#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2occ h PHE 2 N 0.00 1.10 0.36 2.03 3.57 -2.03 -2.13 116.94 119.85 2occ h PHE 2 Ca 0.00 -0.30 -0.02 0.00 3.53 0.00 0.00 57.97 61.18 2occ h PHE 2 Cb 0.00 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.50 2occ h PHE 2 CO 0.00 1.12 -0.17 0.82 -2.23 0.00 0.00 178.31 177.84 2occ h ILE 3 N 0.79 0.63 -0.75 1.41 5.03 -2.00 0.26 117.51 122.89 2occ h ILE 3 Ca 0.08 -0.41 0.13 0.00 -0.12 0.00 0.00 64.86 64.54 2occ h ILE 3 Cb 0.88 0.84 -0.05 0.00 -3.03 0.00 0.00 36.82 35.46 2occ h ILE 3 CO 0.08 0.08 0.50 0.78 -0.68 0.00 0.00 178.15 178.90 2occ h ASN 4 N -0.73 0.49 0.02 1.72 4.21 -1.94 0.20 115.58 119.55 2occ h ASN 4 Ca -0.05 0.02 -0.13 0.00 1.21 0.00 0.00 56.30 57.35 2occ h ASN 4 Cb 0.50 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.61 2occ h ASN 4 CO 0.08 0.27 -0.69 -0.09 -1.29 0.00 0.00 177.43 175.71 2occ h ARG 5 N 0.53 0.04 0.00 0.81 2.43 -1.25 -3.27 114.38 113.66 2occ h ARG 5 Ca 0.36 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2occ h ARG 5 Cb 0.67 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 2occ h ARG 5 CO -0.13 1.03 -1.35 0.91 -1.51 0.00 0.00 179.97 178.92 2occ n TRP 6 N -4.45 0.61 -0.03 2.20 7.02 0.91 -3.54 117.44 120.16 2occ n TRP 6 Ca -0.21 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.45 2occ n TRP 6 Cb 0.62 -0.78 -0.10 0.00 -2.42 0.00 0.00 31.31 28.63 2occ n TRP 6 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2occ n LEU 7 N -2.50 0.00 -0.58 -0.99 4.77 0.63 -4.61 117.00 113.72 2occ n LEU 7 Ca -0.01 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.02 2occ n LEU 7 Cb 0.55 0.14 0.19 0.00 -2.33 0.00 0.00 43.42 41.98 2occ n LEU 7 CO 0.42 0.14 0.57 0.49 -1.33 0.00 0.00 177.39 177.68 2occ n PHE 8 N -2.19 0.40 -1.64 -1.77 3.72 -0.71 -5.02 117.46 110.25 2occ n PHE 8 Ca -0.11 -1.23 -0.38 0.00 -0.05 0.00 0.00 57.45 55.68 2occ n PHE 8 Cb 0.60 -0.28 0.05 0.00 -0.94 0.00 0.00 39.48 38.92 2occ n PHE 8 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2occ n SER 9 N -1.12 1.16 -1.46 4.37 2.88 -1.23 -4.87 113.62 113.35 2occ n SER 9 Ca 0.21 0.85 0.04 0.00 -1.33 0.00 0.00 58.87 58.64 2occ n SER 9 Cb 0.78 -1.42 0.02 0.00 -0.75 0.00 0.00 64.21 62.84 2occ n SER 9 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2occ n THR 10 N -1.53 0.04 -4.35 2.46 -2.24 -1.26 -4.68 114.28 102.72 2occ n THR 10 Ca 0.13 -1.01 -0.33 0.00 -2.27 0.00 0.00 64.05 60.57 2occ n THR 10 Cb 0.46 0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 69.50 2occ n THR 10 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2occ s ASN 11 N -1.99 3.52 0.41 3.42 3.84 -1.26 -4.85 114.94 118.03 2occ s ASN 11 Ca 0.33 -0.53 0.14 0.00 0.21 0.00 0.00 52.86 53.02 2occ s ASN 11 Cb 0.38 -1.55 1.00 0.00 -0.55 0.00 0.00 41.25 40.53 2occ s ASN 11 CO -0.16 0.05 1.90 1.12 -2.79 0.00 0.00 177.10 177.21 2occ h HIS 12 N 7.60 0.57 -0.01 0.43 2.07 -1.92 -0.96 115.15 122.93 2occ h HIS 12 Ca -0.38 0.02 -0.01 0.00 -2.85 0.00 0.00 60.37 57.15 2occ h HIS 12 Cb 1.17 -0.18 0.00 0.00 2.57 0.00 0.00 27.41 30.97 2occ h HIS 12 CO 0.50 0.21 -0.04 0.87 -3.07 0.00 0.00 177.93 176.40 2occ h LYS 13 N 0.48 0.05 -0.80 5.12 1.57 -1.90 -1.34 116.57 119.75 2occ h LYS 13 Ca 0.40 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 59.12 2occ h LYS 13 Cb 0.87 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.15 2occ h LYS 13 CO -0.15 0.63 0.38 -0.44 -0.57 0.00 0.00 179.45 179.31 2occ h ASP 14 N -0.53 1.05 -0.57 0.86 3.32 -1.80 -0.60 116.42 118.16 2occ h ASP 14 Ca -0.00 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.82 2occ h ASP 14 Cb 0.63 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2occ h ASP 14 CO 0.01 0.89 -0.06 0.40 -1.72 0.00 0.00 179.24 178.76 2occ h ILE 15 N 1.15 1.27 -0.72 0.35 2.04 -1.23 -1.13 117.51 119.22 2occ h ILE 15 Ca 0.28 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 2occ h ILE 15 Cb 0.12 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 2occ h ILE 15 CO -0.03 0.44 0.41 1.23 0.00 0.00 0.00 178.15 180.19 2occ h GLY 16 N 0.96 1.06 1.08 5.37 0.00 -0.47 -1.60 103.07 109.48 2occ h GLY 16 Ca 0.16 -0.46 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 2occ h GLY 16 CO 0.04 0.44 -0.18 -0.84 0.00 0.00 0.00 176.54 176.00 2occ h THR 17 N 1.00 1.27 -0.62 4.70 2.02 -0.65 -1.90 112.91 118.74 2occ h THR 17 Ca 0.26 -1.33 0.03 0.00 0.77 0.00 0.00 66.41 66.13 2occ h THR 17 Cb 0.00 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 2occ h THR 17 CO -0.04 0.46 0.37 -0.07 0.37 0.00 0.00 175.52 176.61 2occ h LEU 18 N 0.82 0.60 -0.32 2.58 4.07 -0.60 -0.92 115.31 121.55 2occ h LEU 18 Ca 0.11 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.07 2occ h LEU 18 Cb 0.75 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 2occ h LEU 18 CO 0.06 0.42 0.18 1.88 -1.08 0.00 0.00 178.44 179.89 2occ h TYR 19 N 0.73 0.43 -0.58 1.13 0.05 -1.08 0.74 116.97 118.40 2occ h TYR 19 Ca 0.25 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 59.00 2occ h TYR 19 Cb 0.04 -0.14 -0.03 0.00 1.01 0.00 0.00 36.73 37.61 2occ h TYR 19 CO -0.06 0.35 0.26 -0.07 -1.05 0.00 0.00 178.16 177.59 2occ h LEU 20 N 0.39 0.74 -0.21 3.88 3.38 -0.87 0.28 115.31 122.90 2occ h LEU 20 Ca 0.11 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2occ h LEU 20 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2occ h LEU 20 CO -0.02 0.64 -0.01 -0.07 0.09 0.00 0.00 178.44 179.07 2occ h LEU 21 N 0.82 0.38 0.02 1.67 3.38 -0.70 -1.00 115.31 119.87 2occ h LEU 21 Ca 0.20 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2occ h LEU 21 Cb 0.11 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2occ h LEU 21 CO -0.02 0.61 -0.02 0.15 0.09 0.00 0.00 178.44 179.25 2occ h PHE 22 N 0.13 -0.05 -0.70 1.13 3.04 -0.36 -2.53 116.94 117.60 2occ h PHE 22 Ca 0.06 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.01 2occ h PHE 22 Cb 0.43 0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.92 2occ h PHE 22 CO 0.04 -0.03 0.44 0.78 -2.02 0.00 0.00 178.31 177.51 2occ h GLY 23 N -0.04 1.00 0.94 2.40 0.00 -0.95 -0.60 103.07 105.81 2occ h GLY 23 Ca 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 2occ h GLY 23 CO -0.01 0.38 0.17 0.00 0.00 0.00 0.00 176.54 177.08 2occ h ALA 24 N 1.53 0.49 0.04 3.60 0.00 -0.97 -1.23 119.26 122.72 2occ h ALA 24 Ca 0.25 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2occ h ALA 24 Cb -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2occ h ALA 24 CO -0.05 0.07 -0.02 2.35 0.00 0.00 0.00 179.25 181.60 2occ h TRP 25 N 0.47 -0.05 -0.58 0.00 7.01 -1.01 -2.13 115.95 119.66 2occ h TRP 25 Ca 0.13 -0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.24 2occ h TRP 25 Cb 0.15 0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.20 2occ h TRP 25 CO -0.01 0.08 0.39 0.00 -2.79 0.00 0.00 178.44 176.11 2occ h ALA 26 N 0.79 2.11 0.00 2.65 0.00 -1.06 0.60 119.26 124.36 2occ h ALA 26 Ca -0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2occ h ALA 26 Cb 0.15 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2occ h ALA 26 CO 0.01 -0.25 -0.24 0.78 0.00 0.00 0.00 179.25 179.55 2occ h GLY 27 N 0.32 0.00 0.86 0.00 0.00 -0.54 0.18 103.07 103.88 2occ h GLY 27 Ca 0.27 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.46 2occ h GLY 27 CO -0.07 0.00 -0.49 -0.33 0.00 0.00 0.00 176.54 175.65 2occ h MET 28 N 0.00 0.50 -0.21 4.80 2.07 -0.64 -0.86 114.93 120.59 2occ h MET 28 Ca -0.00 -0.41 0.02 0.00 -2.07 0.00 0.00 59.70 57.24 2occ h MET 28 Cb 0.46 0.09 -0.02 0.00 -1.87 0.00 0.00 31.60 30.25 2occ h MET 28 CO 0.03 1.04 0.08 0.28 1.07 0.00 0.00 176.91 179.41 2occ h VAL 29 N 0.08 0.96 -0.30 -2.22 2.07 -1.12 0.12 116.25 115.84 2occ h VAL 29 Ca -0.03 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 2occ h VAL 29 Cb 1.14 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 2occ h VAL 29 CO 0.10 0.03 0.05 1.23 0.02 0.00 0.00 177.57 179.01 2occ h GLY 30 N 0.18 0.47 1.17 2.17 0.00 -0.67 -1.35 103.07 105.05 2occ h GLY 30 Ca 0.09 -0.24 -0.19 0.00 0.00 0.00 0.00 47.33 46.99 2occ h GLY 30 CO -0.08 0.23 -0.55 -0.84 0.00 0.00 0.00 176.54 175.30 2occ h THR 31 N 0.43 1.27 -0.52 4.70 2.02 -0.29 -1.74 112.91 118.79 2occ h THR 31 Ca 0.10 -1.73 -0.01 0.00 0.77 0.00 0.00 66.41 65.54 2occ h THR 31 Cb 0.20 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2occ h THR 31 CO -0.00 0.56 0.28 0.00 0.37 0.00 0.00 175.52 176.74 2occ h ALA 32 N 0.70 0.67 -0.86 6.16 0.00 -0.33 -2.03 119.26 123.57 2occ h ALA 32 Ca 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2occ h ALA 32 Cb 1.15 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 2occ h ALA 32 CO 0.12 0.19 0.47 -0.07 0.00 0.00 0.00 179.25 179.97 2occ h LEU 33 N 0.70 1.07 -1.47 0.00 3.38 -1.18 -1.01 115.31 116.80 2occ h LEU 33 Ca 0.18 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2occ h LEU 33 Cb 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2occ h LEU 33 CO -0.03 0.86 -0.25 0.77 0.09 0.00 0.00 178.44 179.88 2occ h SER 34 N 1.20 0.00 0.68 -0.43 4.64 -0.75 -2.33 113.55 116.57 2occ h SER 34 Ca 0.30 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.36 2occ h SER 34 Cb 0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 2occ h SER 34 CO -0.05 0.25 -1.25 -0.07 -0.87 0.00 0.00 176.83 174.85 2occ h LEU 35 N 0.00 0.32 -1.34 5.97 3.38 -0.67 -2.73 115.31 120.25 2occ h LEU 35 Ca -0.00 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 2occ h LEU 35 Cb 0.56 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2occ h LEU 35 CO 0.03 1.29 0.03 -0.07 0.09 0.00 0.00 178.44 179.81 2occ h LEU 36 N 0.06 0.43 0.22 1.67 3.38 -0.90 0.11 115.31 120.27 2occ h LEU 36 Ca -0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2occ h LEU 36 Cb 1.94 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.58 2occ h LEU 36 CO 0.18 0.48 -0.11 0.40 0.09 0.00 0.00 178.44 179.48 2occ h ILE 37 N 0.45 0.86 0.00 1.22 2.04 -1.42 -2.49 117.51 118.17 2occ h ILE 37 Ca 0.10 -0.50 -0.05 0.00 1.00 0.00 0.00 64.86 65.41 2occ h ILE 37 Cb 0.26 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2occ h ILE 37 CO 0.00 0.11 -0.24 0.03 0.00 0.00 0.00 178.15 178.06 2occ h ARG 38 N -0.55 0.00 -0.14 2.37 2.47 -1.24 -2.78 114.38 114.51 2occ h ARG 38 Ca -0.03 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.67 2occ h ARG 38 Cb 0.41 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 2occ h ARG 38 CO 0.05 0.24 0.00 0.00 0.56 0.00 0.00 179.97 180.82 2occ h ALA 39 N 1.76 0.19 -0.82 0.04 0.00 -0.70 0.09 119.26 119.83 2occ h ALA 39 Ca -0.00 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2occ h ALA 39 Cb 0.67 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 2occ h ALA 39 CO 0.03 -0.11 0.53 1.49 0.00 0.00 0.00 179.25 181.20 2occ h GLU 40 N -0.01 0.88 -0.02 0.00 4.57 -1.27 -2.68 114.58 116.05 2occ h GLU 40 Ca 0.04 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2occ h GLU 40 Cb 0.37 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 2occ h GLU 40 CO 0.01 0.58 -0.23 1.28 -1.18 0.00 0.00 179.01 179.47 2occ n LEU 41 N -4.48 1.78 0.00 1.64 4.77 -1.07 -4.37 117.00 115.28 2occ n LEU 41 Ca 0.12 -0.59 0.10 0.00 -0.03 0.00 0.00 56.01 55.60 2occ n LEU 41 Cb 0.21 -0.04 0.44 0.00 -2.33 0.00 0.00 43.42 41.70 2occ n LEU 41 CO 0.33 0.32 0.81 0.61 -1.33 0.00 0.00 177.39 178.13 2occ n GLY 42 N 1.34 -1.10 3.39 -0.72 0.00 0.01 -4.48 105.19 103.62 2occ n GLY 42 Ca 0.13 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2occ n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2occ s GLN 43 N -2.87 0.54 0.63 1.61 0.74 -1.26 -4.50 119.66 114.55 2occ s GLN 43 Ca 0.12 0.81 -0.18 0.00 0.05 0.00 0.00 55.36 56.16 2occ s GLN 43 Cb 0.13 0.16 -0.04 0.00 1.10 0.00 0.00 33.01 34.36 2occ s GLN 43 CO 0.34 -0.11 0.94 -2.30 -0.55 0.00 0.00 175.29 173.61 2occ n PRO 44 N 3.51 0.79 0.00 1.67 -0.02 -1.26 -4.72 135.00 134.96 2occ n PRO 44 Ca -0.18 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2occ n PRO 44 Cb 0.56 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 2occ n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2occ n GLY 45 N 1.29 -0.83 3.15 -1.23 0.00 -1.26 -5.00 105.19 101.31 2occ n GLY 45 Ca 0.14 -2.16 -0.27 0.00 0.00 0.00 0.00 46.02 43.73 2occ n GLY 45 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2occ s THR 46 N 0.00 1.53 -0.20 2.61 -4.23 -1.26 -4.66 115.64 109.43 2occ s THR 46 Ca 0.00 -0.77 -0.12 0.00 -1.18 0.00 0.00 61.69 59.62 2occ s THR 46 Cb 0.00 -1.31 -0.08 0.00 1.34 0.00 0.00 72.50 72.45 2occ s THR 46 CO 0.00 0.44 -0.29 -0.11 -0.54 0.00 0.00 174.62 174.12 2occ n LEU 47 N 3.15 1.64 0.02 4.79 7.94 -1.26 -4.82 117.00 128.46 2occ n LEU 47 Ca -0.18 0.28 -0.19 0.00 -1.11 0.00 0.00 56.01 54.81 2occ n LEU 47 Cb 0.53 -0.66 -0.14 0.00 0.53 0.00 0.00 43.42 43.67 2occ n LEU 47 CO 0.25 0.21 0.10 -0.07 -1.11 0.00 0.00 177.39 176.77 2occ h LEU 48 N -0.81 0.37 0.00 -1.96 3.38 -1.96 -3.51 115.31 110.82 2occ h LEU 48 Ca -0.40 -0.96 0.00 0.00 0.09 0.00 0.00 57.88 56.61 2occ h LEU 48 Cb 1.29 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2occ h LEU 48 CO -0.24 1.32 0.00 0.61 0.09 0.00 0.00 178.44 180.22 2occ n GLY 49 N 1.66 0.13 3.64 0.83 0.00 -1.26 -5.04 105.19 105.15 2occ n GLY 49 Ca -0.14 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.45 2occ n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2occ s ASP 50 N -4.00 2.10 0.30 1.61 1.47 -1.26 -4.81 116.67 112.08 2occ s ASP 50 Ca 0.00 1.08 0.17 0.00 1.18 0.00 0.00 52.55 54.98 2occ s ASP 50 Cb 0.00 -1.68 0.93 0.00 -0.34 0.00 0.00 42.92 41.83 2occ s ASP 50 CO 0.00 -3.44 1.48 0.47 0.68 0.00 0.00 175.17 174.36 2occ n ASP 51 N -4.37 0.45 0.16 2.11 8.00 -1.26 -2.30 116.55 119.33 2occ n ASP 51 Ca 0.06 0.67 -0.10 0.00 0.71 0.00 0.00 54.79 56.13 2occ n ASP 51 Cb 0.58 -0.69 -0.06 0.00 -0.02 0.00 0.00 41.12 40.93 2occ n ASP 51 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2occ h GLN 52 N 0.00 -0.45 0.00 -1.24 5.75 -1.94 0.22 115.11 117.46 2occ h GLN 52 Ca 0.00 0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.49 2occ h GLN 52 Cb 0.23 0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 2occ h GLN 52 CO 0.00 -0.17 -0.20 0.97 -2.65 0.00 0.00 178.83 176.78 2occ h ILE 53 N -1.02 1.10 0.10 2.39 6.09 -1.82 -0.66 117.51 123.69 2occ h ILE 53 Ca -0.05 -0.69 -0.00 0.00 -1.37 0.00 0.00 64.86 62.74 2occ h ILE 53 Cb 0.48 1.38 0.00 0.00 0.47 0.00 0.00 36.82 39.15 2occ h ILE 53 CO 0.08 0.20 -0.05 0.22 -3.07 0.00 0.00 178.15 175.53 2occ h TYR 54 N 0.00 -0.12 0.00 2.19 3.20 -1.46 -2.82 116.97 117.95 2occ h TYR 54 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2occ h TYR 54 Cb 0.36 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.67 2occ h TYR 54 CO 0.00 0.27 0.00 -0.91 -1.64 0.00 0.00 178.16 175.88 2occ h ASN 55 N -0.55 0.00 -0.27 -2.11 2.35 -0.21 0.10 115.58 114.90 2occ h ASN 55 Ca -0.01 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.58 2occ h ASN 55 Cb 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 2occ h ASN 55 CO 0.02 0.00 -0.40 0.58 -1.65 0.00 0.00 177.43 175.99 2occ h VAL 56 N 0.00 1.28 -0.19 2.81 2.07 -1.09 -0.70 116.25 120.44 2occ h VAL 56 Ca 0.00 -1.57 -0.07 0.00 0.82 0.00 0.00 66.70 65.88 2occ h VAL 56 Cb 0.47 1.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2occ h VAL 56 CO 0.00 0.52 -0.17 0.58 0.02 0.00 0.00 177.57 178.52 2occ h VAL 57 N 0.67 1.33 -0.73 2.57 2.07 -0.64 -2.15 116.25 119.36 2occ h VAL 57 Ca 0.05 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.23 2occ h VAL 57 Cb 0.96 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.45 2occ h VAL 57 CO 0.09 0.40 0.32 0.58 0.02 0.00 0.00 177.57 178.98 2occ h VAL 58 N 0.13 1.24 -0.19 2.57 2.07 -0.88 -1.59 116.25 119.60 2occ h VAL 58 Ca 0.03 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 2occ h VAL 58 Cb 0.70 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2occ h VAL 58 CO 0.04 0.29 -0.04 0.74 0.02 0.00 0.00 177.57 178.63 2occ h THR 59 N 1.05 1.28 -0.06 2.57 2.02 -1.02 -2.78 112.91 115.97 2occ h THR 59 Ca 0.25 -1.