#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7b s MET 70 N 0.00 -0.02 -0.10 1.43 1.75 -1.26 -0.53 119.30 120.57 1i7b s MET 70 Ca 0.00 0.19 0.03 0.00 -1.25 0.00 0.00 55.69 54.66 1i7b s MET 70 Cb 0.00 -0.22 0.01 0.00 2.84 0.00 0.00 34.83 37.46 1i7b s MET 70 CO 0.00 -0.15 -0.20 -0.06 -0.65 0.00 0.00 175.02 173.96 1i7b s PHE 71 N 0.98 2.22 -0.16 4.11 0.40 0.55 -4.98 117.98 121.10 1i7b s PHE 71 Ca -0.08 -0.94 0.00 0.00 -0.60 0.00 0.00 56.93 55.31 1i7b s PHE 71 Cb -0.12 -1.53 0.03 0.00 0.51 0.00 0.00 43.02 41.92 1i7b s PHE 71 CO -0.03 -0.41 -0.10 0.08 0.70 0.00 0.00 175.22 175.45 1i7b s VAL 72 N 0.56 1.39 0.00 -0.44 1.01 -1.26 -1.07 120.40 120.59 1i7b s VAL 72 Ca -0.15 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1i7b s VAL 72 Cb -0.17 -1.41 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1i7b s VAL 72 CO 0.05 0.32 0.00 -1.54 0.00 0.00 0.00 175.10 173.93 1i7b n SER 73 N 4.81 1.85 -0.05 3.32 3.41 -0.58 -5.03 113.62 121.35 1i7b n SER 73 Ca -0.15 -0.85 -0.08 0.00 -0.26 0.00 0.00 58.87 57.53 1i7b n SER 73 Cb 0.49 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.42 1i7b n SER 73 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1i7b h LYS 74 N 0.00 0.03 0.00 4.33 3.64 -2.06 -3.34 116.57 119.17 1i7b h LYS 74 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1i7b h LYS 74 Cb 0.00 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1i7b h LYS 74 CO 0.00 0.02 0.00 2.89 -2.27 0.00 0.00 179.45 180.09 1i7b n ARG 75 N -5.19 -0.58 -4.72 1.90 1.85 -1.26 -5.05 116.66 103.61 1i7b n ARG 75 Ca -0.02 -0.34 -0.33 0.00 -1.00 0.00 0.00 57.85 56.16 1i7b n ARG 75 Cb 0.13 -0.82 -0.13 0.00 -1.05 0.00 0.00 32.46 30.59 1i7b n ARG 75 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1i7b s ARG 76 N -0.01 3.08 -0.08 2.89 3.52 -1.26 -5.07 118.95 122.02 1i7b s ARG 76 Ca 0.00 -0.63 0.03 0.00 -0.13 0.00 0.00 55.73 55.00 1i7b s ARG 76 Cb 0.00 -2.60 0.01 0.00 -1.56 0.00 0.00 34.95 30.79 1i7b s ARG 76 CO 0.00 0.41 -0.19 0.12 -0.81 0.00 0.00 175.30 174.83 1i7b s PHE 77 N -0.16 2.08 -0.10 5.12 5.36 -1.26 -1.52 117.98 127.50 1i7b s PHE 77 Ca 0.00 -0.82 0.01 0.00 -0.96 0.00 0.00 56.93 55.17 1i7b s PHE 77 Cb -0.13 -1.43 0.02 0.00 -0.34 0.00 0.00 43.02 41.14 1i7b s PHE 77 CO 0.03 -0.35 -0.12 0.42 -1.46 0.00 0.00 175.22 173.74 1i7b s ILE 78 N 0.45 1.29 -0.09 3.12 1.01 -0.23 -4.98 121.20 121.77 1i7b s ILE 78 Ca -0.16 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1i7b s ILE 78 Cb -0.17 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.11 1i7b s ILE 78 CO 0.07 0.40 -0.07 -0.22 0.00 0.00 0.00 174.94 175.12 1i7b s LEU 79 N 1.15 1.18 -0.10 2.97 2.96 -1.26 -0.33 118.68 125.26 1i7b s LEU 79 Ca -0.04 -0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 53.61 1i7b s LEU 79 Cb -0.14 -0.74 0.02 0.00 0.50 0.00 0.00 46.19 45.83 1i7b s LEU 79 CO -0.03 -0.10 -0.06 -0.75 -1.32 0.00 0.00 176.35 174.09 1i7b s LYS 80 N 1.50 1.28 0.09 1.98 2.20 0.31 -5.02 119.74 122.09 1i7b s LYS 80 Ca 0.00 -0.17 0.02 0.00 -0.36 0.00 0.00 55.97 55.46 1i7b s LYS 80 Cb -0.13 -1.38 -0.04 0.00 -1.51 0.00 0.00 37.83 34.77 1i7b s LYS 80 CO -0.05 -0.24 -0.07 0.95 -0.36 0.00 0.00 175.35 175.58 1i7b s THR 81 N 1.64 0.70 0.00 3.43 -4.23 -1.26 -1.35 115.64 114.56 1i7b s THR 81 Ca 0.02 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 1i7b s THR 81 Cb -0.13 -1.56 0.00 0.00 1.34 0.00 0.00 72.50 72.16 1i7b s THR 81 CO -0.06 -0.81 0.00 0.00 -0.54 0.00 0.00 174.62 173.21 1i7b n GLY 83 N 2.68 3.37 1.45 0.00 0.00 -1.26 -1.94 105.19 109.48 1i7b n GLY 83 Ca 0.00 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.89 1i7b n GLY 83 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1i7b n THR 84 N 0.00 2.19 -1.69 2.61 -2.24 -1.26 -4.99 114.28 108.89 1i7b n THR 84 Ca 0.00 -1.42 -0.41 0.00 -2.27 0.00 0.00 64.05 59.95 1i7b n THR 84 Cb 0.00 -0.07 0.01 0.00 -2.10 0.00 0.00 70.33 68.17 1i7b n THR 84 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1i7b n THR 85 N 0.52 2.35 -2.90 4.28 -2.24 -0.82 -4.69 114.28 110.78 1i7b n THR 85 Ca 0.24 -0.50 -0.43 0.00 -2.27 0.00 0.00 64.05 61.10 1i7b n THR 85 Cb 0.96 -1.54 0.01 0.00 -2.10 0.00 0.00 70.33 67.66 1i7b n THR 85 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1i7b n LEU 86 N 0.42 6.63 -0.22 3.22 4.77 -1.26 -4.89 117.00 125.68 1i7b n LEU 86 Ca 0.06 -5.22 -0.01 0.00 -0.03 0.00 0.00 56.01 50.81 1i7b n LEU 86 Cb 0.38 -1.26 0.06 0.00 -2.33 0.00 0.00 43.42 40.27 1i7b n LEU 86 CO 0.60 1.75 0.72 0.25 -1.33 0.00 0.00 177.39 179.38 1i7b h LEU 87 N 5.31 -0.66 -2.11 2.23 6.46 -1.95 -1.90 115.31 122.69 1i7b h LEU 87 Ca 0.27 0.20 0.00 0.00 -0.12 0.00 0.00 57.88 58.23 1i7b h LEU 87 Cb 0.56 0.42 0.00 0.00 -0.73 0.00 0.00 40.66 40.91 1i7b h LEU 87 CO 1.33 -0.23 0.10 -0.07 -0.62 0.00 0.00 178.44 178.95 1i7b h LEU 88 N -0.02 0.00 0.00 2.25 3.38 -1.99 -0.02 115.31 118.91 1i7b h LEU 88 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1i7b h LEU 88 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1i7b h LEU 88 CO -0.67 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.15 1i7b n LYS 89 N -2.69 0.36 0.08 1.13 5.02 -0.71 -2.45 118.16 118.90 1i7b n LYS 89 Ca -0.02 0.07 0.11 0.00 -2.02 0.00 0.00 58.31 56.46 1i7b n LYS 89 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 1i7b n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1i7b n ALA 90 N -1.24 2.72 0.43 7.82 0.00 -0.02 -4.55 120.51 125.67 1i7b n ALA 90 Ca 0.11 -0.29 -0.19 0.00 0.00 0.00 0.00 53.44 53.07 1i7b n ALA 90 Cb 0.16 -1.05 -0.09 0.00 0.00 0.00 0.00 19.45 18.46 1i7b n ALA 90 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1i7b h LEU 91 N 0.00 -1.13 -0.44 0.00 5.85 -1.64 -0.12 115.31 117.83 1i7b h LEU 91 Ca 0.00 0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.83 1i7b h LEU 91 Cb 0.93 0.32 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 1i7b h LEU 91 CO 0.00 -0.72 0.15 0.58 -0.34 0.00 0.00 178.44 178.11 1i7b h VAL 92 N -1.16 0.85 -0.70 1.05 2.07 -1.81 -1.87 116.25 114.69 1i7b h VAL 92 Ca -0.11 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1i7b h VAL 92 Cb 0.92 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1i7b h VAL 92 CO 0.13 0.06 0.38 -0.65 0.02 0.00 0.00 177.57 177.50 1i7b h PRO 93 N 0.32 0.96 -0.46 1.57 0.11 -1.79 -2.79 132.00 129.93 1i7b h PRO 93 Ca 0.21 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 66.20 1i7b h PRO 93 Cb 0.21 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1i7b h PRO 93 CO -0.22 0.71 0.22 1.25 -0.21 0.00 0.00 178.00 179.75 1i7b h LEU 94 N 0.97 0.60 -1.31 2.35 5.85 -0.43 -2.04 115.31 121.30 1i7b h LEU 94 Ca 0.25 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1i7b h LEU 94 Cb 0.03 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1i7b h LEU 94 CO -0.04 0.56 0.05 -0.07 -0.34 0.00 0.00 178.44 178.61 1i7b h LEU 95 N 0.60 0.48 -0.26 2.25 3.38 -1.12 -1.12 115.31 119.51 1i7b h LEU 95 Ca 0.16 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1i7b h LEU 95 Cb 0.12 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1i7b h LEU 95 CO -0.02 0.51 -0.31 0.50 0.09 0.00 0.00 178.44 179.21 1i7b h LYS 96 N 0.51 0.67 -0.72 1.13 3.64 -1.26 -2.41 116.57 118.14 1i7b h LYS 96 Ca 0.12 -0.37 -0.06 0.00 -1.27 0.00 0.00 60.65 59.06 1i7b h LYS 96 Cb 0.25 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1i7b h LYS 96 CO 0.00 0.99 0.22 -0.07 -2.27 0.00 0.00 179.45 178.32 1i7b h LEU 97 N 0.40 1.05 -1.00 5.20 3.38 -1.02 0.22 115.31 123.54 1i7b h LEU 97 Ca 0.04 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 1i7b h LEU 97 Cb 0.89 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1i7b h LEU 97 CO 0.07 0.97 -0.21 0.00 0.09 0.00 0.00 178.44 179.37 1i7b h ALA 98 N 1.16 1.16 0.19 1.53 0.00 -1.19 -1.26 119.26 120.84 1i7b h ALA 98 Ca 0.23 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1i7b h ALA 98 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1i7b h ALA 98 CO -0.01 0.53 -0.09 -0.09 0.00 0.00 0.00 179.25 179.60 1i7b h ARG 99 N 0.43 -0.24 0.02 0.00 2.43 -1.07 -1.54 114.38 114.41 1i7b h ARG 99 Ca 0.07 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1i7b h ARG 99 Cb 0.61 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1i7b h ARG 99 CO 0.04 0.12 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.17 1i7b h ASP 100 N -0.94 -0.03 0.21 -3.80 3.32 -0.97 -0.81 116.42 113.41 1i7b h ASP 100 Ca -0.03 -0.10 -0.35 0.00 0.02 0.00 0.00 57.03 56.58 1i7b h ASP 100 Cb 0.48 0.01 0.02 0.00 0.22 0.00 0.00 39.33 40.05 1i7b h ASP 100 CO 0.04 0.08 -1.68 1.88 -1.72 0.00 0.00 179.24 177.84 1i7b h