#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xdg s ASN 129 N 0.00 6.84 -0.13 1.61 0.01 -1.26 -4.90 114.94 117.10 1xdg s ASN 129 Ca 0.00 1.02 0.03 0.00 -0.71 0.00 0.00 52.86 53.20 1xdg s ASN 129 Cb 0.00 -2.27 0.01 0.00 0.41 0.00 0.00 41.25 39.40 1xdg s ASN 129 CO 0.00 0.24 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.92 1xdg s VAL 130 N -1.23 2.05 -0.36 1.60 1.01 -1.20 -0.30 120.40 121.97 1xdg s VAL 130 Ca 0.29 -0.98 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 1xdg s VAL 130 Cb -0.16 -1.81 0.03 0.00 0.00 0.00 0.00 36.38 34.44 1xdg s VAL 130 CO 0.17 0.55 0.17 -1.81 0.00 0.00 0.00 175.10 174.18 1xdg s ASP 131 N 0.75 5.60 -0.14 3.32 1.11 -0.01 -1.52 116.67 125.78 1xdg s ASP 131 Ca -0.09 -1.03 -0.01 0.00 0.18 0.00 0.00 52.55 51.60 1xdg s ASP 131 Cb -0.16 -1.97 -0.02 0.00 1.07 0.00 0.00 42.92 41.84 1xdg s ASP 131 CO -0.00 -0.36 -0.12 -0.22 1.18 0.00 0.00 175.17 175.64 1xdg s LEU 132 N 1.51 2.78 -0.17 1.23 0.20 -0.55 -1.13 118.68 122.55 1xdg s LEU 132 Ca 0.01 -0.31 -0.01 0.00 0.69 0.00 0.00 54.13 54.51 1xdg s LEU 132 Cb -0.19 -1.63 -0.01 0.00 -0.43 0.00 0.00 46.19 43.93 1xdg s LEU 132 CO 0.05 0.16 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.47 1xdg s VAL 133 N 0.39 2.96 -0.21 1.68 1.01 -0.07 -1.56 120.40 124.59 1xdg s VAL 133 Ca -0.10 -0.66 -0.23 0.00 0.00 0.00 0.00 61.98 61.00 1xdg s VAL 133 Cb -0.16 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 1xdg s VAL 133 CO 0.05 0.49 0.72 -0.36 0.00 0.00 0.00 175.10 176.00 1xdg s PHE 134 N 0.89 3.35 -0.34 5.22 0.40 -0.46 -0.72 117.98 126.31 1xdg s PHE 134 Ca -0.03 1.02 -0.03 0.00 -0.60 0.00 0.00 56.93 57.29 1xdg s PHE 134 Cb -0.15 -2.91 0.07 0.00 0.51 0.00 0.00 43.02 40.53 1xdg s PHE 134 CO -0.00 -0.28 0.09 -1.17 0.70 0.00 0.00 175.22 174.56 1xdg s LEU 135 N 2.32 4.43 -0.06 -0.37 2.96 0.10 0.25 118.68 128.32 1xdg s LEU 135 Ca 0.32 -1.50 0.05 0.00 -0.22 0.00 0.00 54.13 52.78 1xdg s LEU 135 Cb -0.16 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.73 1xdg s LEU 135 CO 0.10 -0.37 -0.21 0.72 -1.32 0.00 0.00 176.35 175.27 1xdg s PHE 136 N 1.25 2.54 -0.04 5.38 -0.12 0.81 -1.24 117.98 126.55 1xdg s PHE 136 Ca -0.00 -0.49 -0.30 0.00 -0.05 0.00 0.00 56.93 56.09 1xdg s PHE 136 Cb -0.21 -1.62 -0.06 0.00 -0.63 0.00 0.00 43.02 40.51 1xdg s PHE 136 CO -0.01 -0.06 1.65 0.34 -0.05 0.00 0.00 175.22 177.08 1xdg s ASP 137 N -0.36 6.67 -0.24 1.98 3.68 -0.06 -1.21 116.67 127.14 1xdg s ASP 137 Ca 0.03 2.25 0.11 0.00 2.13 0.00 0.00 52.55 57.07 1xdg s ASP 137 Cb -0.12 -2.54 0.45 0.00 -1.45 0.00 0.00 42.92 39.26 1xdg s ASP 137 CO 0.02 -0.92 1.34 0.61 0.13 0.00 0.00 175.17 176.35 1xdg n GLY 138 N 4.11 4.92 3.60 2.66 0.00 0.48 -4.90 105.19 116.06 1xdg n GLY 138 Ca 0.17 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 1xdg n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xdg s SER 139 N -2.78 2.02 0.52 1.61 1.04 -1.26 -0.69 113.70 114.16 1xdg s SER 139 Ca 0.41 1.40 0.34 0.00 0.48 0.00 0.00 55.95 58.57 1xdg s SER 139 Cb 0.37 -2.10 1.52 0.00 0.10 0.00 0.00 66.02 65.92 1xdg s SER 139 CO -0.02 -3.54 2.01 0.00 0.98 0.00 0.00 173.24 172.67 1xdg h MET 140 N -2.17 0.00 0.00 4.02 -0.00 -1.05 -2.93 114.93 112.79 1xdg h MET 140 Ca -0.57 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.13 1xdg h MET 140 Cb 1.32 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.92 1xdg h MET 140 CO 0.54 0.00 -0.02 0.66 -0.00 0.00 0.00 176.91 178.08 1xdg h SER 141 N 0.00 0.00 -3.51 -0.10 4.64 -1.92 -3.44 113.55 109.22 1xdg h SER 141 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1xdg h SER 141 Cb 0.36 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.42 1xdg h SER 141 CO 0.00 0.02 0.29 -0.76 -0.87 0.00 0.00 176.83 175.51 1xdg s LEU 142 N -6.26 4.47 0.58 5.97 1.43 -1.11 -5.05 118.68 118.71 1xdg s LEU 142 Ca 0.00 1.66 -0.11 0.00 -1.03 0.00 0.00 54.13 54.65 1xdg s LEU 142 Cb 0.09 -3.45 -0.05 0.00 0.03 0.00 0.00 46.19 42.81 1xdg s LEU 142 CO 0.54 -0.05 0.98 -1.10 0.23 0.00 0.00 176.35 176.95 1xdg s GLN 143 N 0.05 3.66 0.19 1.70 -1.52 -1.26 -4.87 119.66 117.60 1xdg s GLN 143 Ca 0.44 0.70 -0.13 0.00 -1.95 0.00 0.00 55.36 54.42 1xdg s GLN 143 Cb -0.22 -2.14 0.21 0.00 -0.22 0.00 0.00 33.01 30.64 1xdg s GLN 143 CO 0.27 -0.45 1.68 -1.35 -0.25 0.00 0.00 175.29 175.19 1xdg h PRO 144 N 0.02 0.10 0.00 2.91 0.11 -1.99 -0.98 132.00 132.17 1xdg h PRO 144 Ca -0.45 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 1xdg h PRO 144 Cb 1.19 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1xdg h PRO 144 CO 0.62 0.07 -0.28 0.38 -0.21 0.00 0.00 178.00 178.58 1xdg h ASP 145 N 0.11 0.00 -0.18 -2.05 2.03 -1.99 -1.50 116.42 112.85 1xdg h ASP 145 Ca 0.26 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.46 1xdg h ASP 145 Cb 0.40 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.90 1xdg h ASP 145 CO -0.45 0.28 -0.31 -0.33 -1.03 0.00 0.00 179.24 177.41 1xdg h GLU 146 N 0.00 0.52 -0.62 4.15 5.08 -1.59 -1.82 114.58 120.29 1xdg h GLU 146 Ca -0.00 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 1xdg h GLU 146 Cb 0.59 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 1xdg h GLU 146 CO 0.04 0.93 0.31 0.35 -1.00 0.00 0.00 179.01 179.64 1xdg h PHE 147 N 0.17 0.89 -0.85 4.33 3.57 -1.04 -2.19 116.94 121.81 1xdg h PHE 147 Ca 0.01 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1xdg h PHE 147 Cb 0.89 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 39.32 1xdg h PHE 147 CO 0.09 0.66 0.39 0.37 -2.23 0.00 0.00 178.31 177.60 1xdg h GLN 148 N 0.85 1.23 -0.36 1.11 5.75 -1.27 -2.34 115.11 120.08 1xdg h GLN 148 Ca 0.22 -0.19 -0.05 0.00 -0.15 0.00 0.00 58.65 58.48 1xdg h GLN 148 Cb 0.09 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 1xdg h GLN 148 CO -0.03 0.95 0.01 0.87 -2.65 0.00 0.00 178.83 177.98 1xdg h LYS 149 N 1.21 0.56 -0.26 1.69 1.57 -0.85 0.49 116.57 120.98 1xdg h LYS 149 Ca 0.29 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1xdg h LYS 149 Cb 0.14 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1xdg h LYS 149 CO -0.03 0.58 0.12 0.82 -0.57 0.00 0.00 179.45 180.36 1xdg h ILE 150 N 0.54 1.15 -0.59 1.86 2.04 -1.02 -1.63 117.51 119.87 1xdg h ILE 150 Ca 0.11 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.55 1xdg h ILE 150 Cb 0.33 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1xdg h ILE 150 CO 0.01 0.16 0.37 -0.07 0.00 0.00 0.00 178.15 178.61 1xdg h LEU 151 N 0.29 0.61 -0.97 1.44 3.38 -0.93 -2.26 115.31 116.87 1xdg h LEU 151 Ca 0.09 