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.35 2occ h THR 59 Cb 0.15 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2occ h THR 59 CO -0.03 0.30 -0.34 0.00 0.37 0.00 0.00 175.52 175.82 2occ h ALA 60 N 0.74 1.33 -0.27 6.16 0.00 -1.30 -2.41 119.26 123.50 2occ h ALA 60 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2occ h ALA 60 Cb 0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2occ h ALA 60 CO 0.02 0.48 0.18 1.25 0.00 0.00 0.00 179.25 181.18 2occ h HIS 61 N 0.09 0.34 -0.00 0.00 6.17 -1.11 -1.39 115.15 119.25 2occ h HIS 61 Ca 0.01 0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.10 2occ h HIS 61 Cb 0.66 -0.12 -0.00 0.00 2.52 0.00 0.00 27.41 30.47 2occ h HIS 61 CO 0.00 0.22 0.00 0.00 0.71 0.00 0.00 177.93 178.87 2occ h ALA 62 N 1.09 0.01 -0.76 5.26 0.00 -1.21 -2.37 119.26 121.28 2occ h ALA 62 Ca 0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2occ h ALA 62 Cb -0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2occ h ALA 62 CO -0.02 -0.45 0.28 0.74 0.00 0.00 0.00 179.25 179.79 2occ h PHE 63 N -0.08 1.18 -0.01 0.00 0.04 -1.33 -1.90 116.94 114.83 2occ h PHE 63 Ca 0.00 -0.10 -0.00 0.00 2.80 0.00 0.00 57.97 60.67 2occ h PHE 63 Cb 0.08 -0.35 -0.00 0.00 2.20 0.00 0.00 35.95 37.88 2occ h PHE 63 CO -0.05 0.91 0.00 0.28 -0.60 0.00 0.00 178.31 178.85 2occ h VAL 64 N 1.11 1.20 -0.68 -0.55 2.07 -1.24 0.04 116.25 118.20 2occ h VAL 64 Ca 0.25 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 2occ h VAL 64 Cb 0.25 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 2occ h VAL 64 CO -0.02 0.16 0.22 0.24 0.02 0.00 0.00 177.57 178.19 2occ h MET 65 N -0.23 1.03 0.00 1.57 2.86 -1.39 -0.29 114.93 118.48 2occ h MET 65 Ca 0.00 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 2occ h MET 65 Cb 0.25 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 2occ h MET 65 CO 0.00 0.88 -0.14 0.82 1.06 0.00 0.00 176.91 179.53 2occ h ILE 66 N 1.00 0.17 0.00 -1.22 2.04 -1.30 -0.85 117.51 117.34 2occ h ILE 66 Ca 0.22 -1.14 -0.17 0.00 1.00 0.00 0.00 64.86 64.78 2occ h ILE 66 Cb 0.27 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2occ h ILE 66 CO -0.01 0.06 -0.83 -0.26 0.00 0.00 0.00 178.15 177.10 2occ h PHE 67 N -1.00 0.00 0.00 1.37 -1.00 -1.11 -2.90 116.94 112.30 2occ h PHE 67 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2occ h PHE 67 Cb 0.22 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.78 2occ h PHE 67 CO -0.02 0.77 -0.85 1.19 -1.61 0.00 0.00 178.31 177.78 2occ n PHE 68 N -3.26 0.00 0.00 -0.55 3.72 -0.60 -4.31 117.46 112.45 2occ n PHE 68 Ca -0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2occ n PHE 68 Cb 0.85 -0.07 -0.00 0.00 -0.94 0.00 0.00 39.48 39.32 2occ n PHE 68 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 2occ n MET 69 N -1.46 0.00 -0.09 -1.08 1.56 -0.22 -4.19 117.12 111.64 2occ n MET 69 Ca 0.01 0.00 -0.08 0.00 -0.27 0.00 0.00 57.70 57.37 2occ n MET 69 Cb 0.24 -0.13 0.00 0.00 2.15 0.00 0.00 33.22 35.48 2occ n MET 69 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2occ h VAL 70 N -0.00 0.97 -0.19 1.12 2.07 -1.25 -2.56 116.25 116.41 2occ h VAL 70 Ca 0.00 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 2occ h VAL 70 Cb 0.00 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2occ h VAL 70 CO 0.00 0.06 -0.15 0.24 0.02 0.00 0.00 177.57 177.74 2occ h MET 71 N 0.32 0.44 -0.83 1.57 2.07 -1.75 -1.60 114.93 115.15 2occ h MET 71 Ca 0.14 -0.22 -0.01 0.00 -2.07 0.00 0.00 59.70 57.54 2occ h MET 71 Cb 0.06 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 29.75 2occ h MET 71 CO -0.10 0.77 0.48 -1.35 1.07 0.00 0.00 176.91 177.78 2occ h PRO 72 N 0.11 1.14 0.57 -0.22 0.11 -1.74 -1.36 132.00 130.61 2occ h PRO 72 Ca 0.04 -0.12 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 2occ h PRO 72 Cb 0.67 -0.23 0.01 0.00 0.11 0.00 0.00 31.00 31.56 2occ h PRO 72 CO 0.04 0.82 -0.27 0.82 -0.21 0.00 0.00 178.00 179.20 2occ h ILE 73 N 1.14 0.08 -0.19 4.15 2.04 -1.47 0.72 117.51 123.98 2occ h ILE 73 Ca 0.29 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2occ h ILE 73 Cb -0.01 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 2occ h ILE 73 CO -0.05 0.02 0.10 0.24 0.00 0.00 0.00 178.15 178.45 2occ h MET 74 N -1.17 0.27 0.00 2.37 2.86 -1.35 -0.48 114.93 117.43 2occ h MET 74 Ca -0.08 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.43 2occ h MET 74 Cb 0.61 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2occ h MET 74 CO 0.13 0.28 -0.81 -0.89 1.06 0.00 0.00 176.91 176.67 2occ n ILE 75 N -4.89 1.46 0.06 -1.22 5.41 -0.52 -2.87 119.36 116.79 2occ n ILE 75 Ca -0.04 0.12 -0.05 0.00 1.00 0.00 0.00 62.75 63.78 2occ n ILE 75 Cb 0.08 -2.25 0.13 0.00 -0.71 0.00 0.00 39.64 36.89 2occ n ILE 75 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2occ h GLY 76 N -1.00 0.35 0.00 7.39 0.00 -1.17 -2.04 103.07 106.61 2occ h GLY 76 Ca -0.14 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2occ h GLY 76 CO -0.09 0.36 0.00 0.61 0.00 0.00 0.00 176.54 177.42 2occ n GLY 77 N 0.14 1.68 0.27 4.60 0.00 0.24 -3.17 105.19 108.95 2occ n GLY 77 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 2occ n GLY 77 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2occ h PHE 78 N 0.00 0.00 0.63 1.61 0.04 -1.20 -2.08 116.94 115.94 2occ h PHE 78 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2occ h PHE 78 Cb 0.00 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.16 2occ h PHE 78 CO 0.00 0.00 -0.30 0.78 -0.60 0.00 0.00 178.31 178.19 2occ h GLY 79 N 0.00 -0.89 1.38 -1.45 0.00 -1.22 -1.04 103.07 99.86 2occ h GLY 79 Ca 0.01 0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.57 2occ h GLY 79 CO -0.00 -0.32 -0.15 3.43 0.00 0.00 0.00 176.54 179.50 2occ h ASN 80 N -0.94 0.72 0.37 0.19 2.35 -1.48 -1.29 115.58 115.50 2occ h ASN 80 Ca -0.09 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.42 2occ h ASN 80 Cb 0.68 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.86 2occ h ASN 80 CO 0.14 0.88 -0.18 -0.50 -1.65 0.00 0.00 177.43 176.12 2occ h TRP 81 N 0.65 -0.47 0.11 1.19 4.06 -1.37 -3.40 115.95 116.73 2occ h TRP 81 Ca 0.11 -0.01 -0.30 0.00 2.06 0.00 0.00 58.89 60.75 2occ h TRP 81 Cb 0.62 0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.92 2occ h TRP 81 CO 0.03 -0.15 -1.48 -0.07 -3.56 0.00 0.00 178.44 173.21 2occ h LEU 82 N -0.79 0.35 -0.08 -4.49 3.38 -1.23 -3.38 115.31 109.08 2occ h LEU 82 Ca -0.05 -0.47 0.04 0.00 0.09 0.00 0.00 57.88 57.48 2occ h LEU 82 Cb 0.52 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.11 2occ h LEU 82 CO 0.08 1.39 -0.22 0.58 0.09 0.00 0.00 178.44 180.36 2occ h VAL 83 N 0.06 0.46 -0.72 1.22 2.07 -1.39 -0.43 116.25 117.53 2occ h VAL 83 Ca -0.22 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 2occ h VAL 83 Cb 2.00 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.20 2occ h VAL 83 CO 0.16 0.00 0.27 -0.65 0.02 0.00 0.00 177.57 177.37 2occ h PRO 84 N -0.31 1.09 -0.18 1.57 0.11 -1.79 -2.14 132.00 130.35 2occ h PRO 84 Ca 0.08 -0.20 -0.03 0.00 0.11 0.00 0.00 66.00 65.96 2occ h PRO 84 Cb 0.43 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2occ h PRO 84 CO -0.26 0.90 -0.02 -0.07 -0.21 0.00 0.00 178.00 178.34 2occ h LEU 85 N 1.06 0.23 0.00 2.35 3.38 -1.64 -0.79 115.31 119.90 2occ h LEU 85 Ca 0.24 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2occ h LEU 85 Cb 0.23 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2occ h LEU 85 CO -0.02 0.30 -0.10 0.24 0.09 0.00 0.00 178.44 178.96 2occ h MET 86 N 0.25 0.00 -0.19 1.13 2.86 -0.43 -3.31 114.93 115.24 2occ h MET 86 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2occ h MET 86 Cb 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 2occ h MET 86 CO 0.01 0.00 0.00 0.44 1.06 0.00 0.00 176.91 178.42 2occ n ILE 87 N -3.04 0.80 -2.37 -1.22 -5.35 -0.92 -4.79 119.36 102.47 2occ n ILE 87 Ca 0.04 -0.90 -0.09 0.00 -0.27 0.00 0.00 62.75 61.53 2occ n ILE 87 Cb 0.53 0.63 0.01 0.00 -1.74 0.00 0.00 39.64 39.07 2occ n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2occ n GLY 88 N 0.24 0.11 3.89 3.28 0.00 -0.39 -4.02 105.19 108.30 2occ n GLY 88 Ca 0.07 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 2occ n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s ALA 89 N -2.62 3.91 0.40 4.61 0.00 -0.66 -4.57 121.76 122.83 2occ s ALA 89 Ca 0.06 -0.77 0.11 0.00 0.00 0.00 0.00 51.96 51.37 2occ s ALA 89 Cb -0.03 -1.85 0.82 0.00 0.00 0.00 0.00 23.12 22.06 2occ s ALA 89 CO 0.08 0.73 1.91 -1.00 0.00 0.00 0.00 175.76 177.49 2occ h PRO 90 N 3.95 0.13 0.00 0.00 0.13 -1.78 -3.42 132.00 131.02 2occ h PRO 90 Ca -0.49 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2occ h PRO 90 Cb 1.19 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2occ h PRO 90 CO 0.67 0.33 0.00 -3.47 -0.23 0.00 0.00 178.00 175.30 2occ n ASP 91 N -4.25 0.00 -4.90 1.44 -0.08 -1.26 -4.57 116.55 102.92 2occ n ASP 91 Ca -0.01 -0.75 -0.29 0.00 -1.51 0.00 0.00 54.79 52.23 2occ n ASP 91 Cb 0.29 0.00 0.08 0.00 2.34 0.00 0.00 41.12 43.83 2occ n ASP 91 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 2occ s MET 92 N -1.24 2.14 0.18 -0.67 -1.94 -1.26 -4.91 119.30 111.59 2occ s MET 92 Ca 0.00 0.09 -0.07 0.00 -1.71 0.00 0.00 55.69 54.00 2occ s MET 92 Cb 0.00 -2.00 0.07 0.00 2.01 0.00 0.00 34.83 34.91 2occ s MET 92 CO 0.00 -1.45 1.54 0.00 -0.01 0.00 0.00 175.02 175.10 2occ h ALA 93 N -0.91 0.70 -2.91 3.03 0.00 -1.93 -3.36 119.26 113.89 2occ h ALA 93 Ca -0.46 -0.44 -0.61 0.00 0.00 0.00 0.00 54.91 53.41 2occ h ALA 93 Cb 1.32 -0.13 -0.41 0.00 0.00 0.00 0.00 17.79 18.57 2occ h ALA 93 CO 0.65 0.66 -0.70 -0.06 0.00 0.00 0.00 179.25 179.80 2occ s PHE 94 N -4.40 2.73 0.38 0.00 0.08 -1.26 -4.96 117.98 110.56 2occ s PHE 94 Ca -0.10 -2.97 0.05 0.00 0.12 0.00 0.00 56.93 54.04 2occ s PHE 94 Cb 0.12 -2.17 0.75 0.00 -0.57 0.00 0.00 43.02 41.15 2occ s PHE 94 CO 0.86 -0.66 2.00 -1.35 -0.10 0.00 0.00 175.22 175.97 2occ h PRO 95 N 5.69 0.60 -0.01 0.24 0.11 -1.89 -0.82 132.00 135.91 2occ h PRO 95 Ca 0.14 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 2occ h PRO 95 Cb 0.82 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.82 2occ h PRO 95 CO 0.60 0.45 -0.40 -0.09 -0.21 0.00 0.00 178.00 178.35 2occ h ARG 96 N 0.61 0.29 -0.07 1.05 2.43 -1.88 -2.74 114.38 114.07 2occ h ARG 96 Ca 0.16 -0.30 -0.04 0.00 -0.81 0.00 0.00 59.98 58.99 2occ h ARG 96 Cb 0.03 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2occ h ARG 96 CO -0.03 0.99 -0.13 1.98 -1.51 0.00 0.00 179.97 181.27 2occ h MET 97 N -0.29 0.11 -0.79 0.20 4.05 -1.92 -0.68 114.93 115.62 2occ h MET 97 Ca -0.05 -0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.31 2occ h MET 97 Cb 1.12 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.87 2occ h MET 97 CO 0.08 0.25 0.33 -0.97 0.23 0.00 0.00 176.91 176.84 2occ h ASN 98 N 0.11 1.08 -0.06 1.39 -1.24 -1.11 -1.97 115.58 113.78 2occ h ASN 98 Ca 0.02 -0.16 -0.05 0.00 0.71 0.00 0.00 56.30 56.81 2occ h ASN 98 Cb 0.31 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 2occ h ASN 98 CO 0.02 0.95 -0.11 -1.13 -1.29 0.00 0.00 177.43 175.87 2occ h ASN 99 N 1.14 0.33 -0.35 1.15 -1.24 -0.81 -2.45 115.58 113.34 2occ h ASN 99 Ca 0.27 -0.07 -0.12 0.00 0.71 0.00 0.00 56.30 57.09 2occ h ASN 99 Cb 0.19 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.14 2occ h ASN 99 CO -0.02 0.47 -0.22 -0.03 -1.29 0.00 0.00 177.43 176.34 2occ h MET 100 N 0.33 0.85 -0.95 6.67 4.05 -1.10 -2.00 114.93 122.78 2occ h MET 100 Ca 0.07 -0.35 0.17 0.00 -0.28 0.00 0.00 59.70 59.30 2occ h MET 100 Cb 0.39 -0.04 -0.10 0.00 -0.80 0.00 0.00 31.60 31.06 2occ h MET 100 CO 0.02 0.98 0.55 0.77 0.23 0.00 0.00 176.91 179.46 2occ h SER 101 N 0.74 0.71 0.08 1.39 0.02 -0.93 -1.35 113.55 114.20 2occ h SER 101 Ca 0.10 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2occ h SER 101 Cb 0.75 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2occ h SER 101 CO 0.06 0.28 -0.04 0.15 -1.14 0.00 0.00 176.83 176.15 2occ h PHE 102 N 0.74 -0.10 0.00 3.45 3.57 -1.38 -3.29 116.94 119.93 2occ h PHE 102 Ca 0.53 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.03 2occ h PHE 102 Cb 0.76 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2occ h PHE 102 CO -0.04 0.40 0.00 0.91 -2.23 0.00 0.00 178.31 177.35 2occ n TRP 103 N -4.89 0.23 0.16 0.41 7.02 -0.79 -1.21 117.44 118.38 2occ n TRP 103 Ca -0.08 0.10 0.05 0.00 -1.02 0.00 0.00 57.50 56.55 2occ n TRP 103 Cb 0.27 -0.67 0.08 0.00 -2.42 0.00 0.00 31.31 28.57 2occ n TRP 103 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 2occ h LEU 104 N 0.00 0.00 0.07 -0.99 3.38 -1.34 -3.37 115.31 113.06 2occ h LEU 104 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2occ h LEU 104 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2occ h LEU 104 CO 0.00 0.38 -0.04 -0.07 0.09 0.00 0.00 178.44 178.81 2occ h LEU 105 N 0.00 -0.08 -0.32 1.67 4.07 -1.29 -1.53 115.31 117.82 2occ h LEU 105 Ca -0.00 -0.21 0.03 0.00 0.08 0.00 0.00 57.88 57.78 2occ h LEU 105 Cb 1.27 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 43.00 2occ h LEU 105 CO 0.05 0.16 0.13 -0.65 -1.08 0.00 0.00 178.44 177.06 2occ h PRO 106 N -0.33 0.28 -0.66 1.13 0.11 -1.72 -0.31 132.00 130.49 2occ h PRO 106 Ca -0.01 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.14 2occ h PRO 106 Cb 0.29 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 31.28 2occ h PRO 106 CO 0.02 0.18 0.37 -1.35 -0.21 0.00 0.00 178.00 177.01 2occ h PRO 107 N 0.28 0.66 -0.91 1.05 0.11 -1.73 -0.96 132.00 130.51 2occ h PRO 107 Ca 0.14 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 66.27 2occ h PRO 107 Cb 0.09 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 30.99 2occ h PRO 107 CO -0.12 0.44 0.58 1.03 -0.21 0.00 0.00 178.00 179.71 2occ h SER 108 N 0.68 0.92 -0.41 -2.05 0.87 -0.81 -1.45 113.55 111.30 2occ h SER 108 Ca 0.30 0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.79 2occ h SER 108 Cb 0.18 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2occ h SER 108 CO -0.18 0.60 -0.02 0.15 -0.53 0.00 0.00 176.83 176.84 2occ h PHE 109 N 1.06 0.82 -0.09 2.24 3.04 -0.12 -2.48 116.94 121.41 2occ h PHE 109 Ca 0.39 -0.15 0.04 0.00 3.98 0.00 0.00 57.97 62.23 2occ h PHE 109 Cb 0.14 -0.21 -0.05 0.00 2.56 0.00 0.00 35.95 38.39 2occ h PHE 109 CO -0.02 0.83 -0.23 1.25 -2.02 0.00 0.00 178.31 178.12 2occ h LEU 110 N 0.58 -0.70 -1.59 0.59 5.85 -0.48 0.23 115.31 119.78 2occ h LEU 110 Ca 0.11 0.11 0.10 0.00 0.84 0.00 0.00 57.88 59.04 2occ h LEU 110 Cb 0.52 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 2occ h LEU 110 CO 0.03 -0.28 0.42 -0.07 -0.34 0.00 0.00 178.44 178.19 2occ h LEU 111 N -0.31 0.42 -0.22 2.25 3.38 -1.13 0.38 115.31 120.07 2occ h LEU 111 Ca 0.09 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 2occ h LEU 111 Cb 0.44 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2occ h LEU 111 CO -0.27 0.25 -0.51 0.25 0.09 0.00 0.00 178.44 178.25 2occ h LEU 112 N 0.47 0.83 -1.14 1.67 5.85 -0.66 -1.81 115.31 120.52 2occ h LEU 112 Ca 0.29 -0.56 -0.08 0.00 0.84 0.00 0.00 57.88 58.37 2occ h LEU 112 Cb 0.51 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2occ h LEU 112 CO -0.09 1.24 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.96 2occ h LEU 113 N 0.45 0.32 -0.66 2.25 3.38 0.13 -2.81 115.31 118.37 2occ h LEU 113 Ca -0.00 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.76 2occ h LEU 113 Cb 1.12 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 2occ h LEU 113 CO 0.11 0.56 -0.19 0.00 0.09 0.00 0.00 178.44 179.01 2occ h ALA 114 N 1.47 0.85 0.00 1.53 0.00 -0.21 -2.76 119.26 120.13 2occ h ALA 114 Ca 0.05 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2occ h ALA 114 Cb 0.57 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2occ h ALA 114 CO 0.04 0.64 -0.02 0.66 0.00 0.00 0.00 179.25 180.57 2occ h SER 115 N 0.74 0.00 0.11 0.00 4.64 -1.06 -1.09 113.55 116.89 2occ h SER 115 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2occ h SER 115 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2occ h SER 115 CO 0.06 0.02 -0.15 -1.54 -0.87 0.00 0.00 176.83 174.35 2occ n SER 116 N -4.06 1.38 -0.09 4.97 3.41 -1.05 -3.67 113.62 114.51 2occ n SER 116 Ca -0.03 -1.23 -0.11 0.00 -0.26 0.00 0.00 58.87 57.24 2occ n SER 116 Cb 0.11 0.09 -0.12 0.00 -0.26 0.00 0.00 64.21 64.03 2occ n SER 116 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 2occ n MET 117 N -0.17 0.98 -2.82 4.33 2.81 -0.46 -4.43 117.12 117.36 2occ n MET 117 Ca 0.15 0.04 -0.32 0.00 -1.81 0.00 0.00 57.70 55.76 2occ n MET 117 Cb 0.37 -1.43 -0.05 0.00 -0.71 0.00 0.00 33.22 31.40 2occ n MET 117 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2occ s VAL 118 N -2.41 4.62 0.00 2.03 -7.23 -0.89 -4.88 120.40 111.64 2occ s VAL 118 Ca -0.16 1.02 0.00 0.00 -1.81 0.00 0.00 61.98 61.02 2occ s VAL 118 Cb 0.06 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.33 2occ s VAL 118 CO 0.61 -0.43 0.00 -0.62 -0.31 0.00 0.00 175.10 174.35 2occ n GLU 119 N -0.98 0.00 -0.51 4.82 -0.58 -1.26 -1.99 120.64 120.14 2occ n GLU 119 Ca 0.05 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.86 2occ n GLU 119 Cb 0.54 0.00 0.27 0.00 -0.57 0.00 0.00 31.44 31.68 2occ n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2occ n ALA 120 N 8.29 3.15 -0.79 0.62 0.00 -1.26 -5.09 120.51 125.43 2occ n ALA 120 Ca 0.00 -2.33 0.11 0.00 0.00 0.00 0.00 53.44 51.22 2occ n ALA 120 Cb 0.00 -0.76 -0.03 0.00 0.00 0.00 0.00 19.45 18.66 2occ n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2occ n GLY 121 N -0.45 -1.75 3.32 0.00 0.00 -0.84 -4.68 105.19 100.78 2occ n GLY 121 Ca 0.23 -1.32 -0.46 0.00 0.00 0.00 0.00 46.02 44.47 2occ n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s ALA 122 N -1.87 3.63 -0.88 4.61 0.00 -1.25 -4.82 121.76 121.18 2occ s ALA 122 Ca 0.00 -2.51 -0.00 0.00 0.00 0.00 0.00 51.96 49.45 2occ s ALA 122 Cb 0.00 -3.28 0.34 0.00 0.00 0.00 0.00 23.12 20.18 2occ s ALA 122 CO 0.00 -2.03 1.73 0.41 0.00 0.00 0.00 175.76 175.87 2occ n GLY 123 N 5.25 5.89 0.00 0.00 0.00 -1.26 -4.35 105.19 110.73 2occ n GLY 123 Ca -0.14 -2.59 0.10 0.00 0.00 0.00 0.00 46.02 43.39 2occ n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2occ n THR 124 N -0.25 0.00 0.00 2.61 -2.24 -1.26 -4.78 114.28 108.36 2occ n THR 124 Ca 0.47 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 2occ n THR 124 Cb 0.29 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2occ n THR 124 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2occ n GLY 125 N 1.41 0.60 0.13 3.38 0.00 -1.26 -3.98 105.19 105.47 2occ n GLY 125 Ca 0.01 -1.68 0.11 0.00 0.00 0.00 0.00 46.02 44.45 2occ n GLY 125 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2occ n TRP 126 N 0.75 0.71 0.69 1.61 4.27 -1.26 -1.09 117.44 123.13 2occ n TRP 126 Ca 0.00 0.32 0.13 0.00 -3.89 0.00 0.00 57.50 54.06 2occ n TRP 126 Cb 0.00 -1.01 0.42 0.00 -1.36 0.00 0.00 31.31 29.36 2occ n TRP 126 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 2occ n THR 127 N -2.18 0.46 -4.00 -1.67 -2.24 -1.26 -4.95 114.28 98.43 2occ n THR 127 Ca 0.01 -0.23 -0.28 0.00 -2.27 0.00 0.00 64.05 61.27 2occ n THR 127 Cb 0.14 -0.51 -0.08 0.00 -2.10 0.00 0.00 70.33 67.78 2occ n THR 127 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2occ n VAL 128 N -2.10 -0.60 -2.15 2.28 3.14 -0.25 -4.89 118.33 113.76 2occ n VAL 128 Ca 0.06 -0.30 -0.40 0.00 -2.96 0.00 0.00 64.34 60.73 2occ n VAL 128 Cb 0.41 -0.71 -0.02 0.00 -1.06 0.00 0.00 33.84 32.46 2occ n VAL 128 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 2occ s TYR 129 N -3.79 3.09 0.41 1.45 2.02 -1.26 -4.69 117.35 114.57 2occ s TYR 129 Ca 0.19 1.45 -0.04 0.00 -0.37 0.00 0.00 57.07 58.30 2occ s TYR 129 Cb -0.11 -3.63 -0.04 0.00 -0.40 0.00 0.00 41.96 37.78 2occ s TYR 129 CO 0.83 -1.73 0.68 -1.25 -1.57 0.00 0.00 175.55 172.51 2occ s PRO 130 N -1.80 3.55 0.40 -1.71 0.04 -1.26 -1.82 135.00 132.40 2occ s PRO 130 Ca 0.49 0.02 0.27 0.00 0.04 0.00 0.00 61.00 61.83 2occ s PRO 130 Cb -0.39 -2.51 0.91 0.00 0.04 0.00 0.00 34.50 32.56 2occ s PRO 130 CO 0.51 -0.02 1.79 -1.35 0.04 0.00 0.00 177.00 177.97 2occ h PRO 131 N 0.68 0.00 -0.78 0.56 0.11 -1.94 -3.45 132.00 127.17 2occ h PRO 131 Ca -0.48 0.00 0.19 0.00 0.11 0.00 0.00 66.00 65.83 2occ h PRO 