TYR 101 N -0.13 0.80 0.00 4.55 -1.99 -1.41 -3.40 116.97 115.39 1i7b h TYR 101 Ca -0.00 -0.59 0.00 0.00 2.00 0.00 0.00 58.73 60.14 1i7b h TYR 101 Cb 0.12 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 38.82 1i7b h TYR 101 CO -0.04 1.65 -1.28 0.43 -0.00 0.00 0.00 178.16 178.91 1i7b n SER 102 N -3.63 0.84 0.00 3.88 7.64 -0.98 -5.00 113.62 116.37 1i7b n SER 102 Ca -0.23 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.15 1i7b n SER 102 Cb 1.09 1.37 0.00 0.00 -1.01 0.00 0.00 64.21 65.66 1i7b n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i7b n GLY 103 N 1.44 0.66 3.64 0.23 0.00 -0.31 -4.97 105.19 105.89 1i7b n GLY 103 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1i7b n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1i7b s PHE 104 N -2.49 3.14 -0.72 1.61 2.99 -0.74 -4.89 117.98 116.88 1i7b s PHE 104 Ca 0.00 1.22 0.11 0.00 0.00 0.00 0.00 56.93 58.26 1i7b s PHE 104 Cb 0.00 -3.60 0.31 0.00 0.00 0.00 0.00 43.02 39.74 1i7b s PHE 104 CO 0.00 -0.83 1.26 -0.40 -0.00 0.00 0.00 175.22 175.24 1i7b n ASP 105 N 6.78 2.99 -3.69 1.36 5.68 -1.26 -3.15 116.55 125.26 1i7b n ASP 105 Ca 0.12 -2.17 -0.10 0.00 -0.50 0.00 0.00 54.79 52.14 1i7b n ASP 105 Cb 0.47 -0.26 -0.05 0.00 -1.14 0.00 0.00 41.12 40.14 1i7b n ASP 105 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1i7b s SER 106 N -1.17 -0.21 -0.18 -1.12 1.04 -1.26 -5.12 113.70 105.68 1i7b s SER 106 Ca 0.24 -0.40 -0.05 0.00 0.48 0.00 0.00 55.95 56.22 1i7b s SER 106 Cb 0.15 0.49 -0.03 0.00 0.10 0.00 0.00 66.02 66.72 1i7b s SER 106 CO 0.13 -0.89 -0.01 -0.63 0.98 0.00 0.00 173.24 172.82 1i7b s ILE 107 N -3.83 4.05 -0.07 -1.02 1.01 -1.26 -4.99 121.20 115.08 1i7b s ILE 107 Ca 0.05 -0.29 -0.24 0.00 0.00 0.00 0.00 60.65 60.17 1i7b s ILE 107 Cb 0.02 -2.80 -0.30 0.00 0.01 0.00 0.00 42.46 39.38 1i7b s ILE 107 CO -0.09 0.46 0.86 -0.61 0.00 0.00 0.00 174.94 175.56 1i7b h GLN 108 N 6.99 0.22 -2.71 2.79 4.15 -2.01 -3.48 115.11 121.07 1i7b h GLN 108 Ca -0.34 -0.37 -0.10 0.00 0.77 0.00 0.00 58.65 58.61 1i7b h GLN 108 Cb 1.18 0.14 -0.21 0.00 0.21 0.00 0.00 27.48 28.80 1i7b h GLN 108 CO 0.63 1.18 -0.16 -1.54 -1.93 0.00 0.00 178.83 177.01 1i7b s SER 109 N -6.77 -0.37 -0.02 -0.69 1.04 -1.26 -5.01 113.70 100.63 1i7b s SER 109 Ca -0.15 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.75 1i7b s SER 109 Cb -0.00 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.68 1i7b s SER 109 CO 0.79 -0.39 -0.00 0.12 0.98 0.00 0.00 173.24 174.74 1i7b s PHE 110 N -0.81 0.21 -0.05 5.02 5.36 -1.26 -5.05 117.98 121.40 1i7b s PHE 110 Ca -0.09 0.01 -0.02 0.00 -0.96 0.00 0.00 56.93 55.87 1i7b s PHE 110 Cb -0.04 -0.25 0.03 0.00 -0.34 0.00 0.00 43.02 42.42 1i7b s PHE 110 CO 0.04 -0.07 0.08 -0.06 -1.46 0.00 0.00 175.22 173.75 1i7b s PHE 111 N 0.57 0.00 -0.12 10.12 0.40 -1.26 -3.31 117.98 124.37 1i7b s PHE 111 Ca -0.05 0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.62 1i7b s PHE 111 Cb -0.08 -0.39 0.01 0.00 0.51 0.00 0.00 43.02 43.07 1i7b s PHE 111 CO -0.01 -0.19 -0.19 -0.47 0.70 0.00 0.00 175.22 175.06 1i7b s TYR 112 N 1.99 2.36 0.12 0.36 5.04 0.86 -4.98 117.35 123.10 1i7b s TYR 112 Ca 0.02 -1.15 -0.13 0.00 -2.44 0.00 0.00 57.07 53.37 1i7b s TYR 112 Cb -0.12 -1.64 0.02 0.00 0.35 0.00 0.00 41.96 40.57 1i7b s TYR 112 CO -0.04 -0.55 0.33 -1.54 -1.34 0.00 0.00 175.55 172.42 1i7b s SER 113 N 0.87 -0.09 -0.15 4.32 1.04 -1.26 0.11 113.70 118.54 1i7b s SER 113 Ca -0.07 -0.51 -0.30 0.00 0.48 0.00 0.00 55.95 55.54 1i7b s SER 113 Cb -0.15 0.43 0.13 0.00 0.10 0.00 0.00 66.02 66.53 1i7b s SER 113 CO -0.01 -0.84 1.04 0.00 0.98 0.00 0.00 173.24 174.41 1i7b s ARG 114 N -3.85 0.54 0.66 4.02 1.70 -0.83 -5.00 118.95 116.19 1i7b s ARG 114 Ca 0.06 0.02 -0.10 0.00 -0.47 0.00 0.00 55.73 55.24 1i7b s ARG 114 Cb 0.03 0.25 0.00 0.00 -0.57 0.00 0.00 34.95 34.66 1i7b s ARG 114 CO -0.09 -0.19 1.04 0.21 -1.08 0.00 0.00 175.30 175.18 1i7b s LYS 115 N -1.60 3.02 0.50 3.89 2.20 -1.26 -0.50 119.74 125.99 1i7b s LYS 115 Ca 0.02 0.41 -0.23 0.00 -0.36 0.00 0.00 55.97 55.81 1i7b s LYS 115 Cb -0.01 -2.09 -0.06 0.00 -1.51 0.00 0.00 37.83 34.16 1i7b s LYS 115 CO -0.02 -0.86 1.31 0.54 -0.36 0.00 0.00 175.35 175.96 1i7b s ASN 116 N -4.31 5.65 0.60 1.43 2.20 -0.80 -4.85 114.94 114.86 1i7b s ASN 116 Ca 0.56 2.64 -0.13 0.00 -0.94 0.00 0.00 52.86 54.99 1i7b s ASN 116 Cb -0.11 -2.63 -0.04 0.00 -2.00 0.00 0.00 41.25 36.47 1i7b s ASN 116 CO 0.51 -1.30 1.03 -0.36 -2.94 0.00 0.00 177.10 174.03 1i7b s PHE 117 N -1.36 3.39 0.04 1.54 2.99 -1.26 -4.94 117.98 118.38 1i7b s PHE 117 Ca 0.67 1.40 -0.16 0.00 0.00 0.00 0.00 56.93 58.84 1i7b s PHE 117 Cb -0.37 -2.81 -0.30 0.00 0.00 0.00 0.00 43.02 39.54 1i7b s PHE 117 CO 0.45 -0.75 1.07 0.52 -0.00 0.00 0.00 175.22 176.51 1i7b h MET 118 N 0.09 0.58 -2.59 0.44 2.86 -2.03 -3.39 114.93 110.90 1i7b h MET 118 Ca -0.45 -0.81 -0.60 0.00 -2.06 0.00 0.00 59.70 55.78 1i7b h MET 118 Cb 1.20 0.27 -0.40 0.00 0.06 0.00 0.00 31.60 32.73 1i7b h MET 118 CO 0.60 1.37 -0.82 1.63 1.06 0.00 0.00 176.91 180.75 1i7b n LYS 119 N -3.83 0.95 -0.32 1.72 5.02 -1.26 -5.00 118.16 115.45 1i7b n LYS 119 Ca -0.14 -3.74 0.11 0.00 -2.02 0.00 0.00 58.31 52.52 1i7b n LYS 119 Cb 0.98 -1.89 0.32 0.00 -0.02 0.00 0.00 35.03 34.42 1i7b n LYS 119 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1i7b h PRO 120 N 5.34 0.78 0.00 1.97 0.11 -1.93 -2.41 132.00 135.86 1i7b h PRO 120 Ca 0.21 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1i7b h PRO 120 Cb 0.84 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1i7b h PRO 120 CO 0.53 0.51 0.00 0.66 -0.21 0.00 0.00 178.00 179.49 1i7b h SER 121 N 0.80 0.00 1.08 -2.05 4.64 -1.94 -2.51 113.55 113.56 1i7b h SER 121 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1i7b h SER 121 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1i7b h SER 121 CO -0.26 0.00 -0.12 1.41 -0.87 0.00 0.00 176.83 176.99 1i7b n HIS 122 N -2.46 0.35 -1.92 4.77 8.25 -0.91 -4.88 115.22 118.42 1i7b n HIS 122 Ca 0.00 0.10 -0.31 0.00 -0.26 0.00 0.00 57.72 57.25 1i7b n HIS 122 Cb 0.16 -0.62 0.01 0.00 1.12 0.00 0.00 29.99 30.65 1i7b n HIS 122 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1i7b s GLN 123 N -3.05 3.63 0.38 -0.41 -1.52 -0.95 -4.97 119.66 112.78 1i7b s GLN 123 Ca 0.12 0.77 0.08 0.00 -1.95 0.00 0.00 55.36 54.38 1i7b s GLN 123 Cb 0.16 -2.08 -0.03 0.00 -0.22 0.00 0.00 33.01 30.83 1i7b s GLN 123 CO 0.59 -0.55 0.26 0.20 -0.25 0.00 0.00 175.29 175.54 1i7b s GLY 124 N -4.07 2.07 0.38 3.09 0.00 -1.26 -4.69 107.32 102.83 1i7b s GLY 124 Ca 0.55 -1.88 -0.28 0.00 0.00 0.00 0.00 44.72 43.12 1i7b s GLY 124 CO 0.52 -1.74 1.44 2.98 0.00 0.00 0.00 173.10 176.30 1i7b n TYR 125 N -1.35 2.81 -0.87 1.90 9.36 -1.26 -0.50 117.16 127.25 1i7b n TYR 125 Ca -0.00 0.47 -0.21 0.00 3.32 0.00 0.00 57.90 61.48 1i7b n TYR 125 Cb 0.62 -2.50 0.14 0.00 -0.63 0.00 0.00 39.34 36.97 1i7b n TYR 125 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1i7b n PRO 126 N 0.40 2.06 -0.97 2.98 -0.04 -1.26 -4.97 135.00 133.20 1i7b n PRO 126 Ca 0.02 -2.51 -0.11 0.00 -0.04 0.00 0.00 63.50 60.87 1i7b n PRO 126 Cb 0.39 -1.98 0.19 0.00 -0.04 0.00 0.00 33.50 32.05 1i7b n PRO 126 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1i7b n HIS 127 N -0.84 1.70 0.50 0.54 8.25 0.34 -3.02 115.22 122.69 1i7b n HIS 127 Ca 0.50 -1.74 0.13 0.00 -0.26 0.00 0.00 57.72 56.34 1i7b n HIS 127 Cb 1.41 -0.63 0.36 0.00 1.12 0.00 0.00 29.99 32.25 1i7b n HIS 127 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i7b h ARG 128 N 1.07 0.00 -1.39 -0.41 3.08 -1.84 -3.43 114.38 111.46 1i7b h ARG 128 Ca 0.34 0.00 0.26 0.00 0.07 0.00 0.00 59.98 60.66 1i7b h ARG 128 Cb 1.93 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 31.79 1i7b h ARG 128 CO 0.62 0.00 0.84 0.54 -1.07 0.00 0.00 179.97 180.90 1i7b s ASN 129 N -4.94 -0.11 0.32 7.04 2.20 -1.26 -4.71 114.94 113.48 1i7b s ASN 129 Ca 0.09 0.01 0.01 0.00 -0.94 0.00 0.00 52.86 52.02 1i7b s ASN 129 Cb 0.10 0.12 0.55 0.00 -2.00 0.00 0.00 41.25 40.02 1i7b s ASN 129 CO 0.60 -0.19 1.98 0.15 -2.94 0.00 0.00 177.10 176.69 1i7b h PHE 130 N 2.01 0.93 -0.55 1.54 3.57 -1.92 -1.80 116.94 120.71 1i7b h PHE 130 Ca -0.08 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1i7b h PHE 130 Cb 1.16 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 1i7b h PHE 130 CO 0.28 0.56 0.30 1.96 -2.23 0.00 0.00 178.31 179.19 1i7b h GLN 131 N 0.98 0.76 -0.47 1.11 1.08 -1.97 0.22 115.11 116.83 1i7b h GLN 131 Ca 0.29 -0.08 -0.13 0.00 -1.45 0.00 0.00 58.65 57.29 1i7b h GLN 131 Cb -0.04 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.22 