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1xdg h LEU 151 Cb 0.13 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1xdg h LEU 151 CO -0.01 0.43 0.49 0.44 0.09 0.00 0.00 178.44 179.89 1xdg h ASP 152 N 0.74 1.08 -0.25 -0.43 3.32 -0.80 -1.45 116.42 118.63 1xdg h ASP 152 Ca 0.23 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1xdg h ASP 152 Cb -0.02 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1xdg h ASP 152 CO -0.08 0.86 0.12 0.15 -1.72 0.00 0.00 179.24 178.56 1xdg h PHE 153 N 1.22 0.37 -0.76 4.55 3.57 -0.82 -0.20 116.94 124.86 1xdg h PHE 153 Ca 0.31 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 1xdg h PHE 153 Cb 0.01 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.60 1xdg h PHE 153 CO 0.01 0.36 0.32 0.52 -2.23 0.00 0.00 178.31 177.29 1xdg h MET 154 N 0.27 1.14 -0.54 1.11 2.86 -1.13 -1.65 114.93 116.99 1xdg h MET 154 Ca 0.09 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1xdg h MET 154 Cb 0.14 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1xdg h MET 154 CO -0.01 0.92 0.22 0.87 1.06 0.00 0.00 176.91 179.97 1xdg h LYS 155 N 1.10 0.80 -0.54 1.72 1.57 -1.03 -1.66 116.57 118.53 1xdg h LYS 155 Ca 0.26 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1xdg h LYS 155 Cb 0.20 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1xdg h LYS 155 CO -0.02 0.69 0.31 -0.44 -0.57 0.00 0.00 179.45 179.42 1xdg h ASP 156 N 0.73 0.66 -0.10 0.86 3.45 -0.68 -0.12 116.42 121.22 1xdg h ASP 156 Ca 0.18 -0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.56 1xdg h ASP 156 Cb 0.18 -0.17 -0.00 0.00 -0.56 0.00 0.00 39.33 38.78 1xdg h ASP 156 CO -0.02 0.54 0.05 0.58 -1.57 0.00 0.00 179.24 178.83 1xdg h VAL 157 N 0.72 1.10 -0.68 -1.35 2.07 -1.22 -1.36 116.25 115.53 1xdg h VAL 157 Ca 0.19 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1xdg h VAL 157 Cb 0.02 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1xdg h VAL 157 CO -0.03 0.09 0.29 0.24 0.02 0.00 0.00 177.57 178.18 1xdg h MET 158 N 0.06 1.00 -0.48 1.57 2.86 -1.08 -1.41 114.93 117.45 1xdg h MET 158 Ca 0.04 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.46 1xdg h MET 158 Cb 0.09 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1xdg h MET 158 CO -0.01 0.82 0.14 0.87 1.06 0.00 0.00 176.91 179.80 1xdg h LYS 159 N 0.96 0.75 -0.94 1.72 1.57 -0.92 -1.40 116.57 118.31 1xdg h LYS 159 Ca 0.23 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1xdg h LYS 159 Cb 0.18 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 1xdg h LYS 159 CO -0.02 0.72 0.62 -0.22 -0.57 0.00 0.00 179.45 179.97 1xdg h LYS 160 N 0.64 1.24 -0.77 3.15 1.63 -0.92 -2.82 116.57 118.73 1xdg h LYS 160 Ca 0.15 -0.08 -0.25 0.00 -0.85 0.00 0.00 60.65 59.63 1xdg h LYS 160 Cb 0.29 -0.28 -0.15 0.00 -0.60 0.00 0.00 32.23 31.49 1xdg h LYS 160 CO -0.00 0.82 0.31 1.28 -3.45 0.00 0.00 179.45 178.41 1xdg n LEU 161 N -4.42 6.18 -4.78 5.20 4.77 -0.56 -4.99 117.00 118.40 1xdg n LEU 161 Ca 0.11 -3.27 -0.36 0.00 -0.03 0.00 0.00 56.01 52.46 1xdg n LEU 161 Cb 0.02 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.34 1xdg n LEU 161 CO 0.37 0.84 0.78 -0.94 -1.33 0.00 0.00 177.39 177.11 1xdg s SER 162 N -1.07 6.12 -1.44 -1.43 1.04 -0.55 -3.30 113.70 113.07 1xdg s SER 162 Ca 0.56 2.17 0.00 0.00 0.48 0.00 0.00 55.95 59.16 1xdg s SER 162 Cb 0.45 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.98 1xdg s SER 162 CO 0.13 -0.94 0.00 0.59 0.98 0.00 0.00 173.24 174.00 1xdg n ASN 163 N -0.78 -4.62 -1.39 7.02 3.02 -1.26 -5.00 115.26 112.25 1xdg n ASN 163 Ca 0.09 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.94 1xdg n ASN 163 Cb 0.50 -3.40 0.00 0.00 -0.61 0.00 0.00 39.78 36.27 1xdg n ASN 163 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1xdg n THR 164 N -2.76 0.00 1.52 3.41 -2.24 -1.21 -5.00 114.28 108.00 1xdg n THR 164 Ca -0.14 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.78 1xdg n THR 164 Cb 0.47 -0.84 0.71 0.00 -2.10 0.00 0.00 70.33 68.57 1xdg n THR 164 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xdg n SER 165 N -1.87 0.30 -4.76 3.42 7.64 -1.26 -4.84 113.62 112.25 1xdg n SER 165 Ca 0.00 -0.56 -0.39 0.00 1.01 0.00 0.00 58.87 58.93 1xdg n SER 165 Cb 0.00 -0.12 -0.06 0.00 -1.01 0.00 0.00 64.21 63.03 1xdg n SER 165 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1xdg s TYR 166 N -2.40 3.78 0.17 1.43 1.51 -1.26 -3.27 117.35 117.31 1xdg s TYR 166 Ca 0.32 1.82 0.10 0.00 -1.01 0.00 0.00 57.07 58.31 1xdg s TYR 166 Cb 0.20 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.96 1xdg s TYR 166 CO 0.45 0.09 -0.22 -0.65 -1.11 0.00 0.00 175.55 174.11 1xdg s GLN 167 N -1.50 1.39 0.07 -0.62 -0.21 -0.58 -4.90 119.66 113.32 1xdg s GLN 167 Ca 0.45 -1.43 0.04 0.00 0.02 0.00 0.00 55.36 54.44 1xdg s GLN 167 Cb -0.26 -1.64 -0.03 0.00 1.00 0.00 0.00 33.01 32.08 1xdg s GLN 167 CO 0.32 0.36 -0.12 -0.06 -2.12 0.00 0.00 175.29 173.67 1xdg s PHE 168 N -1.66 1.04 0.06 0.91 0.40 -1.26 -1.48 117.98 115.99 1xdg s PHE 168 Ca 0.17 -0.52 0.01 0.00 -0.60 0.00 0.00 56.93 55.98 1xdg s PHE 168 Cb -0.08 -0.59 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 1xdg s PHE 168 CO 0.08 0.01 -0.05 0.00 0.70 0.00 0.00 175.22 175.96 1xdg s ALA 169 N -1.61 0.63 -0.04 5.36 0.00 -0.60 -3.82 121.76 121.68 1xdg s ALA 169 Ca -0.02 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.85 1xdg s ALA 169 Cb -0.08 0.18 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1xdg s ALA 169 CO 0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 175.76 175.50 1xdg s ALA 170 N -3.06 0.59 -0.12 0.00 0.00 -0.56 -1.35 121.76 117.26 1xdg s ALA 170 Ca 0.03 -0.00 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1xdg s ALA 170 Cb 0.02 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.77 1xdg s ALA 170 CO -0.05 -0.01 -0.14 0.08 0.00 0.00 0.00 175.76 175.63 1xdg s VAL 171 N 0.89 1.47 0.05 0.00 1.01 0.14 -0.31 120.40 123.66 1xdg s VAL 171 Ca -0.11 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1xdg s VAL 171 Cb -0.14 -1.37 -0.06 0.00 0.00 0.00 0.00 36.38 34.81 1xdg s VAL 171 CO -0.00 0.44 0.60 -1.58 0.00 0.00 0.00 175.10 174.56 1xdg s GLN 172 N 1.20 4.28 0.04 2.72 0.74 -0.27 -0.13 119.66 128.23 1xdg s GLN 172 Ca -0.02 0.78 0.03 0.00 0.05 0.00 0.00 55.36 56.20 1xdg s GLN 172 Cb -0.14 -3.28 -0.02 0.00 1.10 0.00 0.00 33.01 30.67 1xdg s GLN 172 CO -0.05 0.53 -0.10 -0.59 -0.55 0.00 0.00 175.29 174.53 1xdg s PHE 173 N -0.77 0.87 0.00 1.67 -0.71 -0.35 -0.94 117.98 117.76 1xdg s PHE 173 Ca 0.30 -0.41 0.00 0.00 -1.04 0.00 0.00 56.93 55.78 1xdg s PHE 173 Cb -0.19 -0.51 0.00 0.00 -1.21 0.00 0.00 43.02 41.11 1xdg s PHE 173 CO 0.19 -0.02 0.00 0.45 -1.34 0.00 0.00 175.22 174.50 1xdg n SER 174 N 1.69 0.00 0.07 1.98 2.88 -1.26 -0.39 113.62 118.59 1xdg n SER 174 Ca -0.20 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.13 1xdg n SER 174 Cb 0.55 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.87 1xdg n SER 174 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1xdg h THR 175 N 0.00 1.43 -5.18 2.46 2.02 -1.87 0.41 112.91 112.18 1xdg h THR 175 Ca 0.00 -2.50 -0.46 0.00 0.77 0.00 0.00 66.41 64.22 1xdg h THR 175 Cb 0.00 3.03 -0.06 0.00 -1.74 0.00 0.00 68.15 69.38 1xdg h THR 175 CO 0.00 0.73 -0.26 -0.24 0.37 0.00 0.00 175.52 176.11 1xdg n SER 176 N -4.02 2.60 -4.12 4.18 2.88 -1.26 -4.65 113.62 109.22 1xdg n SER 176 Ca -0.14 -2.52 -0.22 0.00 -1.33 0.00 0.00 58.87 54.66 1xdg n SER 176 Cb 0.88 0.08 -0.15 0.00 -0.75 0.00 0.00 64.21 64.27 1xdg n SER 176 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1xdg s TYR 177 N -2.18 1.30 -0.05 0.66 1.51 -1.26 -4.36 117.35 112.97 1xdg s TYR 177 Ca 0.15 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1xdg s TYR 177 Cb -0.01 -0.82 0.04 0.00 -0.11 0.00 0.00 41.96 41.06 1xdg s TYR 177 CO 0.09 -0.01 0.09 0.21 -1.11 0.00 0.00 175.55 174.83 1xdg s LYS 178 N -0.53 -0.01 -0.39 -0.62 2.20 -0.11 -5.02 119.74 115.27 1xdg s LYS 178 Ca 0.05 0.38 -0.29 0.00 -0.36 0.00 0.00 55.97 55.76 1xdg s LYS 178 Cb -0.06 -0.33 0.00 0.00 -1.51 0.00 0.00 37.83 35.93 1xdg s LYS 178 CO -0.00 -0.26 1.48 0.99 -0.36 0.00 0.00 175.35 177.20 1xdg s THR 179 N 1.78 3.83 0.12 3.43 2.01 -1.26 -1.11 115.64 124.44 1xdg s THR 179 Ca -0.01 0.86 0.03 0.00 0.31 0.00 0.00 61.69 62.87 1xdg s THR 179 Cb -0.12 -4.09 -0.22 0.00 0.01 0.00 0.00 72.50 68.08 1xdg s THR 179 CO -0.04 -0.67 1.26 -0.33 -0.69 0.00 0.00 174.62 174.15 1xdg h GLU 180 N 11.01 0.13 -1.87 4.92 4.39 -1.04 -3.46 114.58 128.66 1xdg h GLU 180 Ca -0.29 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.21 1xdg h GLU 180 Cb 1.12 0.07 -0.22 0.00 -0.10 0.00 0.00 28.75 29.62 1xdg h GLU 180 CO 1.07 1.05 0.25 -0.59 -1.16 0.00 0.00 179.01 179.64 1xdg s PHE 181 N -2.81 -0.65 0.54 4.33 -0.71 -1.19 -4.96 117.98 112.52 1xdg s PHE 181 Ca -0.01 1.48 0.07 0.00 -1.04 0.00 0.00 56.93 57.43 1xdg s PHE 181 Cb 0.09 0.33 0.05 0.00 -1.21 0.00 0.00 43.02 42.28 1xdg s PHE 181 CO 0.84 -0.38 0.54 0.16 -1.34 0.00 0.00 175.22 175.03 1xdg s ASP 182 N -0.08 4.86 0.25 1.98 3.84 -1.26 -1.49 116.67 124.76 1xdg s ASP 182 Ca -0.01 -1.04 -0.04 0.00 -0.00 0.00 0.00 52.55 51.46 1xdg s ASP 182 Cb -0.04 0.24 0.41 0.00 -1.38 0.00 0.00 42.92 42.15 1xdg s ASP 182 CO 0.01 -1.13 1.80 -0.26 -0.00 0.00 0.00 175.17 175.60 1xdg h PHE 183 N 0.59 0.83 -0.71 2.11 -1.00 -1.64 -1.64 116.94 115.47 1xdg h PHE 183 Ca -0.35 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.41 1xdg h PHE 183 Cb 1.29 -0.25 -0.03 0.00 3.61 0.00 0.00 35.95 40.57 1xdg h PHE 183 CO 0.73 0.32 0.23 0.66 -1.61 0.00 0.00 178.31 178.63 1xdg h SER 184 N 0.76 1.02 -0.71 2.17 4.64 -1.67 -1.40 113.55 118.35 1xdg h SER 184 Ca 0.40 -0.18 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 1xdg h SER 184 Cb 0.40 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.19 1xdg h SER 184 CO -0.26 0.94 0.39 0.44 -0.87 0.00 0.00 176.83 177.47 1xdg h ASP 185 N 1.05 0.88 0.30 4.97 3.32 -1.67 -0.97 116.42 124.28 1xdg h ASP 185 Ca 0.23 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1xdg h ASP 185 Cb 0.29 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1xdg h ASP 185 CO -0.01 0.71 -0.14 0.22 -1.72 0.00 0.00 179.24 178.30 1xdg h TYR 186 N 0.97 -0.37 -0.22 4.55 3.20 -0.64 0.12 116.97 124.58 1xdg h TYR 186 Ca 0.25 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 1xdg h TYR 186 Cb 0.03 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1xdg h TYR 186 CO -0.00 -0.17 -0.09 -0.39 -1.64 0.00 0.00 178.16 175.86 1xdg h VAL 187 N -0.48 1.19 -0.04 1.81 -1.51 -1.20 0.29 116.25 116.32 1xdg h VAL 187 Ca -0.04 -0.81 -0.01 0.00 -1.23 0.00 0.00 66.70 64.60 1xdg h VAL 187 Cb 0.36 1.13 -0.00 0.00 -2.13 0.00 0.00 31.29 30.65 1xdg h VAL 187 CO 0.07 0.26 -0.03 0.50 -1.23 0.00 0.00 177.57 177.14 1xdg h LYS 188 N 0.33 0.08 0.01 5.19 3.64 -0.89 -3.38 116.57 121.55 1xdg h LYS 188 Ca 0.07 -0.04 -0.37 0.00 -1.27 0.00 0.00 60.65 59.04 1xdg h LYS 188 Cb 0.38 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.13 1xdg h LYS 188 CO 0.02 0.53 -2.33 0.91 -2.27 0.00 0.00 179.45 176.30 1xdg n TRP 189 N -4.80 0.20 -2.03 1.91 7.02 0.40 -5.00 117.44 115.13 1xdg n TRP 189 Ca -0.08 0.06 -0.12 0.00 -1.02 0.00 0.00 57.50 56.34 1xdg n TRP 189 Cb 0.26 -1.03 -0.02 0.00 -2.42 0.00 0.00 31.31 28.10 1xdg n TRP 189 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1xdg n LYS 190 N -3.04 -1.88 -3.83 -0.99 5.02 0.10 -4.91 118.16 108.63 1xdg n LYS 190 Ca -0.37 0.62 -0.30 0.00 -2.02 0.00 0.00 58.31 56.24 1xdg n LYS 190 Cb 1.07 -5.08 -0.15 0.00 -0.02 0.00 0.00 35.03 30.86 1xdg n LYS 190 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1xdg s ASP 191 N -2.02 4.24 0.36 4.39 3.68 -1.26 -5.01 116.67 121.05 1xdg s ASP 191 Ca 0.00 -1.94 0.06 0.00 2.13 0.00 0.00 52.55 52.80 1xdg s ASP 191 Cb 0.00 -1.15 0.74 0.00 -1.45 0.00 0.00 42.92 41.06 1xdg s ASP 191 CO 0.00 -0.39 1.94 -0.65 0.13 0.00 0.00 175.17 176.20 1xdg h PRO 192 N 7.76 0.74 -0.45 4.34 0.11 -1.93 -0.45 132.00 142.11 1xdg h PRO 192 Ca -0.09 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.93 1xdg h PRO 192 Cb 1.00 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.93 1xdg h PRO 192 CO 0.49 0.49 0.12 -0.44 -0.21 0.00 0.00 178.00 178.45 1xdg h ASP 193 N 0.76 0.67 -0.45 -2.05 3.32 -1.95 -2.68 116.42 114.04 1xdg h ASP 193 Ca 0.34 -0.22 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 1xdg h ASP 193 Cb 0.34 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1xdg h ASP 193 CO -0.12 0.72 -0.24 0.00 -1.72 0.00 0.00 179.24 177.88 1xdg h ALA 194 N 0.98 0.70 0.00 3.45 0.00 -1.84 -2.19 119.26 120.36 1xdg h ALA 194 Ca 0.14 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1xdg h ALA 194 Cb 0.30 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1xdg h ALA 194 CO -0.00 0.67 -0.27 -0.07 0.00 0.00 0.00 179.25 179.59 1xdg h LEU 195 N 0.83 0.00 -2.65 0.00 3.38 -0.98 -2.91 115.31 112.98 1xdg h LEU 195 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1xdg h LEU 195 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1xdg