131 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2occ h PRO 131 CO 0.62 0.00 0.54 1.25 -0.21 0.00 0.00 178.00 180.20 2occ h LEU 132 N 0.00 0.20 -0.53 2.35 5.85 -1.95 0.42 115.31 121.65 2occ h LEU 132 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2occ h LEU 132 Cb 0.65 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.66 2occ h LEU 132 CO 0.00 0.09 -0.23 0.00 -0.34 0.00 0.00 178.44 177.96 2occ n ALA 133 N -2.60 3.03 -1.18 1.25 0.00 -0.76 -3.54 120.51 116.72 2occ n ALA 133 Ca 0.16 -0.41 -0.29 0.00 0.00 0.00 0.00 53.44 52.90 2occ n ALA 133 Cb 0.71 -1.14 0.20 0.00 0.00 0.00 0.00 19.45 19.22 2occ n ALA 133 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2occ s GLY 134 N -2.46 1.57 0.00 0.00 0.00 0.15 -4.76 107.32 101.82 2occ s GLY 134 Ca 0.25 -0.61 0.10 0.00 0.00 0.00 0.00 44.72 44.47 2occ s GLY 134 CO 0.50 0.10 1.05 1.16 0.00 0.00 0.00 173.10 175.92 2occ n ASN 135 N -4.36 0.00 -0.08 1.64 0.23 -1.26 -1.76 115.26 109.67 2occ n ASN 135 Ca 0.08 -0.66 -0.12 0.00 -0.53 0.00 0.00 54.58 53.36 2occ n ASN 135 Cb 0.58 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.24 2occ n ASN 135 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2occ n LEU 136 N -0.83 1.76 0.24 -4.53 0.00 -1.26 -3.43 117.00 108.95 2occ n LEU 136 Ca 0.08 0.29 0.15 0.00 0.00 0.00 0.00 56.01 56.53 2occ n LEU 136 Cb 0.04 -0.67 0.47 0.00 0.00 0.00 0.00 43.42 43.25 2occ n LEU 136 CO 0.06 -0.15 0.91 0.00 0.00 0.00 0.00 177.39 178.21 2occ h ALA 137 N -0.83 1.00 -1.83 1.96 0.00 -1.76 -3.28 119.26 114.52 2occ h ALA 137 Ca -0.15 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.30 2occ h ALA 137 Cb 1.00 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 18.39 2occ h ALA 137 CO -0.09 0.00 -1.17 0.72 0.00 0.00 0.00 179.25 178.71 2occ n HIS 138 N -2.99 0.58 -1.99 0.00 8.25 -0.72 -4.95 115.22 113.40 2occ n HIS 138 Ca 0.02 -3.63 -0.35 0.00 -0.26 0.00 0.00 57.72 53.50 2occ n HIS 138 Cb 0.39 -0.41 0.03 0.00 1.12 0.00 0.00 29.99 31.12 2occ n HIS 138 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2occ s ALA 139 N -2.62 2.53 0.00 -1.41 0.00 -1.22 -4.55 121.76 114.49 2occ s ALA 139 Ca 0.38 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2occ s ALA 139 Cb 0.37 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2occ s ALA 139 CO -0.06 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 174.96 2occ n GLY 140 N 0.28 1.87 0.25 0.00 0.00 -1.26 -4.80 105.19 101.52 2occ n GLY 140 Ca 0.13 -2.10 0.17 0.00 0.00 0.00 0.00 46.02 44.21 2occ n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ h ALA 141 N 0.00 1.00 0.02 4.61 0.00 -1.94 -3.38 119.26 119.57 2occ h ALA 141 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2occ h ALA 141 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2occ h ALA 141 CO 0.00 0.00 -0.43 0.77 0.00 0.00 0.00 179.25 179.59 2occ h SER 142 N 0.00 -1.33 -0.17 0.00 0.02 -1.86 0.56 113.55 110.78 2occ h SER 142 Ca 0.00 0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2occ h SER 142 Cb 0.35 0.50 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 2occ h SER 142 CO 0.00 -0.43 0.07 0.58 -1.14 0.00 0.00 176.83 175.91 2occ h VAL 143 N -0.56 1.10 -0.16 2.27 2.07 -1.86 -1.09 116.25 118.02 2occ h VAL 143 Ca 0.01 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.09 2occ h VAL 143 Cb 0.59 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2occ h VAL 143 CO -0.28 0.12 -0.43 0.44 0.02 0.00 0.00 177.57 177.44 2occ h ASP 144 N 0.30 0.40 0.12 0.57 3.32 -1.57 -0.81 116.42 118.76 2occ h ASP 144 Ca 0.08 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 56.82 2occ h ASP 144 Cb 0.09 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2occ h ASP 144 CO -0.01 0.79 -0.46 -0.07 -1.72 0.00 0.00 179.24 177.77 2occ h LEU 145 N 0.31 0.44 -0.46 1.55 3.38 0.01 -2.19 115.31 118.35 2occ h LEU 145 Ca 0.03 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 57.70 2occ h LEU 145 Cb 0.89 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2occ h LEU 145 CO 0.07 0.84 -0.05 0.74 0.09 0.00 0.00 178.44 180.13 2occ h THR 146 N 0.33 1.27 -0.54 0.22 2.02 -0.83 -1.62 112.91 113.75 2occ h THR 146 Ca 0.02 -1.14 -0.04 0.00 0.77 0.00 0.00 66.41 66.01 2occ h THR 146 Cb 0.94 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2occ h THR 146 CO 0.08 0.39 0.16 0.40 0.37 0.00 0.00 175.52 176.93 2occ h ILE 147 N 0.69 1.24 -0.28 3.11 2.04 -1.01 -2.30 117.51 121.00 2occ h ILE 147 Ca 0.12 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.12 2occ h ILE 147 Cb 0.58 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2occ h ILE 147 CO 0.03 0.30 -0.10 -0.26 0.00 0.00 0.00 178.15 178.12 2occ h PHE 148 N 0.74 0.48 -0.49 1.37 0.04 -1.28 -0.87 116.94 116.93 2occ h PHE 148 Ca 0.17 -0.06 -0.03 0.00 2.80 0.00 0.00 57.97 60.85 2occ h PHE 148 Cb 0.29 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 2occ h PHE 148 CO 0.02 0.55 0.20 1.03 -0.60 0.00 0.00 178.31 179.51 2occ h SER 149 N 0.43 0.67 0.18 2.17 0.87 -0.98 -2.06 113.55 114.83 2occ h SER 149 Ca 0.08 -0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 60.42 2occ h SER 149 Cb 0.44 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 2occ h SER 149 CO 0.02 0.65 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.65 2occ h LEU 150 N 0.65 0.14 -0.24 2.23 4.07 -0.89 -1.41 115.31 119.85 2occ h LEU 150 Ca 0.16 -0.04 -0.05 0.00 0.08 0.00 0.00 57.88 58.03 2occ h LEU 150 Cb 0.18 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2occ h LEU 150 CO -0.01 0.39 -0.06 0.45 -1.08 0.00 0.00 178.44 178.13 2occ h HIS 151 N 0.13 0.52 -0.44 1.13 3.86 -0.63 -1.07 115.15 118.65 2occ h HIS 151 Ca 0.02 -0.11 -0.10 0.00 -1.16 0.00 0.00 60.37 59.02 2occ h HIS 151 Cb 0.52 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 2occ h HIS 151 CO 0.00 0.69 -0.14 -0.07 0.86 0.00 0.00 177.93 179.28 2occ h LEU 152 N 0.21 0.81 -0.85 2.43 3.38 -1.14 -1.27 115.31 118.89 2occ h LEU 152 Ca 0.06 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 2occ h LEU 152 Cb 0.52 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2occ h LEU 152 CO 0.02 0.96 -0.12 0.00 0.09 0.00 0.00 178.44 179.40 2occ h ALA 153 N 1.11 1.03 -0.14 1.53 0.00 -1.21 -0.92 119.26 120.66 2occ h ALA 153 Ca 0.12 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2occ h ALA 153 Cb 0.64 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2occ h ALA 153 CO 0.04 0.59 -0.02 0.78 0.00 0.00 0.00 179.25 180.64 2occ h GLY 154 N 0.97 0.28 0.86 0.00 0.00 -0.95 -1.35 103.07 102.88 2occ h GLY 154 Ca 0.11 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.25 2occ h GLY 154 CO 0.04 0.21 0.42 -2.08 0.00 0.00 0.00 176.54 175.12 2occ h VAL 155 N -0.04 1.08 0.13 4.60 2.07 -1.05 -0.37 116.25 122.67 2occ h VAL 155 Ca 0.04 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.29 2occ h VAL 155 Cb 0.43 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 2occ h VAL 155 CO 0.01 0.15 -0.25 -1.28 0.02 0.00 0.00 177.57 176.22 2occ h SER 156 N 0.82 -0.70 0.35 0.57 0.87 -0.97 -1.07 113.55 113.42 2occ h SER 156 Ca 0.28 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.86 2occ h SER 156 Cb 0.03 0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 2occ h SER 156 CO -0.11 -0.34 -0.24 0.28 -0.53 0.00 0.00 176.83 175.88 2occ h SER 157 N -0.46 0.00 -0.09 6.23 0.02 -0.76 -1.38 113.55 117.10 2occ h SER 157 Ca 0.03 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.87 2occ h SER 157 Cb 0.48 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 2occ h SER 157 CO -0.13 0.24 -0.37 0.40 -1.14 0.00 0.00 176.83 175.83 2occ h ILE 158 N 0.00 1.40 -0.85 3.27 2.04 -0.61 -0.97 117.51 121.80 2occ h ILE 158 Ca -0.00 -1.74 -0.03 0.00 1.00 0.00 0.00 64.86 64.09 2occ h ILE 158 Cb 0.48 2.26 -0.04 0.00 -0.74 0.00 0.00 36.82 38.78 2occ h ILE 158 CO 0.03 0.51 0.42 -0.07 0.00 0.00 0.00 178.15 179.04 2occ h LEU 159 N -0.06 1.09 -0.82 1.44 4.07 -1.09 -2.01 115.31 117.93 2occ h LEU 159 Ca -0.02 -0.12 -0.07 0.00 0.08 0.00 0.00 57.88 57.75 2occ h LEU 159 Cb 1.01 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 42.45 2occ h LEU 159 CO 0.08 0.91 0.09 1.23 -1.08 0.00 0.00 178.44 179.66 2occ h GLY 160 N 1.21 1.05 1.05 0.83 0.00 -1.19 -2.53 103.07 103.49 2occ h GLY 160 Ca 0.29 -0.67 -0.06 0.00 0.00 0.00 0.00 47.33 46.89 2occ h GLY 160 CO -0.04 0.63 0.24 0.00 0.00 0.00 0.00 176.54 177.37 2occ h ALA 161 N 1.18 0.97 -0.80 3.60 0.00 -0.72 -0.16 119.26 123.33 2occ h ALA 161 Ca 0.19 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2occ h ALA 161 Cb 0.41 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2occ h ALA 161 CO 0.01 0.65 0.31 0.82 0.00 0.00 0.00 179.25 181.03 2occ h ILE 162 N 1.10 1.26 0.10 0.00 2.04 -1.22 -1.99 117.51 118.79 2occ h ILE 162 Ca 0.24 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 2occ h ILE 162 Cb 0.29 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2occ h ILE 162 CO -0.01 0.34 -0.05 -1.13 0.00 0.00 0.00 178.15 177.31 2occ h ASN 163 N 1.16 -0.11 -0.59 1.72 -1.24 -1.01 -2.09 115.58 113.42 2occ h ASN 163 Ca 0.26 -0.16 -0.03 0.00 0.71 0.00 0.00 56.30 57.08 2occ h ASN 163 Cb 0.23 0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.28 2occ h ASN 163 CO -0.02 0.10 0.25 -0.26 -1.29 0.00 0.00 177.43 176.21 2occ h PHE 164 N -0.32 0.88 -0.32 0.67 0.04 -0.99 -0.94 116.94 115.97 2occ h PHE 164 Ca -0.01 -0.06 -0.07 0.00 2.80 0.00 0.00 57.97 60.62 2occ h PHE 164 Cb 0.27 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 2occ h PHE 164 CO -0.01 0.70 -0.09 0.82 -0.60 0.00 0.00 178.31 179.13 2occ h ILE 165 N 0.81 1.28 -0.44 -0.55 2.04 -1.36 -1.17 117.51 118.12 2occ h ILE 165 Ca 0.20 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 2occ h ILE 165 Cb 0.17 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 2occ h ILE 165 CO -0.02 0.37 0.20 0.74 0.00 0.00 0.00 178.15 179.44 2occ h THR 166 N 0.40 1.19 0.59 -0.27 2.02 -1.33 -1.86 112.91 113.64 2occ h THR 166 Ca 0.08 -0.55 -0.03 0.00 0.77 0.00 0.00 66.41 66.68 2occ h THR 166 Cb 0.59 0.74 0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2occ h THR 166 CO 0.03 0.21 -0.28 0.74 0.37 0.00 0.00 175.52 176.59 2occ h THR 167 N 0.57 0.40 -0.03 3.16 2.02 -1.14 0.13 112.91 118.01 2occ h THR 167 Ca 0.15 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.21 2occ h THR 167 Cb 0.15 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 67.00 2occ h THR 167 CO -0.02 0.02 0.03 0.40 0.37 0.00 0.00 175.52 176.32 2occ h ILE 168 N -0.88 0.82 0.06 3.11 2.04 -1.21 -0.78 117.51 120.67 2occ h ILE 168 Ca -0.08 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.44 2occ h ILE 168 Cb 0.64 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 2occ h ILE 168 CO 0.13 0.00 -1.95 -0.38 0.00 0.00 0.00 178.15 175.95 2occ n ILE 169 N -4.29 1.66 0.03 -0.67 5.41 -0.70 -4.59 119.36 116.20 2occ n ILE 169 Ca -0.02 -0.72 0.11 0.00 1.00 0.00 0.00 62.75 63.12 2occ n ILE 169 Cb 0.12 -1.33 -0.16 0.00 -0.71 0.00 0.00 39.64 37.57 2occ n ILE 169 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2occ n ASN 170 N -3.23 0.09 -1.60 4.38 5.15 0.45 -4.69 115.26 115.80 2occ n ASN 170 Ca -0.27 -0.01 -0.15 0.00 -0.60 0.00 0.00 54.58 53.55 2occ n ASN 170 Cb 1.05 1.86 0.14 0.00 -0.53 0.00 0.00 39.78 42.30 2occ n ASN 170 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2occ n MET 171 N -2.26 2.41 -3.62 1.20 2.81 -0.31 -5.02 117.12 112.32 2occ n MET 171 Ca -0.03 -3.44 -0.23 0.00 -1.81 0.00 0.00 57.70 52.19 2occ n MET 171 Cb 0.56 -2.02 -0.02 0.00 -0.71 0.00 0.00 33.22 31.04 2occ n MET 171 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2occ s LYS 172 N -3.43 3.47 0.30 0.03 1.02 -1.26 -4.42 119.74 115.45 2occ s LYS 172 Ca 0.50 -0.51 -0.29 0.00 0.02 0.00 0.00 55.97 55.69 2occ s LYS 172 Cb 0.43 -2.76 -0.12 0.00 -0.52 0.00 0.00 37.83 34.86 2occ s LYS 172 CO 0.01 0.27 1.38 -2.30 -0.92 0.00 0.00 175.35 173.79 2occ n PRO 173 N -1.61 2.21 -0.46 -1.68 -0.02 -1.26 -4.81 135.00 127.37 2occ n PRO 173 Ca -0.06 0.78 0.41 0.00 -2.02 0.00 0.00 63.50 62.61 2occ n PRO 173 Cb 0.56 -2.42 0.76 0.00 -0.02 0.00 0.00 33.50 32.38 2occ n PRO 173 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2occ h PRO 174 N 3.41 0.02 0.00 0.52 0.11 -1.95 1.00 132.00 135.10 2occ h PRO 174 Ca -0.46 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2occ h PRO 174 Cb 1.27 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2occ h PRO 174 CO 0.69 0.01 -0.63 0.00 -0.21 0.00 0.00 178.00 177.87 2occ n ALA 175 N -2.80 2.95 -2.66 -0.75 0.00 -1.26 -4.85 120.51 111.14 2occ n ALA 175 Ca 0.33 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 53.08 2occ n ALA 175 Cb 1.51 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 19.77 2occ n ALA 175 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2occ s MET 176 N -3.16 4.26 0.66 0.00 0.00 0.34 -4.97 119.30 116.43 2occ s MET 176 Ca 0.06 1.30 -0.04 0.00 0.00 0.00 0.00 55.69 57.01 2occ s MET 176 Cb 0.14 -3.64 0.05 0.00 0.00 0.00 0.00 34.83 31.38 2occ s MET 176 CO 0.72 -0.60 0.95 -1.54 0.00 0.00 0.00 175.02 174.55 2occ s SER 177 N 1.21 4.94 0.55 1.11 1.04 -1.26 -4.81 113.70 116.49 2occ s SER 177 Ca 0.43 0.32 0.28 0.00 0.48 0.00 0.00 55.95 57.47 2occ s SER 177 Cb -0.15 -1.04 1.63 0.00 0.10 0.00 0.00 66.02 66.56 2occ s SER 177 CO 0.07 -1.47 2.16 -0.61 0.98 0.00 0.00 173.24 174.36 2occ h GLN 178 N -0.42 0.00 -0.70 4.02 5.75 -1.96 -1.13 115.11 120.67 2occ h GLN 178 Ca -0.44 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.06 2occ h GLN 178 Cb 1.31 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.86 2occ h GLN 178 CO 0.58 0.06 0.00 0.66 -2.65 0.00 0.00 178.83 177.48 2occ n TYR 179 N -3.75 0.34 -0.69 3.99 4.01 -1.26 -2.95 117.16 116.85 2occ n TYR 179 Ca -0.02 -0.13 0.02 0.00 -0.16 0.00 0.00 57.90 57.61 2occ n TYR 179 Cb 0.16 -0.13 0.02 0.00 -0.31 0.00 0.00 39.34 39.09 2occ n TYR 179 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2occ n GLN 180 N 0.06 1.51 -3.71 -0.72 6.02 -0.43 -5.05 117.38 115.06 2occ n GLN 180 Ca 0.05 -1.32 -0.33 0.00 -0.01 0.00 0.00 57.00 55.39 2occ n GLN 180 Cb 0.34 -0.88 -0.05 0.00 1.02 0.00 0.00 30.24 30.68 2occ n GLN 180 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2occ s THR 181 N -0.89 5.22 0.74 5.09 -4.23 -1.15 -4.93 115.64 115.49 2occ s THR 181 Ca 0.05 0.11 -0.14 0.00 -1.18 0.00 0.00 61.69 60.53 2occ s THR 181 Cb 0.04 -3.61 0.05 0.00 1.34 0.00 0.00 72.50 70.32 2occ s THR 181 CO 0.00 0.21 1.17 -2.84 -0.54 0.00 0.00 174.62 172.62 2occ s PRO 182 N -2.19 2.14 0.40 3.99 0.02 -1.26 -4.84 135.00 133.25 2occ s PRO 182 Ca 0.34 1.60 0.11 0.00 0.02 0.00 0.00 61.00 63.08 2occ s PRO 182 Cb -0.13 -1.85 0.92 0.00 0.02 0.00 0.00 34.50 33.46 2occ s PRO 182 CO 0.21 -1.80 1.94 -0.07 -0.33 0.00 0.00 177.00 176.94 2occ h LEU 183 N -0.51 0.50 -1.08 -5.54 3.38 -1.98 -1.14 115.31 108.95 2occ h LEU 183 Ca -0.46 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 2occ h LEU 183 Cb 1.28 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 2occ h LEU 183 CO 0.50 0.29 0.25 0.15 0.09 0.00 0.00 178.44 179.72 2occ h PHE 184 N 0.55 0.91 -0.58 1.13 3.57 -1.92 0.28 116.94 120.88 2occ h PHE 184 Ca 0.35 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.70 2occ h PHE 184 Cb 0.59 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.03 2occ h PHE 184 CO -0.00 0.70 -0.01 0.28 -2.23 0.00 0.00 178.31 177.04 2occ h VAL 185 N 0.89 1.26 -0.50 1.41 2.07 -1.57 -1.09 116.25 118.72 2occ h VAL 185 Ca 0.21 -1.14 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 2occ h VAL 185 Cb 0.17 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2occ h VAL 185 CO -0.02 0.41 0.11 -0.50 0.02 0.00 0.00 177.57 177.60 2occ h TRP 186 N 0.92 0.85 -0.91 1.57 4.06 -1.00 -0.77 115.95 120.67 2occ h TRP 186 Ca 0.16 -0.10 0.02 0.00 2.06 0.00 0.00 58.89 61.03 2occ h TRP 186 Cb 0.55 -0.24 -0.05 0.00 -1.00 0.00 0.00 29.16 28.43 2occ h TRP 186 CO 0.04 0.76 0.60 0.66 -3.56 0.00 0.00 178.44 176.93 2occ h SER 187 N 0.69 1.02 1.63 -3.49 4.64 -0.08 -1.29 113.55 116.67 2occ h SER 187 Ca 0.16 -0.02 -0.06 0.00 -0.47 0.00 0.00 61.79 61.39 2occ h SER 187 Cb 0.34 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2occ h SER 187 CO 0.00 0.73 -0.38 -0.37 -0.87 0.00 0.00 176.83 175.94 2occ h VAL 188 N 1.20 0.49 -0.16 0.95 -1.51 -0.90 -2.49 116.25 113.82 2occ h VAL 188 Ca 0.34 -1.70 -0.07 0.00 -1.23 0.00 0.00 66.70 64.04 2occ h VAL 188 Cb -0.09 2.21 -0.00 0.00 -2.13 0.00 0.00 31.29 31.28 2occ h VAL 188 CO -0.09 0.28 -0.17 -0.03 -1.23 0.00 0.00 177.57 176.33 2occ h MET 189 N 0.00 0.41 -0.47 5.19 -1.53 -0.08 -1.56 114.93 116.89 2occ h MET 189 Ca -0.01 -0.22 -0.02 0.00 -3.44 0.00 0.00 59.70 56.02 2occ h MET 189 Cb 1.23 0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 32.27 2occ h MET 189 CO 0.04 0.78 0.23 0.82 0.14 0.00 0.00 176.91 178.92 2occ h ILE 190 N 0.05 1.18 -0.53 1.77 2.04 -1.32 -1.34 117.51 119.37 2occ h ILE 190 Ca 0.03 -0.51 0.06 0.00 1.00 0.00 0.00 64.86 65.44 2occ h ILE 190 Cb 0.71 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2occ h ILE 190 CO 0.04 0.20 0.22 0.74 0.00 0.00 0.00 178.15 179.36 2occ h THR 191 N 0.61 0.87 -0.85 -0.27 2.02 -1.47 -0.83 112.91 113.00 2occ h THR 191 Ca 0.16 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.20 2occ h THR 191 Cb 0.11 0.41 -0.04 0.00 -1.74 0.00 0.00 68.15 66.88 2occ h THR 191 CO -0.02 0.08 0.56 0.00 0.37 0.00 0.00 175.52 176.51 2occ h ALA 192 N 1.32 1.40 -0.69 6.16 0.00 -0.81 -0.02 119.26 126.63 2occ h ALA 192 Ca 0.25 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2occ h ALA 192 Cb 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2occ h ALA 192 CO -0.22 0.56 0.14 0.28 0.00 0.00 0.00 179.25 180.00 2occ h VAL 193 N 1.14 1.26 -0.69 0.00 2.07 -0.07 -1.94 116.25 118.03 2occ h VAL 193 Ca 0.31 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 2occ h VAL 193 Cb -0.13 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 2occ h VAL 193 CO -0.07 0.39 0.18 -0.07 0.02 0.00 0.00 177.57 178.02 2occ h LEU 194 N 1.06 1.04 -0.65 2.57 4.07 -0.15 -2.17 115.31 121.08 2occ h LEU 194 Ca 0.21 -0.23 -0.09 0.00 0.08 0.00 0.00 57.88 57.85 2occ h LEU 