1i7b h GLN 131 CO -0.07 0.56 -0.21 1.49 -0.95 0.00 0.00 178.83 179.65 1i7b h GLU 132 N 0.77 0.95 -0.50 1.46 4.81 -1.63 -1.44 114.58 119.00 1i7b h GLU 132 Ca 0.20 -0.40 -0.13 0.00 -0.13 0.00 0.00 59.36 58.90 1i7b h GLU 132 Cb 0.02 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1i7b h GLU 132 CO -0.03 1.06 -0.19 0.93 -0.73 0.00 0.00 179.01 180.05 1i7b h GLU 133 N 0.82 1.01 -0.36 1.92 5.08 -0.88 -1.82 114.58 120.35 1i7b h GLU 133 Ca 0.11 -0.42 0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1i7b h GLU 133 Cb 0.77 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1i7b h GLU 133 CO 0.06 1.10 0.23 0.82 -1.00 0.00 0.00 179.01 180.22 1i7b h ILE 134 N 0.87 1.07 -0.72 3.13 2.04 -0.43 -1.50 117.51 121.98 1i7b h ILE 134 Ca 0.12 -0.16 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1i7b h ILE 134 Cb 0.76 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1i7b h ILE 134 CO 0.06 0.09 0.20 -0.33 0.00 0.00 0.00 178.15 178.17 1i7b h GLU 135 N 0.47 1.13 -0.30 2.37 5.08 -1.14 0.12 114.58 122.32 1i7b h GLU 135 Ca 0.14 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1i7b h GLU 135 Cb -0.04 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1i7b h GLU 135 CO -0.04 0.97 0.14 0.35 -1.00 0.00 0.00 179.01 179.43 1i7b h PHE 136 N 1.08 0.43 -0.26 4.33 3.57 -1.06 -2.46 116.94 122.57 1i7b h PHE 136 Ca 0.23 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.57 1i7b h PHE 136 Cb 0.33 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1i7b h PHE 136 CO 0.03 0.40 -0.40 -0.07 -2.23 0.00 0.00 178.31 176.04 1i7b h LEU 137 N 0.34 0.64 -1.97 0.59 3.38 -1.08 -2.88 115.31 114.33 1i7b h LEU 137 Ca 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1i7b h LEU 137 Cb 0.14 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1i7b h LEU 137 CO -0.01 0.96 -0.11 0.78 0.09 0.00 0.00 178.44 180.16 1i7b h ASN 138 N 0.50 0.00 1.30 -0.43 2.35 -0.60 0.13 115.58 118.83 1i7b h ASN 138 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1i7b h ASN 138 Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1i7b h ASN 138 CO 0.08 0.11 0.00 0.00 -1.65 0.00 0.00 177.43 175.97 1i7b h ALA 139 N 1.89 1.00 0.00 -0.83 0.00 -1.21 -3.31 119.26 116.81 1i7b h ALA 139 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.48 1i7b h ALA 139 Cb 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.98 1i7b h ALA 139 CO 0.01 0.00 -2.50 -0.89 0.00 0.00 0.00 179.25 175.87 1i7b n ILE 140 N -2.72 1.49 -4.55 0.00 5.41 -0.36 -5.00 119.36 113.63 1i7b n ILE 140 Ca 0.03 -0.46 -0.32 0.00 1.00 0.00 0.00 62.75 63.00 1i7b n ILE 140 Cb 0.37 -1.67 -0.11 0.00 -0.71 0.00 0.00 39.64 37.52 1i7b n ILE 140 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1i7b s PHE 141 N -2.51 2.78 -0.20 1.39 0.40 0.30 -5.03 117.98 115.11 1i7b s PHE 141 Ca -0.37 -0.11 0.21 0.00 -0.60 0.00 0.00 56.93 56.06 1i7b s PHE 141 Cb 0.12 -1.57 -0.05 0.00 0.51 0.00 0.00 43.02 42.04 1i7b s PHE 141 CO 0.53 0.32 0.97 -0.35 0.70 0.00 0.00 175.22 177.39 1i7b n PRO 142 N 1.60 0.61 -2.00 0.24 -0.04 -1.26 -4.41 135.00 129.74 1i7b n PRO 142 Ca -0.16 0.14 -0.31 0.00 -0.04 0.00 0.00 63.50 63.13 1i7b n PRO 142 Cb 0.52 -1.81 0.03 0.00 -0.04 0.00 0.00 33.50 32.20 1i7b n PRO 142 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1i7b n ASN 143 N -2.72 6.07 -4.81 3.54 6.94 -1.26 -5.05 115.26 117.98 1i7b n ASN 143 Ca -0.03 -3.77 -0.34 0.00 -0.02 0.00 0.00 54.58 50.42 1i7b n ASN 143 Cb 0.62 -0.69 -0.06 0.00 -2.36 0.00 0.00 39.78 37.29 1i7b n ASN 143 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1i7b s GLY 144 N -2.60 2.53 -0.12 4.83 0.00 -1.26 -0.68 107.32 110.03 1i7b s GLY 144 Ca 0.53 0.47 -0.03 0.00 0.00 0.00 0.00 44.72 45.69 1i7b s GLY 144 CO -0.16 0.81 0.05 0.00 0.00 0.00 0.00 173.10 173.80 1i7b s ALA 145 N -1.98 0.56 -0.07 3.20 0.00 0.26 -4.83 121.76 118.90 1i7b s ALA 145 Ca 0.59 -0.23 -0.01 0.00 0.00 0.00 0.00 51.96 52.31 1i7b s ALA 145 Cb -0.13 -0.90 -0.03 0.00 0.00 0.00 0.00 23.12 22.06 1i7b s ALA 145 CO 0.17 -0.84 -0.01 0.20 0.00 0.00 0.00 175.76 175.29 1i7b s GLY 146 N 2.05 1.84 0.07 0.00 0.00 -1.26 -1.22 107.32 108.80 1i7b s GLY 146 Ca 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.91 1i7b s GLY 146 CO -0.06 -0.62 -0.05 -0.19 0.00 0.00 0.00 173.10 172.17 1i7b s TYR 147 N -0.91 0.66 -0.11 1.90 1.51 0.13 -4.99 117.35 115.54 1i7b s TYR 147 Ca 0.14 -0.96 -0.01 0.00 -1.01 0.00 0.00 57.07 55.24 1i7b s TYR 147 Cb -0.11 -0.43 0.03 0.00 -0.11 0.00 0.00 41.96 41.33 1i7b s TYR 147 CO 0.04 -0.27 -0.05 0.00 -1.11 0.00 0.00 175.55 174.16 1i7b s MET 149 N 1.79 3.39 0.54 0.00 -1.94 0.11 -4.95 119.30 118.24 1i7b s MET 149 Ca 0.05 -0.26 0.00 0.00 -1.71 0.00 0.00 55.69 53.76 1i7b s MET 149 Cb -0.13 -3.06 0.00 0.00 2.01 0.00 0.00 34.83 33.65 1i7b s MET 149 CO -0.07 0.66 0.00 0.41 -0.01 0.00 0.00 175.02 176.01 1i7b n GLY 150 N 2.33 -2.11 3.64 -0.03 0.00 -1.26 -0.75 105.19 107.01 1i7b n GLY 150 Ca -0.19 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 1i7b n GLY 150 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1i7b s ARG 151 N -0.14 4.05 0.55 1.61 0.52 -1.24 -4.90 118.95 119.40 1i7b s ARG 151 Ca 0.00 1.11 -0.20 0.00 -0.52 0.00 0.00 55.73 56.12 1i7b s ARG 151 Cb 0.00 -3.75 -0.05 0.00 0.52 0.00 0.00 34.95 31.67 1i7b s ARG 151 CO 0.00 -0.92 1.24 -1.64 0.02 0.00 0.00 175.30 174.00 1i7b s MET 152 N 3.71 3.17 -1.12 3.54 -1.94 -1.26 -2.29 119.30 123.10 1i7b s MET 152 Ca 0.47 1.93 0.00 0.00 -1.71 0.00 0.00 55.69 56.38 1i7b s MET 152 Cb -0.13 -2.11 0.00 0.00 2.01 0.00 0.00 34.83 34.60 1i7b s MET 152 CO 0.16 -1.08 0.00 0.09 -0.01 0.00 0.00 175.02 174.18 1i7b n ASN 153 N -1.22 -4.08 0.00 3.03 4.13 -1.26 -4.92 115.26 110.94 1i7b n ASN 153 Ca 0.12 0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.50 1i7b n ASN 153 Cb 0.48 -3.00 0.00 0.00 -1.54 0.00 0.00 39.78 35.72 1i7b n ASN 153 CO 0.00 0.00 0.00 -0.24 0.28 0.00 0.00 177.26 177.30 1i7b n SER 154 N -0.11 0.00 -4.60 6.41 2.88 -0.97 -5.10 113.62 112.13 1i7b n SER 154 Ca -0.13 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 56.98 1i7b n SER 154 Cb 0.51 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 1i7b n SER 154 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1i7b s ASP 155 N 2.00 6.20 0.35 -3.46 1.11 -1.25 -4.87 116.67 116.74 1i7b s ASP 155 Ca 0.00 0.85 0.06 0.00 0.18 0.00 0.00 52.55 53.64 1i7b s ASP 155 Cb 0.00 -2.54 -0.03 0.00 1.07 0.00 0.00 42.92 41.42 1i7b s ASP 155 CO 0.00 -1.54 0.22 0.00 1.18 0.00 0.00 175.17 175.03 1i7b s TRP 157 N -3.41 -0.03 -0.03 0.00 -0.00 0.07 -1.91 118.94 113.62 1i7b s TRP 157 Ca 0.35 0.22 -0.02 0.00 -0.00 0.00 0.00 56.10 56.66 1i7b s TRP 157 Cb 0.03 -0.17 -0.04 0.00 -0.00 0.00 0.00 33.47 33.29 1i7b s TRP 157 CO 0.23 -0.10 0.08 0.71 -0.00 0.00 0.00 176.95 177.86 1i7b s TYR 158 N 0.98 3.31 -0.04 5.86 1.51 0.34 0.08 117.35 129.39 1i7b s TYR 158 Ca -0.08 0.25 -0.02 0.00 -1.01 0.00 0.00 57.07 56.21 1i7b s TYR 158 Cb -0.11 -1.77 0.03 0.00 -0.11 0.00 0.00 41.96 39.99 1i7b s TYR 158 CO -0.03 0.56 0.08 -1.17 -1.11 0.00 0.00 175.55 173.88 1i7b s LEU 159 N -1.50 1.13 -0.12 -1.29 2.96 -0.57 -1.96 118.68 117.33 1i7b s LEU 159 Ca 0.20 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.28 1i7b s LEU 159 Cb -0.12 0.17 0.02 0.00 0.50 0.00 0.00 46.19 46.76 1i7b s LEU 159 CO 0.11 -0.11 -0.14 -0.47 -1.32 0.00 0.00 176.35 174.42 1i7b s TYR 160 N 0.83 1.97 0.21 5.38 5.04 0.12 0.17 117.35 131.07 1i7b s TYR 160 Ca -0.07 -1.01 0.00 0.00 -2.44 0.00 0.00 57.07 53.56 1i7b s TYR 160 Cb -0.09 -1.46 -0.05 0.00 0.35 0.00 0.00 41.96 40.71 1i7b s TYR 160 CO -0.03 -0.56 0.08 -0.08 -1.34 0.00 0.00 175.55 173.63 1i7b s THR 161 N 1.28 0.38 -0.16 4.34 -1.32 -0.35 -0.10 115.64 119.71 1i7b s THR 161 Ca -0.00 -1.99 -0.07 0.00 -1.21 0.00 0.00 61.69 58.42 1i7b s THR 161 Cb -0.14 -2.44 -0.04 0.00 -1.51 0.00 0.00 72.50 68.37 1i7b s THR 161 CO -0.06 -0.14 0.09 -0.76 -2.21 0.00 0.00 174.62 171.55 1i7b s LEU 162 N -3.22 4.05 -0.83 9.08 1.43 -1.21 -0.58 118.68 127.41 1i7b s LEU 162 Ca 0.34 0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 53.51 1i7b s LEU 162 Cb 0.07 -2.01 0.16 0.00 0.03 0.00 0.00 46.19 44.45 1i7b s LEU 162 CO 0.10 0.27 0.90 -0.62 0.23 0.00 0.00 176.35 177.23 1i7b s ASP 163 N -0.19 6.61 -0.19 2.29 3.68 0.15 -4.81 116.67 124.20 1i7b s ASP 163 Ca 0.09 -2.22 -0.19 0.00 2.13 0.00 0.00 52.55 52.36 1i7b s ASP 163 Cb -0.12 -2.30 -0.03 0.00 -1.45 0.00 0.00 42.92 39.02 1i7b s ASP 163 CO 0.01 -0.86 0.55 -0.36 0.13 0.00 0.00 175.17 174.63 1i7b s PHE 164 N 1.61 3.38 0.33 -5.34 0.08 -1.26 -4.89 117.98 111.88 1i7b s PHE 164 Ca 