h LEU 195 CO 0.07 0.27 0.00 0.18 0.09 0.00 0.00 178.44 179.05 1xdg n LEU 196 N -4.02 2.60 -0.09 1.67 4.77 -1.02 -4.73 117.00 116.17 1xdg n LEU 196 Ca -0.02 -1.84 0.02 0.00 -0.03 0.00 0.00 56.01 54.14 1xdg n LEU 196 Cb 0.33 -0.16 0.33 0.00 -2.33 0.00 0.00 43.42 41.60 1xdg n LEU 196 CO 0.36 0.64 1.17 0.50 -1.33 0.00 0.00 177.39 178.73 1xdg h LYS 197 N 1.69 0.73 -0.68 3.23 3.64 -1.18 -3.18 116.57 120.82 1xdg h LYS 197 Ca 0.00 -0.05 -0.44 0.00 -1.27 0.00 0.00 60.65 58.88 1xdg h LYS 197 Cb 0.64 -0.16 -0.27 0.00 -0.41 0.00 0.00 32.23 32.03 1xdg h LYS 197 CO 0.00 0.51 -0.02 0.72 -2.27 0.00 0.00 179.45 178.39 1xdg n HIS 198 N -4.43 2.28 -2.54 1.91 8.25 -1.26 -5.00 115.22 114.42 1xdg n HIS 198 Ca 0.05 -2.18 -0.41 0.00 -0.26 0.00 0.00 57.72 54.92 1xdg n HIS 198 Cb 0.07 -0.72 -0.04 0.00 1.12 0.00 0.00 29.99 30.41 1xdg n HIS 198 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xdg s VAL 199 N -4.07 4.00 -0.20 1.59 1.01 -1.21 -5.02 120.40 116.50 1xdg s VAL 199 Ca 0.53 1.68 -0.02 0.00 0.00 0.00 0.00 61.98 64.17 1xdg s VAL 199 Cb 0.44 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1xdg s VAL 199 CO 0.01 0.27 -0.11 -0.75 0.00 0.00 0.00 175.10 174.52 1xdg s LYS 200 N -0.17 3.21 -0.06 2.72 2.47 -1.26 -5.07 119.74 121.58 1xdg s LYS 200 Ca 0.50 -0.72 -0.32 0.00 -1.56 0.00 0.00 55.97 53.87 1xdg s LYS 200 Cb -0.28 -2.80 -0.10 0.00 -1.46 0.00 0.00 37.83 33.18 1xdg s LYS 200 CO 0.33 -0.19 1.94 1.58 0.16 0.00 0.00 175.35 179.18 1xdg n HIS 201 N 4.67 2.36 -0.13 4.03 -0.00 -1.26 -4.90 115.22 119.99 1xdg n HIS 201 Ca -0.19 -0.15 -0.10 0.00 -0.00 0.00 0.00 57.72 57.28 1xdg n HIS 201 Cb 0.51 -2.72 -0.01 0.00 -0.00 0.00 0.00 29.99 27.76 1xdg n HIS 201 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.34 176.86 1xdg h MET 202 N 10.12 0.64 -4.49 1.57 2.86 -1.93 -3.48 114.93 120.23 1xdg h MET 202 Ca -0.48 -0.17 -0.28 0.00 -2.06 0.00 0.00 59.70 56.70 1xdg h MET 202 Cb 1.26 -0.08 0.10 0.00 0.06 0.00 0.00 31.60 32.95 1xdg h MET 202 CO 0.95 0.70 -0.49 1.28 1.06 0.00 0.00 176.91 180.40 1xdg n LEU 203 N -4.53 -3.03 0.00 1.22 4.77 0.13 -4.97 117.00 110.58 1xdg n LEU 203 Ca -0.01 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1xdg n LEU 203 Cb 0.23 -2.33 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 1xdg n LEU 203 CO 0.39 0.46 0.00 0.18 -1.33 0.00 0.00 177.39 177.09 1xdg n LEU 204 N -3.72 0.00 0.00 2.23 4.77 -1.25 -4.20 117.00 114.83 1xdg n LEU 204 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xdg n LEU 204 Cb 0.55 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1xdg n LEU 204 CO 0.47 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.71 1xdg n LEU 205 N 0.00 0.00 -3.19 2.23 4.77 -1.26 -0.65 117.00 118.89 1xdg n LEU 205 Ca 0.00 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.76 1xdg n LEU 205 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1xdg n LEU 205 CO 0.00 0.00 -0.27 0.41 -1.33 0.00 0.00 177.39 176.20 1xdg n THR 206 N 0.00 -0.48 -2.52 -5.08 -1.04 -1.20 -3.66 114.28 100.30 1xdg n THR 206 Ca 0.00 -4.22 -0.43 0.00 -2.04 0.00 0.00 64.05 57.36 1xdg n THR 206 Cb 0.00 -1.40 0.00 0.00 -1.82 0.00 0.00 70.33 67.11 1xdg n THR 206 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1xdg n ASN 207 N 1.03 4.86 -0.14 8.00 3.02 0.14 -1.07 115.26 131.11 1xdg n ASN 207 Ca 0.22 -2.94 -0.12 0.00 -0.03 0.00 0.00 54.58 51.71 1xdg n ASN 207 Cb 0.57 -1.66 -0.02 0.00 -0.61 0.00 0.00 39.78 38.07 1xdg n ASN 207 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1xdg h THR 208 N 4.88 1.28 0.11 3.41 2.02 -1.93 -1.28 112.91 121.39 1xdg h THR 208 Ca 0.43 -1.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.22 1xdg h THR 208 Cb 0.81 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1xdg h THR 208 CO 1.49 0.47 -0.05 -0.26 0.37 0.00 0.00 175.52 177.53 1xdg h PHE 209 N 0.70 -0.13 -0.97 3.16 -1.00 -1.89 -0.97 116.94 115.84 1xdg h PHE 209 Ca 0.09 -0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.90 1xdg h PHE 209 Cb 0.80 0.04 -0.06 0.00 3.61 0.00 0.00 35.95 40.35 1xdg h PHE 209 CO 0.06 0.02 0.63 0.78 -1.61 0.00 0.00 178.31 178.19 1xdg h GLY 210 N -0.26 1.40 0.79 -1.45 0.00 -1.88 -2.46 103.07 99.21 1xdg h GLY 210 Ca -0.01 -0.48 0.02 0.00 0.00 0.00 0.00 47.33 46.86 1xdg h GLY 210 CO 0.02 0.42 0.03 0.00 0.00 0.00 0.00 176.54 177.01 1xdg h ALA 211 N 1.43 0.17 -0.82 3.60 0.00 -0.68 -0.39 119.26 122.58 1xdg h ALA 211 Ca 0.38 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 1xdg h ALA 211 Cb -0.00 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1xdg h ALA 211 CO -0.12 -0.41 0.36 0.82 0.00 0.00 0.00 179.25 179.91 1xdg h ILE 212 N 0.10 1.26 -0.39 0.00 2.04 -0.95 -0.52 117.51 119.05 1xdg h ILE 212 Ca 0.08 -0.77 -0.11 0.00 1.00 0.00 0.00 64.86 65.05 1xdg h ILE 212 Cb 0.08 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1xdg h ILE 212 CO -0.11 0.32 -0.19 0.78 0.00 0.00 0.00 178.15 178.95 1xdg h ASN 213 N 1.18 0.84 -0.16 1.72 4.21 -1.26 -0.22 115.58 121.88 1xdg h ASN 213 Ca 0.28 -0.41 0.03 0.00 1.21 0.00 0.00 56.30 57.41 1xdg h ASN 213 Cb 0.17 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 37.10 1xdg h ASN 213 CO -0.03 1.06 -0.05 0.22 -1.29 0.00 0.00 177.43 177.34 1xdg h TYR 214 N 0.61 -0.11 -0.49 1.19 3.20 -0.73 -0.72 116.97 119.92 1xdg h TYR 214 Ca 0.09 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.99 1xdg h TYR 214 Cb 0.75 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 39.06 1xdg h TYR 214 CO 0.06 -0.08 0.31 0.28 -1.64 0.00 0.00 178.16 177.08 1xdg h VAL 215 N -0.02 1.08 -0.41 1.81 2.07 -0.78 0.61 116.25 120.62 1xdg h VAL 215 Ca 0.08 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1xdg h VAL 215 Cb 0.14 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1xdg h VAL 215 CO -0.17 0.11 0.10 0.00 0.02 0.00 0.00 177.57 177.63 1xdg h ALA 216 N 1.20 1.41 0.00 1.67 0.00 -0.41 -2.37 119.26 120.77 1xdg h ALA 216 Ca 0.19 -0.16 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 1xdg h ALA 216 Cb -0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1xdg h ALA 216 CO -0.07 0.43 -2.14 0.25 0.00 0.00 0.00 179.25 177.72 1xdg n THR 217 N -4.32 0.85 -0.07 0.00 -2.24 -0.33 -4.52 114.28 103.65 1xdg n THR 217 Ca 0.03 -0.67 -0.08 0.00 -2.27 0.00 0.00 64.05 61.06 1xdg n THR 217 Cb 0.19 -0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 67.98 1xdg n THR 217 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xdg n GLU 218 N -2.52 1.50 -0.07 -0.78 -0.58 0.19 -4.78 120.64 113.60 1xdg