194 Cb 0.41 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 2occ h LEU 194 CO 0.01 0.99 0.02 -0.07 -1.08 0.00 0.00 178.44 178.31 2occ h LEU 195 N 1.03 1.05 -0.90 1.67 3.38 -0.92 -1.18 115.31 119.44 2occ h LEU 195 Ca 0.22 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2occ h LEU 195 Cb 0.35 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2occ h LEU 195 CO -0.00 1.09 0.50 0.25 0.09 0.00 0.00 178.44 180.36 2occ h LEU 196 N 0.98 1.12 0.00 1.67 5.85 -0.81 -1.74 115.31 122.39 2occ h LEU 196 Ca 0.18 -0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.66 2occ h LEU 196 Cb 0.54 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2occ h LEU 196 CO 0.03 0.90 -1.19 -0.07 -0.34 0.00 0.00 178.44 177.77 2occ h LEU 197 N 1.26 0.00 0.06 2.25 3.38 -1.40 -3.41 115.31 117.45 2occ h LEU 197 Ca 0.32 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.91 2occ h LEU 197 Cb 0.02 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 2occ h LEU 197 CO -0.05 0.52 -2.23 -1.54 0.09 0.00 0.00 178.44 175.23 2occ n SER 198 N -2.94 1.90 -0.18 -0.43 3.41 -0.45 -4.49 113.62 110.44 2occ n SER 198 Ca -0.06 0.05 0.07 0.00 -0.26 0.00 0.00 58.87 58.66 2occ n SER 198 Cb 0.80 -0.53 0.36 0.00 -0.26 0.00 0.00 64.21 64.57 2occ n SER 198 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2occ h LEU 199 N 0.03 0.66 -1.28 1.04 4.07 -1.52 -1.94 115.31 116.37 2occ h LEU 199 Ca -0.50 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.41 2occ h LEU 199 Cb 1.98 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 43.57 2occ h LEU 199 CO 0.00 0.42 -0.12 -0.65 -1.08 0.00 0.00 178.44 177.01 2occ h PRO 200 N 0.75 0.34 -0.23 1.13 0.11 -1.79 -0.59 132.00 131.72 2occ h PRO 200 Ca 0.32 -0.09 -0.15 0.00 0.11 0.00 0.00 66.00 66.19 2occ h PRO 200 Cb 0.28 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 2occ h PRO 200 CO -0.11 0.47 -0.48 0.28 -0.21 0.00 0.00 178.00 177.96 2occ h VAL 201 N 0.32 1.31 -0.02 3.15 2.07 -1.58 -1.52 116.25 119.97 2occ h VAL 201 Ca 0.06 -1.69 -0.00 0.00 0.82 0.00 0.00 66.70 65.90 2occ h VAL 201 Cb 0.42 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2occ h VAL 201 CO 0.02 0.53 0.01 0.25 0.02 0.00 0.00 177.57 178.40 2occ h LEU 202 N 0.48 0.03 -1.27 2.57 5.85 -1.26 -1.52 115.31 120.19 2occ h LEU 202 Ca 0.03 -0.17 0.19 0.00 0.84 0.00 0.00 57.88 58.76 2occ h LEU 202 Cb 1.01 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.95 2occ h LEU 202 CO 0.09 0.19 0.60 0.00 -0.34 0.00 0.00 178.44 178.99 2occ h ALA 203 N 0.84 1.92 -0.17 1.25 0.00 -0.90 0.07 119.26 122.27 2occ h ALA 203 Ca 0.01 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2occ h ALA 203 Cb 0.17 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2occ h ALA 203 CO -0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 179.25 178.81 2occ h ALA 204 N 1.61 0.26 -0.35 0.00 0.00 -0.87 -2.52 119.26 117.39 2occ h ALA 204 Ca 0.51 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2occ h ALA 204 Cb 0.97 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 2occ h ALA 204 CO -0.26 0.21 0.21 0.78 0.00 0.00 0.00 179.25 180.19 2occ h GLY 205 N 0.10 0.52 2.00 0.00 0.00 -0.08 -1.77 103.07 103.84 2occ h GLY 205 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2occ h GLY 205 CO 0.05 0.21 0.00 0.29 0.00 0.00 0.00 176.54 177.09 2occ n ILE 206 N -4.80 0.68 0.08 2.60 -5.35 -0.15 -1.35 119.36 111.07 2occ n ILE 206 Ca -0.01 -0.11 -0.14 0.00 -0.27 0.00 0.00 62.75 62.22 2occ n ILE 206 Cb 0.06 -0.79 -0.07 0.00 -1.74 0.00 0.00 39.64 37.09 2occ n ILE 206 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2occ h THR 207 N 0.00 1.42 -0.34 7.28 2.02 -0.98 -1.27 112.91 121.04 2occ h THR 207 Ca 0.00 -2.60 -0.07 0.00 0.77 0.00 0.00 66.41 64.51 2occ h THR 207 Cb 0.61 2.56 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 2occ h THR 207 CO 0.00 0.77 -0.07 0.24 0.37 0.00 0.00 175.52 176.83 2occ h MET 208 N 0.19 0.64 -0.67 6.66 2.86 -0.95 -0.69 114.93 122.97 2occ h MET 208 Ca -0.10 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 2occ h MET 208 Cb 1.69 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 33.28 2occ h MET 208 CO 0.18 0.81 0.43 1.25 1.06 0.00 0.00 176.91 180.63 2occ h LEU 209 N 0.43 0.78 -0.71 1.22 5.85 -1.14 -1.13 115.31 120.61 2occ h LEU 209 Ca 0.09 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 2occ h LEU 209 Cb 0.56 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2occ h LEU 209 CO 0.03 0.58 -0.24 0.25 -0.34 0.00 0.00 178.44 178.72 2occ h LEU 210 N 0.91 0.75 -0.39 2.25 5.85 -0.75 -2.59 115.31 121.34 2occ h LEU 210 Ca 0.24 -0.27 -0.19 0.00 0.84 0.00 0.00 57.88 58.50 2occ h LEU 210 Cb -0.08 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.74 2occ h LEU 210 CO -0.05 0.97 -0.73 0.71 -0.34 0.00 0.00 178.44 178.99 2occ h THR 211 N 0.64 1.37 -0.46 1.05 1.35 -0.44 -2.42 112.91 114.01 2occ h THR 211 Ca 0.09 -2.13 -0.00 0.00 -0.55 0.00 0.00 66.41 63.82 2occ h THR 211 Cb 0.74 2.10 -0.02 0.00 -1.73 0.00 0.00 68.15 69.24 2occ h THR 211 CO 0.06 0.64 0.28 0.44 -0.25 0.00 0.00 175.52 176.69 2occ h ASP 212 N 0.29 0.54 1.42 5.36 5.19 -1.12 0.49 116.42 128.58 2occ h ASP 212 Ca -0.03 -0.02 -0.11 0.00 -0.62 0.00 0.00 57.03 56.25 2occ h ASP 212 Cb 1.31 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.67 2occ h ASP 212 CO 0.13 0.41 -0.59 0.03 -3.12 0.00 0.00 179.24 176.09 2occ h ARG 213 N 0.62 0.00 0.00 3.56 3.08 -1.33 -3.38 114.38 116.93 2occ h ARG 213 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2occ h ARG 213 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2occ h ARG 213 CO -0.03 0.47 -0.33 0.09 -1.07 0.00 0.00 179.97 179.10 2occ n ASN 214 N -3.18 1.64 -0.30 7.04 3.02 -0.92 -4.74 115.26 117.81 2occ n ASN 214 Ca 0.01 -0.06 0.08 0.00 -0.03 0.00 0.00 54.58 54.58 2occ n ASN 214 Cb 0.74 0.46 0.15 0.00 -0.61 0.00 0.00 39.78 40.52 2occ n ASN 214 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2occ n LEU 215 N -0.62 2.73 -2.71 3.41 4.32 0.17 -4.99 117.00 119.31 2occ n LEU 215 Ca 0.00 -2.86 -0.20 0.00 -0.02 0.00 0.00 56.01 52.93 2occ n LEU 215 Cb 0.00 -0.39 0.01 0.00 -1.62 0.00 0.00 43.42 41.42 2occ n LEU 215 CO 0.00 0.67 -0.14 0.59 -1.22 0.00 0.00 177.39 177.30 2occ n ASN 216 N -0.96 -5.31 -4.93 -1.43 3.02 -1.10 -4.94 115.26 99.60 2occ n ASN 216 Ca 0.15 -0.10 -0.26 0.00 -0.03 0.00 0.00 54.58 54.35 2occ n ASN 216 Cb 0.64 -4.38 0.06 0.00 -0.61 0.00 0.00 39.78 35.49 2occ n ASN 216 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2occ s THR 217 N -2.98 2.47 -0.34 3.41 -4.23 -1.20 -5.00 115.64 107.78 2occ s THR 217 Ca 0.14 -0.26 0.16 0.00 -1.18 0.00 0.00 61.69 60.55 2occ s THR 217 Cb -0.07 -3.06 0.45 0.00 1.34 0.00 0.00 72.50 71.17 2occ s THR 217 CO 0.17 -0.06 0.96 0.35 -0.54 0.00 0.00 174.62 175.51 2occ n THR 218 N -2.84 1.11 -0.11 3.99 -2.24 -1.26 -4.35 114.28 108.58 2occ n THR 218 Ca 0.08 -3.31 -0.04 0.00 -2.27 0.00 0.00 64.05 58.50 2occ n THR 218 Cb 0.60 0.42 0.16 0.00 -2.10 0.00 0.00 70.33 69.42 2occ n THR 218 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2occ h PHE 219 N 2.95 0.85 -0.12 4.78 0.04 -1.96 -2.96 116.94 120.53 2occ h PHE 219 Ca -0.05 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.61 2occ h PHE 219 Cb 1.14 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2occ h PHE 219 CO 0.53 0.77 0.00 1.19 -0.60 0.00 0.00 178.31 180.20 2occ n PHE 220 N -4.23 0.15 -3.54 -0.55 3.72 -1.26 -1.47 117.46 110.29 2occ n PHE 220 Ca 0.03 -0.25 -0.40 0.00 -0.05 0.00 0.00 57.45 56.77 2occ n PHE 220 Cb 0.29 -0.02 -0.11 0.00 -0.94 0.00 0.00 39.48 38.70 2occ n PHE 220 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2occ s ASP 221 N -0.80 6.00 0.56 4.37 -1.08 -1.22 -2.64 116.67 121.85 2occ s ASP 221 Ca 0.12 -0.51 0.26 0.00 -0.52 0.00 0.00 52.55 51.89 2occ s ASP 221 Cb 0.07 -2.12 1.49 0.00 -1.46 0.00 0.00 42.92 40.89 2occ s ASP 221 CO 0.10 -0.26 2.05 -0.65 0.52 0.00 0.00 175.17 176.92 2occ h PRO 222 N 8.49 0.00 -0.79 4.34 0.11 -1.87 -0.21 132.00 142.07 2occ h PRO 222 Ca -0.31 0.00 0.11 0.00 0.11 0.00 0.00 66.00 65.91 2occ h PRO 222 Cb 1.15 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 2occ h PRO 222 CO 0.65 0.00 0.51 0.00 -0.21 0.00 0.00 178.00 178.95 2occ h ALA 223 N 1.76 1.84 -0.38 -0.75 0.00 -1.94 -0.07 119.26 119.72 2occ h ALA 223 Ca 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2occ h ALA 223 Cb 0.68 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2occ h ALA 223 CO -0.00 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2occ n GLY 224 N -1.46 1.74 0.14 0.00 0.00 -0.82 -4.94 105.19 99.85 2occ n GLY 224 Ca 0.14 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2occ n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2occ n GLY 225 N 1.36 0.56 3.65 -0.02 0.00 -0.04 -4.97 105.19 105.73 2occ n GLY 225 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2occ n GLY 225 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2occ s GLY 226 N -1.11 1.61 -0.14 -0.02 0.00 -0.15 -4.90 107.32 102.61 2occ s GLY 226 Ca 0.00 -0.98 -0.04 0.00 0.00 0.00 0.00 44.72 43.70 2occ s GLY 226 CO 0.00 -0.12 0.20 -0.35 0.00 0.00 0.00 173.10 172.83 2occ s ASP 227 N -4.05 0.94 0.56 1.64 -1.08 -0.54 -3.49 116.67 110.65 2occ s ASP 227 Ca 0.71 0.17 0.25 0.00 -0.52 0.00 0.00 52.55 53.16 2occ s ASP 227 Cb -0.09 0.38 1.58 0.00 -1.46 0.00 0.00 42.92 43.33 2occ s ASP 227 CO 0.56 -0.28 2.17 -0.65 0.52 0.00 0.00 175.17 177.49 2occ h PRO 228 N 8.33 0.00 -0.10 4.34 0.11 -1.78 -0.59 132.00 142.31 2occ h PRO 228 Ca -0.15 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.88 2occ h PRO 228 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2occ h PRO 228 CO 0.19 0.00 -0.30 0.82 -0.21 0.00 0.00 178.00 178.51 2occ h ILE 229 N 0.00 1.25 -0.73 4.15 1.08 -1.92 -2.97 117.51 118.37 2occ h ILE 229 Ca 0.04 -1.19 0.07 0.00 -0.39 0.00 0.00 64.86 63.39 2occ h ILE 229 Cb 0.18 1.51 -0.06 0.00 -3.07 0.00 0.00 36.82 35.38 2occ h ILE 229 CO -0.00 0.35 0.41 0.25 -0.69 0.00 0.00 178.15 178.48 2occ h LEU 230 N 0.16 0.60 -0.67 1.44 5.85 -1.45 -0.76 115.31 120.49 2occ h LEU 230 Ca 0.02 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.85 2occ h LEU 230 Cb 0.61 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 2occ h LEU 230 CO 0.04 0.38 0.35 0.22 -0.34 0.00 0.00 178.44 179.09 2occ h TYR 231 N 0.74 0.64 -0.85 1.25 3.20 -1.62 -2.11 116.97 118.21 2occ h TYR 231 Ca 0.34 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.26 2occ h TYR 231 Cb 0.24 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.27 2occ h TYR 231 CO -0.07 0.28 0.55 1.96 -1.64 0.00 0.00 178.16 179.23 2occ h GLN 232 N 0.64 1.04 -0.03 1.82 4.20 -1.20 0.10 115.11 121.67 2occ h GLN 232 Ca 0.31 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 2occ h GLN 232 Cb 0.25 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2occ h GLN 232 CO -0.21 0.69 0.02 0.45 -0.67 0.00 0.00 178.83 179.10 2occ h HIS 233 N 1.07 0.05 -0.30 2.96 3.86 -0.86 -0.04 115.15 121.89 2occ h HIS 233 Ca 0.34 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.52 2occ h HIS 233 Cb -0.01 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 2occ h HIS 233 CO -0.02 0.15 0.11 -0.07 0.86 0.00 0.00 177.93 178.95 2occ h LEU 234 N -0.07 0.42 -0.28 2.43 3.38 -1.11 -1.18 115.31 118.90 2occ h LEU 234 Ca 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2occ h LEU 234 Cb 0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2occ h LEU 234 CO -0.00 0.48 0.13 0.15 0.09 0.00 0.00 178.44 179.29 2occ h PHE 235 N 0.32 0.42 0.00 1.13 3.04 -0.72 -2.88 116.94 118.25 2occ h PHE 235 Ca 0.10 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.02 2occ h PHE 235 Cb 0.21 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.59 2occ h PHE 235 CO -0.00 0.39 0.00 0.91 -2.02 0.00 0.00 178.31 177.59 2occ n TRP 236 N -4.78 0.77 0.17 0.41 7.02 -0.04 -0.01 117.44 120.98 2occ n TRP 236 Ca -0.02 0.27 0.02 0.00 -1.02 0.00 0.00 57.50 56.74 2occ n TRP 236 Cb 0.11 -0.94 0.30 0.00 -2.42 0.00 0.00 31.31 28.36 2occ n TRP 236 CO 0.00 0.00 0.00 0.35 -2.02 0.00 0.00 177.69 176.02 2occ h PHE 237 N 0.00 0.00 0.10 -5.99 3.57 -0.99 -2.29 116.94 111.34 2occ h PHE 237 Ca 0.00 0.00 -0.34 0.00 3.53 0.00 0.00 57.97 61.16 2occ h PHE 237 Cb 0.49 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 2occ h PHE 237 CO 0.00 0.46 -1.89 0.34 -2.23 0.00 0.00 178.31 174.98 2occ n PHE 238 N -3.93 1.16 -0.23 0.41 7.35 -1.04 -4.36 117.46 116.81 2occ n PHE 238 Ca -0.01 0.28 0.03 0.00 -0.76 0.00 0.00 57.45 56.99 2occ n PHE 238 Cb 0.49 -1.15 0.15 0.00 0.35 0.00 0.00 39.48 39.33 2occ n PHE 238 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 2occ h GLY 239 N 0.72 0.96 0.48 7.13 0.00 -0.26 0.13 103.07 112.24 2occ h GLY 239 Ca -0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 2occ h GLY 239 CO 0.02 -0.13 -0.00 0.84 0.00 0.00 0.00 176.54 177.27 2occ h HIS 240 N 0.33 -0.01 -1.00 5.60 -0.00 -1.65 -3.16 115.15 115.26 2occ h HIS 240 Ca 0.37 -0.00 0.22 0.00 -0.00 0.00 0.00 60.37 60.96 2occ h HIS 240 Cb 0.58 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 27.88 2occ h HIS 240 CO -0.22 0.52 0.61 -1.35 -0.00 0.00 0.00 177.93 177.48 2occ h PRO 241 N -0.53 0.65 -0.99 5.26 0.11 -1.55 0.27 132.00 135.22 2occ h PRO 241 Ca -0.00 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.19 2occ h PRO 241 Cb 0.52 -0.15 -0.08 0.00 0.11 0.00 0.00 31.00 31.40 2occ h PRO 241 CO 0.00 0.43 0.63 1.49 -0.21 0.00 0.00 178.00 180.34 2occ h GLU 242 N 0.67 0.94 0.00 1.05 4.57 -0.71 -0.48 114.58 120.61 2occ h GLU 242 Ca 0.60 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.65 2occ h GLU 242 Cb 1.06 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 2occ h GLU 242 CO -0.41 0.62 -0.38 -0.39 -1.18 0.00 0.00 179.01 177.27 2occ h VAL 243 N 0.96 0.91 0.00 0.32 -1.51 -0.91 -1.31 116.25 114.71 2occ h VAL 243 Ca 0.49 -1.50 -0.14 0.00 -1.23 0.00 0.00 66.70 64.32 2occ h VAL 243 Cb 0.51 1.91 -0.02 0.00 -2.13 0.00 0.00 31.29 31.56 2occ h VAL 243 CO -0.26 0.37 -0.65 1.88 -1.23 0.00 0.00 177.57 177.68 2occ h TYR 244 N 0.00 0.00 0.00 5.19 0.05 -1.21 -2.76 116.97 118.24 2occ h TYR 244 Ca -0.00 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 2occ h TYR 244 Cb 0.88 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.61 2occ h TYR 244 CO 0.00 0.65 -0.41 0.82 -1.05 0.00 0.00 178.16 178.17 2occ h ILE 245 N 0.00 1.13 0.00 -2.88 2.04 -0.47 -0.87 117.51 116.46 2occ h ILE 245 Ca -0.01 -1.47 -0.02 0.00 1.00 0.00 0.00 64.86 64.36 2occ h ILE 245 Cb 1.48 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 39.39 2occ h ILE 245 CO 0.08 0.40 -0.40 -0.07 0.00 0.00 0.00 178.15 178.16 2occ h LEU 246 N 0.00 0.00 0.00 1.44 3.38 -1.06 -3.37 115.31 115.70 2occ h LEU 246 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 2occ h LEU 246 Cb 0.80 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 2occ h LEU 246 CO 0.05 0.10 -2.01 0.00 0.09 0.00 0.00 178.44 176.67 2occ n ILE 247 N -3.00 0.73 -0.04 1.22 0.13 -1.02 -4.62 119.36 112.76 2occ n ILE 247 Ca 0.02 -0.59 -0.08 0.00 -1.10 0.00 0.00 62.75 61.00 2occ n ILE 247 Cb 0.58 -0.34 -0.03 0.00 -0.84 0.00 0.00 39.64 39.01 2occ n ILE 247 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 2occ h LEU 248 N 0.00 -0.23 -2.15 9.51 3.38 -1.33 0.78 115.31 125.28 2occ h LEU 248 Ca -0.29 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 2occ h LEU 248 Cb 1.59 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.48 2occ h LEU 248 CO 0.02 -0.08 -0.04 -0.65 0.09 0.00 0.00 178.44 177.77 2occ h PRO 249 N -0.02 0.00 -0.47 1.13 0.11 -1.79 -0.13 132.00 130.83 2occ h PRO 249 Ca 0.10 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.11 2occ h PRO 249 Cb 0.