0.23 0.82 0.11 0.00 0.12 0.00 0.00 56.93 58.21 1i7b s PHE 164 Cb -0.10 -2.70 0.93 0.00 -0.57 0.00 0.00 43.02 40.58 1i7b s PHE 164 CO -0.07 -0.11 1.72 -1.35 -0.10 0.00 0.00 175.22 175.32 1i7b h PRO 165 N 7.43 0.52 -2.53 0.24 0.11 -2.00 -3.49 132.00 132.28 1i7b h PRO 165 Ca -0.33 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.65 1i7b h PRO 165 Cb 1.15 -0.12 -0.22 0.00 0.11 0.00 0.00 31.00 31.93 1i7b h PRO 165 CO 0.75 0.34 -0.10 -2.00 -0.21 0.00 0.00 178.00 176.78 1i7b s GLU 166 N -5.74 0.69 0.00 1.05 2.56 -1.26 -5.20 118.70 110.80 1i7b s GLU 166 Ca -0.10 0.45 0.00 0.00 0.00 0.00 0.00 54.97 55.32 1i7b s GLU 166 Cb 0.28 0.33 0.00 0.00 2.00 0.00 0.00 34.13 36.73 1i7b s GLU 166 CO 0.80 -0.14 0.00 -1.13 -0.56 0.00 0.00 175.26 174.23 1i7b n SER 171 N 2.18 0.00 -4.96 -1.70 3.41 -1.26 -5.17 113.62 106.12 1i7b n SER 171 Ca -0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.23 1i7b n SER 171 Cb 0.56 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.55 1i7b n SER 171 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1i7b s GLN 172 N -1.99 2.67 0.14 4.33 0.00 -1.26 -4.89 119.66 118.65 1i7b s GLN 172 Ca 0.00 -0.60 -0.34 0.00 -0.00 0.00 0.00 55.36 54.42 1i7b s GLN 172 Cb 0.00 -2.46 -0.13 0.00 0.00 0.00 0.00 33.01 30.42 1i7b s GLN 172 CO 0.00 -0.65 1.62 -2.30 0.00 0.00 0.00 175.29 173.96 1i7b n PRO 173 N -2.35 2.20 -3.75 9.60 -0.02 -1.26 -4.80 135.00 134.61 1i7b n PRO 173 Ca 0.06 0.79 -0.13 0.00 -2.02 0.00 0.00 63.50 62.20 1i7b n PRO 173 Cb 0.59 -2.58 -0.10 0.00 -0.02 0.00 0.00 33.50 31.39 1i7b n PRO 173 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1i7b s ASP 174 N 1.30 -0.33 0.04 2.55 2.15 -1.26 -4.87 116.67 116.24 1i7b s ASP 174 Ca 0.80 0.54 -0.26 0.00 0.43 0.00 0.00 52.55 54.06 1i7b s ASP 174 Cb -0.67 0.61 0.06 0.00 -0.30 0.00 0.00 42.92 42.63 1i7b s ASP 174 CO 0.39 -0.24 0.60 0.00 -0.17 0.00 0.00 175.17 175.76 1i7b s GLN 175 N -0.30 1.10 -0.09 4.34 0.00 -1.26 -1.55 119.66 121.90 1i7b s GLN 175 Ca -0.04 -0.10 -0.04 0.00 -0.00 0.00 0.00 55.36 55.18 1i7b s GLN 175 Cb -0.03 0.51 0.05 0.00 0.00 0.00 0.00 33.01 33.53 1i7b s GLN 175 CO 0.02 -0.40 0.20 0.99 0.00 0.00 0.00 175.29 176.10 1i7b s THR 176 N -2.26 -0.12 -0.08 3.63 2.01 -0.33 -4.33 115.64 114.16 1i7b s THR 176 Ca -0.06 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.18 1i7b s THR 176 Cb -0.01 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.16 1i7b s THR 176 CO 0.00 0.08 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.61 1i7b s LEU 177 N 1.52 2.44 -0.02 4.42 2.96 0.14 -0.95 118.68 129.20 1i7b s LEU 177 Ca -0.06 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 1i7b s LEU 177 Cb -0.11 -1.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.07 1i7b s LEU 177 CO -0.07 0.24 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.42 1i7b s GLU 178 N -0.12 1.41 -0.26 1.98 2.02 -0.47 -1.00 118.70 122.25 1i7b s GLU 178 Ca -0.03 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.38 1i7b s GLU 178 Cb -0.14 -1.33 0.07 0.00 0.10 0.00 0.00 34.13 32.83 1i7b s GLU 178 CO 0.04 0.34 -0.02 0.42 0.02 0.00 0.00 175.26 176.06 1i7b s ILE 179 N -0.31 1.56 -0.38 -1.63 1.01 0.68 -1.79 121.20 120.35 1i7b s ILE 179 Ca 0.05 -1.43 -0.12 0.00 0.00 0.00 0.00 60.65 59.14 1i7b s ILE 179 Cb -0.07 -1.93 0.03 0.00 0.01 0.00 0.00 42.46 40.50 1i7b s ILE 179 CO -0.00 -0.26 0.23 -0.76 0.00 0.00 0.00 174.94 174.14 1i7b s LEU 180 N 1.34 4.82 -0.04 2.97 1.43 -0.17 -1.42 118.68 127.61 1i7b s LEU 180 Ca -0.01 -0.98 -0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1i7b s LEU 180 Cb -0.19 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 1i7b s LEU 180 CO -0.09 -0.40 0.01 -0.04 0.23 0.00 0.00 176.35 176.05 1i7b s MET 181 N 1.58 2.89 0.22 1.70 -1.94 0.63 -1.20 119.30 123.19 1i7b s MET 181 Ca 0.03 -0.51 0.01 0.00 -1.71 0.00 0.00 55.69 53.50 1i7b s MET 181 Cb -0.19 -2.74 -0.05 0.00 2.01 0.00 0.00 34.83 33.86 1i7b s MET 181 CO 0.07 0.66 0.08 -1.12 -0.01 0.00 0.00 175.02 174.70 1i7b s SER 182 N -1.29 1.03 -1.21 3.03 0.01 -0.04 -1.34 113.70 113.89 1i7b s SER 182 Ca 0.17 -1.33 -0.15 0.00 1.31 0.00 0.00 55.95 55.96 1i7b s SER 182 Cb -0.11 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.29 1i7b s SER 182 CO 0.07 -0.70 0.70 -0.62 0.41 0.00 0.00 173.24 173.10 1i7b n GLU 183 N -0.37 -1.94 -2.28 12.44 1.02 -1.24 -1.82 120.64 126.45 1i7b n GLU 183 Ca -0.02 0.45 -0.32 0.00 -0.02 0.00 0.00 57.16 57.26 1i7b n GLU 183 Cb 0.65 -4.27 -0.02 0.00 -0.02 0.00 0.00 31.44 27.78 1i7b n GLU 183 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1i7b s LEU 184 N -6.61 3.53 0.13 -4.62 1.02 -1.26 -0.36 118.68 110.51 1i7b s LEU 184 Ca 0.34 1.51 -0.33 0.00 0.02 0.00 0.00 54.13 55.67 1i7b s LEU 184 Cb -0.12 -4.48 -0.12 0.00 0.02 0.00 0.00 46.19 41.49 1i7b s LEU 184 CO 0.86 -0.65 1.74 -0.67 0.02 0.00 0.00 176.35 177.65 1i7b n ASP 185 N -1.87 3.67 -0.36 2.29 -0.08 -0.74 -4.90 116.55 114.56 1i7b n ASP 185 Ca 0.06 1.03 0.02 0.00 -1.51 0.00 0.00 54.79 54.39 1i7b n ASP 185 Cb 0.54 -1.50 0.16 0.00 2.34 0.00 0.00 41.12 42.67 1i7b n ASP 185 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1i7b h PRO 186 N 7.41 1.14 -0.61 -0.67 0.11 -1.94 -1.17 132.00 136.27 1i7b h PRO 186 Ca -0.45 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 65.49 1i7b h PRO 186 Cb 1.23 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 1i7b h PRO 186 CO 0.93 0.75 0.00 0.00 -0.21 0.00 0.00 178.00 179.48 1i7b h ALA 187 N 1.44 0.85 -0.30 -0.75 0.00 -2.00 -1.19 119.26 117.31 1i7b h ALA 187 Ca 0.42 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1i7b h ALA 187 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1i7b h ALA 187 CO -0.16 0.67 0.05 0.28 0.00 0.00 0.00 179.25 180.09 1i7b h VAL 188 N 0.98 1.23 0.00 0.00 2.07 -1.82 -3.00 116.25 115.71 1i7b h VAL 188 Ca 0.17 -0.80 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 1i7b h VAL 188 Cb 0.55 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1i7b h VAL 188 CO 0.03 0.26 -0.12 0.24 0.02 0.00 0.00 177.57 178.00 1i7b h MET 189 N 0.33 0.00 0.00 1.57 2.86 -1.01 -2.57 114.93 116.11 1i7b h MET 189 Ca 0.09 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1i7b h MET 189 Cb 0.34 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 1i7b h MET 189 CO 0.01 0.12 -0.05 0.22 1.06 0.00 0.00 176.91 178.27 1i7b h ASP 190 N 0.00 0.00 0.51 1.22 3.58 -1.06 -1.19 116.42 119.48 1i7b h ASP 190 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1i7b h ASP 190 Cb 0.25 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 1i7b h ASP 190 CO 0.02 0.05 -0.04 1.56 -2.88 0.00 0.00 179.24 177.95 1i7b h GLN 191 N 0.00 0.00 -1.00 0.28 4.20 -1.57 -3.10 115.11 113.93 1i7b h GLN 191 Ca -0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 1i7b h GLN 191 Cb 0.12 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 27.59 1i7b h GLN 191 CO 0.01 0.04 0.66 1.19 -0.67 0.00 0.00 178.83 180.05 1i7b n PHE 192 N -3.23 3.08 -5.19 2.96 3.01 -0.45 -4.85 117.46 112.78 1i7b n PHE 192 Ca -0.01 -1.88 -0.31 0.00 1.01 0.00 0.00 57.45 56.25 1i7b n PHE 192 Cb 0.21 -0.96 -0.17 0.00 -0.01 0.00 0.00 39.48 38.55 1i7b n PHE 192 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 1i7b s TYR 193 N -3.31 2.45 0.22 1.38 1.51 -1.17 -1.17 117.35 117.26 1i7b s TYR 193 Ca 0.57 -0.92 -0.32 0.00 -1.01 0.00 0.00 57.07 55.39 1i7b s TYR 193 Cb 0.48 -1.63 -0.13 0.00 -0.11 0.00 0.00 41.96 40.57 1i7b s TYR 193 CO 0.11 -0.35 1.55 -1.33 -1.11 0.00 0.00 175.55 174.42 1i7b n MET 194 N 3.36 2.34 -4.20 -0.62 2.81 -0.46 -5.00 117.12 115.35 1i7b n MET 194 Ca -0.19 0.84 -0.16 0.00 -1.81 0.00 0.00 57.70 56.38 1i7b n MET 194 Cb 0.53 -2.59 -0.14 0.00 -0.71 0.00 0.00 33.22 30.31 1i7b n MET 194 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1i7b s LYS 195 N 0.23 0.54 0.24 0.03 1.02 -1.26 -5.01 119.74 115.53 1i7b s LYS 195 Ca 0.72 -0.34 -0.31 0.00 0.02 0.00 0.00 55.97 56.05 1i7b s LYS 195 Cb -0.60 -0.49 -0.12 0.00 -0.52 0.00 0.00 37.83 36.10 1i7b s LYS 195 CO 0.43 0.13 1.60 -0.25 -0.92 0.00 0.00 175.35 176.33 1i7b n ASP 196 N 2.64 3.61 0.00 2.83 8.00 -1.26 -1.90 116.55 130.46 1i7b n ASP 196 Ca -0.15 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.47 1i7b n ASP 196 Cb 0.57 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 1i7b n ASP 196 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i7b n GLY 197 N 2.84 0.84 3.15 0.44 0.00 -1.26 -5.00 105.19 106.19 1i7b n GLY 197 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1i7b n GLY 197 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i7b s VAL 198 N -3.40 2.52 0.55 1.61 1.01 -0.80 -5.09 120.40 116.81 1i7b s VAL 198 Ca 0.00 -1.14 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1i7b s VAL 198 Cb 0.00 -2.27 0.03 0.00 0.00 0.00 0.00 36.38 34.13 1i7b s VAL 198 CO 0.00 0.23 0.79 0.42 0.00 0.00 0.00 175.10 176.55 1i7b s THR 199 N 1.27 3.04 0.40 3.92 -4.23 -1.26 -4.53 115.64 114.25 1i7b s THR 199 Ca -0.01 -0.50 0.07 0.00 -1.18 0.00 0.00 61.69 60.08 1i7b s THR 199 Cb -0.16 -3.16 0.24 0.00 1.34 0.00 0.00 72.50 70.75 1i7b s THR 199 CO -0.07 -0.13 2.02 0.00 -0.54 0.00 0.00 174.62 175.90 1i7b h ALA 200 N 0.03 1.64 -0.29 3.99 0.00 -1.96 -1.38 119.26 121.30 1i7b h ALA 200 Ca -0.44 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 1i7b h ALA 200 Cb 1.28 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1i7b h ALA 200 CO 0.55 0.29 -0.07 -0.22 0.00 0.00 0.00 179.25 179.81 1i7b h LYS 201 N 0.48 0.55 -0.20 0.00 3.64 -1.94 -1.03 116.57 118.08 1i7b h LYS 201 Ca 0.12 -0.21 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1i7b h LYS 201 Cb 0.06 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 1i7b h LYS 201 CO -0.02 0.76 0.02 -0.44 -2.27 0.00 0.00 179.45 177.50 1i7b h ASP 202 N 0.31 -0.02 -0.51 4.20 3.32 -1.75 -2.57 116.42 119.40 1i7b h ASP 202 Ca 0.07 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.18 1i7b h ASP 202 Cb 0.55 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1i7b h ASP 202 CO 0.03 0.02 0.30 0.58 -1.72 0.00 0.00 179.24 178.45 1i7b h VAL 203 N 0.10 1.05 -0.68 -1.35 2.07 -1.20 -0.05 116.25 116.19 1i7b h VAL 203 Ca 0.09 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.46 1i7b h VAL 203 Cb 0.10 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 1i7b h VAL 203 CO -0.14 0.11 0.39 0.74 0.02 0.00 0.00 177.57 178.69 1i7b h THR 204 N 0.60 0.99 0.15 2.57 2.02 -0.90 -1.45 112.91 116.88 1i7b h THR 204 Ca 0.20 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.13 1i7b h THR 204 Cb 0.03 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1i7b h THR 204 CO -0.09 0.13 -0.07 -0.09 0.37 0.00 0.00 175.52 175.76 1i7b h ARG 205 N 0.72 -0.19 -0.02 6.66 2.43 -1.20 -0.49 114.38 122.29 1i7b h ARG 205 Ca 0.30 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 1i7b h ARG 205 Cb 0.16 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1i7b h ARG 205 CO -0.17 0.17 0.02 0.93 -1.51 0.00 0.00 179.97 179.41 1i7b h GLU 206 N -0.96 0.00 0.00 0.20 5.08 -1.00 -1.85 114.58 116.06 1i7b h GLU 206 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1i7b h GLU 206 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1i7b h GLU 206 CO 0.03 0.00 -0.16 -1.13 -1.00 0.00 0.00 179.01 176.75 1i7b n SER 207 N -4.18 0.22 0.00 1.42 3.41 -0.55 -4.91 113.62 109.02 1i7b n SER 207 Ca -0.03 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1i7b n SER 207 Cb 0.11 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1i7b n SER 207 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i7b n GLY 208 N 1.48 0.74 0.08 5.00 0.00 -0.70 -4.92 105.19 106.87 1i7b n GLY 208 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1i7b n GLY 208 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1i7b h ILE 209 N 0.00 1.29 -0.73 -0.61 2.04 -1.63 -3.30 117.51 114.57 1i7b h ILE 209 Ca 0.00 -0.93 0.16 0.00 1.00 0.00 0.00 64.86 65.10 1i7b h ILE 209 Cb 0.00 1.79 -0.13 0.00 -0.74 0.00 0.00 36.82 37.74 1i7b h ILE 209 CO 0.00 0.25 0.02 -0.09 0.00 0.00 0.00 178.15 178.33 1i7b h ARG 210 N -0.22 0.11 -0.03 2.37 2.43 -1.37 -1.53 114.38 116.15 1i7b h ARG 210 Ca 0.02 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1i7b h ARG 210 Cb 0.41 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1i7b h ARG 210 CO 0.01 0.07 0.00 -0.25 -1.51 0.00 0.00 179.97 178.29 1i7b n ASP 211 N -5.32 0.22 -0.24 -3.80 8.00 -1.24 -3.83 116.55 110.33 1i7b n ASP 211 Ca 0.13 -1.63 -0.07 0.00 0.71 0.00 0.00 54.79 53.93 1i7b n ASP 211 Cb 0.45 -0.02 0.07 0.00 -0.02 0.00 0.00 41.12 41.61 1i7b n ASP 211 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1i7b h LEU 212 N 0.27 1.04 -6.57 0.64 3.38 -1.36 -3.34 115.31 109.37 1i7b h LEU 212 Ca 0.00 -0.22 -0.59 0.00 0.09 0.00 0.00 57.88 57.16 1i7b h LEU 212 Cb 0.06 -0.27 -0.39 0.00 0.09 0.00 0.00 40.66 40.15 1i7b h LEU 212 CO 0.00 0.99 -0.87 -0.63 0.09 0.00 0.00 178.44 178.02 1i7b s ILE 213 N -5.30 0.57 0.86 1.22 1.01 -1.25 -5.08 121.20 113.24 1i7b s ILE 213 Ca -0.12 -2.40 -0.14 0.00 0.00 0.00 0.00 60.65 58.00 1i7b s ILE 213 Cb 0.15 -1.41 0.03 0.00 0.01 0.00 0.00 42.46 41.24 1i7b s ILE 213 CO 0.84 -1.09 0.64 -2.65 0.00 0.00 0.00 174.94 172.69 1i7b n PRO 214 N 3.32 -0.06 -1.73 2.79 -0.02 -1.26 -3.67 135.00 134.37 1i7b n PRO 214 Ca 0.20 0.04 -0.11 0.00 -2.02 0.00 0.00 63.50 61.61 1i7b n PRO 214 Cb 0.41 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 1i7b n PRO 214 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i7b n GLY 215 N 1.27 0.60 3.91 -1.23 0.00 -1.26 -5.02 105.19 103.46 1i7b n GLY 215 Ca 0.09 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.30 1i7b n GLY 215 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1i7b s SER 216 N -2.72 6.40 -0.15 1.61 0.01 -1.24 -4.74 113.70 112.88 1i7b s SER 216 Ca 0.00 0.38 -0.22 0.00 1.31 0.00 0.00 55.95 57.42 1i7b s SER 216 Cb 0.00 -2.01 -0.03 0.00 0.21 0.00 0.00 66.02 64.20 1i7b s SER 216 CO 0.00 0.15 0.68 -0.69 0.41 0.00 0.00 173.24 173.79 1i7b s VAL 217 N -1.52 5.02 -0.05 3.43 1.01 0.37 -4.87 120.40 123.78 1i7b s VAL 217 Ca 0.35 1.33 0.05 0.00 0.00 0.00 0.00 61.98 63.71 1i7b s VAL 217 Cb -0.13 -4.00 -0.00 0.00 0.00 0.00 0.00 36.38 32.25 1i7b s VAL 217 CO 0.26 0.15 -0.20 -0.63 0.00 0.00 0.00 175.10 174.68 1i7b s ILE 218 N 1.51 1.69 -0.25 2.22 1.01 -1.26 -1.38 121.20 124.75 1i7b s ILE 218 Ca 0.33 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 60.15 1i7b s ILE 218 Cb -0.16 -1.45 0.06 0.00 0.01 0.00 0.00 42.46 40.92 1i7b s ILE 218 CO 0.13 0.48 -0.10 -0.62 0.00 0.00 0.00 174.94 174.82 1i7b s ASP 219 N 0.02 4.19 0.10 3.58 2.15 -0.68 -5.00 116.67 121.03 1i7b s ASP 219 Ca -0.06 -1.28 0.08 0.00 0.43 0.00 0.00 52.55 51.73 1i7b s ASP 219 Cb -0.13 -1.46 -0.03 0.00 -0.30 0.00 0.00 42.92 41.00 1i7b s ASP 219 CO 0.03 -0.18 -0.20 0.00 -0.17 0.00 0.00 175.17 174.65 1i7b s ALA 220 N 1.19 1.77 -0.00 3.66 0.00 -1.26 -1.36 121.76 125.75 1i7b s ALA 220 Ca -0.07 -1.24 -0.00 0.00 0.00 0.00 0.00 51.96 50.65 1i7b s ALA 220 Cb -0.19 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.70 1i7b s ALA 220 CO -0.06 0.34 0.01 0.99 0.00 0.00 0.00 175.76 177.04 1i7b s THR 221 N -1.21 -0.01 -0.14 0.00 2.01 0.30 -4.84 115.64 111.74 1i7b s THR 221 Ca 0.06 0.05 -0.07 0.00 0.31 0.00 0.00 61.69 62.04 1i7b s THR 221 Cb -0.10 -0.03 -0.04 0.00 0.01 0.00 0.00 72.50 72.34 1i7b s THR 221 CO 0.04 0.02 0.11 -0.04 -0.69 0.00 0.00 174.62 174.06 1i7b s MET 222 N 0.23 3.61 0.34 4.92 -1.94 -1.26 -1.14 119.30 124.05 1i7b s MET 222 Ca -0.02 -0.22 0.05 0.00 -1.71 0.00 0.00 55.69 53.80 1i7b s MET 222 Cb -0.03 -3.19 -0.01 0.00 2.01 0.00 0.00 34.83 33.61 1i7b s MET 222 CO -0.01 0.60 0.49 -0.06 -0.01 0.00 0.00 175.02 176.03 1i7b s PHE 223 N -0.53 3.20 -0.22 -0.03 0.40 0.44 -4.96 117.98 116.27 1i7b s PHE 223 Ca 0.12 -0.10 -0.15 0.00 -0.60 0.00 0.00 56.93 56.20 1i7b s PHE 223 Cb -0.12 -1.98 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 1i7b s PHE 223 CO 0.02 0.01 0.37 -0.80 0.70 0.00 0.00 175.22 175.52 1i7b s ASN 224 N -4.15 6.38 0.00 1.36 -0.87 -1.26 -1.55 114.94 114.85 1i7b s ASN 224 Ca 0.44 0.44 0.25 0.00 -1.57 0.00 0.00 52.86 52.42 1i7b s ASN 224 Cb -0.10 -2.22 0.45 0.00 -0.02 0.00 0.00 41.25 39.36 1i7b s ASN 224 CO 0.32 -0.08 1.37 -0.81 -2.57 0.00 0.00 177.10 175.33 1i7b n PRO 225 N 4.59 0.89 -4.00 -0.60 -0.04 -1.26 -4.97 135.00 129.61 1i7b n PRO 225 Ca -0.09 -0.62 -0.09 0.00 -0.04 0.00 0.00 63.50 62.66 1i7b n PRO 225 Cb 0.51 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.40 1i7b n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1i7b n GLY 227 N -0.15 3.28 3.38 0.00 0.00 -0.32 -4.33 105.19 107.05 1i7b n GLY 227 Ca -0.08 -1.