n GLU 218 Ca -0.21 0.01 -0.22 0.00 -0.42 0.00 0.00 57.16 56.32 1xdg n GLU 218 Cb 0.91 -1.36 -0.12 0.00 -0.57 0.00 0.00 31.44 30.30 1xdg n GLU 218 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1xdg h VAL 219 N 0.00 0.83 0.00 2.62 2.07 -1.47 -3.40 116.25 116.91 1xdg h VAL 219 Ca -0.38 -2.23 -0.60 0.00 0.82 0.00 0.00 66.70 64.31 1xdg h VAL 219 Cb 1.82 2.32 0.02 0.00 -1.52 0.00 0.00 31.29 33.93 1xdg h VAL 219 CO 0.01 0.50 3.47 0.49 0.02 0.00 0.00 177.57 182.06 1xdg n PHE 220 N -4.13 2.20 -5.07 1.57 3.01 -1.11 -4.75 117.46 109.18 1xdg n PHE 220 Ca -0.32 -2.77 -0.30 0.00 1.01 0.00 0.00 57.45 55.07 1xdg n PHE 220 Cb 0.80 -2.27 -0.15 0.00 -0.01 0.00 0.00 39.48 37.85 1xdg n PHE 220 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1xdg s ARG 221 N 2.61 1.90 0.29 -1.08 0.52 -1.26 -4.95 118.95 116.97 1xdg s ARG 221 Ca 0.60 -1.01 0.00 0.00 -0.52 0.00 0.00 55.73 54.81 1xdg s ARG 221 Cb 0.16 -1.96 0.52 0.00 0.52 0.00 0.00 34.95 34.18 1xdg s ARG 221 CO -0.05 0.52 1.88 0.93 0.02 0.00 0.00 175.30 178.60 1xdg h GLU 222 N 5.13 1.02 0.00 3.54 5.08 -1.90 -1.21 114.58 126.23 1xdg h GLU 222 Ca -0.44 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.84 1xdg h GLU 222 Cb 1.13 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 1xdg h GLU 222 CO 0.45 0.67 -0.09 1.05 -1.00 0.00 0.00 179.01 180.10 1xdg h GLU 223 N 1.05 0.00 -0.63 2.33 9.09 -1.95 -1.40 114.58 123.07 1xdg h GLU 223 Ca 0.44 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.85 1xdg h GLU 223 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 1xdg h GLU 223 CO -0.19 0.09 0.00 1.28 0.05 0.00 0.00 179.01 180.24 1xdg n LEU 224 N -3.39 3.76 0.00 3.06 4.77 -0.53 -4.91 117.00 119.75 1xdg n LEU 224 Ca -0.01 -1.89 0.00 0.00 -0.03 0.00 0.00 56.01 54.08 1xdg n LEU 224 Cb 0.26 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 1xdg n LEU 224 CO 0.28 0.74 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 1xdg n GLY 225 N 1.19 0.50 3.76 -0.72 0.00 -0.53 -1.96 105.19 107.43 1xdg n GLY 225 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 1xdg n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xdg s ALA 226 N -2.12 3.05 -0.24 4.61 0.00 -0.78 -4.69 121.76 121.60 1xdg s ALA 226 Ca 0.00 1.29 -0.10 0.00 0.00 0.00 0.00 51.96 53.14 1xdg s ALA 226 Cb 0.00 -3.53 -0.05 0.00 0.00 0.00 0.00 23.12 19.54 1xdg s ALA 226 CO 0.00 -1.10 0.15 1.03 0.00 0.00 0.00 175.76 175.84 1xdg s ARG 227 N -2.61 4.06 0.29 0.00 0.52 -1.26 -4.33 118.95 115.62 1xdg s ARG 227 Ca 0.64 -0.27 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 1xdg s ARG 227 Cb -0.39 -3.51 0.51 0.00 0.52 0.00 0.00 34.95 32.07 1xdg s ARG 227 CO 0.48 0.08 1.88 -1.35 0.02 0.00 0.00 175.30 176.41 1xdg h PRO 228 N 7.45 1.03 0.00 3.54 0.11 -1.98 -2.03 132.00 140.12 1xdg h PRO 228 Ca -0.38 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1xdg h PRO 228 Cb 1.17 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1xdg h PRO 228 CO 0.66 0.68 0.00 -0.40 -0.21 0.00 0.00 178.00 178.73 1xdg n ASP 229 N -4.53 0.54 -4.81 -2.05 5.68 -1.26 -4.94 116.55 105.20 1xdg n ASP 229 Ca 0.16 0.57 -0.32 0.00 -0.50 0.00 0.00 54.79 54.69 1xdg n ASP 229 Cb 0.24 -0.71 0.03 0.00 -1.14 0.00 0.00 41.12 39.54 1xdg n ASP 229 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xdg s ALA 230 N -3.10 2.70 0.08 2.12 0.00 -0.76 -4.74 121.76 118.05 1xdg s ALA 230 Ca 0.10 0.31 -0.28 0.00 0.00 0.00 0.00 51.96 52.09 1xdg s ALA 230 Cb 0.13 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 1xdg s ALA 230 CO 0.53 -0.97 0.87 0.99 0.00 0.00 0.00 175.76 177.18 1xdg s THR 231 N -2.63 4.61 -0.22 0.00 2.01 0.58 -4.85 115.64 115.14 1xdg s THR 231 Ca 0.62 1.87 -0.16 0.00 0.31 0.00 0.00 61.69 64.33 1xdg s THR 231 Cb -0.16 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 1xdg s THR 231 CO 0.43 0.34 0.40 -0.54 -0.69 0.00 0.00 174.62 174.55 1xdg s LYS 232 N -0.01 4.14 -0.02 4.92 1.02 -1.26 -0.83 119.74 127.69 1xdg s LYS 232 Ca 0.43 0.18 0.05 0.00 0.02 0.00 0.00 55.97 56.64 1xdg s LYS 232 Cb -0.22 -3.57 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 1xdg s LYS 232 CO 0.27 -0.11 -0.15 0.08 -0.92 0.00 0.00 175.35 174.51 1xdg s VAL 233 N 1.53 1.25 -0.09 3.17 1.01 -0.29 -1.52 120.40 125.46 1xdg s VAL 233 Ca 0.18 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1xdg s VAL 233 Cb -0.15 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1xdg s VAL 233 CO 0.08 0.36 -0.15 -0.22 0.00 0.00 0.00 175.10 175.17 1xdg s LEU 234 N -0.22 1.72 -0.26 3.92 2.96 0.87 -0.90 118.68 126.78 1xdg s LEU 234 Ca 0.03 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.53 1xdg s LEU 234 Cb -0.08 -1.02 0.03 0.00 0.50 0.00 0.00 46.19 45.62 1xdg s LEU 234 CO 0.00 0.04 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.40 1xdg s ILE 235 N 0.78 2.96 -0.21 6.68 1.01 0.10 -1.07 121.20 131.45 1xdg s ILE 235 Ca -0.11 -1.04 -0.12 0.00 0.00 0.00 0.00 60.65 59.38 1xdg s ILE 235 Cb -0.16 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 1xdg s ILE 235 CO 0.02 0.16 0.22 -0.63 0.00 0.00 0.00 174.94 174.71 1xdg s ILE 236 N 1.33 5.33 -0.17 2.92 1.01 0.18 -0.72 121.20 131.08 1xdg s ILE 236 Ca -0.00 0.34 0.01 0.00 0.00 0.00 0.00 60.65 61.00 1xdg s ILE 236 Cb -0.17 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.75 1xdg s ILE 236 CO -0.04 0.35 -0.17 -0.63 0.00 0.00 0.00 174.94 174.45 1xdg s ILE 237 N 0.87 2.38 0.01 2.92 1.01 -0.37 0.53 121.20 128.54 1xdg s ILE 237 Ca 0.11 -0.85 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 1xdg s ILE 237 Cb -0.13 -2.00 0.03 0.00 0.01 0.00 0.00 42.46 40.36 1xdg s ILE 237 CO 0.04 0.52 0.35 0.28 0.00 0.00 0.00 174.94 176.12 1xdg s THR 238 N 1.08 0.06 -0.24 2.92 -1.32 -0.55 -0.88 115.64 116.71 1xdg s THR 238 Ca -0.00 -0.50 0.15 0.00 -1.21 0.00 0.00 61.69 60.13 1xdg s THR 238 Cb -0.14 -0.78 0.39 0.00 -1.51 0.00 0.00 72.50 70.46 1xdg s THR 238 CO -0.06 -0.28 1.29 -0.90 -2.21 0.00 0.00 174.62 172.46 1xdg n ASP 239 N 0.95 3.17 -3.50 8.08 5.75 -1.26 -0.97 116.55 128.77 1xdg n ASP 239 Ca -0.20 -2.85 -0.02 0.00 -0.01 0.00 0.00 54.79 51.71 1xdg n ASP 239 Cb 0.58 -0.43 0.01 0.00 -1.03 0.00 0.00 41.12 40.24 1xdg n ASP 239 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1xdg s GLY 240 N -2.05 -0.01 0.55 6.12 0.00 -1.26 -4.61 107.32 106.05 1xdg s GLY 240 Ca 0.34 -0.13 -0.18 0.00 0.00 0.00 0.00 44.72 44.75 1xdg s GLY 240 CO 0.07 2.30 1.06 -0.54 0.00 0.00 0.00 173.10 175.99 1xdg s GLU 241 N -2.34 3.49 0.46 2.90 2.02 -1.26 -5.01 118.70 118.97 1xdg