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 2occ h PRO 249 CO -0.22 0.04 -0.09 0.78 -0.21 0.00 0.00 178.00 178.30 2occ h GLY 250 N 0.20 0.97 0.97 -0.55 0.00 -1.33 -0.06 103.07 103.27 2occ h GLY 250 Ca -0.00 -0.79 0.01 0.00 0.00 0.00 0.00 47.33 46.56 2occ h GLY 250 CO 0.01 0.72 0.46 0.74 0.00 0.00 0.00 176.54 178.46 2occ h PHE 251 N 0.74 0.87 0.17 5.60 0.04 0.76 -1.60 116.94 123.53 2occ h PHE 251 Ca 0.12 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.91 2occ h PHE 251 Cb 0.63 -0.29 0.00 0.00 2.20 0.00 0.00 35.95 38.49 2occ h PHE 251 CO 0.05 0.53 -0.08 0.78 -0.60 0.00 0.00 178.31 178.99 2occ h GLY 252 N 0.93 -0.25 1.13 -1.45 0.00 -0.16 -2.62 103.07 100.66 2occ h GLY 252 Ca 0.27 0.09 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 2occ h GLY 252 CO -0.07 -0.09 0.44 -0.33 0.00 0.00 0.00 176.54 176.49 2occ h MET 253 N -0.26 1.13 -0.58 4.80 2.86 -0.89 -2.46 114.93 119.54 2occ h MET 253 Ca -0.02 -0.13 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 2occ h MET 253 Cb 0.20 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 2occ h MET 253 CO 0.04 0.83 0.27 0.82 1.06 0.00 0.00 176.91 179.93 2occ h ILE 254 N 1.14 1.19 -0.55 -1.22 1.08 -1.17 -0.61 117.51 117.36 2occ h ILE 254 Ca 0.29 -0.55 -0.03 0.00 -0.39 0.00 0.00 64.86 64.17 2occ h ILE 254 Cb 0.03 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.22 2occ h ILE 254 CO -0.05 0.23 0.23 0.28 -0.69 0.00 0.00 178.15 178.15 2occ h SER 255 N 0.81 0.76 -0.46 1.72 0.02 -1.06 0.23 113.55 115.58 2occ h SER 255 Ca 0.20 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.89 2occ h SER 255 Cb 0.10 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2occ h SER 255 CO -0.03 0.71 -0.11 0.45 -1.14 0.00 0.00 176.83 176.72 2occ h HIS 256 N 0.76 0.99 -0.08 3.45 3.86 -1.20 -2.56 115.15 120.37 2occ h HIS 256 Ca 0.19 -0.21 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 2occ h HIS 256 Cb 0.19 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 2occ h HIS 256 CO 0.01 0.97 -0.01 0.82 0.86 0.00 0.00 177.93 180.58 2occ h ILE 257 N 0.72 1.27 -0.82 2.45 2.04 -0.91 0.05 117.51 122.32 2occ h ILE 257 Ca 0.12 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 2occ h ILE 257 Cb 0.65 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 2occ h ILE 257 CO 0.04 0.24 0.43 0.58 0.00 0.00 0.00 178.15 179.44 2occ h VAL 258 N -0.15 1.25 0.06 1.67 2.07 -1.02 -1.07 116.25 119.06 2occ h VAL 258 Ca 0.02 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 2occ h VAL 258 Cb 0.38 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2occ h VAL 258 CO 0.01 0.28 -0.03 0.74 0.02 0.00 0.00 177.57 178.59 2occ h THR 259 N 1.15 1.13 -0.00 2.57 2.02 -1.42 -2.67 112.91 115.68 2occ h THR 259 Ca 0.29 -0.66 0.02 0.00 0.77 0.00 0.00 66.41 66.82 2occ h THR 259 Cb 0.07 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2occ h THR 259 CO -0.04 0.16 -0.12 0.22 0.37 0.00 0.00 175.52 176.11 2occ h TYR 260 N -0.38 -0.31 0.00 3.16 3.20 -0.77 -2.27 116.97 119.61 2occ h TYR 260 Ca -0.01 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2occ h TYR 260 Cb 0.34 0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.74 2occ h TYR 260 CO 0.02 -0.18 0.00 0.66 -1.64 0.00 0.00 178.16 177.02 2occ n TYR 261 N -5.25 0.00 0.80 -3.82 4.01 -0.42 -1.42 117.16 111.05 2occ n TYR 261 Ca -0.05 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.78 2occ n TYR 261 Cb 0.17 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.28 2occ n TYR 261 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2occ n SER 262 N -0.94 2.57 -1.07 7.72 7.64 -1.01 -1.35 113.62 127.18 2occ n SER 262 Ca 0.18 -1.78 -0.10 0.00 1.01 0.00 0.00 58.87 58.18 2occ n SER 262 Cb 0.08 0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.29 2occ n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2occ n GLY 263 N 1.09 0.24 3.95 0.23 0.00 -0.51 -1.02 105.19 109.18 2occ n GLY 263 Ca 0.11 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.42 2occ n GLY 263 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2occ s LYS 264 N -4.11 3.32 -0.02 1.61 -0.14 -0.88 -4.86 119.74 114.67 2occ s LYS 264 Ca 0.00 -0.47 -0.08 0.00 -1.36 0.00 0.00 55.97 54.06 2occ s LYS 264 Cb 0.00 -2.66 -0.30 0.00 -1.68 0.00 0.00 37.83 33.19 2occ s LYS 264 CO 0.00 0.03 0.79 0.87 -0.76 0.00 0.00 175.35 176.28 2occ h LYS 265 N 0.68 0.34 -3.69 1.68 1.57 -1.96 -3.42 116.57 111.78 2occ h LYS 265 Ca -0.48 -0.58 -0.11 0.00 -1.87 0.00 0.00 60.65 57.60 2occ h LYS 265 Cb 1.23 0.22 -0.17 0.00 0.08 0.00 0.00 32.23 33.59 2occ h LYS 265 CO 0.59 1.23 -0.43 -1.83 -0.57 0.00 0.00 179.45 178.44 2occ s GLU 266 N -2.60 0.69 0.64 3.15 -1.05 -1.26 -4.90 118.70 113.37 2occ s GLU 266 Ca -0.12 -0.74 -0.16 0.00 -0.15 0.00 0.00 54.97 53.80 2occ s GLU 266 Cb 0.06 0.28 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 2occ s GLU 266 CO 0.86 -0.19 1.12 -1.25 0.95 0.00 0.00 175.26 176.75 2occ s PRO 267 N -2.84 2.86 0.32 -4.83 0.04 -1.26 -4.97 135.00 124.32 2occ s PRO 267 Ca -0.03 1.45 -0.29 0.00 0.04 0.00 0.00 61.00 62.17 2occ s PRO 267 Cb 0.00 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.49 2occ s PRO 267 CO -0.05 -1.21 1.28 0.12 0.04 0.00 0.00 177.00 177.18 2occ s PHE 268 N -2.22 3.12 -1.31 0.56 2.19 -1.26 -3.84 117.98 115.21 2occ s PHE 268 Ca 0.68 1.45 -0.00 0.00 0.33 0.00 0.00 56.93 59.38 2occ s PHE 268 Cb -0.21 -3.63 0.00 0.00 -1.31 0.00 0.00 43.02 37.87 2occ s PHE 268 CO 0.39 -1.70 0.71 0.41 1.83 0.00 0.00 175.22 176.87 2occ n GLY 269 N 0.88 -0.30 0.33 13.12 0.00 -1.26 -4.81 105.19 113.16 2occ n GLY 269 Ca -0.00 0.13 0.07 0.00 0.00 0.00 0.00 46.02 46.22 2occ n GLY 269 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2occ h TYR 270 N -1.88 -0.32 0.00 1.61 5.03 -1.98 0.38 116.97 119.81 2occ h TYR 270 Ca -0.61 0.08 -0.08 0.00 2.58 0.00 0.00 58.73 60.69 2occ h TYR 270 Cb 1.36 0.29 -0.01 0.00 1.55 0.00 0.00 36.73 39.91 2occ h TYR 270 CO 0.47 -0.39 -0.40 0.52 -1.32 0.00 0.00 178.16 177.05 2occ h MET 271 N 0.02 0.00 -0.23 1.82 2.86 -1.95 -2.35 114.93 115.09 2occ h MET 271 Ca 0.48 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 58.00 2occ h MET 271 Cb 0.83 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 2occ h MET 271 CO -0.91 0.40 -0.38 0.78 1.06 0.00 0.00 176.91 177.86 2occ h GLY 272 N 1.89 0.56 1.22 8.32 0.00 -0.65 -0.62 103.07 113.79 2occ h GLY 272 Ca -0.00 -0.53 -0.17 0.00 0.00 0.00 0.00 47.33 46.63 2occ h GLY 272 CO 0.05 0.48 -0.46 -0.33 0.00 0.00 0.00 176.54 176.29 2occ h MET 273 N 0.43 0.84 -0.18 4.80 2.86 -1.00 0.13 114.93 122.81 2occ h MET 273 Ca 0.04 -0.48 -0.04 0.00 -2.06 0.00 0.00 59.70 57.17 2occ h MET 273 Cb 0.85 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 2occ h MET 273 CO 0.07 1.11 -0.04 0.28 1.06 0.00 0.00 176.91 179.40 2occ h VAL 274 N 0.67 1.28 -0.16 -2.22 2.07 -1.31 -1.76 116.25 114.81 2occ h VAL 274 Ca 0.04 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.59 2occ h VAL 274 Cb 1.04 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 32.36 2occ h VAL 274 CO 0.10 0.30 -0.02 -0.25 0.02 0.00 0.00 177.57 177.73 2occ h TRP 275 N 0.06 -0.04 -0.61 1.57 7.01 -1.04 -2.03 115.95 120.88 2occ h TRP 275 Ca 0.05 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.12 2occ h TRP 275 Cb 0.47 0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.52 2occ h TRP 275 CO 0.05 -0.04 0.32 0.00 -2.79 0.00 0.00 178.44 175.98 2occ h ALA 276 N 1.15 0.80 -0.30 2.65 0.00 -0.61 -1.19 119.26 121.75 2occ h ALA 276 Ca 0.08 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2occ h ALA 276 Cb 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2occ h ALA 276 CO -0.14 -0.02 -0.15 0.52 0.00 0.00 0.00 179.25 179.45 2occ h MET 277 N 0.60 0.54 -0.37 0.00 2.86 -1.09 -1.10 114.93 116.36 2occ h MET 277 Ca 0.28 -0.17 -0.15 0.00 -2.06 0.00 0.00 59.70 57.59 2occ h MET 277 Cb 0.19 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2occ h MET 277 CO -0.19 0.68 -0.37 0.52 1.06 0.00 0.00 176.91 178.61 2occ h MET 278 N 0.49 0.87 -0.20 1.72 2.07 -0.61 -1.76 114.93 117.51 2occ h MET 278 Ca 0.09 -0.44 -0.01 0.00 -2.07 0.00 0.00 59.70 57.26 2occ h MET 278 Cb 0.55 0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.28 2occ h MET 278 CO 0.04 1.09 0.09 0.77 1.07 0.00 0.00 176.91 179.96 2occ h SER 279 N 0.71 0.27 -0.84 1.22 0.02 -1.01 -0.13 113.55 113.79 2occ h SER 279 Ca 0.06 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2occ h SER 279 Cb 0.94 -0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.37 2occ h SER 279 CO 0.09 0.35 0.51 0.40 -1.14 0.00 0.00 176.83 177.04 2occ h ILE 280 N 0.18 1.23 0.06 3.27 2.04 -1.18 -0.42 117.51 122.69 2occ h ILE 280 Ca 0.07 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.43 2occ h ILE 280 Cb 0.15 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 2occ h ILE 280 CO -0.01 0.24 -0.03 1.23 0.00 0.00 0.00 178.15 179.59 2occ h GLY 281 N 1.15 -0.08 0.93 5.37 0.00 -1.06 -1.12 103.07 108.26 2occ h GLY 281 Ca 0.30 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.64 2occ h GLY 281 CO -0.06 -0.03 -0.21 -2.75 0.00 0.00 0.00 176.54 173.50 2occ h PHE 282 N -0.15 -0.53 -0.14 5.60 3.57 -0.87 -3.06 116.94 121.37 2occ h PHE 282 Ca -0.01 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.50 2occ h PHE 282 Cb 0.12 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 2occ h PHE 282 CO -0.05 -0.29 0.09 -0.07 -2.23 0.00 0.00 178.31 175.76 2occ h LEU 283 N -0.65 0.10 0.00 0.59 3.38 -1.10 -2.21 115.31 115.42 2occ h LEU 283 Ca -0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2occ h LEU 283 Cb 0.48 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2occ h LEU 283 CO 0.10 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.30 2occ n GLY 284 N -1.54 -0.53 0.00 0.83 0.00 -0.43 -2.25 105.19 101.28 2occ n GLY 284 Ca -0.00 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.00 2occ n GLY 284 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2occ n PHE 285 N -0.98 0.00 -1.43 1.61 3.72 -0.83 -3.63 117.46 115.92 2occ n PHE 285 Ca 0.12 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.59 2occ n PHE 285 Cb 0.06 0.00 0.19 0.00 -0.94 0.00 0.00 39.48 38.78 2occ n PHE 285 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2occ n ILE 286 N -1.39 2.11 -0.87 4.37 -5.35 -0.96 -4.69 119.36 112.59 2occ n ILE 286 Ca 0.03 -2.94 0.01 0.00 -0.27 0.00 0.00 62.75 59.59 2occ n ILE 286 Cb 0.27 -0.24 0.01 0.00 -1.74 0.00 0.00 39.64 37.94 2occ n ILE 286 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2occ n VAL 287 N -1.22 0.50 -0.31 7.28 0.24 -1.25 -4.93 118.33 118.64 2occ n VAL 287 Ca 0.18 -0.54 0.12 0.00 -2.04 0.00 0.00 64.34 62.07 2occ n VAL 287 Cb 0.68 0.64 0.30 0.00 -1.47 0.00 0.00 33.84 33.99 2occ n VAL 287 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 2occ h TRP 288 N 0.00 0.77 0.00 6.34 0.09 -1.84 -2.22 115.95 119.10 2occ h TRP 288 Ca 0.00 0.04 0.00 0.00 0.09 0.00 0.00 58.89 59.02 2occ h TRP 288 Cb 0.91 -0.20 0.00 0.00 0.08 0.00 0.00 29.16 29.95 2occ h TRP 288 CO 0.02 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.60 2occ n ALA 289 N -2.43 1.80 1.11 0.11 0.00 -1.26 -2.23 120.51 117.60 2occ n ALA 289 Ca 0.22 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.72 2occ n ALA 289 Cb 0.61 -1.09 0.55 0.00 0.00 0.00 0.00 19.45 19.51 2occ n ALA 289 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2occ n HIS 290 N -0.83 0.00 -0.53 0.00 1.44 -0.84 -1.64 115.22 112.82 2occ n HIS 290 Ca 0.04 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.85 2occ n HIS 290 Cb 0.02 -0.11 0.32 0.00 0.12 0.00 0.00 29.99 30.34 2occ n HIS 290 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2occ n HIS 291 N -1.11 1.22 -2.66 -1.40 8.25 -0.95 -4.43 115.22 114.13 2occ n HIS 291 Ca 0.13 -0.58 0.01 0.00 -0.26 0.00 0.00 57.72 57.02 2occ n HIS 291 Cb 0.10 -0.16 0.04 0.00 1.12 0.00 0.00 29.99 31.09 2occ n HIS 291 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2occ n MET 292 N 1.12 0.96 0.08 -0.41 2.00 -0.65 -4.89 117.12 115.33 2occ n MET 292 Ca 0.24 -2.70 0.11 0.00 0.00 0.00 0.00 57.70 55.35 2occ n MET 292 Cb 0.77 -0.79 0.45 0.00 0.00 0.00 0.00 33.22 33.65 2occ n MET 292 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 2occ n PHE 293 N -0.18 0.57 -1.08 2.03 3.72 -1.25 -2.87 117.46 118.39 2occ n PHE 293 Ca 0.04 0.21 0.08 0.00 -0.05 0.00 0.00 57.45 57.73 2occ n PHE 293 Cb 0.94 -0.84 0.21 0.00 -0.94 0.00 0.00 39.48 38.86 2occ n PHE 293 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2occ n THR 294 N -2.00 2.17 0.84 4.37 -2.24 -1.26 -4.62 114.28 111.54 2occ n THR 294 Ca 0.03 -2.14 0.11 0.00 -2.27 0.00 0.00 64.05 59.79 2occ n THR 294 Cb 0.26 -0.26 0.08 0.00 -2.10 0.00 0.00 70.33 68.31 2occ n THR 294 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2occ n VAL 295 N -0.92 0.06 -0.18 2.28 0.31 -1.14 -4.97 118.33 113.78 2occ n VAL 295 Ca 0.20 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 2occ n VAL 295 Cb 0.81 0.42 0.00 0.00 -0.91 0.00 0.00 33.84 34.16 2occ n VAL 295 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2occ n GLY 296 N 1.45 1.51 3.89 2.92 0.00 -1.26 -5.10 105.19 108.60 2occ n GLY 296 Ca 0.04 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2occ n GLY 296 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2occ s MET 297 N -0.89 3.66 0.62 1.61 1.00 -1.26 -5.03 119.30 119.02 2occ s MET 297 Ca 0.00 0.26 -0.18 0.00 0.00 0.00 0.00 55.69 55.78 2occ s MET 297 Cb 0.00 -2.45 -0.06 0.00 0.00 0.00 0.00 34.83 32.33 2occ s MET 297 CO 0.00 -0.03 0.72 -0.25 0.00 0.00 0.00 175.02 175.46 2occ n ASP 298 N -1.54 -0.29 -0.06 3.03 8.00 -1.26 -4.82 116.55 119.60 2occ n ASP 298 Ca 0.01 0.73 -0.05 0.00 0.71 0.00 0.00 54.79 56.19 2occ n ASP 298 Cb 0.54 -1.28 0.17 0.00 -0.02 0.00 0.00 41.12 40.53 2occ n ASP 298 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2occ h VAL 299 N 0.17 1.25 -0.55 2.53 3.04 -1.98 -2.37 116.25 118.34 2occ h VAL 299 Ca -0.47 -1.14 -0.05 0.00 -1.01 0.00 0.00 66.70 64.03 2occ h VAL 299 Cb 1.37 1.10 -0.02 0.00 -2.01 0.00 0.00 31.29 31.74 2occ h VAL 299 CO 0.48 0.38 0.16 0.44 -1.01 0.00 0.00 177.57 178.02 2occ h ASP 300 N 0.61 0.81 0.85 3.17 3.32 -1.99 0.28 116.42 123.47 2occ h ASP 300 Ca 0.10 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 2occ h ASP 300 Cb 0.57 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2occ h ASP 300 CO 0.04 0.81 -0.23 0.71 -1.72 0.00 0.00 179.24 178.84 2occ h THR 301 N 0.76 0.60 -0.01 0.35 1.35 -1.89 -1.50 112.91 112.58 2occ h THR 301 Ca 0.17 -1.11 -0.17 0.00 -0.55 0.00 0.00 66.41 64.75 2occ h THR 301 Cb 0.30 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 68.44 2occ h THR 301 CO -0.00 0.23 -0.80 0.03 -0.25 0.00 0.00 175.52 174.73 2occ h ARG 302 N 0.00 0.10 -0.39 4.72 3.08 -0.84 -1.81 114.38 119.24 2occ h ARG 302 Ca -0.00 -0.10 -0.14 0.00 0.07 0.00 0.00 59.98 59.81 2occ h ARG 302 Cb 0.72 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 2occ h ARG 302 CO 0.03 0.84 -0.31 0.00 -1.07 0.00 0.00 179.97 179.46 2occ h ALA 303 N 1.12 0.71 0.43 0.04 0.00 -0.35 -2.54 119.26 118.67 2occ h ALA 303 Ca -0.02 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 2occ h ALA 303 Cb 1.40 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2occ h ALA 303 CO 0.11 0.66 -0.21 -0.92 0.00 0.00 0.00 179.25 178.90 2occ h TYR 304 N 0.72 -0.54 -0.01 0.00 3.20 -1.14 -2.15 116.97 117.05 2occ h TYR 304 Ca 0.08 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.94 2occ h TYR 304 Cb 0.87 0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.32 2occ h TYR 304 CO 0.05 -0.26 0.02 0.74 -1.64 0.00 0.00 178.16 177.08 2occ h PHE 305 N -0.73 0.00 0.20 -3.82 0.04 -1.34 0.12 116.94 111.42 2occ h PHE 305 Ca -0.06 0.00 -0.34 0.00 2.80 0.00 0.00 57.97 60.37 2occ h PHE 305 Cb 0.52 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.68 2occ h PHE 305 CO -0.01 0.00 -1.67 1.79 -0.60 0.00 0.00 178.31 177.82 2occ h THR 306 N 0.00 1.04 0.15 -1.55 1.35 -1.36 -2.80 112.91 109.74 2occ h THR 306 Ca 0.01 -2.59 -0.01 0.00 -0.55 0.00 0.00 66.41 63.27 2occ h THR 306 Cb 0.06 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2occ h THR 306 CO -0.00 0.84 -0.07 0.28 -0.25 0.00 0.00 175.52 176.32 2occ h SER 307 N 0.11 -0.17 -0.83 5.36 0.02 -0.65 -2.30 113.55 115.09 2occ h SER 307 Ca -0.31 -0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.60 2occ h SER 307 Cb 2.11 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 64.65 2occ h SER 307 CO 0.20 -0.07 0.52 0.00 -1.14 0.00 0.00 176.83 176.34 2occ h ALA 308 N 0.59 1.06 -0.09 3.77 0.00 -0.94 -2.35 119.26 121.30 2occ h ALA 308 Ca -0.02 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2occ h ALA 308 Cb 0.20 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2occ h ALA 308 CO 0.03 0.50 -0.16 1.15 0.00 0.00 0.00 179.25 180.78 2occ h THR 309 N 1.14 1.16 -0.01 0.00 2.02 -1.34 -3.06 112.91 112.81 2occ h THR 309 Ca 0.30 -0.74 -0.16 0.00 0.77 0.00 0.00 66.41 66.58 2occ h THR 309 Cb -0.07 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2occ h THR 309 CO -0.06 0.22 -0.73 0.24 0.37 0.00 0.00 175.52 175.57 2occ h MET 310 N 0.13 0.10 0.00 6.66 2.86 -0.86 -3.18 114.93 120.65 2occ h MET 310 Ca 0.03 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2occ h MET 310 Cb 0.36 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2occ h MET 310 CO 0.02 0.78 0.00 0.44 1.06 0.00 0.00 176.91 179.22 2occ n ILE 311 N -3.73 0.95 0.25 -1.22 -5.35 -1.16 -1.67 119.36 107.44 2occ n ILE 311 Ca -0.02 0.43 0.05 0.00 -0.27 0.00 0.00 62.75 62.94 2occ n ILE 311 Cb 0.70 -1.38 0.23 0.00 -1.74 0.00 0.00 39.64 37.45 2occ n ILE 311 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 2occ n ILE 312 N -2.20 1.39 0.12 7.28 5.41 -1.20 -1.67 119.36 128.49 2occ n ILE 312 Ca 0.01 0.40 -0.01 0.00 1.00 0.00 0.00 62.75 64.14 2occ n ILE 312 Cb 0.15 -1.29 0.02 0.00 -0.71 0.00 0.00 39.64 37.81 2occ n ILE 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2occ h ALA 313 N 2.23 0.62 0.80 -1.39 0.00 -1.55 -3.06 119.26 116.91 2occ h ALA 313 Ca 0.00 -0.62 -0.04 0.00 0.00 0.00 0.00 54.91 54.25 2occ h ALA 313 Cb 0.14 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.83 2occ h ALA 313 CO 0.00 0.85 -0.39 0.82 0.00 0.00 0.00 179.25 180.53 2occ h ILE 314 N 0.00 0.00 -0.09 0.00 2.04 -1.53 0.31 117.51 118.24 2occ h ILE 314 Ca -0.01 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 2occ h ILE 314 Cb 1.44 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2occ h ILE 314 CO 0.09 0.00 0.03 1.55 0.00 0.00 0.00 178.15 179.82 2occ h PRO 315 N -1.21 0.11 -0.07 2.37 0.13 -1.72 -0.34 132.00 131.26 2occ h PRO 315 Ca -0.11 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 64.87 2occ h PRO 315 Cb 0.83 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.92 2occ h PRO 315 CO 0.18 0.10 -0.57 1.15 -0.23 0.00 0.00 178.00 178.63 2occ h THR 316 N 0.12 1.38 -0.46 1.56 2.02 -1.42 -3.03 112.91 113.08 2occ h THR 316 Ca 0.03 -1.90 -0.14 0.00 0.77 0.00 0.00 66.41 65.17 2occ h THR 316 Cb 0.03 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 2occ h THR 316 CO -0.00 0.56 -0.26 1.23 0.37 0.00 0.00 175.52 177.42 2occ h GLY 317 N 1.46 1.06 1.85 2.16 0.00 0.13 -1.96 103.07 107.77 2occ h GLY 317 Ca -0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 47.33 46.33 2occ h GLY 317 CO 0.09 0.89 -0.02 -0.39 0.00 0.00 0.00 176.54 177.10 2occ h VAL 318 N 0.83 1.11 -0.15 4.60 -1.51 -1.28 -1.05 116.25 118.80 2occ h VAL 318 Ca 0.10 -0.42 -0.05 0.00 -1.23 0.00 0.00 66.70 65.10 2occ h VAL 318 Cb 0.84 1.02 -0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2occ h VAL 318 CO 0.07 0.14 -0.09 0.11 -1.23 0.00 0.00 177.57 176.57 2occ h LYS 319 N 0.20 0.33 -0.65 5.19 1.57 -1.35 -0.35 116.57 121.51 2occ h LYS 319 Ca 0.05 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2occ h LYS 319 Cb 0.17 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 2occ h LYS 319 CO 0.00 0.67 0.42 0.28 -0.57 0.00 0.00 179.45 180.25 2occ h VAL 320 N -0.01 1.17 0.00 0.50 2.07 -0.88 -1.94 116.25 117.16 2occ h VAL 320 Ca 0.03 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 2occ h VAL 320 Cb 0.58 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2occ h VAL 320 CO 0.03 0.16 -0.32 -0.26 0.02 0.00 0.00 177.57 177.20 2occ h PHE 321 N 0.88 0.00 -0.05 1.57 0.04 -1.18 -2.84 116.94 115.35 2occ h PHE 321 Ca 0.24 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.82 2occ h PHE 321 Cb -0.09 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.05 2occ h PHE 321 CO -0.03 0.32 -0.75 0.77 -0.60 0.00 0.00 178.31 178.03 2occ h SER 322 N 0.00 0.39 -0.52 2.17 0.02 -0.38 -0.74 113.55 114.49 2occ h SER 322 Ca -0.00 -0.26 -0.08 0.00 -0.84 0.00 0.00 61.79 60.60 2occ h SER 322 Cb 0.83 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 2occ h SER 322 CO 0.04 1.00 0.01 -0.50 -1.14 0.00 0.00 176.83 176.24 2occ h TRP 323 N 0.21 1.03 -0.32 3.45 6.55 -1.25 -0.49 115.95 125.13 2occ h TRP 323 Ca -0.03 -0.16 -0.14 0.00 0.95 0.00 0.00 58.89 59.51 2occ h TRP 323 Cb 1.32 -0.27 -0.01 0.00 -0.86 0.00 0.00 29.16 29.34 2occ h TRP 323 CO 0.04 0.91 -0.37 -0.07 -1.05 0.00 0.00 178.44 177.90 2occ h LEU 324 N 0.88 0.79 -1.43 -4.49 4.07 -1.40 -2.79 115.31 110.94 2occ h LEU 324 Ca 0.16 -0.35 -0.05 0.00 0.08 0.00 0.00 57.88 57.73 2occ h LEU 324 Cb 0.50 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 2occ h LEU 324 CO 0.02 1.08 -0.24 0.00 -1.08 0.00 0.00 178.44 178.23 2occ h ALA 325 N 0.96 1.18 -0.19 1.53 0.00 -0.73 -2.57 119.26 119.45 2occ h ALA 325 Ca 0.06 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.56 2occ h ALA 325 Cb 0.92 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2occ h ALA 325 CO 0.08 0.29 -0.66 1.15 0.00 0.00 0.00 179.25 180.11 2occ h THR 326 N 0.00 1.30 0.00 0.00 2.02 -0.88 -2.98 112.91 112.37 2occ h THR 326 Ca -0.00 -1.89 -0.08 0.00 0.77 0.00 0.00 66.41 65.21 2occ h THR 326 Cb 0.60 1.