -12.036 -15.852 -17.263 1122 HD13 LEU 151 3HD1 LEU 151 -10.342 -15.565 -17.660 1123 HD21 LEU 151 3HD2 LEU 151 -10.711 -12.950 -19.216 1124 HD22 LEU 151 1HD2 LEU 151 -9.501 -13.280 -17.977 1125 HD23 LEU 151 2HD2 LEU 151 -10.580 -11.895 -17.808 1126 H GLU 152 H GLU 152 -14.075 -10.523 -19.165 1127 HA GLU 152 HA GLU 152 -16.670 -9.925 -18.174 1128 HB2 GLU 152 1HB GLU 152 -15.574 -9.737 -20.987 1129 HB3 GLU 152 2HB GLU 152 -17.107 -9.061 -20.454 1130 HG2 GLU 152 1HG GLU 152 -15.833 -7.672 -18.818 1131 HG3 GLU 152 2HG GLU 152 -14.350 -8.255 -19.574 1132 H HIS 153 H HIS 153 -18.585 -10.903 -18.502 1133 HA HIS 153 HA HIS 153 -18.586 -13.356 -20.135 1134 HD1 HIS 153 HD1 HIS 153 -17.733 -15.555 -18.872 1135 HD2 HIS 153 HD2 HIS 153 -18.352 -13.129 -15.550 1136 HE1 HIS 153 HE1 HIS 153 -15.977 -16.228 -17.200 1137 HE2 HIS 153 HE2 HIS 153 -16.465 -14.849 -15.144 1138 HB2 HIS 153 1HB HIS 153 -20.110 -12.868 -17.562 1139 HB3 HIS 153 2HB HIS 153 -20.229 -14.312 -18.561 1140 H HIS 154 H HIS 154 -20.689 -13.916 -21.044 1141 HA HIS 154 HA HIS 154 -22.020 -11.475 -21.943 1142 HD1 HIS 154 HD1 HIS 154 -21.875 -11.228 -25.061 1143 HD2 HIS 154 HD2 HIS 154 -19.358 -14.213 -23.614 1144 HE1 HIS 154 HE1 HIS 154 -19.709 -10.966 -26.316 1145 HE2 HIS 154 HE2 HIS 154 -18.240 -12.851 -25.518 1146 HB2 HIS 154 1HB HIS 154 -22.090 -14.318 -22.961 1147 HB3 HIS 154 2HB HIS 154 -23.073 -13.023 -23.635 1148 H HIS 155 H HIS 155 -22.454 -12.685 -19.288 1149 HA HIS 155 HA HIS 155 -25.387 -12.751 -19.444 1150 HD1 HIS 155 HD1 HIS 155 -27.046 -15.548 -18.235 1151 HD2 HIS 155 HD2 HIS 155 -23.485 -15.930 -20.345 1152 HE1 HIS 155 HE1 HIS 155 -27.439 -17.395 -19.897 1153 HE2 HIS 155 HE2 HIS 155 -25.201 -17.752 -21.003 1154 HB2 HIS 155 1HB HIS 155 -23.575 -14.511 -17.807 1155 HB3 HIS 155 2HB HIS 155 -25.212 -14.158 -17.268 1156 H HIS 156 H HIS 156 -25.922 -10.791 -18.740 1157 HA HIS 156 HA HIS 156 -24.204 -9.355 -16.923 1158 HD1 HIS 156 HD1 HIS 156 -25.365 -6.332 -16.025 1159 HD2 HIS 156 HD2 HIS 156 -23.840 -7.154 -19.806 1160 HE1 HIS 156 HE1 HIS 156 -23.727 -4.486 -16.514 1161 HE2 HIS 156 HE2 HIS 156 -23.020 -4.870 -18.904 1162 HB2 HIS 156 1HB HIS 156 -25.980 -8.637 -18.951 1163 HB3 HIS 156 2HB HIS 156 -26.751 -8.074 -17.472 1164 H HIS 157 H HIS 157 -24.345 -10.394 -14.946 1165 HA HIS 157 HA HIS 157 -26.767 -9.784 -13.434 1166 HD1 HIS 157 HD1 HIS 157 -29.152 -11.780 -13.024 1167 HD2 HIS 157 HD2 HIS 157 -26.632 -13.073 -16.071 1168 HE1 HIS 157 HE1 HIS 157 -30.668 -12.613 -14.855 1169 HE2 HIS 157 HE2 HIS 157 -29.117 -13.509 -16.633 1170 HB2 HIS 157 1HB HIS 157 -25.525 -12.541 -13.565 1171 HB3 HIS 157 2HB HIS 157 -26.665 -12.043 -12.322 1172 H HIS 158 H HIS 158 -26.318 -9.049 -11.444 1173 HA HIS 158 HA HIS 158 -23.518 -9.161 -10.582 1174 HD1 HIS 158 HD1 HIS 158 -26.222 -6.120 -11.976 1175 HD2 HIS 158 HD2 HIS 158 -26.850 -7.216 -8.020 1176 HE1 HIS 158 HE1 HIS 158 -28.566 -5.398 -11.439 1177 HE2 HIS 158 HE2 HIS 158 -28.988 -6.261 -9.107 1178 HB2 HIS 158 1HB HIS 158 -24.193 -7.199 -9.085 1179 HB3 HIS 158 2HB HIS 158 -24.102 -6.888 -10.812