s GLU 241 Ca 0.21 1.31 -0.24 0.00 0.02 0.00 0.00 54.97 56.26 1xdg s GLU 241 Cb -0.02 -2.05 -0.07 0.00 0.10 0.00 0.00 34.13 32.09 1xdg s GLU 241 CO 0.03 -0.68 1.33 0.00 0.02 0.00 0.00 175.26 175.96 1xdg s ALA 242 N -2.20 3.11 -0.97 5.21 0.00 -1.26 -4.83 121.76 120.82 1xdg s ALA 242 Ca 0.66 1.28 0.17 0.00 0.00 0.00 0.00 51.96 54.06 1xdg s ALA 242 Cb -0.17 -3.52 0.60 0.00 0.00 0.00 0.00 23.12 20.03 1xdg s ALA 242 CO 0.30 -1.03 1.51 0.25 0.00 0.00 0.00 175.76 176.79 1xdg n THR 243 N -0.31 1.69 -3.84 0.00 -2.24 -0.23 -4.96 114.28 104.38 1xdg n THR 243 Ca 0.06 -1.26 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 1xdg n THR 243 Cb 0.44 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1xdg n THR 243 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1xdg n ASP 244 N 0.75 0.28 -3.90 3.42 5.75 -1.26 -4.91 116.55 116.69 1xdg n ASP 244 Ca 0.22 -0.84 -0.08 0.00 -0.01 0.00 0.00 54.79 54.08 1xdg n ASP 244 Cb 0.78 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.84 1xdg n ASP 244 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1xdg s SER 245 N -0.68 -0.20 0.00 -1.12 1.04 -1.26 -4.86 113.70 106.61 1xdg s SER 245 Ca 0.00 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1xdg s SER 245 Cb 0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1xdg s SER 245 CO 0.00 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.59 1xdg n GLY 246 N -0.42 0.11 3.30 7.32 0.00 -1.26 -4.84 105.19 109.41 1xdg n GLY 246 Ca -0.04 -1.20 -0.16 0.00 0.00 0.00 0.00 46.02 44.62 1xdg n GLY 246 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xdg s ASN 247 N -4.00 1.96 -0.25 1.61 2.20 -1.26 -5.06 114.94 110.13 1xdg s ASN 247 Ca 0.00 -1.10 0.11 0.00 -0.94 0.00 0.00 52.86 50.93 1xdg s ASN 247 Cb 0.00 -0.03 0.46 0.00 -2.00 0.00 0.00 41.25 39.68 1xdg s ASN 247 CO 0.00 -0.38 1.18 2.30 -2.94 0.00 0.00 177.10 177.26 1xdg n ILE 248 N -0.33 2.12 0.29 0.54 -5.35 -1.26 -4.79 119.36 110.58 1xdg n ILE 248 Ca -0.08 -3.64 0.14 0.00 -0.27 0.00 0.00 62.75 58.90 1xdg n ILE 248 Cb 0.62 -0.44 0.86 0.00 -1.74 0.00 0.00 39.64 38.94 1xdg n ILE 248 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1xdg h ASP 249 N 1.96 0.00 0.35 7.28 3.32 -2.00 -0.19 116.42 127.13 1xdg h ASP 249 Ca 0.18 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1xdg h ASP 249 Cb 1.41 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.96 1xdg h ASP 249 CO 0.48 0.01 -0.16 0.00 -1.72 0.00 0.00 179.24 177.84 1xdg h ALA 250 N 1.99 1.37 -0.66 3.45 0.00 -1.97 -2.91 119.26 120.52 1xdg h ALA 250 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1xdg h ALA 250 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1xdg h ALA 250 CO 0.00 0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.45 1xdg n ALA 251 N -2.34 2.82 -0.35 0.00 0.00 -0.09 -4.60 120.51 115.95 1xdg n ALA 251 Ca -0.02 -1.50 0.02 0.00 0.00 0.00 0.00 53.44 51.94 1xdg n ALA 251 Cb 0.26 -0.96 0.18 0.00 0.00 0.00 0.00 19.45 18.94 1xdg n ALA 251 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1xdg h LYS 252 N 4.05 1.15 0.00 0.00 1.57 -1.52 -0.90 116.57 120.91 1xdg h LYS 252 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1xdg h LYS 252 Cb 1.28 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1xdg h LYS 252 CO 0.15 0.76 0.00 -0.40 -0.57 0.00 0.00 179.45 179.39 1xdg n ASP 253 N -4.47 0.00 -4.78 0.86 5.75 -1.26 -4.75 116.55 107.89 1xdg n ASP 253 Ca 0.14 0.05 -0.36 0.00 -0.01 0.00 0.00 54.79 54.62 1xdg n ASP 253 Cb 0.15 -0.31 -0.07 0.00 -1.03 0.00 0.00 41.12 39.86 1xdg n ASP 253 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1xdg s ILE 254 N -2.61 5.44 -0.04 2.12 1.01 -0.35 -4.76 121.20 122.02 1xdg s ILE 254 Ca 0.18 0.21 -0.30 0.00 0.00 0.00 0.00 60.65 60.74 1xdg s ILE 254 Cb 0.13 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 1xdg s ILE 254 CO 0.31 0.50 1.14 -0.63 0.00 0.00 0.00 174.94 176.26 1xdg s ILE 255 N -0.12 4.38 -0.16 2.92 1.01 -0.57 -4.92 121.20 123.74 1xdg s ILE 255 Ca 0.11 1.70 0.02 0.00 0.00 0.00 0.00 60.65 62.47 1xdg s ILE 255 Cb -0.11 -4.09 0.02 0.00 0.01 0.00 0.00 42.46 38.28 1xdg s ILE 255 CO 0.00 0.04 -0.20 -0.13 0.00 0.00 0.00 174.94 174.65 1xdg s ARG 256 N 1.84 2.92 -0.07 2.79 0.52 -1.26 -0.09 118.95 125.60 1xdg s ARG 256 Ca 0.55 -0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 54.94 1xdg s ARG 256 Cb -0.24 -2.45 -0.03 0.00 0.52 0.00 0.00 34.95 32.75 1xdg s ARG 256 CO 0.23 -0.12 0.00 0.71 0.02 0.00 0.00 175.30 176.14 1xdg s TYR 257 N 1.09 3.14 -0.04 -0.53 1.51 -0.23 -1.77 117.35 120.52 1xdg s TYR 257 Ca -0.00 0.17 0.04 0.00 -1.01 0.00 0.00 57.07 56.26 1xdg s TYR 257 Cb -0.14 -1.76 -0.00 0.00 -0.11 0.00 0.00 41.96 39.95 1xdg s TYR 257 CO -0.08 0.46 -0.15 -1.50 -1.11 0.00 0.00 175.55 173.18 1xdg s ILE 258 N -0.93 1.22 -0.31 2.71 2.07 -0.37 -0.64 121.20 124.95 1xdg s ILE 258 Ca 0.15 -0.60 0.01 0.00 -1.41 0.00 0.00 60.65 58.80 1xdg s ILE 258 Cb -0.11 -1.06 0.07 0.00 0.13 0.00 0.00 42.46 41.49 1xdg s ILE 258 CO 0.04 0.36 -0.00 -0.63 -1.91 0.00 0.00 174.94 172.80 1xdg s ILE 259 N 0.08 2.54 -0.19 2.00 1.01 0.19 -1.00 121.20 125.82 1xdg s ILE 259 Ca -0.03 -1.82 -0.15 0.00 0.00 0.00 0.00 60.65 58.65 1xdg s ILE 259 Cb -0.10 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.70 1xdg s ILE 259 CO 0.02 -0.28 0.35 -0.83 0.00 0.00 0.00 174.94 174.19 1xdg s GLY 260 N 1.17 2.11 0.02 6.18 0.00 0.20 -1.48 107.32 115.53 1xdg s GLY 260 Ca -0.01 -0.55 0.08 0.00 0.00 0.00 0.00 44.72 44.25 1xdg s GLY 260 CO -0.05 0.67 -0.24 -0.42 0.00 0.00 0.00 173.10 173.06 1xdg s ILE 261 N 1.06 1.95 0.00 0.90 1.01 -0.14 -1.50 121.20 124.48 1xdg s ILE 261 Ca 0.17 -1.22 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1xdg s ILE 261 Cb -0.14 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.67 1xdg s ILE 261 CO 0.07 0.39 0.00 0.61 0.00 0.00 0.00 174.94 176.01 1xdg n GLY 262 N 2.04 -3.82 0.38 6.18 0.00 -0.59 -4.39 105.19 105.00 1xdg n GLY 262 Ca -0.17 -2.08 0.15 0.00 0.00 0.00 0.00 46.02 43.92 1xdg n GLY 262 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1xdg h LYS 263 N 0.00 0.52 0.00 1.61 2.10 -1.90 -1.94 116.57 116.95 1xdg h LYS 263 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1xdg h LYS 263 Cb 0.00 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.21 1xdg h LYS 263 CO 0.00 0.34 0.00 0.72 -2.00 0.00 0.00 179.45 178.51 1xdg n HIS 264 N -4.53 0.00 -1.80 0.07 8.25 -1.26 -2.33 115.22 113.62 1xdg n HIS 264 Ca 0.17 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.69 1xdg n