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.84 2occ h THR 326 CO 0.03 0.60 -0.38 -0.07 0.37 0.00 0.00 175.52 176.07 2occ h LEU 327 N 0.53 0.00 -9.11 2.58 3.38 -1.25 -3.41 115.31 108.03 2occ h LEU 327 Ca -0.02 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.29 2occ h LEU 327 Cb 1.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.03 2occ h LEU 327 CO 0.13 0.38 1.12 1.57 0.09 0.00 0.00 178.44 181.73 2occ n HIS 328 N -3.97 2.13 -0.97 1.13 -0.00 -0.99 -0.83 115.22 111.72 2occ n HIS 328 Ca -0.02 0.18 0.00 0.00 0.46 0.00 0.00 57.72 58.34 2occ n HIS 328 Cb 0.43 -2.59 0.00 0.00 -0.12 0.00 0.00 29.99 27.70 2occ n HIS 328 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2occ n GLY 329 N 4.76 0.52 3.84 1.57 0.00 -1.26 -5.02 105.19 109.60 2occ n GLY 329 Ca 0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 2occ n GLY 329 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2occ s GLY 330 N -2.00 1.62 -0.85 -0.02 0.00 -0.01 -4.96 107.32 101.10 2occ s GLY 330 Ca 0.00 -0.32 -0.15 0.00 0.00 0.00 0.00 44.72 44.25 2occ s GLY 330 CO 0.00 0.10 0.83 0.21 0.00 0.00 0.00 173.10 174.25 2occ s ASN 331 N -4.13 6.77 0.01 1.64 2.47 -0.19 -5.00 114.94 116.51 2occ s ASN 331 Ca 0.60 -2.64 -0.30 0.00 0.42 0.00 0.00 52.86 50.94 2occ s ASN 331 Cb -0.13 -2.24 -0.06 0.00 -1.45 0.00 0.00 41.25 37.37 2occ s ASN 331 CO 0.53 -0.63 1.45 -0.63 -3.72 0.00 0.00 177.10 174.10 2occ s ILE 332 N 0.47 3.58 -0.33 -5.21 -1.09 -1.26 -3.99 121.20 113.37 2occ s ILE 332 Ca 0.21 0.97 -0.10 0.00 -2.23 0.00 0.00 60.65 59.50 2occ s ILE 332 Cb -0.09 -3.62 0.01 0.00 -1.58 0.00 0.00 42.46 37.17 2occ s ILE 332 CO -0.09 -0.00 0.16 -0.75 -1.23 0.00 0.00 174.94 173.03 2occ s LYS 333 N 2.47 3.06 -1.24 2.79 2.20 -0.46 -5.01 119.74 123.56 2occ s LYS 333 Ca 0.66 -0.91 -0.15 0.00 -0.36 0.00 0.00 55.97 55.21 2occ s LYS 333 Cb -0.33 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 2occ s LYS 333 CO 0.28 -0.54 2.22 0.91 -0.36 0.00 0.00 175.35 177.86 2occ n TRP 334 N 4.96 2.76 -2.48 4.03 7.02 -1.26 -4.78 117.44 127.69 2occ n TRP 334 Ca -0.13 -2.58 -0.26 0.00 -1.02 0.00 0.00 57.50 53.51 2occ n TRP 334 Cb 0.47 -2.24 0.03 0.00 -2.42 0.00 0.00 31.31 27.16 2occ n TRP 334 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2occ s SER 335 N 3.60 5.54 0.19 -0.99 1.04 -1.26 -4.92 113.70 116.90 2occ s SER 335 Ca 0.52 0.58 -0.11 0.00 0.48 0.00 0.00 55.95 57.42 2occ s SER 335 Cb 0.14 -1.57 0.19 0.00 0.10 0.00 0.00 66.02 64.88 2occ s SER 335 CO -0.02 -1.06 1.79 1.55 0.98 0.00 0.00 173.24 176.48 2occ h PRO 336 N -0.11 0.55 -0.92 4.02 0.13 -1.92 -1.37 132.00 132.38 2occ h PRO 336 Ca -0.45 -0.03 0.08 0.00 -0.87 0.00 0.00 66.00 64.73 2occ h PRO 336 Cb 1.26 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 2occ h PRO 336 CO 0.60 0.37 0.60 0.00 -0.23 0.00 0.00 178.00 179.33 2occ h ALA 337 N 1.31 1.55 -0.23 -0.56 0.00 -1.91 0.82 119.26 120.23 2occ h ALA 337 Ca 0.26 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2occ h ALA 337 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2occ h ALA 337 CO -0.18 0.28 -0.33 1.98 0.00 0.00 0.00 179.25 181.00 2occ h MET 338 N 0.98 0.49 -0.56 0.00 -1.53 -1.61 -1.40 114.93 111.31 2occ h MET 338 Ca 0.42 -0.22 -0.05 0.00 -3.44 0.00 0.00 59.70 56.41 2occ h MET 338 Cb 0.32 -0.01 -0.02 0.00 -0.55 0.00 0.00 31.60 31.33 2occ h MET 338 CO -0.18 0.77 0.15 0.52 0.14 0.00 0.00 176.91 178.31 2occ h MET 339 N 0.42 0.89 -0.58 0.39 2.86 0.13 -0.84 114.93 118.19 2occ h MET 339 Ca 0.05 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 2occ h MET 339 Cb 0.79 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 2occ h MET 339 CO 0.06 0.82 0.17 -1.49 1.06 0.00 0.00 176.91 177.54 2occ h TRP 340 N 0.79 0.89 -0.25 -0.22 4.06 -0.83 -2.42 115.95 117.97 2occ h TRP 340 Ca 0.18 -0.07 -0.16 0.00 2.06 0.00 0.00 58.89 60.90 2occ h TRP 340 Cb 0.33 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 28.22 2occ h TRP 340 CO 0.02 0.73 -0.49 0.00 -3.56 0.00 0.00 178.44 175.14 2occ h ALA 341 N 1.34 0.67 -0.28 1.49 0.00 -0.83 -1.92 119.26 119.74 2occ h ALA 341 Ca 0.19 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 2occ h ALA 341 Cb 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2occ h ALA 341 CO -0.01 0.68 -0.46 -0.07 0.00 0.00 0.00 179.25 179.39 2occ h LEU 342 N 0.53 0.79 -0.61 0.00 3.38 -1.02 -2.07 115.31 116.31 2occ h LEU 342 Ca 0.03 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 2occ h LEU 342 Cb 1.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 2occ h LEU 342 CO 0.10 1.13 0.33 1.23 0.09 0.00 0.00 178.44 181.32 2occ h GLY 343 N 0.91 0.91 0.79 0.83 0.00 -1.35 -2.59 103.07 102.58 2occ h GLY 343 Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 2occ h GLY 343 CO 0.10 0.40 -0.22 -2.75 0.00 0.00 0.00 176.54 174.07 2occ h PHE 344 N 0.83 -0.58 -0.75 5.60 3.04 -1.24 0.90 116.94 124.74 2occ h PHE 344 Ca 0.21 0.00 0.16 0.00 3.98 0.00 0.00 57.97 62.33 2occ h PHE 344 Cb 0.05 0.22 -0.11 0.00 2.56 0.00 0.00 35.95 38.67 2occ h PHE 344 CO -0.01 -0.33 0.22 0.82 -2.02 0.00 0.00 178.31 176.99 2occ h ILE 345 N -0.49 0.54 0.03 1.41 2.04 -1.16 0.28 117.51 120.15 2occ h ILE 345 Ca -0.01 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 2occ h ILE 345 Cb 0.44 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2occ h ILE 345 CO -0.03 0.06 -0.01 0.15 0.00 0.00 0.00 178.15 178.32 2occ h PHE 346 N 0.31 -0.03 -0.87 1.37 3.57 -1.13 -3.05 116.94 117.11 2occ h PHE 346 Ca 0.43 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.90 2occ h PHE 346 Cb 0.72 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 2occ h PHE 346 CO -0.23 0.68 0.44 -0.07 -2.23 0.00 0.00 178.31 176.89 2occ h LEU 347 N -0.88 1.12 -1.13 0.59 4.07 -0.63 -1.40 115.31 117.04 2occ h LEU 347 Ca -0.00 -0.12 -0.05 0.00 0.08 0.00 0.00 57.88 57.78 2occ h LEU 347 Cb 0.73 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.16 2occ h LEU 347 CO 0.01 0.92 0.05 0.15 -1.08 0.00 0.00 178.44 178.49 2occ h PHE 348 N 1.23 0.69 -0.65 1.13 3.57 -0.58 -0.86 116.94 121.47 2occ h PHE 348 Ca 0.30 -0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 2occ h PHE 348 Cb 0.09 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 2occ h PHE 348 CO 0.01 0.62 0.13 1.15 -2.23 0.00 0.00 178.31 178.00 2occ h THR 349 N 0.64 1.26 -0.01 4.41 2.02 -1.17 0.80 112.91 120.86 2occ h THR 349 Ca 0.14 -0.98 -0.00 0.00 0.77 0.00 0.00 66.41 66.34 2occ h THR 349 Cb 0.32 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.38 2occ h THR 349 CO 0.01 0.37 0.00 0.58 0.37 0.00 0.00 175.52 176.85 2occ h VAL 350 N 0.97 1.14 -0.22 3.16 2.07 -0.93 -0.82 116.25 121.62 2occ h VAL 350 Ca 0.20 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2occ h VAL 350 Cb 0.40 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2occ h VAL 350 CO 0.01 0.11 0.04 1.23 0.02 0.00 0.00 177.57 178.97 2occ h GLY 351 N -0.16 0.34 1.52 2.17 0.00 -1.04 -1.86 103.07 104.03 2occ h GLY 351 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 47.33 46.94 2occ h GLY 351 CO -0.00 0.15 -0.99 -1.33 0.00 0.00 0.00 176.54 174.37 2occ h GLY 352 N 0.54 0.47 1.07 4.60 0.00 -0.53 -2.80 103.07 106.42 2occ h GLY 352 Ca 0.08 -0.87 -0.10 0.00 0.00 0.00 0.00 47.33 46.44 2occ h GLY 352 CO -0.00 0.77 -0.03 1.41 0.00 0.00 0.00 176.54 178.69 2occ h LEU 353 N 0.23 1.01 -2.41 3.11 4.07 -0.84 -1.73 115.31 118.74 2occ h LEU 353 Ca -0.09 -0.32 -0.01 0.00 0.08 0.00 0.00 57.88 57.54 2occ h LEU 353 Cb 1.64 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 43.11 2occ h LEU 353 CO 0.17 1.08 -0.03 0.74 -1.08 0.00 0.00 178.44 179.32 2occ h THR 354 N 0.91 0.34 0.00 0.22 2.02 -1.34 0.73 112.91 115.79 2occ h THR 354 Ca 0.16 -0.18 -0.10 0.00 0.77 0.00 0.00 66.41 67.06 2occ h THR 354 Cb 0.58 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2occ h THR 354 CO 0.03 0.03 -0.53 1.23 0.37 0.00 0.00 175.52 176.65 2occ h GLY 355 N 0.37 0.00 1.90 2.16 0.00 -1.04 -3.08 103.07 103.38 2occ h GLY 355 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2occ h GLY 355 CO 0.00 0.00 -0.70 -2.22 0.00 0.00 0.00 176.54 173.63 2occ h ILE 356 N 0.00 1.46 -0.16 2.60 1.08 -0.54 -2.22 117.51 119.74 2occ h ILE 356 Ca -0.01 -2.30 -0.01 0.00 -0.39 0.00 0.00 64.86 62.15 2occ h ILE 356 Cb 1.37 2.23 -0.01 0.00 -3.07 0.00 0.00 36.82 37.34 2occ h ILE 356 CO 0.06 0.66 0.06 0.58 -0.69 0.00 0.00 178.15 178.83 2occ h VAL 357 N 0.07 1.15 0.00 1.67 2.07 -1.39 -2.51 116.25 117.31 2occ h VAL 357 Ca -0.01 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.04 2occ h VAL 357 Cb 1.24 1.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 2occ h VAL 357 CO 0.10 0.14 0.00 -0.07 0.02 0.00 0.00 177.57 177.76 2occ h LEU 358 N 0.10 0.00 -1.75 2.57 3.38 -1.46 -2.59 115.31 115.57 2occ h LEU 358 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2occ h LEU 358 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2occ h LEU 358 CO -0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 2occ h ALA 359 N 2.05 1.00 -1.67 1.53 0.00 -0.93 -3.41 119.26 117.83 2occ h ALA 359 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 2occ h ALA 359 Cb 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 2occ h ALA 359 CO 0.00 0.00 1.00 -0.80 0.00 0.00 0.00 179.25 179.45 2occ s ASN 360 N -5.41 6.45 0.20 0.00 0.01 -0.98 -4.37 114.94 110.83 2occ s ASN 360 Ca -0.00 0.40 -0.11 0.00 -0.71 0.00 0.00 52.86 52.45 2occ s ASN 360 Cb 0.10 -2.55 0.23 0.00 0.41 0.00 0.00 41.25 39.44 2occ s ASN 360 CO 0.49 -1.43 1.75 0.77 -1.51 0.00 0.00 177.10 177.18 2occ h SER 361 N 9.89 0.25 -0.13 -1.22 4.64 -1.87 0.40 113.55 125.51 2occ h SER 361 Ca -0.25 0.06 0.05 0.00 -0.47 0.00 0.00 61.79 61.18 2occ h SER 361 Cb 1.07 0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 63.14 2occ h SER 361 CO 1.15 0.16 -0.26 0.77 -0.87 0.00 0.00 176.83 177.78 2occ h SER 362 N 0.42 -0.80 1.05 4.97 4.64 -1.95 -0.97 113.55 120.91 2occ h SER 362 Ca 0.28 0.13 -0.05 0.00 -0.47 0.00 0.00 61.79 61.67 2occ h SER 362 Cb 0.31 0.35 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 2occ h SER 362 CO -0.27 -0.31 -0.26 0.25 -0.87 0.00 0.00 176.83 175.38 2occ h LEU 363 N -0.33 0.00 -0.71 5.97 5.85 -1.79 -2.92 115.31 121.38 2occ h LEU 363 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2occ h LEU 363 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2occ h LEU 363 CO -0.32 0.26 0.00 -0.78 -0.34 0.00 0.00 178.44 177.26 2occ h ASP 364 N 0.00 0.00 -0.28 1.25 3.58 0.12 -3.05 116.42 118.03 2occ h ASP 364 Ca -0.00 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.50 2occ h ASP 364 Cb 0.85 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.85 2occ h ASP 364 CO 0.03 0.00 -0.07 0.40 -2.88 0.00 0.00 179.24 176.73 2occ h ILE 365 N 0.00 0.72 0.00 2.25 1.08 -1.23 0.30 117.51 120.63 2occ h ILE 365 Ca 0.00 -0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2occ h ILE 365 Cb 0.49 0.72 0.00 0.00 -3.07 0.00 0.00 36.82 34.96 2occ h ILE 365 CO 0.00 0.00 -0.40 0.55 -0.69 0.00 0.00 178.15 177.61 2occ n VAL 366 N -5.24 0.01 -0.05 1.67 3.14 -1.17 -4.07 118.33 112.62 2occ n VAL 366 Ca -0.00 -0.01 -0.00 0.00 -2.96 0.00 0.00 64.34 61.37 2occ n VAL 366 Cb 0.16 0.09 -0.15 0.00 -1.06 0.00 0.00 33.84 32.88 2occ n VAL 366 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2occ n LEU 367 N -1.52 0.00 -4.69 6.55 4.77 -1.05 -4.88 117.00 116.18 2occ n LEU 367 Ca 0.06 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.61 2occ n LEU 367 Cb 0.34 0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.66 2occ n LEU 367 CO 0.33 0.24 0.89 1.57 -1.33 0.00 0.00 177.39 179.10 2occ n HIS 368 N -2.46 2.22 -1.55 -1.77 -0.00 0.10 -1.82 115.22 109.95 2occ n HIS 368 Ca -0.18 0.55 -0.19 0.00 0.46 0.00 0.00 57.72 58.37 2occ n HIS 368 Cb 0.83 -2.41 -0.08 0.00 -0.12 0.00 0.00 29.99 28.21 2occ n HIS 368 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2occ n ASP 369 N 0.90 -5.46 -4.86 0.26 8.00 -1.26 -4.99 116.55 109.14 2occ n ASP 369 Ca 0.05 0.47 -0.25 0.00 0.71 0.00 0.00 54.79 55.77 2occ n ASP 369 Cb 0.35 -4.62 -0.03 0.00 -0.02 0.00 0.00 41.12 36.80 2occ n ASP 369 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2occ s THR 370 N -2.64 2.02 -1.98 -3.53 -4.23 -0.75 -1.24 115.64 103.28 2occ s THR 370 Ca 0.00 -1.51 0.18 0.00 -1.18 0.00 0.00 61.69 59.17 2occ s THR 370 Cb 0.00 -2.53 0.50 0.00 1.34 0.00 0.00 72.50 71.81 2occ s THR 370 CO 0.00 0.00 1.47 -1.22 -0.54 0.00 0.00 174.62 174.33 2occ n TYR 371 N -1.59 0.00 0.11 3.99 4.02 -0.51 -2.33 117.16 120.85 2occ n TYR 371 Ca -0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.85 2occ n TYR 371 Cb 0.64 -0.01 0.13 0.00 -0.02 0.00 0.00 39.34 40.08 2occ n TYR 371 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 2occ h TYR 372 N 0.00 0.13 0.00 -0.72 3.20 -1.81 -1.78 116.97 116.00 2occ h TYR 372 Ca 0.00 -0.06 -0.19 0.00 3.14 0.00 0.00 58.73 61.62 2occ h TYR 372 Cb 0.01 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2occ h TYR 372 CO 0.00 0.72 -0.92 -0.39 -1.64 0.00 0.00 178.16 175.93 2occ h VAL 373 N 0.07 1.64 -0.26 1.81 -1.51 -1.69 -2.58 116.25 113.75 2occ h VAL 373 Ca -0.01 -3.10 -0.05 0.00 -1.23 0.00 0.00 66.70 62.31 2occ h VAL 373 Cb 1.16 2.68 -0.01 0.00 -2.13 0.00 0.00 31.29 32.99 2occ h VAL 373 CO 0.09 0.89 -0.07 0.58 -1.23 0.00 0.00 177.57 177.83 2occ h VAL 374 N 0.01 1.19 0.03 7.19 2.07 -1.61 -2.05 116.25 123.09 2occ h VAL 374 Ca -0.02 -0.82 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 2occ h VAL 374 Cb 1.62 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.47 2occ h VAL 374 CO 0.12 0.27 -0.02 0.00 0.02 0.00 0.00 177.57 177.96 2occ h ALA 375 N 1.55 -0.04 -0.00 1.67 0.00 -1.16 -2.63 119.26 118.63 2occ h ALA 375 Ca 0.08 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2occ h ALA 375 Cb 0.37 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2occ h ALA 375 CO 0.02 -0.31 -0.41 1.25 0.00 0.00 0.00 179.25 179.80 2occ h HIS 376 N -0.48 -1.20 0.00 0.00 6.17 -1.12 -1.60 115.15 116.92 2occ h HIS 376 Ca -0.00 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.11 2occ h HIS 376 Cb 0.44 0.53 0.00 0.00 2.52 0.00 0.00 27.41 30.90 2occ h HIS 376 CO 0.07 -0.44 0.00 0.27 0.71 0.00 0.00 177.93 178.54 2occ h PHE 377 N -0.51 0.00 0.00 5.26 -5.15 -1.47 -0.93 116.94 114.14 2occ h PHE 377 Ca 0.01 0.00 -0.11 0.00 -0.20 0.00 0.00 57.97 57.67 2occ h PHE 377 Cb 0.55 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.70 2occ h PHE 377 CO -0.48 0.00 -0.87 0.45 -2.00 0.00 0.00 178.31 175.41 2occ h HIS 378 N 0.00 0.00 -0.24 6.09 3.86 -1.09 -1.52 115.15 122.25 2occ h HIS 378 Ca 0.00 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.11 2occ h HIS 378 Cb 0.