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 1i7b n GLY 227 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1i7b s TYR 228 N -2.26 -0.50 0.00 1.61 5.04 -0.97 -0.42 117.35 119.86 1i7b s TYR 228 Ca 0.00 1.15 -0.03 0.00 -2.44 0.00 0.00 57.07 55.75 1i7b s TYR 228 Cb 0.00 0.19 -0.01 0.00 0.35 0.00 0.00 41.96 42.50 1i7b s TYR 228 CO 0.00 -0.31 0.05 -1.12 -1.34 0.00 0.00 175.55 172.83 1i7b s SER 229 N -0.10 0.09 0.04 4.32 0.01 -0.30 0.06 113.70 117.82 1i7b s SER 229 Ca -0.03 -0.24 -0.18 0.00 1.31 0.00 0.00 55.95 56.81 1i7b s SER 229 Cb -0.03 0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.38 1i7b s SER 229 CO 0.02 -0.26 0.41 0.00 0.41 0.00 0.00 173.24 173.82 1i7b s MET 230 N -1.06 0.90 0.00 12.44 0.23 -0.35 -0.54 119.30 130.92 1i7b s MET 230 Ca -0.12 -0.34 0.04 0.00 -1.03 0.00 0.00 55.69 54.24 1i7b s MET 230 Cb -0.07 0.40 -0.01 0.00 -1.53 0.00 0.00 34.83 33.62 1i7b s MET 230 CO 0.00 -0.30 -0.14 -0.80 -2.03 0.00 0.00 175.02 171.75 1i7b s ASN 231 N -1.94 1.64 0.05 -1.18 0.01 -0.46 -2.17 114.94 110.89 1i7b s ASN 231 Ca -0.06 -0.31 0.04 0.00 -0.71 0.00 0.00 52.86 51.82 1i7b s ASN 231 Cb -0.01 -0.16 -0.02 0.00 0.41 0.00 0.00 41.25 41.47 1i7b s ASN 231 CO -0.02 0.13 -0.12 -0.83 -1.51 0.00 0.00 177.10 174.75 1i7b s GLY 232 N -0.56 0.72 -0.09 0.66 0.00 0.16 -1.69 107.32 106.52 1i7b s GLY 232 Ca 0.04 -0.82 -0.10 0.00 0.00 0.00 0.00 44.72 43.84 1i7b s GLY 232 CO -0.00 -0.83 0.27 1.06 0.00 0.00 0.00 173.10 173.60 1i7b s MET 233 N -1.33 0.34 0.24 2.90 -1.94 -0.48 -1.25 119.30 117.79 1i7b s MET 233 Ca -0.02 0.32 0.08 0.00 -1.71 0.00 0.00 55.69 54.37 1i7b s MET 233 Cb -0.08 0.16 -0.04 0.00 2.01 0.00 0.00 34.83 36.88 1i7b s MET 233 CO 0.01 -0.05 0.05 0.15 -0.01 0.00 0.00 175.02 175.18 1i7b s LYS 234 N 0.02 2.50 0.56 2.03 1.02 -0.05 -0.48 119.74 125.34 1i7b s LYS 234 Ca -0.01 -1.25 0.27 0.00 0.02 0.00 0.00 55.97 54.99 1i7b s LYS 234 Cb -0.02 -2.32 1.64 0.00 -0.52 0.00 0.00 37.83 36.61 1i7b s LYS 234 CO 0.01 0.39 2.20 0.66 -0.92 0.00 0.00 175.35 177.69 1i7b h SER 235 N 1.93 0.00 0.00 2.83 4.64 -1.88 -2.31 113.55 118.76 1i7b h SER 235 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1i7b h SER 235 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1i7b h SER 235 CO 0.60 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 1i7b n ASP 236 N -3.93 0.00 0.00 4.97 5.75 -1.26 -4.84 116.55 117.23 1i7b n ASP 236 Ca -0.03 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 1i7b n ASP 236 Cb 0.12 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1i7b n ASP 236 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i7b n GLY 237 N 0.65 0.66 3.73 6.12 0.00 -0.87 -5.06 105.19 110.43 1i7b n GLY 237 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1i7b n GLY 237 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i7b s THR 238 N -2.24 3.76 0.13 2.61 2.01 -1.24 -4.89 115.64 115.79 1i7b s THR 238 Ca 0.00 1.47 0.06 0.00 0.31 0.00 0.00 61.69 63.53 1i7b s THR 238 Cb 0.00 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 1i7b s THR 238 CO 0.00 0.23 -0.14 -0.72 -0.69 0.00 0.00 174.62 173.30 1i7b s TYR 239 N -0.01 1.44 -0.06 4.92 -0.85 -1.26 -0.87 117.35 120.66 1i7b s TYR 239 Ca 0.52 -0.57 -0.20 0.00 -0.52 0.00 0.00 57.07 56.30 1i7b s TYR 239 Cb -0.31 -0.74 0.04 0.00 0.38 0.00 0.00 41.96 41.33 1i7b s TYR 239 CO 0.35 0.17 0.45 1.67 -1.52 0.00 0.00 175.55 176.67 1i7b s TRP 240 N -2.30 -0.39 -0.06 -3.49 1.48 -0.38 -2.69 118.94 111.12 1i7b s TRP 240 Ca 0.11 0.72 -0.07 0.00 -1.06 0.00 0.00 56.10 55.81 1i7b s TRP 240 Cb -0.04 0.20 0.02 0.00 -1.16 0.00 0.00 33.47 32.49 1i7b s TRP 240 CO 0.03 -0.42 0.17 -0.08 -4.06 0.00 0.00 176.95 172.59 1i7b s THR 241 N -0.96 0.01 -0.04 0.66 -1.32 -0.14 0.40 115.64 114.25 1i7b s THR 241 Ca -0.10 -0.11 0.02 0.00 -1.21 0.00 0.00 61.69 60.29 1i7b s THR 241 Cb -0.03 -0.29 0.01 0.00 -1.51 0.00 0.00 72.50 70.68 1i7b s THR 241 CO 0.05 -0.06 -0.08 -0.63 -2.21 0.00 0.00 174.62 171.69 1i7b s ILE 242 N -0.15 0.76 -0.06 5.08 1.01 -0.92 -1.02 121.20 125.89 1i7b s ILE 242 Ca -0.02 -0.30 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1i7b s ILE 242 Cb -0.02 -0.71 0.01 0.00 0.01 0.00 0.00 42.46 41.75 1i7b s ILE 242 CO 0.00 0.26 -0.12 -1.00 0.00 0.00 0.00 174.94 174.08 1i7b s HIS 243 N 0.51 1.40 -0.08 3.97 3.76 -1.04 -1.21 115.29 122.61 1i7b s HIS 243 Ca -0.08 -0.50 0.04 0.00 -0.15 0.00 0.00 55.06 54.37 1i7b s HIS 243 Cb -0.12 -1.03 0.00 0.00 1.11 0.00 0.00 32.58 32.54 1i7b s HIS 243 CO 0.01 -0.26 -0.21 0.42 -0.85 0.00 0.00 174.74 173.85 1i7b s ILE 244 N 0.64 1.79 -0.44 0.60 1.01 0.11 -1.41 121.20 123.51 1i7b s ILE 244 Ca -0.14 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.67 1i7b s ILE 244 Cb -0.15 -1.55 0.12 0.00 0.01 0.00 0.00 42.46 40.88 1i7b s ILE 244 CO 0.03 0.50 0.18 -0.89 0.00 0.00 0.00 174.94 174.76 1i7b s THR 245 N 0.27 2.20 -0.89 2.92 2.01 0.22 -2.29 115.64 120.09 1i7b s THR 245 Ca -0.13 -2.76 0.23 0.00 0.31 0.00 0.00 61.69 59.33 1i7b s THR 245 Cb -0.16 -2.57 0.21 0.00 0.01 0.00 0.00 72.50 69.99 1i7b s THR 245 CO 0.06 -0.74 1.73 -0.81 -0.69 0.00 0.00 174.62 174.17 1i7b n PRO 246 N 3.66 0.07 -1.67 4.92 -0.04 -1.26 -0.80 135.00 139.88 1i7b n PRO 246 Ca 0.05 0.17 -0.48 0.00 -0.04 0.00 0.00 63.50 63.19 1i7b n PRO 246 Cb 0.36 -1.60 -0.05 0.00 -0.04 0.00 0.00 33.50 32.18 1i7b n PRO 246 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1i7b n GLU 247 N -1.72 2.06 0.02 0.54 4.71 -1.26 -4.76 120.64 120.24 1i7b n GLU 247 Ca 0.05 0.75 0.19 0.00 -0.01 0.00 0.00 57.16 58.14 1i7b n GLU 247 Cb 0.28 -2.55 0.68 0.00 -1.01 0.00 0.00 31.44 28.85 1i7b n GLU 247 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 1i7b h PRO 248 N 7.73 0.00 0.00 3.49 0.13 -1.97 0.13 132.00 141.51 1i7b h PRO 248 Ca -0.47 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1i7b h PRO 248 Cb 1.27 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1i7b h PRO 248 CO 0.92 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.62 1i7b h GLU 249 N 0.00 0.00 -0.08 0.86 3.07 -1.99 -3.35 114.58 113.10 1i7b h GLU 249 Ca 0.23 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.88 1i7b h GLU 249 Cb 0.91 0.00 -0.18 0.00 -0.84 0.00 0.00 28.75 28.65 1i7b h GLU 249 CO -0.00 0.00 -0.40 1.97 -1.40 0.00 0.00 179.01 179.18 1i7b n PHE 250 N -2.66 -1.94 -1.76 4.33 1.16 -0.85 -5.13 117.46 110.61 1i7b n PHE 250 Ca 0.03 -1.90 -0.41 0.00 -1.87 0.00 0.00 57.45 53.29 1i7b n PHE 250 Cb 0.34 1.40 -0.00 0.00 -1.61 0.00 0.00 39.48 39.60 1i7b n PHE 250 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76 1i7b n SER 251 N -0.96 3.61 -3.67 5.98 3.41 0.38 -4.79 113.62 117.58 1i7b n SER 251 Ca -0.08 1.22 -0.13 0.00 -0.26 0.00 0.00 58.87 59.61 1i7b n SER 251 Cb 0.86 -1.59 -0.08 0.00 -0.26 0.00 0.00 64.21 63.14 1i7b n SER 251 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1i7b s TYR 252 N -0.98 -0.67 -0.03 7.33 5.04 0.02 -3.60 117.35 124.46 1i7b s TYR 252 Ca 0.55 1.63 -0.00 0.00 -2.44 0.00 0.00 57.07 56.81 1i7b s TYR 252 Cb -0.50 0.24 0.03 0.00 0.35 0.00 0.00 41.96 42.08 1i7b s TYR 252 CO 0.62 -0.33 0.02 0.08 -1.34 0.00 0.00 175.55 174.61 1i7b s VAL 253 N 0.37 0.04 0.11 3.14 1.01 -0.45 -0.61 120.40 124.01 1i7b s VAL 253 Ca -0.00 0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.26 1i7b s VAL 253 Cb -0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.11 1i7b s VAL 253 CO 0.00 0.14 -0.09 -0.94 0.00 0.00 0.00 175.10 174.20 1i7b s SER 254 N 1.34 4.41 -0.04 3.32 1.04 -0.50 -0.27 113.70 123.00 1i7b s SER 254 Ca -0.05 -0.40 -0.02 0.00 0.48 0.00 0.00 55.95 55.96 1i7b s SER 254 Cb -0.13 -0.84 0.03 0.00 0.10 0.00 0.00 66.02 65.19 1i7b s SER 254 CO -0.03 0.17 0.08 0.12 0.98 0.00 0.00 173.24 174.56 1i7b s PHE 255 N -1.28 -0.02 0.01 5.02 5.36 -0.51 -2.49 117.98 124.08 1i7b s PHE 255 Ca 0.22 0.30 0.02 0.00 -0.96 0.00 0.00 56.93 56.51 1i7b s PHE 255 Cb -0.11 -0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 42.26 1i7b s PHE 255 CO 0.14 -0.16 -0.07 -2.00 -1.46 0.00 0.00 175.22 171.67 1i7b s GLU 256 N 1.64 0.55 0.05 10.12 2.12 -0.19 -0.23 118.70 132.76 1i7b s GLU 256 Ca -0.03 -0.44 -0.27 0.00 0.36 0.00 0.00 54.97 54.60 1i7b s GLU 256 Cb -0.12 -0.47 0.08 0.00 0.26 0.00 0.00 34.13 33.88 1i7b s GLU 256 CO -0.04 0.12 0.69 -0.08 -0.54 0.00 0.00 175.26 175.40 1i7b s THR 257 N -0.59 0.00 -0.49 -1.70 -1.32 -0.17 -0.97 115.64 110.40 1i7b s THR 257 Ca -0.01 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.56 1i7b s THR 257 Cb -0.05 -1.00 0.27 0.00 -1.51 0.00 0.00 72.50 70.20 1i7b s THR 257 CO 0.00 0.00 1.21 -0.46 -2.21 0.00 0.00 174.62 173.16 1i7b n ASN 258 N 0.12 2.81 -4.64 8.08 6.94 -1.09 -0.69 115.26 126.79 1i7b n ASN 258 Ca -0.16 -2.28 -0.50 0.00 -0.02 0.00 0.00 54.58 51.62 1i7b n ASN 258 Cb 0.62 -0.25 -0.05 0.00 -2.36 0.00 0.00 39.78 37.74 1i7b n ASN 258 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1i7b n LEU 259 N -0.09 2.36 -4.72 -4.53 7.94 -1.26 -4.63 117.00 112.06 1i7b n LEU 259 Ca 0.11 1.09 -0.42 0.00 -1.11 0.00 0.00 56.01 55.68 1i7b n LEU 259 Cb 0.48 -1.28 -0.03 0.00 0.53 0.00 0.00 43.42 43.12 1i7b n LEU 259 CO 0.07 -0.64 0.80 -0.55 -1.11 0.00 0.00 177.39 175.95 1i7b s SER 260 N 1.27 7.23 -0.04 1.96 0.15 -1.26 -4.96 113.70 118.04 1i7b s SER 260 Ca 0.85 1.95 -0.11 0.00 0.70 0.00 0.00 55.95 59.34 1i7b s SER 260 Cb -0.85 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 60.89 1i7b s SER 260 CO 0.46 -0.32 0.25 -1.10 1.20 0.00 0.00 173.24 173.73 1i7b s GLN 261 N 0.53 0.48 0.25 5.44 -1.52 -1.26 -5.03 119.66 118.54 1i7b s GLN 261 Ca 0.53 -0.03 0.03 0.00 -1.95 0.00 0.00 55.36 53.94 1i7b s GLN 261 Cb -0.27 0.22 0.29 0.00 -0.22 0.00 0.00 33.01 33.03 1i7b s GLN 261 CO 0.31 -0.11 1.61 1.15 -0.25 0.00 0.00 175.29 177.99 1i7b h THR 262 N 4.30 1.34 -2.66 -0.19 2.02 -1.96 -3.30 112.91 112.45 1i7b h THR 262 Ca -0.28 -1.72 -0.11 0.00 0.77 0.00 0.00 66.41 65.06 1i7b h THR 262 Cb 1.19 1.78 -0.25 0.00 -1.74 0.00 0.00 68.15 69.13 1i7b h THR 262 CO 0.38 0.52 -0.23 -0.55 0.37 0.00 0.00 175.52 176.01 1i7b s SER 263 N -6.89 -0.48 0.00 4.18 0.15 -1.26 -4.61 113.70 104.79 1i7b s SER 263 Ca -0.05 0.89 0.18 0.00 0.70 0.00 0.00 55.95 57.67 1i7b s SER 263 Cb 0.12 0.86 0.64 0.00 -1.71 0.00 0.00 66.02 65.93 1i7b s SER 263 CO 0.80 -0.16 1.47 -1.22 1.20 0.00 0.00 173.24 175.33 1i7b n TYR 264 N 3.29 0.28 -0.00 3.44 4.02 -1.26 -4.40 117.16 122.53 1i7b n TYR 264 Ca -0.16 -0.14 -0.09 0.00 -0.01 0.00 0.00 57.90 57.49 1i7b n TYR 264 Cb 0.56 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.86 1i7b n TYR 264 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1i7b h ASP 265 N 2.22 -0.72 -0.59 7.72 3.45 -1.99 0.56 116.42 127.08 1i7b h ASP 265 Ca 0.00 0.12 -0.01 0.00 0.43 0.00 0.00 57.03 57.56 1i7b h ASP 265 Cb 0.49 0.32 -0.03 0.00 -0.56 0.00 0.00 39.33 39.56 1i7b h ASP 265 CO 0.00 -0.28 0.31 0.44 -1.57 0.00 0.00 179.24 178.14 1i7b h ASP 266 N -0.29 0.74 -0.41 6.45 3.32 -2.00 -1.35 116.42 122.89 1i7b h ASP 266 Ca 0.10 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1i7b h ASP 266 Cb 0.44 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1i7b h ASP 266 CO -0.31 0.64 -0.11 0.25 -1.72 0.00 0.00 179.24 177.99 1i7b h LEU 267 N 0.79 0.81 -0.74 1.55 5.85 -1.77 -1.21 115.31 120.59 1i7b h LEU 267 Ca 0.20 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1i7b h LEU 267 Cb 0.07 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 1i7b h LEU 267 CO -0.03 0.99 0.47 0.40 -0.34 0.00 0.00 178.44 179.92 1i7b h ILE 268 N 0.62 1.20 -0.70 4.05 2.04 -0.75 -1.72 117.51 122.24 1i7b h ILE 268 Ca 0.10 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 1i7b h ILE 268 Cb 0.64 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1i7b h ILE 268 CO 0.04 0.20 0.38 -0.09 0.00 0.00 0.00 178.15 178.67 1i7b h ARG 269 N 1.00 0.98 -0.44 2.37 2.43 -1.07 -1.52 114.38 118.12 1i7b h ARG 269 Ca 0.27 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1i7b h ARG 269 Cb -0.08 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.26 1i7b h ARG 269 CO -0.05 0.74 0.17 0.87 -1.51 0.00 0.00 179.97 180.18 1i7b h LYS 270 N 0.96 0.67 -0.29 0.20 1.79 -0.71 -1.82 116.57 117.37 1i7b h LYS 270 Ca 0.24 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1i7b h LYS 270 Cb 0.05 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.58 1i7b h LYS 270 CO -0.04 0.62 0.01 0.28 -1.08 0.00 0.00 179.45 179.24 1i7b h VAL 271 N 0.57 1.25 -0.74 0.50 2.07 -1.12 -2.17 116.25 116.62 1i7b h VAL 271 Ca 0.15 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.75 1i7b h VAL 271 Cb 0.21 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 1i7b h VAL 271 CO -0.01 0.29 0.40 0.58 0.02 0.00 0.00 177.57 178.85 1i7b h VAL 272 N 0.31 1.22 0.00 2.57 2.07 -1.24 -1.52 116.25 119.65 1i7b h VAL 272 Ca 0.08 -0.56 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 1i7b h VAL 272 Cb 0.41 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1i7b h VAL 272 CO 0.01 0.25 -0.43 -0.33 0.02 0.00 0.00 177.57 177.09 1i7b h GLU 273 N 1.03 0.00 -0.04 1.57 5.08 -1.19 0.25 114.58 121.28 1i7b h GLU 273 Ca 0.26 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.54 1i7b h GLU 273 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1i7b h GLU 273 CO -0.04 0.43 -0.27 0.28 -1.00 0.00 0.00 179.01 178.41 1i7b h VAL 274 N 0.00 1.46 0.00 3.13 2.07 -0.65 -3.37 116.25 118.90 1i7b h VAL 274 Ca -0.00 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1i7b h VAL 274 Cb 0.78 2.45 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 1i7b h VAL 274 CO 0.06 0.49 -1.01 0.49 0.02 0.00 0.00 177.57 177.62 1i7b n PHE 275 N -4.48 0.72 -3.72 1.57 3.01 -0.67 -5.00 117.46 108.90 1i7b n PHE 275 Ca -0.09 0.21 -0.30 0.00 1.01 0.00 0.00 57.45 58.28 1i7b n PHE 275 Cb 0.48 -0.79 0.03 0.00 -0.01 0.00 0.00 39.48 39.19 1i7b n PHE 275 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1i7b n LYS 276 N -2.43 -1.09 -2.35 -1.08 5.02 0.88 -3.91 118.16 113.19 1i7b n LYS 276 Ca 0.01 0.53 -0.32 0.00 -2.02 0.00 0.00 58.31 56.50 1i7b n LYS 276 Cb 0.51 -3.67 -0.03 0.00 -0.02 0.00 0.00 35.03 31.83 1i7b n LYS 276 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1i7b s PRO 277 N -5.80 3.81 0.09 1.97 0.04 -1.26 -1.79 135.00 132.06 1i7b s PRO 277 Ca 0.36 1.05 0.10 0.00 0.04 0.00 0.00 61.00 62.56 1i7b s PRO 277 Cb -0.15 -2.11 -0.17 0.00 0.04 0.00 0.00 34.50 32.11 1i7b s PRO 277 CO 0.88 -0.39 1.10 0.78 0.04 0.00 0.00 177.00 179.41 1i7b h GLY 278 N 0.91 0.00 -3.68 0.56 0.00 0.09 -3.45 103.07 97.50 1i7b h GLY 278 Ca -0.47 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 1i7b h GLY 278 CO 0.60 0.00 0.00 -1.59 0.00 0.00 0.00 176.54 175.56 1i7b s LYS 279 N -2.73 1.00 0.02 4.80 -2.85 -1.10 -0.76 119.74 118.13 1i7b s LYS 279 Ca -0.00 -0.25 -0.28 0.00 -1.00 0.00 0.00 55.97 54.44 1i7b s LYS 279 Cb 0.09 0.46 0.09 0.00 -2.06 0.00 0.00 37.83 36.41 1i7b s LYS 279 CO 0.81 -0.36 0.81 -0.59 0.10 0.00 0.00 175.35 176.13 1i7b s PHE 280 N -2.40 -0.41 0.16 1.78 -0.12 -0.92 -0.86 117.98 115.20 1i7b s PHE 280 Ca -0.06 0.32 0.07 0.00 -0.05 0.00 0.00 56.93 57.22 1i7b s PHE 280 Cb -0.01 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.87 1i7b s PHE 280 CO -0.01 -0.61 -0.16 0.14 -0.05 0.00 0.00 175.22 174.53 1i7b s VAL 281 N -3.03 1.62 0.03 -2.49 -7.23 -0.34 -0.41 120.40 108.55 1i7b s VAL 281 Ca 0.03 -1.90 0.05 0.00 -1.81 0.00 0.00 61.98 58.35 1i7b s VAL 281 Cb -0.01 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 1i7b s VAL 281 CO -0.08 -0.40 -0.14 0.42 -0.31 0.00 0.00 175.10 174.59 1i7b s THR 282 N -2.26 1.07 -0.02 5.32 -4.23 0.43 -1.00 115.64 114.95 1i7b s THR 282 Ca 0.14 -0.89 0.04 0.00 -1.18 0.00 0.00 61.69 59.81 1i7b s THR 282 Cb -0.04 -0.95 -0.01 0.00 1.34 0.00 0.00 72.50 72.84 1i7b s THR 282 CO 0.05 0.06 -0.15 0.42 -0.54 0.00 0.00 174.62 174.46 1i7b s THR 283 N -0.73 1.21 -0.04 3.99 -4.23 -0.74 -1.35 115.64 113.76 1i7b s THR 283 Ca 0.02 -0.63 -0.01 0.00 -1.18 0.00 0.00 61.69 59.89 1i7b s THR 283 Cb -0.07 -1.02 0.03 0.00 1.34 0.00 0.00 72.50 72.78 1i7b s THR 283 CO 0.01 0.35 0.05 -0.22 -0.54 0.00 0.00 174.62 174.27 1i7b s LEU 284 N -0.18 0.40 -0.07 4.79 2.96 -0.17 -1.36 118.68 125.04 1i7b s LEU 284 Ca 0.02 0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.01 1i7b s LEU 284 Cb -0.08 -0.11 -0.03 0.00 0.50 0.00 0.00 46.19 46.47 1i7b s LEU 284 CO 0.00 -0.22 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.40 1i7b s PHE 285 N 1.86 2.98 -0.17 5.38 0.40 -0.12 -1.38 117.98 126.93 1i7b s PHE 285 Ca 0.01 0.04 -0.06 0.00 -0.60 0.00 0.00 56.93 56.32 1i7b s PHE 285 Cb -0.12 -1.73 0.08 0.00 0.51 0.00 0.00 43.02 41.75 1i7b s PHE 285 CO -0.03 0.34 0.36 0.08 0.70 0.00 0.00 175.22 176.67 1i7b s VAL 286 N -0.79 -0.50 0.69 -0.44 1.01 -0.73 -1.18 120.40 118.47 1i7b s VAL 286 Ca 0.12 0.20 -0.05 0.00 0.00 0.00 0.00 61.98 62.25 1i7b s VAL 286 Cb -0.11 -0.58 0.07 0.00 0.00 0.00 0.00 36.38 35.76 1i7b s VAL 286 CO 0.02 0.08 0.98 0.54 0.00 0.00 0.00 175.10 176.72 1i7b s ASN 287 N 2.39 4.75 0.65 3.32 4.22 -0.60 -1.07 114.94 128.61 1i7b s ASN 287 Ca -0.02 0.25 0.42 0.00 -2.14 0.00 0.00 52.86 51.37 1i7b s ASN 287 Cb -0.12 -0.88 2.33 0.00 1.28 0.00 0.00 41.25 43.86 1i7b s ASN 287 CO -0.11 -1.60 2.35 1.56 -2.04 0.00 0.00 177.10 177.26 1i7b h GLN 288 N -0.51 0.00 0.00 3.55 1.08 -1.90 -2.46 115.11 114.88 1i7b h GLN 288 Ca -0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 1i7b h GLN 288 Cb 1.