HIS 264 Cb 0.56 0.00 0.12 0.00 1.12 0.00 0.00 29.99 31.79 1xdg n HIS 264 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1xdg n PHE 265 N -0.74 0.00 -0.12 4.41 3.01 -0.73 -4.78 117.46 118.52 1xdg n PHE 265 Ca 0.04 -0.98 -0.13 0.00 1.01 0.00 0.00 57.45 57.39 1xdg n PHE 265 Cb 0.02 -0.18 -0.03 0.00 -0.01 0.00 0.00 39.48 39.28 1xdg n PHE 265 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1xdg h GLN 266 N 0.73 0.86 -6.36 -1.08 4.20 -1.64 -3.44 115.11 108.39 1xdg h GLN 266 Ca -0.06 -0.44 -0.54 0.00 0.06 0.00 0.00 58.65 57.67 1xdg h GLN 266 Cb 1.29 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 29.05 1xdg h GLN 266 CO 0.03 1.09 0.25 0.95 -0.67 0.00 0.00 178.83 180.47 1xdg s THR 267 N -4.43 4.75 0.40 -0.54 -4.23 -1.26 -4.94 115.64 105.39 1xdg s THR 267 Ca -0.12 1.82 0.15 0.00 -1.18 0.00 0.00 61.69 62.37 1xdg s THR 267 Cb 0.10 -4.21 0.36 0.00 1.34 0.00 0.00 72.50 70.10 1xdg s THR 267 CO 0.86 0.29 1.87 0.50 -0.54 0.00 0.00 174.62 177.60 1xdg h LYS 268 N 6.06 0.46 -0.12 3.99 3.64 -1.99 -1.57 116.57 127.03 1xdg h LYS 268 Ca -0.43 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 58.97 1xdg h LYS 268 Cb 1.21 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 1xdg h LYS 268 CO 0.73 0.31 -0.23 1.49 -2.27 0.00 0.00 179.45 179.48 1xdg h GLU 269 N 0.48 -0.28 -0.04 1.90 4.22 -1.97 0.91 114.58 119.81 1xdg h GLU 269 Ca 0.45 0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.91 1xdg h GLU 269 Cb 1.01 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1xdg h GLU 269 CO -0.18 -0.19 0.02 0.66 -2.18 0.00 0.00 179.01 177.14 1xdg h SER 270 N -0.29 0.05 -1.00 1.04 4.64 -1.65 -2.56 113.55 113.78 1xdg h SER 270 Ca 0.10 -0.13 0.21 0.00 -0.47 0.00 0.00 61.79 61.49 1xdg h SER 270 Cb 0.44 -0.01 -0.11 0.00 -0.31 0.00 0.00 62.40 62.41 1xdg h SER 270 CO -0.29 0.16 0.61 1.56 -0.87 0.00 0.00 176.83 178.01 1xdg h GLN 271 N -0.07 0.67 -0.10 4.77 4.20 -0.96 0.32 115.11 123.93 1xdg h GLN 271 Ca 0.01 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1xdg h GLN 271 Cb 0.13 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 1xdg h GLN 271 CO -0.00 0.44 0.07 0.93 -0.67 0.00 0.00 178.83 179.60 1xdg h GLU 272 N 0.69 0.00 0.00 1.46 4.39 -0.40 -1.87 114.58 118.85 1xdg h GLU 272 Ca 0.58 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.25 1xdg h GLU 272 Cb 1.01 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 1xdg h GLU 272 CO -0.38 0.00 -0.19 1.79 -1.16 0.00 0.00 179.01 179.08 1xdg h THR 273 N 0.00 1.09 0.00 1.13 1.35 -0.30 -2.49 112.91 113.69 1xdg h THR 273 Ca 0.05 -0.65 -0.11 0.00 -0.55 0.00 0.00 66.41 65.14 1xdg h THR 273 Cb 0.19 1.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.95 1xdg h THR 273 CO -0.00 0.18 -0.54 -0.07 -0.25 0.00 0.00 175.52 174.84 1xdg h LEU 274 N 0.00 0.00 -1.98 3.87 3.38 -1.41 -3.19 115.31 115.99 1xdg h LEU 274 Ca -0.00 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.16 1xdg h LEU 274 Cb 0.34 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1xdg h LEU 274 CO 0.02 0.54 0.49 0.45 0.09 0.00 0.00 178.44 180.04 1xdg h HIS 275 N 0.00 0.03 0.00 1.13 3.86 -1.52 -0.33 115.15 118.32 1xdg h HIS 275 Ca -0.01 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1xdg h HIS 275 Cb 1.06 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.52 1xdg h HIS 275 CO 0.00 0.01 -0.23 1.57 0.86 0.00 0.00 177.93 180.14 1xdg h LYS 276 N 0.02 0.00 0.01 2.45 2.10 -1.71 -2.96 116.57 116.49 1xdg h LYS 276 Ca 0.33 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.70 1xdg h LYS 276 Cb 1.29 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.57 1xdg h LYS 276 CO -0.01 0.23 -1.57 0.74 -2.00 0.00 0.00 179.45 176.85 1xdg h PHE 277 N 0.00 0.05 -4.34 0.07 0.04 -1.27 -3.48 116.94 108.01 1xdg h PHE 277 Ca -0.00 -0.04 -0.50 0.00 2.80 0.00 0.00 57.97 60.22 1xdg h PHE 277 Cb 0.63 -0.00 0.09 0.00 2.20 0.00 0.00 35.95 38.87 1xdg h PHE 277 CO 0.00 1.07 0.37 0.00 -0.60 0.00 0.00 178.31 179.15 1xdg s ALA 278 N -2.62 2.63 0.75 2.45 0.00 -1.08 -4.84 121.76 119.05 1xdg s ALA 278 Ca -0.05 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.77 1xdg s ALA 278 Cb 0.08 -3.14 0.04 0.00 0.00 0.00 0.00 23.12 20.10 1xdg s ALA 278 CO 0.82 -1.28 1.08 -1.12 0.00 0.00 0.00 175.76 175.26 1xdg s SER 279 N -3.90 4.95 0.03 0.00 0.01 -0.73 -4.94 113.70 109.13 1xdg s SER 279 Ca 0.58 1.37 0.01 0.00 1.31 0.00 0.00 55.95 59.22 1xdg s SER 279 Cb -0.14 -2.16 -0.04 0.00 0.21 0.00 0.00 66.02 63.89 1xdg s SER 279 CO 0.54 -1.68 0.09 -0.54 0.41 0.00 0.00 173.24 172.06 1xdg s LYS 280 N -5.16 3.03 0.30 12.44 1.02 -1.26 -3.38 119.74 126.74 1xdg s LYS 280 Ca 0.59 -0.55 -0.27 0.00 0.02 0.00 0.00 55.97 55.76 1xdg s LYS 280 Cb -0.14 -2.83 -0.10 0.00 -0.52 0.00 0.00 37.83 34.25 1xdg s LYS 280 CO 0.54 0.62 0.94 -1.25 -0.92 0.00 0.00 175.35 175.28 1xdg s PRO 281 N -2.01 4.65 0.37 -1.68 0.04 -1.26 -4.99 135.00 130.12 1xdg s PRO 281 Ca 0.26 1.36 0.22 0.00 0.04 0.00 0.00 61.00 62.88 1xdg s PRO 281 Cb -0.12 -2.92 1.18 0.00 0.04 0.00 0.00 34.50 32.68 1xdg s PRO 281 CO 0.18 0.34 1.63 0.00 0.04 0.00 0.00 177.00 179.19 1xdg h ALA 282 N 3.42 1.07 0.00 8.56 0.00 -1.92 -0.04 119.26 130.36 1xdg h ALA 282 Ca -0.46 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 1xdg h ALA 282 Cb 1.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1xdg h ALA 282 CO 0.66 -0.07 -0.35 0.66 0.00 0.00 0.00 179.25 180.14 1xdg h SER 283 N 0.00 0.00 0.03 0.00 4.64 -1.88 0.14 113.55 116.48 1xdg h SER 283 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1xdg h SER 283 Cb 0.20 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.23 1xdg h SER 283 CO 0.00 0.35 -2.37 -0.62 -0.87 0.00 0.00 176.83 173.32 1xdg n GLU 284 N -3.65 0.67 0.00 4.77 1.02 -0.07 -4.62 120.64 118.76 1xdg n GLU 284 Ca -0.01 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.33 1xdg n GLU 284 Cb 0.46 -1.54 0.10 0.00 -0.02 0.00 0.00 31.44 30.44 1xdg n GLU 284 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1xdg n PHE 285 N -2.98 0.00 -4.40 -0.32 3.01 -0.95 -4.86 117.46 106.96 1xdg n PHE 285 Ca -0.37 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 57.75 1xdg n PHE 285 Cb 1.09 -0.04 -0.13 0.00 -0.01 0.00 0.00 39.48 40.39 1xdg n PHE 285 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1xdg s VAL 286 N -2.53 3.70 -0.11 -4.37 1.01 0.03 -1.24 120.40 116.88 1xdg s VAL 286 Ca 0.19 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.77 1xdg s VAL 286 Cb 0.18 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.95 