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.64 2occ h HIS 378 CO 0.00 0.44 -0.22 1.88 0.86 0.00 0.00 177.93 180.89 2occ h TYR 379 N 0.00 0.69 0.00 2.45 -1.99 -0.19 0.16 116.97 118.09 2occ h TYR 379 Ca -0.06 -0.20 -0.15 0.00 2.00 0.00 0.00 58.73 60.32 2occ h TYR 379 Cb 1.39 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 39.95 2occ h TYR 379 CO 0.00 0.90 -0.71 -0.39 -0.00 0.00 0.00 178.16 177.95 2occ h VAL 380 N 0.28 1.31 0.00 -2.88 -1.51 -1.52 -2.63 116.25 109.30 2occ h VAL 380 Ca 0.04 -2.62 -0.24 0.00 -1.23 0.00 0.00 66.70 62.65 2occ h VAL 380 Cb 0.77 2.50 -0.04 0.00 -2.13 0.00 0.00 31.29 32.39 2occ h VAL 380 CO 0.06 0.70 -1.38 0.18 -1.23 0.00 0.00 177.57 175.90 2occ n LEU 381 N -3.40 1.87 0.12 4.19 4.77 -0.57 -0.94 117.00 123.03 2occ n LEU 381 Ca 0.00 0.43 -0.01 0.00 -0.03 0.00 0.00 56.01 56.41 2occ n LEU 381 Cb 0.77 -0.93 0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2occ n LEU 381 CO 0.43 0.23 0.41 0.28 -1.33 0.00 0.00 177.39 177.41 2occ h SER 382 N -1.00 0.00 -0.03 -1.43 0.02 -0.86 -1.37 113.55 108.88 2occ h SER 382 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2occ h SER 382 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2occ h SER 382 CO -0.22 0.66 0.00 0.23 -1.14 0.00 0.00 176.83 176.36 2occ n MET 383 N -3.40 2.71 0.00 3.45 2.81 -1.02 -4.29 117.12 117.37 2occ n MET 383 Ca 0.00 -1.74 0.00 0.00 -1.81 0.00 0.00 57.70 54.15 2occ n MET 383 Cb 0.74 -1.12 0.00 0.00 -0.71 0.00 0.00 33.22 32.14 2occ n MET 383 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2occ n GLY 384 N -0.58 0.77 0.31 3.03 0.00 -1.02 -4.19 105.19 103.51 2occ n GLY 384 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2occ n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ h ALA 385 N 1.00 0.38 -0.48 4.61 0.00 -0.97 0.13 119.26 123.93 2occ h ALA 385 Ca 0.00 0.28 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 2occ h ALA 385 Cb 0.00 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2occ h ALA 385 CO 0.00 -0.48 0.16 0.28 0.00 0.00 0.00 179.25 179.21 2occ h VAL 386 N -0.03 1.19 -0.16 0.00 2.07 -1.47 -1.25 116.25 116.60 2occ h VAL 386 Ca 0.35 -0.64 -0.13 0.00 0.82 0.00 0.00 66.70 67.10 2occ h VAL 386 Cb 0.57 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2occ h VAL 386 CO -0.80 0.24 -0.46 -0.26 0.02 0.00 0.00 177.57 176.31 2occ h PHE 387 N 0.68 0.47 -0.39 1.57 -1.00 -0.96 -1.77 116.94 115.55 2occ h PHE 387 Ca 0.16 -0.15 -0.11 0.00 2.81 0.00 0.00 57.97 60.69 2occ h PHE 387 Cb 0.19 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 2occ h PHE 387 CO 0.01 0.79 -0.18 0.00 -1.61 0.00 0.00 178.31 177.32 2occ h ALA 388 N 1.19 0.55 -0.42 2.45 0.00 -0.61 -1.20 119.26 121.22 2occ h ALA 388 Ca 0.02 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.60 2occ h ALA 388 Cb 0.94 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 2occ h ALA 388 CO 0.08 0.49 0.21 0.82 0.00 0.00 0.00 179.25 180.85 2occ h ILE 389 N 0.62 0.98 -0.38 0.00 2.04 -1.06 0.17 117.51 119.88 2occ h ILE 389 Ca 0.09 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 2occ h ILE 389 Cb 0.73 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2occ h ILE 389 CO 0.06 0.08 0.05 0.24 0.00 0.00 0.00 178.15 178.57 2occ h MET 390 N 0.43 0.64 -0.20 2.37 2.86 -1.20 0.10 114.93 119.93 2occ h MET 390 Ca 0.18 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2occ h MET 390 Cb 0.08 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2occ h MET 390 CO -0.12 0.71 0.12 0.78 1.06 0.00 0.00 176.91 179.45 2occ h GLY 391 N 0.48 0.28 1.34 8.32 0.00 -0.98 -1.21 103.07 111.30 2occ h GLY 391 Ca 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2occ h GLY 391 CO 0.01 0.11 0.33 -1.33 0.00 0.00 0.00 176.54 175.66 2occ h GLY 392 N 0.24 0.92 0.80 4.60 0.00 -0.55 -1.86 103.07 107.22 2occ h GLY 392 Ca 0.07 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2occ h GLY 392 CO -0.01 0.39 -0.04 -2.75 0.00 0.00 0.00 176.54 174.13 2occ h PHE 393 N 0.87 0.40 0.00 5.60 3.57 -0.36 -1.31 116.94 125.71 2occ h PHE 393 Ca 0.22 -0.08 -0.09 0.00 3.53 0.00 0.00 57.97 61.55 2occ h PHE 393 Cb 0.04 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 2occ h PHE 393 CO 0.01 0.60 -0.43 -0.39 -2.23 0.00 0.00 178.31 175.87 2occ h VAL 394 N 0.08 0.99 0.02 1.41 -1.51 -1.06 -0.44 116.25 115.73 2occ h VAL 394 Ca 0.05 -1.69 -0.00 0.00 -1.23 0.00 0.00 66.70 63.82 2occ h VAL 394 Cb 0.47 2.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.64 2occ h VAL 394 CO 0.02 0.42 -0.01 -0.74 -1.23 0.00 0.00 177.57 176.03 2occ h HIS 395 N 0.00 -0.02 -0.01 5.19 -0.00 -1.28 -3.33 115.15 115.70 2occ h HIS 395 Ca -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2occ h HIS 395 Cb 0.97 0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.39 2occ h HIS 395 CO 0.00 0.63 -0.32 0.91 -0.00 0.00 0.00 177.93 179.15 2occ n TRP 396 N -4.78 0.00 -0.34 5.26 8.01 -0.50 -4.38 117.44 120.71 2occ n TRP 396 Ca -0.09 0.00 0.13 0.00 -1.31 0.00 0.00 57.50 56.23 2occ n TRP 396 Cb 0.33 -0.11 0.31 0.00 -2.01 0.00 0.00 31.31 29.83 2occ n TRP 396 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 2occ h PHE 397 N 1.32 1.00 -0.12 -5.99 3.57 -1.19 -0.60 116.94 114.94 2occ h PHE 397 Ca 0.00 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 2occ h PHE 397 Cb 0.55 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2occ h PHE 397 CO 0.00 0.19 -0.15 -1.35 -2.23 0.00 0.00 178.31 174.77 2occ h PRO 398 N 0.70 0.18 -0.20 6.41 0.11 -1.77 -0.98 132.00 136.47 2occ h PRO 398 Ca 0.57 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 66.43 2occ h PRO 398 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2occ h PRO 398 CO -0.40 0.34 -0.69 1.25 -0.21 0.00 0.00 178.00 178.30 2occ h LEU 399 N 0.18 0.90 -0.40 2.35 5.85 -1.42 0.31 115.31 123.08 2occ h LEU 399 Ca 0.04 -0.55 -0.18 0.00 0.84 0.00 0.00 57.88 58.03 2occ h LEU 399 Cb 0.38 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 2occ h LEU 399 CO 0.02 1.34 -0.60 -0.26 -0.34 0.00 0.00 178.44 178.61 2occ h PHE 400 N 0.56 0.85 0.00 1.25 0.04 -1.04 -3.36 116.94 115.23 2occ h PHE 400 Ca -0.03 -0.32 -0.24 0.00 2.80 0.00 0.00 57.97 60.18 2occ h PHE 400 Cb 1.30 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 39.25 2occ h PHE 400 CO 0.08 1.10 -1.93 -1.13 -0.60 0.00 0.00 178.31 175.82 2occ n SER 401 N -3.96 1.65 0.00 2.17 3.41 -0.40 -4.78 113.62 111.71 2occ n SER 401 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2occ n SER 401 Cb 0.64 0.85 0.00 0.00 -0.26 0.00 0.00 64.21 65.44 2occ n SER 401 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2occ n GLY 402 N 2.15 0.84 3.45 5.00 0.00 0.11 -4.45 105.19 112.29 2occ n GLY 402 Ca -0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.54 2occ n GLY 402 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2occ s TYR 403 N -2.79 2.34 0.19 1.61 2.02 -1.26 -1.52 117.35 117.95 2occ s TYR 403 Ca 0.00 -0.34 0.05 0.00 -0.37 0.00 0.00 57.07 56.41 2occ s TYR 403 Cb 0.00 -1.14 -0.04 0.00 -0.40 0.00 0.00 41.96 40.39 2occ s TYR 403 CO 0.00 0.53 0.23 0.95 -1.57 0.00 0.00 175.55 175.69 2occ s THR 404 N -1.80 4.82 0.48 -0.71 -4.23 -0.84 -3.93 115.64 109.44 2occ s THR 404 Ca 0.23 -1.04 -0.03 0.00 -1.18 0.00 0.00 61.69 59.66 2occ s THR 404 Cb -0.08 -3.53 -0.02 0.00 1.34 0.00 0.00 72.50 70.22 2occ s THR 404 CO 0.11 -0.20 0.75 -0.76 -0.54 0.00 0.00 174.62 173.99 2occ s LEU 405 N -3.46 3.59 -0.53 4.79 1.43 -1.26 -4.68 118.68 118.56 2occ s LEU 405 Ca 0.33 0.66 -0.25 0.00 -1.03 0.00 0.00 54.13 53.84 2occ s LEU 405 Cb -0.10 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.61 2occ s LEU 405 CO 0.26 -0.68 0.96 0.21 0.23 0.00 0.00 176.35 177.33 2occ s ASN 406 N -4.17 6.38 0.47 2.29 3.84 -1.26 -4.91 114.94 117.59 2occ s ASN 406 Ca 0.48 -0.20 0.21 0.00 0.21 0.00 0.00 52.86 53.56 2occ s ASN 406 Cb -0.10 -2.45 1.23 0.00 -0.55 0.00 0.00 41.25 39.37 2occ s ASN 406 CO 0.42 -1.21 1.94 0.44 -2.79 0.00 0.00 177.10 175.89 2occ h ASP 407 N 9.28 0.21 -0.30 -4.21 5.19 -1.99 -2.20 116.42 122.41 2occ h ASP 407 Ca -0.26 0.01 -0.06 0.00 -0.62 0.00 0.00 57.03 56.11 2occ h ASP 407 Cb 1.07 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.55 2occ h ASP 407 CO 1.08 0.10 -0.06 0.74 -3.12 0.00 0.00 179.24 177.99 2occ h THR 408 N 0.22 1.28 -0.53 0.35 2.02 -2.00 -2.33 112.91 111.92 2occ h THR 408 Ca 0.35 -1.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 2occ h THR 408 Cb 1.04 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 2occ h THR 408 CO -0.07 0.35 0.26 -0.50 0.37 0.00 0.00 175.52 175.92 2occ h TRP 409 N 0.33 0.76 -0.55 3.16 -0.00 -1.86 -1.67 115.95 116.12 2occ h TRP 409 Ca 0.08 -0.03 0.08 0.00 -0.00 0.00 0.00 58.89 59.01 2occ h TRP 409 Cb 0.54 -0.24 -0.03 0.00 -0.00 0.00 0.00 29.16 29.43 2occ h TRP 409 CO 0.05 0.59 0.37 0.00 -0.00 0.00 0.00 178.44 179.45 2occ h ALA 410 N 1.10 1.94 0.05 1.49 0.00 -1.30 0.13 119.26 122.67 2occ h ALA 410 Ca 0.18 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.84 2occ h ALA 410 Cb 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2occ h ALA 410 CO -0.02 -0.05 -1.06 0.87 0.00 0.00 0.00 179.25 178.99 2occ h LYS 411 N 0.45 0.33 -0.68 0.00 1.57 -0.87 -1.87 116.57 115.50 2occ h LYS 411 Ca 0.25 -0.43 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 2occ h LYS 411 Cb 0.40 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.81 2occ h LYS 411 CO -0.07 1.14 0.33 0.82 -0.57 0.00 0.00 179.45 181.10 2occ h ILE 412 N 0.16 1.23 -0.21 1.86 2.04 -0.25 -0.99 117.51 121.34 2occ h ILE 412 Ca -0.10 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.12 2occ h ILE 412 Cb 1.73 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.19 2occ h ILE 412 CO 0.18 0.27 0.12 -0.74 0.00 0.00 0.00 178.15 177.98 2occ h HIS 413 N 0.95 0.23 -0.15 1.37 2.76 -0.72 -1.94 115.15 117.65 2occ h HIS 413 Ca 0.23 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.43 2occ h HIS 413 Cb 0.12 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 2occ h HIS 413 CO 0.01 0.14 0.05 0.35 -1.30 0.00 0.00 177.93 177.17 2occ h PHE 414 N 0.25 0.09 -0.36 5.26 3.57 -0.95 -2.20 116.94 122.61 2occ h PHE 414 Ca 0.08 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.65 2occ h PHE 414 Cb -0.01 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.65 2occ h PHE 414 CO -0.08 0.05 -0.02 0.00 -2.23 0.00 0.00 178.31 176.03 2occ h ALA 415 N 1.09 0.30 0.11 2.41 0.00 -0.76 0.38 119.26 122.80 2occ h ALA 415 Ca 0.06 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2occ h ALA 415 Cb 0.04 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2occ h ALA 415 CO -0.07 -0.41 -0.05 0.82 0.00 0.00 0.00 179.25 179.54 2occ h ILE 416 N 0.08 0.90 -0.24 0.00 2.04 -1.27 -2.30 117.51 116.70 2occ h ILE 416 Ca 0.17 -0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.00 2occ h ILE 416 Cb 0.25 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2occ h ILE 416 CO -0.31 0.00 0.01 -0.03 0.00 0.00 0.00 178.15 177.83 2occ h MET 417 N -0.15 0.36 -0.54 2.37 4.05 -1.15 0.06 114.93 119.94 2occ h MET 417 Ca -0.01 -0.06 -0.11 0.00 -0.28 0.00 0.00 59.70 59.24 2occ h MET 417 Cb 0.11 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 2occ h MET 417 CO 0.02 0.38 -0.09 0.35 0.23 0.00 0.00 176.91 177.81 2occ h PHE 418 N 0.35 1.10 -0.05 1.39 3.57 -0.66 -2.43 116.94 120.22 2occ h PHE 418 Ca 0.08 -0.21 -0.04 0.00 3.53 0.00 0.00 57.97 61.33 2occ h PHE 418 Cb 0.22 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2occ h PHE 418 CO 0.01 1.02 -0.13 0.28 -2.23 0.00 0.00 178.31 177.25 2occ h VAL 419 N 0.89 1.44 0.13 1.41 2.07 -0.84 -3.20 116.25 118.15 2occ h VAL 419 Ca 0.14 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.18 2occ h VAL 419 Cb 0.64 2.31 -0.04 0.00 -1.52 0.00 0.00 31.29 32.68 2occ h VAL 419 CO 0.04 0.41 -0.31 1.23 0.02 0.00 0.00 177.57 178.96 2occ h GLY 420 N -0.36 -0.60 1.89 2.17 0.00 -0.97 -1.47 103.07 103.73 2occ h GLY 420 Ca -0.00 0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.66 2occ h GLY 420 CO 0.03 -0.25 -0.14 -0.39 0.00 0.00 0.00 176.54 175.79 2occ h VAL 421 N -0.54 1.15 -0.07 4.60 -1.51 -1.59 -0.63 116.25 117.66 2occ h VAL 421 Ca 0.03 -0.68 -0.25 0.00 -1.23 0.00 0.00 66.70 64.57 2occ h VAL 421 Cb 0.57 1.24 0.02 0.00 -2.13 0.00 0.00 31.29 30.98 2occ h VAL 421 CO -0.17 0.21 -0.92 0.78 -1.23 0.00 0.00 177.57 176.23 2occ h ASN 422 N 0.14 0.93 -0.71 4.19 2.35 -1.50 -1.92 115.58 119.06 2occ h ASN 422 Ca 0.03 -0.69 -0.06 0.00 -0.55 0.00 0.00 56.30 55.02 2occ h ASN 422 Cb 0.33 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2occ h ASN 422 CO 0.02 1.49 0.20 -0.03 -1.65 0.00 0.00 177.43 177.45 2occ h MET 423 N 0.45 1.12 -0.08 0.81 4.05 -0.99 0.64 114.93 120.93 2occ h MET 423 Ca -0.10 -0.25 -0.01 0.00 -0.28 0.00 0.00 59.70 59.06 2occ h MET 423 Cb 1.57 -0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 32.21 2occ h MET 423 CO 0.19 0.97 0.02 1.15 0.23 0.00 0.00 176.91 179.47 2occ h THR 424 N 1.07 1.18 0.00 -0.77 2.02 -1.05 -3.37 112.91 111.99 2occ h THR 424 Ca 0.23 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.86 2occ h THR 424 Cb 0.34 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 2occ h THR 424 CO -0.00 0.16 -1.89 0.49 0.37 0.00 0.00 175.52 174.64 2occ n PHE 425 N -4.90 0.00 0.13 3.16 3.72 -0.73 -4.45 117.46 114.38 2occ n PHE 425 Ca -0.06 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.20 2occ n PHE 425 Cb 0.14 -0.45 -0.08 0.00 -0.94 0.00 0.00 39.48 38.15 2occ n PHE 425 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 2occ h PHE 426 N 0.00 -0.23 -0.09 1.38 3.57 -1.02 -2.80 116.94 117.75 2occ h PHE 426 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2occ h PHE 426 Cb 0.92 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.73 2occ h PHE 426 CO 0.00 -0.12 0.10 -1.00 -2.23 0.00 0.00 178.31 175.06 2occ h PRO 427 N -0.28 0.00 0.00 6.41 0.13 -1.78 -1.78 132.00 134.70 2occ h PRO 427 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2occ h PRO 427 Cb 0.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.35 2occ h PRO 427 CO 0.04 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 178.85 2occ n GLN 428 N -3.84 0.01 -0.02 0.86 6.02 -1.06 -0.50 117.38 118.85 2occ n GLN 428 Ca -0.01 0.47 -0.11 0.00 -0.01 0.00 0.00 57.00 57.34 2occ n GLN 428 Cb 0.20 -1.54 0.03 0.00 1.02 0.00 0.00 30.24 29.95 2occ n GLN 428 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2occ h HIS 429 N 0.00 0.81 0.05 1.08 3.86 -1.45 -2.56 115.15 116.94 2occ h HIS 429 Ca 0.00 -0.28 -0.00 0.00 -1.16 0.00 0.00 60.37 58.92 2occ h HIS 429 Cb 0.05 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 28.36 2occ h HIS 429 CO 0.00 1.04 -0.02 0.74 0.86 0.00 0.00 177.93 180.55 2occ h PHE 430 N 0.51 -0.06 -0.94 2.45 0.04 -1.00 -1.67 116.94 116.27 2occ h PHE 430 Ca 0.01 -0.00 0.19 0.00 2.80 0.00 0.00 57.97 60.98 2occ h PHE 430 Cb 1.09 0.02 -0.08 0.00 2.20 0.00 0.00 35.95 39.18 2occ h PHE 430 CO 0.05 0.22 0.60 -0.07 -0.60 0.00 0.00 178.31 178.52 2occ h LEU 431 N -0.35 0.56 0.00 1.54 3.38 -1.47 -0.43 115.31 118.55 2occ h LEU 431 Ca -0.01 0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2occ h LEU 431 Cb 0.31 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.03 2occ h LEU 431 CO 0.01 0.22 -0.39 1.23 0.09 0.00 0.00 178.44 179.60 2occ h GLY 432 N 0.56 0.29 1.27 0.83 0.00 -1.18 0.24 103.07 105.08 2occ h GLY 432 Ca 0.50 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2occ h GLY 432 CO -0.24 0.45 0.28 1.41 0.00 0.00 0.00 176.54 178.44 2occ h LEU 433 N -0.37 0.85 0.00 3.11 3.38 -0.83 -1.68 115.31 119.78 2occ h LEU 433 Ca -0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2occ h LEU 433 Cb 1.14 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2occ h LEU 433 CO 0.08 0.75 0.00 -1.54 0.09 0.00 0.00 178.44 177.82 2occ n SER 434 N -4.32 0.00 0.00 -0.43 3.41 -0.21 -4.92 113.62 107.14 2occ n SER 434 Ca 0.06 -0.57 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 2occ n SER 434 Cb 0.16 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2occ n SER 434 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2occ n GLY 435 N 0.73 0.83 3.66 5.00 0.00 -0.63 -5.04 105.19 109.74 2occ n GLY 435 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2occ n GLY 435 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2occ s MET 436 N -0.90 4.21 0.87 1.61 0.00 0.79 -4.95 119.30 120.94 2occ s MET 436 Ca 0.00 1.99 -0.11 0.00 0.00 0.00 0.00 55.69 57.56 2occ s MET 436 Cb 0.00 -3.85 0.11 0.00 0.00 0.00 0.00 34.83 31.09 2occ s MET 436 CO 0.00 -0.76 1.09 -2.14 0.00 0.00 0.00 175.02 173.21 2occ s PRO 437 N 3.60 1.50 0.35 4.11 0.02 -1.26 -1.42 135.00 141.90 2occ s PRO 437 Ca 0.66 0.81 -0.08 0.00 0.02 0.00 0.00 61.00 62.42 2occ s PRO 437 Cb -0.29 -1.84 -0.06 0.00 0.02 0.00 0.00 34.50 32.33 2occ s PRO 437 CO 0.24 -2.07 0.67 1.03 -0.33 0.00 0.00 177.00 176.54 2occ s ARG 438 N -4.97 3.71 -0.93 5.54 0.52 -0.37 -4.30 118.95 118.15 2occ s ARG 438 Ca 0.63 0.25 0.00 0.00 -0.52 0.00 0.00 55.73 56.09 2occ s ARG 438 Cb -0.17 -2.51 0.00 0.00 0.52 0.00 0.00 34.95 32.79 2occ s ARG 438 CO 0.56 0.07 0.00 0.54 0.02 0.00 0.00 175.30 176.50 2occ n ARG 439 N -1.16 -0.73 -3.83 3.54 1.74 -1.26 -5.01 116.66 109.96 2occ n ARG 439 Ca 0.00 0.65 -0.35 0.00 -0.77 0.00 0.00 57.85 57.38 2occ n ARG 439 Cb 0.54 -4.63 -0.08 0.00 -1.02 0.00 0.00 32.46 27.27 2occ n ARG 439 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2occ s TYR 440 N -2.42 3.38 -1.30 -1.55 1.51 -1.26 -4.92 117.35 110.79 2occ s TYR 440 Ca 0.00 0.28 0.27 0.00 -1.01 0.00 0.00 57.07 56.61 2occ s TYR 440 Cb 0.00 -2.11 0.90 0.00 -0.11 0.00 0.00 41.96 40.64 2occ s TYR 440 CO 0.00 0.30 1.67 -1.13 -1.11 0.00 0.00 175.55 175.28 2occ n SER 441 N 3.37 0.47 -3.69 2.29 3.41 -1.26 -4.90 113.62 113.30 2occ n SER 441 Ca -0.17 -0.29 -0.10 0.00 -0.26 0.00 0.00 58.87 58.06 2occ n SER 441 Cb 0.52 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 2occ n SER 441 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2occ s ASP 442 N -2.77 -0.30 0.06 4.04 -1.08 -1.26 -4.66 116.67 110.70 2occ s ASP 442 Ca 0.19 -0.40 -0.11 0.00 -0.52 0.00 0.00 52.55 51.71 2occ s ASP 442 Cb 0.19 0.57 0.01 0.00 -1.46 0.00 0.00 42.92 42.23 2occ s ASP 442 CO 0.57 -1.03 0.25 -0.72 0.52 0.00 0.00 175.17 174.76 2occ s TYR 443 N -3.85 0.01 0.49 -5.34 -0.85 -1.26 -5.08 117.35 101.47 2occ s TYR 443 Ca 0.07 -0.28 -0.22 0.00 -0.52 0.00 0.00 57.07 56.13 2occ s TYR 443 Cb -0.01 0.03 -0.09 0.00 0.38 0.00 0.00 41.96 42.27 2occ s TYR 443 CO -0.05 -0.51 0.89 -2.30 -1.52 0.00 0.00 175.55 172.06 2occ n PRO 444 N 0.34 1.05 -0.35 -3.49 -0.02 -1.26 -4.84 135.00 126.44 2occ n PRO 444 Ca -0.17 0.39 0.24 0.00 -2.02 0.00 0.00 63.50 61.94 2occ n PRO 444 Cb 0.61 -1.98 0.50 0.00 -0.02 0.00 0.00 33.50 32.60 2occ n PRO 444 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2occ h ASP 445 N 1.02 0.47 -0.14 2.55 5.19 -2.03 -2.65 116.42 120.83 2occ h ASP 445 Ca -0.45 0.12 0.04 0.00 -0.62 0.00 0.00 57.03 56.12 2occ h ASP 445 Cb 1.36 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 40.92 2occ h ASP 445 CO 0.53 0.01 0.14 0.00 -3.12 0.00 0.00 179.24 176.80 2occ h ALA 446 N 1.68 1.80 -0.30 3.45 0.00 -2.05 -2.23 119.26 121.62 2occ h ALA 446 Ca 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.57 2occ h ALA 446 Cb 1.66 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.46 2occ h ALA 446 CO -0.41 -0.21 0.00 0.66 0.00 0.00 0.00 179.25 179.29 2occ n TYR 447 N -3.93 0.63 -0.09 0.00 4.01 -1.00 -4.51 117.16 112.28 2occ n TYR 447 Ca 0.00 -0.26 -0.13 0.00 -0.16 0.00 0.00 57.90 57.36 2occ n TYR 447 Cb 0.26 -0.11 -0.04 0.00 -0.31 0.00 0.00 39.34 39.13 2occ n TYR 447 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2occ h THR 448 N 1.85 1.30 0.46 -0.72 2.02 -1.60 -3.14 112.91 113.09 2occ h THR 448 Ca 0.00 -1.37 -0.01 0.00 0.77 0.00 0.00 66.41 65.79 2occ h THR 448 Cb 0.73 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.71 2occ h THR 448 CO 0.09 0.44 -0.33 -0.03 0.37 0.00 0.00 175.52 176.06 2occ h MET 449 N 0.37 -0.74 -0.88 6.66 1.85 -1.85 -1.39 114.93 118.95 2occ h MET 449 Ca 0.05 0.05 0.05 0.00 -0.61 0.00 0.00 59.70 59.24 2occ h MET 449 Cb 0.78 0.17 -0.05 0.00 0.43 0.00 0.00 31.60 32.92 2occ h MET 449 CO 0.06 -0.49 0.57 -1.49 -0.40 0.00 0.00 176.91 