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1i7b h GLN 288 CO 0.55 0.00 -1.06 0.43 -0.95 0.00 0.00 178.83 177.80 1i7b n SER 289 N -3.21 0.70 -4.69 1.46 7.64 -1.26 -4.97 113.62 109.29 1i7b n SER 289 Ca -0.03 0.18 -0.37 0.00 1.01 0.00 0.00 58.87 59.66 1i7b n SER 289 Cb 0.08 0.63 0.07 0.00 -1.01 0.00 0.00 64.21 63.97 1i7b n SER 289 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1i7b n SER 290 N -2.44 1.63 0.00 6.43 2.88 -0.93 -4.57 113.62 116.62 1i7b n SER 290 Ca 0.00 0.80 0.14 0.00 -1.33 0.00 0.00 58.87 58.49 1i7b n SER 290 Cb 0.52 -1.51 0.76 0.00 -0.75 0.00 0.00 64.21 63.24 1i7b n SER 290 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1i7b n LYS 291 N -1.78 0.56 -1.91 -1.46 4.01 -1.26 -4.98 118.16 111.33 1i7b n LYS 291 Ca 0.15 0.01 -0.23 0.00 -0.51 0.00 0.00 58.31 57.73 1i7b n LYS 291 Cb 0.48 -1.50 0.15 0.00 -0.51 0.00 0.00 35.03 33.65 1i7b n LYS 291 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1i7b n PRO 299 N -3.13 3.06 -2.42 0.00 -0.04 -1.26 -5.04 135.00 126.17 1i7b n PRO 299 Ca 0.14 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.18 1i7b n PRO 299 Cb 0.51 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.94 1i7b n PRO 299 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1i7b s GLN 300 N 3.04 4.43 0.00 0.54 -0.21 -1.26 -5.00 119.66 121.20 1i7b s GLN 300 Ca 0.00 1.77 0.00 0.00 0.02 0.00 0.00 55.36 57.15 1i7b s GLN 300 Cb 0.00 -3.35 0.00 0.00 1.00 0.00 0.00 33.01 30.66 1i7b s GLN 300 CO 0.00 -0.26 0.00 1.17 -2.12 0.00 0.00 175.29 174.08 1i7b n LYS 301 N 3.93 0.00 -2.20 2.91 4.81 -1.26 -5.03 118.16 121.33 1i7b n LYS 301 Ca 0.09 0.06 -0.00 0.00 -0.87 0.00 0.00 58.31 57.59 1i7b n LYS 301 Cb 0.46 -0.51 -0.00 0.00 0.02 0.00 0.00 35.03 35.00 1i7b n LYS 301 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1i7b n ILE 302 N -0.80-12.15 -2.73 3.15 2.08 -1.26 -4.90 119.36 102.74 1i7b n ILE 302 Ca 0.00 2.81 -0.37 0.00 0.56 0.00 0.00 62.75 65.75 1i7b n ILE 302 Cb 0.00 -5.77 -0.06 0.00 -0.75 0.00 0.00 39.64 33.06 1i7b n ILE 302 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1i7b s GLU 303 N -0.79 4.50 0.00 0.38 2.02 -1.26 -3.69 118.70 119.87 1i7b s GLU 303 Ca -0.00 1.38 0.00 0.00 0.02 0.00 0.00 54.97 56.36 1i7b s GLU 303 Cb 0.00 -2.75 0.00 0.00 0.10 0.00 0.00 34.13 31.48 1i7b s GLU 303 CO 0.01 0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.90 1i7b n GLY 304 N 0.51 0.82 3.06 -1.39 0.00 -1.26 -5.03 105.19 101.91 1i7b n GLY 304 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1i7b n GLY 304 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1i7b s PHE 305 N -3.20 0.88 -0.22 1.61 0.40 -1.24 -3.67 117.98 112.54 1i7b s PHE 305 Ca 0.00 -0.27 -0.13 0.00 -0.60 0.00 0.00 56.93 55.93 1i7b s PHE 305 Cb 0.00 -0.54 -0.05 0.00 0.51 0.00 0.00 43.02 42.94 1i7b s PHE 305 CO 0.00 -0.01 0.26 0.21 0.70 0.00 0.00 175.22 176.38 1i7b s LYS 306 N -0.73 4.13 -0.45 0.44 2.20 0.23 -4.91 119.74 120.64 1i7b s LYS 306 Ca 0.00 -0.06 -0.29 0.00 -0.36 0.00 0.00 55.97 55.26 1i7b s LYS 306 Cb -0.06 -3.52 0.02 0.00 -1.51 0.00 0.00 37.83 32.76 1i7b s LYS 306 CO 0.00 0.05 1.23 0.50 -0.36 0.00 0.00 175.35 176.77 1i7b s ARG 307 N 1.07 3.68 -0.13 4.03 3.52 -1.26 -1.67 118.95 128.19 1i7b s ARG 307 Ca 0.13 0.71 -0.27 0.00 -0.13 0.00 0.00 55.73 56.17 1i7b s ARG 307 Cb -0.14 -3.94 -0.27 0.00 -1.56 0.00 0.00 34.95 29.04 1i7b s ARG 307 CO 0.05 -1.43 0.75 -0.07 -0.81 0.00 0.00 175.30 173.79 1i7b h LEU 308 N 11.52 0.11 -8.20 -0.88 3.38 -0.85 -3.48 115.31 116.91 1i7b h LEU 308 Ca -0.24 -0.95 -0.16 0.00 0.09 0.00 0.00 57.88 56.61 1i7b h LEU 308 Cb 1.08 -0.03 -0.17 0.00 0.09 0.00 0.00 40.66 41.62 1i7b h LEU 308 CO 1.11 1.13 -0.69 -1.81 0.09 0.00 0.00 178.44 178.27 1i7b s ASP 309 N -6.44 0.56 -0.29 -0.43 1.01 -1.17 -4.98 116.67 104.94 1i7b s ASP 309 Ca -0.19 -0.83 0.01 0.00 0.71 0.00 0.00 52.55 52.25 1i7b s ASP 309 Cb -0.01 0.14 0.18 0.00 1.01 0.00 0.00 42.92 44.24 1i7b s ASP 309 CO 0.71 -0.47 0.53 0.00 0.21 0.00 0.00 175.17 176.16 1i7b s GLN 311 N 2.76 2.08 0.20 0.00 -0.21 0.62 -4.97 119.66 120.14 1i7b s GLN 311 Ca 0.15 -0.95 0.11 0.00 0.02 0.00 0.00 55.36 54.69 1i7b s GLN 311 Cb -0.13 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.72 1i7b s GLN 311 CO -0.23 0.55 -0.23 -1.12 -2.12 0.00 0.00 175.29 172.14 1i7b s SER 312 N -1.00 3.45 -0.06 5.90 0.01 -1.26 0.45 113.70 121.19 1i7b s SER 312 Ca 0.12 -0.89 -0.23 0.00 1.31 0.00 0.00 55.95 56.26 1i7b s SER 312 Cb -0.10 -0.26 0.05 0.00 0.21 0.00 0.00 66.02 65.92 1i7b s SER 312 CO 0.02 0.11 0.53 0.00 0.41 0.00 0.00 173.24 174.30 1i7b s ALA 313 N -1.78 -1.36 -0.20 1.44 0.00 0.67 -4.97 121.76 115.56 1i7b s ALA 313 Ca 0.22 1.02 -0.02 0.00 0.00 0.00 0.00 51.96 53.17 1i7b s ALA 313 Cb -0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 23.12 22.91 1i7b s ALA 313 CO 0.10 -0.31 -0.09 -1.64 0.00 0.00 0.00 175.76 173.82 1i7b s MET 314 N -0.98 3.26 0.00 0.00 -1.94 -1.26 0.69 119.30 119.06 1i7b s MET 314 Ca -0.10 -0.69 0.00 0.00 -1.71 0.00 0.00 55.69 53.19 1i7b s MET 314 Cb -0.02 -2.86 0.00 0.00 2.01 0.00 0.00 34.83 33.96 1i7b s MET 314 CO 0.06 -0.18 0.00 1.19 -0.01 0.00 0.00 175.02 176.09 1i7b n PHE 315 N 4.67 -1.02 -0.20 -0.03 3.72 0.41 -5.01 117.46 120.01 1i7b n PHE 315 Ca -0.19 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.12 1i7b n PHE 315 Cb 0.51 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.98 1i7b n PHE 315 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1i7b h ASN 316 N 0.00 -1.42 0.00 4.37 2.35 -1.95 -3.36 115.58 115.57 1i7b h ASN 316 Ca 0.00 0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1i7b h ASN 316 Cb 0.00 0.61 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1i7b h ASN 316 CO 0.00 -0.22 -0.41 0.47 -1.65 0.00 0.00 177.43 175.62 1i7b n ASP 317 N -4.58 2.04 -4.84 5.81 9.92 -1.26 -5.07 116.55 118.57 1i7b n ASP 317 Ca -0.00 -0.15 -0.32 0.00 -0.53 0.00 0.00 54.79 53.78 1i7b n ASP 317 Cb 0.21 0.72 -0.06 0.00 -0.64 0.00 0.00 41.12 41.35 1i7b n ASP 317 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1i7b s TYR 318 N -1.12 3.37 -0.09 1.24 1.51 -1.26 -3.48 117.35 117.52 1i7b s TYR 318 Ca 0.00 0.21 -0.04 0.00 -1.01 0.00 0.00 57.07 56.23 1i7b s TYR 318 Cb 0.00 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1i7b s TYR 318 CO 0.00 0.57 0.07 -0.80 -1.11 0.00 0.00 175.55 174.28 1i7b s ASN 319 N -2.17 5.76 0.08 2.29 0.02 -0.23 -0.44 114.94 120.25 1i7b s ASN 319 Ca 0.29 0.28 0.07 0.00 -1.02 0.00 0.00 52.86 52.48 1i7b s ASN 319 Cb -0.12 -1.74 -0.03 0.00 0.02 0.00 0.00 41.25 39.38 1i7b s ASN 319 CO 0.21 0.38 -0.20 0.12 0.02 0.00 0.00 177.10 177.63 1i7b s PHE 320 N -0.99 1.70 -0.03 2.20 5.36 0.22 -1.77 117.98 124.67 1i7b s PHE 320 Ca 0.15 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 55.72 1i7b s PHE 320 Cb -0.12 -0.96 0.03 0.00 -0.34 0.00 0.00 43.02 41.63 1i7b s PHE 320 CO 0.05 0.15 0.02 0.08 -1.46 0.00 0.00 175.22 174.05 1i7b s VAL 321 N -1.06 0.06 -0.08 3.12 1.01 -0.48 -0.24 120.40 122.74 1i7b s VAL 321 Ca 0.06 0.15 0.05 0.00 0.00 0.00 0.00 61.98 62.23 1i7b s VAL 321 Cb -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1i7b s VAL 321 CO 0.03 0.12 -0.22 0.12 0.00 0.00 0.00 175.10 175.15 1i7b s PHE 322 N 1.07 2.54 -0.01 5.22 5.36 0.17 -1.00 117.98 131.34 1i7b s PHE 322 Ca -0.09 -0.71 0.01 0.00 -0.96 0.00 0.00 56.93 55.18 1i7b s PHE 322 Cb -0.13 -1.66 0.01 0.00 -0.34 0.00 0.00 43.02 40.89 1i7b s PHE 322 CO -0.02 -0.21 -0.03 0.99 -1.46 0.00 0.00 175.22 174.48 1i7b s THR 323 N -0.06 0.31 -0.08 0.12 2.01 -0.45 -0.28 115.64 117.22 1i7b s THR 323 Ca -0.06 -0.12 0.04 0.00 0.31 0.00 0.00 61.69 61.86 1i7b s THR 323 Cb -0.15 -0.30 -0.01 0.00 0.01 0.00 0.00 72.50 72.05 1i7b s THR 323 CO 0.05 0.11 -0.21 -0.55 -0.69 0.00 0.00 174.62 173.33 1i7b s SER 324 N 0.21 3.38 0.18 3.53 0.15 0.25 -0.43 113.70 120.98 1i7b s SER 324 Ca -0.02 -0.44 0.07 0.00 0.70 0.00 0.00 55.95 56.25 1i7b s SER 324 Cb -0.05 -1.09 -0.05 0.00 -1.71 0.00 0.00 66.02 63.13 1i7b s SER 324 CO -0.00 0.23 -0.13 -0.36 1.20 0.00 0.00 173.24 174.17 1i7b s PHE 325 N -0.06 1.55 -0.10 3.44 0.40 0.46 -0.09 117.98 123.58 1i7b s PHE 325 Ca -0.06 -0.63 -0.11 0.00 -0.60 0.00 0.00 56.93 55.53 1i7b s PHE 325 Cb -0.14 -0.74 0.03 0.00 0.51 0.00 0.00 43.02 42.67 1i7b s PHE 325 CO 0.05 0.26 0.31 0.00 0.70 0.00 0.00 175.22 176.53 1i7b s ALA 326 N -3.03 -0.76 0.81 5.36 0.00 -0.67 -2.16 121.76 121.30 1i7b s ALA 326 Ca 0.20 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.82 1i7b s ALA 326 Cb 0.00 -0.40 0.08 0.00 0.00 0.00 0.00 23.12 22.80 1i7b s ALA 326 CO 0.05 -0.17 1.10 0.21 0.00 0.00 0.00 175.76 176.95 1i7b s LYS 327 N -0.12 1.96 0.00 0.00 2.20 0.06 -0.60 119.74 123.24 1i7b s LYS 327 Ca -0.03 1.20 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 1i7b s LYS 327 Cb -0.03 -1.86 0.00 0.00 -1.51 0.00 0.00 37.83 34.43 1i7b s LYS 327 CO 0.01 -1.86 0.00 1.63 -0.36 0.00 0.00 175.35 174.77