1xdg s VAL 286 CO 0.58 0.49 -0.18 -0.54 0.00 0.00 0.00 175.10 175.45 1xdg s LYS 287 N 0.52 2.47 -0.16 2.72 1.02 -0.17 -4.82 119.74 121.33 1xdg s LYS 287 Ca -0.04 -0.66 -0.01 0.00 0.02 0.00 0.00 55.97 55.27 1xdg s LYS 287 Cb -0.15 -2.00 -0.01 0.00 -0.52 0.00 0.00 37.83 35.15 1xdg s LYS 287 CO 0.03 0.02 -0.11 0.42 -0.92 0.00 0.00 175.35 174.79 1xdg s ILE 288 N 0.75 3.12 -0.06 2.17 -1.09 -1.26 -0.63 121.20 124.21 1xdg s ILE 288 Ca -0.11 -0.62 0.06 0.00 -2.23 0.00 0.00 60.65 57.75 1xdg s ILE 288 Cb -0.16 -2.35 -0.01 0.00 -1.58 0.00 0.00 42.46 38.36 1xdg s ILE 288 CO 0.02 0.50 -0.23 -0.76 -1.23 0.00 0.00 174.94 173.23 1xdg s LEU 289 N 0.72 2.20 0.29 2.97 1.43 -0.56 -4.99 118.68 120.74 1xdg s LEU 289 Ca -0.05 -0.45 0.16 0.00 -1.03 0.00 0.00 54.13 52.76 1xdg s LEU 289 Cb -0.15 -1.41 0.11 0.00 0.03 0.00 0.00 46.19 44.76 1xdg s LEU 289 CO 0.02 0.26 1.47 -2.24 0.23 0.00 0.00 176.35 176.08 1xdg h ASP 290 N 5.94 0.00 -4.48 2.29 3.04 -1.88 -1.57 116.42 119.77 1xdg h ASP 290 Ca -0.35 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.16 1xdg h ASP 290 Cb 1.17 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 39.31 1xdg h ASP 290 CO 0.48 0.47 -0.67 0.42 -2.04 0.00 0.00 179.24 177.90 1xdg s THR 291 N -3.00 0.71 -0.03 1.15 -4.23 -1.26 -3.68 115.64 105.31 1xdg s THR 291 Ca 0.04 -1.98 0.27 0.00 -1.18 0.00 0.00 61.69 58.84 1xdg s THR 291 Cb 0.08 -2.05 0.32 0.00 1.34 0.00 0.00 72.50 72.18 1xdg s THR 291 CO 0.74 -0.54 1.82 -0.26 -0.54 0.00 0.00 174.62 175.84 1xdg h PHE 292 N 2.73 0.00 0.00 3.99 -1.00 -1.96 -2.59 116.94 118.10 1xdg h PHE 292 Ca -0.37 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.37 1xdg h PHE 292 Cb 1.20 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.75 1xdg h PHE 292 CO 0.55 0.09 -0.20 0.93 -1.61 0.00 0.00 178.31 178.07 1xdg h GLU 293 N 0.00 0.00 0.00 1.51 3.07 -2.00 -2.52 114.58 114.65 1xdg h GLU 293 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xdg h GLU 293 Cb 0.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 1xdg h GLU 293 CO 0.01 0.20 0.00 1.63 -1.40 0.00 0.00 179.01 179.46 1xdg n LYS 294 N -3.53 0.15 -0.23 2.33 4.76 -0.98 -2.43 118.16 118.23 1xdg n LYS 294 Ca -0.01 0.17 -0.05 0.00 -2.87 0.00 0.00 58.31 55.55 1xdg n LYS 294 Cb 0.36 -1.50 0.10 0.00 -1.84 0.00 0.00 35.03 32.15 1xdg n LYS 294 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1xdg h LEU 295 N 0.00 0.99 -0.67 -0.35 3.38 -1.63 -1.85 115.31 115.18 1xdg h LEU 295 Ca 0.00 -0.18 0.08 0.00 0.09 0.00 0.00 57.88 57.87 1xdg h LEU 295 Cb 0.19 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1xdg h LEU 295 CO 0.00 0.93 0.33 0.11 0.09 0.00 0.00 178.44 179.90 1xdg h LYS 296 N 1.02 0.56 -0.99 1.13 1.79 -1.70 -0.94 116.57 117.45 1xdg h LYS 296 Ca 0.22 -0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.67 1xdg h LYS 296 Cb 0.30 -0.13 -0.05 0.00 -1.58 0.00 0.00 32.23 30.77 1xdg h LYS 296 CO -0.01 0.37 0.65 -0.44 -1.08 0.00 0.00 179.45 178.95 1xdg h ASP 297 N 0.58 1.13 -0.44 0.86 5.19 -1.59 -0.17 116.42 121.97 1xdg h ASP 297 Ca 0.32 -0.03 -0.09 0.00 -0.62 0.00 0.00 57.03 56.61 1xdg h ASP 297 Cb 0.31 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.53 1xdg h ASP 297 CO -0.25 0.81 -0.07 0.25 -3.12 0.00 0.00 179.24 176.87 1xdg h LEU 298 N 1.33 0.88 -0.67 1.55 5.85 -0.65 -1.65 115.31 121.95 1xdg h LEU 298 Ca 0.37 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.73 1xdg h LEU 298 Cb -0.14 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.63 1xdg h LEU 298 CO -0.08 0.98 -0.02 0.15 -0.34 0.00 0.00 178.44 179.12 1xdg h PHE 299 N 0.81 1.10 -0.58 1.25 3.57 -0.45 -0.87 116.94 121.76 1xdg h PHE 299 Ca 0.14 -0.19 0.02 0.00 3.53 0.00 0.00 57.97 61.47 1xdg h PHE 299 Cb 0.58 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.00 1xdg h PHE 299 CO 0.03 0.99 0.36 1.15 -2.23 0.00 0.00 178.31 178.61 1xdg h THR 300 N 0.92 1.09 -0.57 4.41 2.02 -0.70 -1.43 112.91 118.64 1xdg h THR 300 Ca 0.16 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 67.00 1xdg h THR 300 Cb 0.57 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1xdg h THR 300 CO 0.03 0.13 -0.03 -0.08 0.37 0.00 0.00 175.52 175.95 1xdg h GLU 301 N 0.72 1.02 -0.31 6.66 4.81 -1.07 -2.95 114.58 123.47 1xdg h GLU 301 Ca 0.23 -0.34 0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1xdg h GLU 301 Cb -0.01 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1xdg h GLU 301 CO -0.09 1.02 0.12 1.25 -0.73 0.00 0.00 179.01 180.58 1xdg h LEU 302 N 0.90 0.14 -1.85 1.64 5.85 -0.63 -2.56 115.31 118.80 1xdg h LEU 302 Ca 0.16 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1xdg h LEU 302 Cb 0.58 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1xdg h LEU 302 CO 0.03 0.12 0.02 1.56 -0.34 0.00 0.00 178.44 179.82 1xdg h GLN 303 N 0.26 0.11 0.00 1.25 4.20 -1.13 -0.55 115.11 119.25 1xdg h GLN 303 Ca 0.13 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1xdg h GLN 303 Cb 0.09 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1xdg h GLN 303 CO -0.13 0.11 0.00 0.87 -0.67 0.00 0.00 178.83 179.01 1xdg h LYS 304 N 0.11 0.00 -0.63 1.46 1.79 -1.29 -2.55 116.57 115.45 1xdg h LYS 304 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1xdg h LYS 304 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1xdg h LYS 304 CO -0.00 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 180.00 1xdg n LYS 305 N -2.64 3.39 -3.16 3.15 4.76 -0.21 -4.92 118.16 118.53 1xdg n LYS 305 Ca 0.01 -2.77 -0.39 0.00 -2.87 0.00 0.00 58.31 52.29 1xdg n LYS 305 Cb 0.27 -1.76 -0.06 0.00 -1.84 0.00 0.00 35.03 31.64 1xdg n LYS 305 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1xdg s ILE 306 N -1.61 5.08 0.05 -0.18 1.01 -0.96 -5.06 121.20 119.52 1xdg s ILE 306 Ca 0.48 1.17 0.01 0.00 0.00 0.00 0.00 60.65 62.31 1xdg s ILE 306 Cb 0.30 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1xdg s ILE 306 CO 0.26 0.21 -0.06 -0.31 0.00 0.00 0.00 174.94 175.03 1xdg s TYR 307 N 1.28 0.57 -0.14 3.97 2.02 -1.26 -5.10 117.35 118.70 1xdg s TYR 307 Ca 0.30 -0.63 -0.18 0.00 -0.37 0.00 0.00 57.07 56.18 1xdg s TYR 307 Cb -0.16 -0.36 -0.04 0.00 -0.40 0.00 0.00 41.96 41.00 1xdg s TYR 307 CO 0.12 -0.15 0.50 0.08 -1.57 0.00 0.00 175.55 174.52 1xdg s VAL 308 N -2.01 5.16 -0.64 0.71 1.01 -1.26 -5.26 120.40 118.11 1xdg s VAL 308 Ca -0.07 0.97 0.05 0.00 0.00 0.00 0.00 61.98 62.93 1xdg s VAL 308 Cb -0.06 -3.83 0.04 0.00 0.00 0.00 0.00 36.38 32.53 1xdg s VAL 308 CO -0.02 0.28 0.66 -0.38 0.00 0.00 0.00 175.10 175.64