175.16 2occ h TRP 450 N -0.77 1.03 0.00 1.39 -0.00 -1.91 -0.28 115.95 115.42 2occ h TRP 450 Ca -0.05 0.03 -0.09 0.00 -0.00 0.00 0.00 58.89 58.78 2occ h TRP 450 Cb 0.65 -0.34 -0.01 0.00 -0.00 0.00 0.00 29.16 29.45 2occ h TRP 450 CO -0.13 0.57 -0.44 -0.91 -0.00 0.00 0.00 178.44 177.53 2occ h ASN 451 N 1.04 0.00 -0.06 -3.49 2.35 -1.45 -1.25 115.58 112.72 2occ h ASN 451 Ca 0.36 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.99 2occ h ASN 451 Cb 0.11 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.48 2occ h ASN 451 CO -0.12 0.44 -0.43 0.74 -1.65 0.00 0.00 177.43 176.42 2occ h THR 452 N 0.00 1.42 -0.55 2.81 2.02 -0.04 -1.86 112.91 116.71 2occ h THR 452 Ca -0.00 -1.85 0.00 0.00 0.77 0.00 0.00 66.41 65.33 2occ h THR 452 Cb 0.87 2.38 -0.03 0.00 -1.74 0.00 0.00 68.15 69.63 2occ h THR 452 CO 0.06 0.54 0.36 0.40 0.37 0.00 0.00 175.52 177.24 2occ h ILE 453 N -0.09 1.14 -0.11 3.11 2.04 -0.99 -2.56 117.51 120.05 2occ h ILE 453 Ca -0.04 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.56 2occ h ILE 453 Cb 1.10 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2occ h ILE 453 CO 0.09 0.14 0.06 -1.28 0.00 0.00 0.00 178.15 177.15 2occ h SER 454 N 0.74 0.08 0.15 1.72 0.87 -1.24 -1.52 113.55 114.36 2occ h SER 454 Ca 0.20 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 2occ h SER 454 Cb -0.08 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2occ h SER 454 CO -0.04 0.07 -0.15 0.28 -0.53 0.00 0.00 176.83 176.46 2occ h SER 455 N 0.12 0.00 -0.35 6.23 0.02 -1.19 -1.74 113.55 116.64 2occ h SER 455 Ca 0.04 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.91 2occ h SER 455 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 2occ h SER 455 CO -0.03 0.15 -0.12 0.24 -1.14 0.00 0.00 176.83 175.93 2occ h MET 456 N 0.00 0.70 -0.97 3.45 2.07 -0.96 -2.91 114.93 116.31 2occ h MET 456 Ca -0.00 -0.28 0.07 0.00 -2.07 0.00 0.00 59.70 57.41 2occ h MET 456 Cb 0.26 -0.03 -0.06 0.00 -1.87 0.00 0.00 31.60 29.90 2occ h MET 456 CO 0.02 0.88 0.63 0.78 1.07 0.00 0.00 176.91 180.28 2occ h GLY 457 N 0.49 1.45 2.00 8.32 0.00 -0.41 -0.37 103.07 114.55 2occ h GLY 457 Ca 0.09 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 2occ h GLY 457 CO 0.04 0.32 -0.10 1.48 0.00 0.00 0.00 176.54 178.28 2occ h SER 458 N 1.12 0.00 0.39 0.19 4.64 -1.26 -1.13 113.55 117.49 2occ h SER 458 Ca 0.42 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.52 2occ h SER 458 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2occ h SER 458 CO -0.17 0.10 -0.94 -0.26 -0.87 0.00 0.00 176.83 174.69 2occ h PHE 459 N 0.00 0.56 -0.50 4.77 -1.00 -0.96 -2.40 116.94 117.40 2occ h PHE 459 Ca -0.00 -0.31 -0.01 0.00 2.81 0.00 0.00 57.97 60.46 2occ h PHE 459 Cb 0.37 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.85 2occ h PHE 459 CO 0.00 1.13 0.26 0.82 -1.61 0.00 0.00 178.31 178.91 2occ h ILE 460 N 0.21 1.18 -0.80 -0.55 2.04 -0.93 -0.48 117.51 118.18 2occ h ILE 460 Ca -0.08 -0.48 0.01 0.00 1.00 0.00 0.00 64.86 65.32 2occ h ILE 460 Cb 1.58 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 38.20 2occ h ILE 460 CO 0.16 0.20 0.53 0.28 0.00 0.00 0.00 178.15 179.32 2occ h SER 461 N 0.67 0.90 -0.47 1.72 0.02 -1.40 0.06 113.55 115.04 2occ h SER 461 Ca 0.17 -0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.16 2occ h SER 461 Cb 0.08 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.35 2occ h SER 461 CO -0.03 0.64 0.20 0.25 -1.14 0.00 0.00 176.83 176.76 2occ h LEU 462 N 1.06 0.26 -0.43 5.07 5.85 -0.60 -0.53 115.31 125.97 2occ h LEU 462 Ca 0.30 0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.09 2occ h LEU 462 Cb -0.08 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 2occ h LEU 462 CO -0.07 0.18 0.22 0.74 -0.34 0.00 0.00 178.44 179.18 2occ h THR 463 N 0.40 0.98 -1.00 1.05 2.02 0.21 -1.50 112.91 115.08 2occ h THR 463 Ca 0.21 -0.15 0.09 0.00 0.77 0.00 0.00 66.41 67.33 2occ h THR 463 Cb 0.17 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 67.00 2occ h THR 463 CO -0.18 0.08 0.64 0.00 0.37 0.00 0.00 175.52 176.43 2occ h ALA 464 N 1.22 1.46 0.00 6.16 0.00 -0.01 0.09 119.26 128.18 2occ h ALA 464 Ca 0.18 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2occ h ALA 464 Cb 0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2occ h ALA 464 CO -0.12 0.36 -0.69 -0.39 0.00 0.00 0.00 179.25 178.40 2occ h VAL 465 N 1.10 1.35 -0.44 0.00 -1.51 -0.32 -1.40 116.25 115.03 2occ h VAL 465 Ca 0.46 -2.50 -0.14 0.00 -1.23 0.00 0.00 66.70 63.28 2occ h VAL 465 Cb 0.29 2.40 -0.01 0.00 -2.13 0.00 0.00 31.29 31.85 2occ h VAL 465 CO -0.21 0.68 -0.29 0.24 -1.23 0.00 0.00 177.57 176.77 2occ h MET 466 N 0.00 0.98 -0.76 5.19 2.86 -0.31 -2.42 114.93 120.47 2occ h MET 466 Ca -0.01 -0.46 0.01 0.00 -2.06 0.00 0.00 59.70 57.18 2occ h MET 466 Cb 1.35 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.96 2occ h MET 466 CO 0.09 1.13 0.50 1.25 1.06 0.00 0.00 176.91 180.94 2occ h LEU 467 N 0.82 0.88 -1.22 1.22 6.46 -0.88 -2.29 115.31 120.30 2occ h LEU 467 Ca 0.09 -0.03 0.06 0.00 -0.12 0.00 0.00 57.88 57.88 2occ h LEU 467 Cb 0.87 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.53 2occ h LEU 467 CO 0.08 0.64 0.55 -0.03 -0.62 0.00 0.00 178.44 179.06 2occ h MET 468 N 1.03 0.93 -0.83 1.25 4.05 -0.76 -0.87 114.93 119.74 2occ h MET 468 Ca 0.28 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.61 2occ h MET 468 Cb -0.11 -0.21 -0.04 0.00 -0.80 0.00 0.00 31.60 30.44 2occ h MET 468 CO -0.06 0.62 0.39 0.28 0.23 0.00 0.00 176.91 178.37 2occ h VAL 469 N 0.96 1.26 -0.26 -5.77 2.07 -1.18 -2.45 116.25 110.87 2occ h VAL 469 Ca 0.35 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 2occ h VAL 469 Cb 0.17 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2occ h VAL 469 CO -0.12 0.31 0.14 0.15 0.02 0.00 0.00 177.57 178.07 2occ h PHE 470 N 1.18 0.36 -0.98 1.57 3.57 -1.02 -2.32 116.94 119.30 2occ h PHE 470 Ca 0.28 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.89 2occ h PHE 470 Cb 0.12 -0.11 -0.08 0.00 2.79 0.00 0.00 35.95 38.67 2occ h PHE 470 CO 0.01 0.31 0.62 0.82 -2.23 0.00 0.00 178.31 177.85 2occ h ILE 471 N 0.31 0.93 -0.14 1.41 2.04 -0.92 0.14 117.51 121.29 2occ h ILE 471 Ca 0.09 -0.34 -0.16 0.00 1.00 0.00 0.00 64.86 65.45 2occ h ILE 471 Cb 0.07 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.02 2occ h ILE 471 CO -0.01 0.18 -0.60 0.40 0.00 0.00 0.00 178.15 178.11 2occ h ILE 472 N 0.98 1.34 0.15 -0.67 2.04 -1.34 -2.80 117.51 117.21 2occ h ILE 472 Ca 0.48 -1.90 -0.01 0.00 1.00 0.00 0.00 64.86 64.43 2occ h ILE 472 Cb 0.47 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2occ h ILE 472 CO -0.24 0.58 -0.07 -0.25 0.00 0.00 0.00 178.15 178.17 2occ h TRP 473 N 0.34 -0.18 -0.24 1.37 7.01 -0.52 -2.58 115.95 121.14 2occ h TRP 473 Ca -0.00 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.05 2occ h TRP 473 Cb 1.14 0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 28.25 2occ h TRP 473 CO 0.04 0.06 0.17 1.05 -2.79 0.00 0.00 178.44 176.97 2occ h GLU 474 N -0.41 0.06 -0.26 2.65 -0.00 -0.81 0.47 114.58 116.29 2occ h GLU 474 Ca -0.02 -0.00 -0.11 0.00 -0.00 0.00 0.00 59.36 59.22 2occ h GLU 474 Cb 0.32 -0.01 -0.00 0.00 -0.00 0.00 0.00 28.75 29.05 2occ h GLU 474 CO 0.03 0.04 -0.28 0.00 -0.00 0.00 0.00 179.01 178.80 2occ h ALA 475 N 1.88 0.38 0.00 1.06 0.00 -1.28 0.11 119.26 121.40 2occ h ALA 475 Ca 0.11 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 2occ h ALA 475 Cb 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2occ h ALA 475 CO -0.01 0.39 -0.46 0.74 0.00 0.00 0.00 179.25 179.90 2occ h PHE 476 N 0.36 0.00 -0.02 0.00 0.04 -0.85 -1.89 116.94 114.58 2occ h PHE 476 Ca 0.04 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.59 2occ h PHE 476 Cb 0.85 0.00 0.02 0.00 2.20 0.00 0.00 35.95 39.02 2occ h PHE 476 CO 0.08 0.46 -0.85 0.00 -0.60 0.00 0.00 178.31 177.39 2occ h ALA 477 N 1.54 0.13 0.09 2.45 0.00 0.20 -3.34 119.26 120.34 2occ h ALA 477 Ca -0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 54.91 54.01 2occ h ALA 477 Cb 1.10 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2occ h ALA 477 CO 0.06 0.57 -1.15 0.77 0.00 0.00 0.00 179.25 179.49 2occ h SER 478 N 0.24 0.37 -5.45 0.00 0.02 -0.79 -3.49 113.55 104.45 2occ h SER 478 Ca -0.10 -0.37 -0.21 0.00 -0.84 0.00 0.00 61.79 60.26 2occ h SER 478 Cb 1.52 -0.12 0.17 0.00 0.14 0.00 0.00 62.40 64.11 2occ h SER 478 CO 0.17 1.27 -0.72 0.29 -1.14 0.00 0.00 176.83 176.70 2occ n LYS 479 N -3.54 -2.08 -3.24 3.45 5.02 -0.71 -4.96 118.16 112.10 2occ n LYS 479 Ca -0.07 0.97 -0.43 0.00 -2.02 0.00 0.00 58.31 56.76 2occ n LYS 479 Cb 0.98 -5.80 -0.08 0.00 -0.02 0.00 0.00 35.03 30.11 2occ n LYS 479 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2occ s ARG 480 N -4.18 3.21 0.45 1.97 0.52 -1.26 -5.03 118.95 114.63 2occ s ARG 480 Ca 0.38 -0.57 -0.19 0.00 -0.52 0.00 0.00 55.73 54.84 2occ s ARG 480 Cb -0.05 -3.95 -0.10 0.00 0.52 0.00 0.00 34.95 31.37 2occ s ARG 480 CO 0.74 -0.89 0.95 -1.21 0.02 0.00 0.00 175.30 174.91 2occ s GLU 481 N 2.41 4.13 0.26 3.54 2.02 -1.26 -1.98 118.70 127.82 2occ s GLU 481 Ca 0.16 1.05 -0.30 0.00 0.02 0.00 0.00 54.97 55.90 2occ s GLU 481 Cb -0.16 -2.18 -0.09 0.00 0.10 0.00 0.00 34.13 31.80 2occ s GLU 481 CO 0.16 -0.10 1.10 0.08 0.02 0.00 0.00 175.26 176.52 2occ s VAL 482 N -2.31 3.55 0.00 2.63 1.01 -0.58 -4.89 120.40 119.81 2occ s VAL 482 Ca 0.61 1.52 0.00 0.00 0.00 0.00 0.00 61.98 64.10 2occ s VAL 482 Cb -0.09 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2occ s VAL 482 CO 0.19 0.34 0.00 0.18 0.00 0.00 0.00 175.10 175.81 2occ n LEU 483 N 1.42 0.00 -4.35 3.92 4.77 -1.26 -4.93 117.00 116.57 2occ n LEU 483 Ca -0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.73 2occ n LEU 483 Cb 0.45 -0.37 -0.12 0.00 -2.33 0.00 0.00 43.42 41.06 2occ n LEU 483 CO 0.54 -0.48 -0.51 0.42 -1.33 0.00 0.00 177.39 176.03 2occ s THR 484 N -0.96 1.98 -0.04 -5.08 -4.23 -1.26 -5.04 115.64 101.01 2occ s THR 484 Ca 0.00 -1.85 0.05 0.00 -1.18 0.00 0.00 61.69 58.70 2occ s THR 484 Cb 0.00 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.97 2occ s THR 484 CO 0.00 -0.17 -0.18 -0.69 -0.54 0.00 0.00 174.62 173.04 2occ s VAL 485 N -1.66 1.50 0.67 2.29 1.01 -1.26 -5.14 120.40 117.82 2occ s VAL 485 Ca 0.15 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.26 2occ s VAL 485 Cb -0.08 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 2occ s VAL 485 CO 0.07 0.43 1.06 -1.81 0.00 0.00 0.00 175.10 174.85 2occ s ASP 486 N -0.01 5.69 -1.47 3.32 1.11 -1.26 -4.29 116.67 119.76 2occ s ASP 486 Ca -0.03 1.38 -0.11 0.00 0.18 0.00 0.00 52.55 53.96 2occ s ASP 486 Cb -0.12 -2.30 0.07 0.00 1.07 0.00 0.00 42.92 41.65 2occ s ASP 486 CO 0.02 -1.21 0.78 0.18 1.18 0.00 0.00 175.17 176.12 2occ n LEU 487 N -2.96 -2.26 0.26 1.23 4.77 -1.26 -4.89 117.00 111.89 2occ n LEU 487 Ca 0.07 -0.59 0.14 0.00 -0.03 0.00 0.00 56.01 55.60 2occ n LEU 487 Cb 0.55 -2.48 0.63 0.00 -2.33 0.00 0.00 43.42 39.78 2occ n LEU 487 CO 0.57 0.34 0.93 0.71 -1.33 0.00 0.00 177.39 178.61 2occ h THR 488 N -1.65 0.29 -0.03 -5.08 1.35 -1.86 -3.08 112.91 102.85 2occ h THR 488 Ca -0.53 -0.72 -0.02 0.00 -0.55 0.00 0.00 66.41 64.59 2occ h THR 488 Cb 1.35 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2occ h THR 488 CO 0.62 0.10 -0.06 0.71 -0.25 0.00 0.00 175.52 176.64 2occ h THR 489 N 0.00 1.06 -0.21 6.82 1.35 -1.95 -2.25 112.91 117.73 2occ h THR 489 Ca -0.00 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2occ h THR 489 Cb 0.55 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 2occ h THR 489 CO 0.01 0.08 0.00 0.35 -0.25 0.00 0.00 175.52 175.71 2occ n THR 490 N -4.45 1.80 -3.24 6.82 -2.24 -1.17 -4.75 114.28 107.06 2occ n THR 490 Ca -0.02 -1.67 -0.24 0.00 -2.27 0.00 0.00 64.05 59.84 2occ n THR 490 Cb 0.15 -0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.30 2occ n THR 490 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2occ n ASN 491 N -0.44 -0.13 -0.36 3.42 3.02 -0.85 -5.01 115.26 114.91 2occ n ASN 491 Ca 0.16 -2.61 0.30 0.00 -0.03 0.00 0.00 54.58 52.40 2occ n ASN 491 Cb 0.68 -0.54 0.61 0.00 -0.61 0.00 0.00 39.78 39.92 2occ n ASN 491 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2occ h LEU 492 N 4.50 0.28 -2.56 3.41 6.46 -1.86 -1.96 115.31 123.58 2occ h LEU 492 Ca 0.13 0.07 0.01 0.00 -0.12 0.00 0.00 57.88 57.96 2occ h LEU 492 Cb 0.89 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.86 2occ h LEU 492 CO 0.43 0.00 0.03 1.05 -0.62 0.00 0.00 178.44 179.33 2occ h GLU 493 N 0.22 0.00 0.00 1.25 9.09 -1.92 -1.90 114.58 121.31 2occ h GLU 493 Ca 0.65 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.06 2occ h GLU 493 Cb 2.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 29.10 2occ h GLU 493 CO -0.24 0.00 -0.58 0.91 0.05 0.00 0.00 179.01 179.15 2occ n TRP 494 N -3.64 0.38 0.14 2.06 7.02 -0.74 -4.38 117.44 118.29 2occ n TRP 494 Ca -0.02 0.11 0.04 0.00 -1.02 0.00 0.00 57.50 56.60 2occ n TRP 494 Cb 0.11 -0.54 0.19 0.00 -2.42 0.00 0.00 31.31 28.66 2occ n TRP 494 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2occ n LEU 495 N -1.92 0.15 -1.40 -0.99 4.77 -0.72 -2.49 117.00 114.40 2occ n LEU 495 Ca 0.04 0.56 0.08 0.00 -0.03 0.00 0.00 56.01 56.66 2occ n LEU 495 Cb 0.41 -0.57 0.33 0.00 -2.33 0.00 0.00 43.42 41.26 2occ n LEU 495 CO 0.36 -0.54 0.79 0.59 -1.33 0.00 0.00 177.39 177.26 2occ n ASN 496 N -1.69 4.80 0.00 -1.43 3.02 -1.26 -5.08 115.26 113.63 2occ n ASN 496 Ca 0.00 -2.93 0.00 0.00 -0.03 0.00 0.00 54.58 51.62 2occ n ASN 496 Cb 0.05 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 38.61 2occ n ASN 496 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2occ n GLY 497 N 0.13 -1.38 2.97 7.41 0.00 -1.04 -4.22 105.19 109.05 2occ n GLY 497 Ca 0.24 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.38 2occ n GLY 497 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2occ s PRO 499 N 1.37 3.66 0.62 0.00 0.04 -1.26 -4.18 135.00 135.25 2occ s PRO 499 Ca -0.05 0.38 -0.18 0.00 0.04 0.00 0.00 61.00 61.20 2occ s PRO 499 Cb -0.18 -2.35 -0.02 0.00 0.04 0.00 0.00 34.50 31.98 2occ s PRO 499 CO -0.07 -0.16 1.19 -1.25 0.04 0.00 0.00 177.00 176.76 2occ s PRO 500 N -4.35 2.85 0.75 0.56 0.04 -0.81 -4.96 135.00 129.07 2occ s PRO 500 Ca 0.50 1.76 -0.14 0.00 0.04 0.00 0.00 61.00 63.16 2occ s PRO 500 Cb -0.10 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.57 2occ s PRO 500 CO 0.39 -1.29 1.18 -1.25 0.04 0.00 0.00 177.00 176.08 2occ s PRO 501 N -3.49 2.07 0.23 0.56 0.04 -1.26 -4.90 135.00 128.25 2occ s PRO 501 Ca 0.76 1.67 -0.14 0.00 0.04 0.00 0.00 61.00 63.33 2occ s PRO 501 Cb -0.29 -1.84 0.28 0.00 0.04 0.00 0.00 34.50 32.70 2occ s PRO 501 CO 0.35 -1.87 1.58 -0.92 0.04 0.00 0.00 177.00 176.19 2occ h TYR 502 N -0.49 -0.65 -3.62 0.56 3.20 -2.00 -3.31 116.97 110.65 2occ h TYR 502 Ca -0.47 0.08 -0.68 0.00 3.14 0.00 0.00 58.73 60.80 2occ h TYR 502 Cb 1.28 0.41 -0.25 0.00 1.54 0.00 0.00 36.73 39.71 2occ h TYR 502 CO 0.49 -0.37 -0.58 -1.01 -1.64 0.00 0.00 178.16 175.05 2occ s HIS 503 N -6.14 3.19 0.23 -3.82 3.76 -1.26 -4.91 115.29 106.33 2occ s HIS 503 Ca -0.14 -0.92 0.07 0.00 -0.15 0.00 0.00 55.06 53.92 2occ s HIS 503 Cb 0.21 -2.32 -0.04 0.00 1.11 0.00 0.00 32.58 31.55 2occ s HIS 503 CO 0.74 -0.57 0.14 0.95 -0.85 0.00 0.00 174.74 175.14 2occ s THR 504 N 1.53 4.25 -1.48 1.30 -4.23 -1.25 -4.61 115.64 111.15 2occ s THR 504 Ca 0.02 -1.40 -0.13 0.00 -1.18 0.00 0.00 61.69 59.01 2occ s THR 504 Cb -0.18 -3.25 0.09 0.00 1.34 0.00 0.00 72.50 70.50 2occ s THR 504 CO 0.04 -0.28 0.76 0.49 -0.54 0.00 0.00 174.62 175.10 2occ n PHE 505 N -0.85 -2.02 0.24 3.99 3.72 -1.26 -4.41 117.46 116.88 2occ n PHE 505 Ca -0.08 0.71 0.07 0.00 -0.05 0.00 0.00 57.45 58.10 2occ n PHE 505 Cb 0.57 -3.50 0.58 0.00 -0.94 0.00 0.00 39.48 36.19 2occ n PHE 505 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 2occ h GLU 506 N -1.56 0.00 -5.00 -1.08 5.08 -1.95 -3.32 114.58 106.74 2occ h GLU 506 Ca -0.53 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.17 2occ h GLU 506 Cb 1.35 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.29 2occ h GLU 506 CO 0.64 0.09 -0.77 -2.00 -1.00 0.00 0.00 179.01 175.97 2occ s GLU 507 N -4.83 3.16 1.09 2.33 2.12 -1.26 -5.11 118.70 116.20 2occ s GLU 507 Ca -0.04 -0.75 -0.14 0.00 0.36 0.00 0.00 54.97 54.40 2occ s GLU 507 Cb 0.16 -2.86 0.19 0.00 0.26 0.00 0.00 34.13 31.89 2occ s GLU 507 CO 0.68 -0.23 0.70 -2.30 -0.54 0.00 0.00 175.26 173.57 2occ n PRO 508 N 4.72 -1.66 -1.62 4.30 -0.02 -1.25 -5.01 135.00 134.46 2occ n PRO 508 Ca -0.19 -0.45 -0.30 0.00 -2.02 0.00 0.00 63.50 60.54 2occ n PRO 508 Cb 0.50 -2.04 0.08 0.00 -0.02 0.00 0.00 33.50 32.01 2occ n PRO 508 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2occ s THR 509 N -2.40 3.29 -0.24 3.45 -4.23 -1.26 -5.03 115.64 109.23 2occ s THR 509 Ca 0.64 0.42 -0.05 0.00 -1.18 0.00 0.00 61.69 61.52 2occ s THR 509 Cb -0.21 -3.21 -0.01 0.00 1.34 0.00 0.00 72.50 70.41 2occ s THR 509 CO 0.65 -0.55 -0.00 -0.47 -0.54 0.00 0.00 174.62 173.70 2occ s TYR 510 N -3.18 3.02 -0.09 3.99 6.14 -1.26 -5.03 117.35 120.95 2occ s TYR 510 Ca 0.60 -0.90 -0.01 0.00 0.64 0.00 0.00 57.07 57.40 2occ s TYR 510 Cb -0.14 -2.15 0.03 0.00 0.42 0.00 0.00 41.96 40.12 2occ s TYR 510 CO 0.54 -0.53 -0.03 0.08 0.64 0.00 0.00 175.55 176.24 2occ s VAL 511 N 1.50 0.67 0.42 3.14 1.01 -1.26 -5.12 120.40 120.75 2occ s VAL 511 Ca 0.05 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 2occ s VAL 511 Cb -0.15 -0.76 -0.08 0.00 0.00 0.00 0.00 36.38 35.39 2occ s VAL 511 CO -0.01 0.31 1.21 0.20 0.00 0.00 0.00 175.10 176.80 2occ s ASN 512 N 1.80 6.37 -1.07 3.32 0.02 -1.26 -4.61 114.94 119.50 2occ s ASN 512 Ca 0.04 2.42 -0.15 0.00 -1.02 0.00 0.00 52.86 54.15 2occ s ASN 512 Cb -0.12 -2.62 0.17 0.00 0.02 0.00 0.00 41.25 38.70 2occ s ASN 512 CO -0.06 -0.79 1.24 -0.22 0.02 0.00 0.00 177.10 177.29 2occ s LEU 513 N -2.61 5.33 0.00 0.60 1.98 -1.26 -4.95 118.68 117.77 2occ s LEU 513 Ca 0.59 -2.70 0.26 0.00 -2.89 0.00 0.00 54.13 49.38 2occ s LEU 513 Cb -0.32 -2.37 0.63 0.00 0.66 0.00 0.00 46.19 44.79 2occ s LEU 513 CO 0.41 -0.80 1.51 0.29 -1.89 0.00 0.00 176.35 175.87