#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dgq n ALA 125 N 0.00 6.49 -0.82 -5.12 0.00 -0.09 -4.66 120.51 116.31 1dgq n ALA 125 Ca 0.00 -3.80 0.00 0.00 0.00 0.00 0.00 53.44 49.64 1dgq n ALA 125 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 19.45 16.10 1dgq n ALA 125 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1dgq n SER 126 N 4.45 -1.61 -2.35 0.00 7.64 -1.20 -4.44 113.62 116.11 1dgq n SER 126 Ca 0.63 -1.13 -0.18 0.00 1.01 0.00 0.00 58.87 59.20 1dgq n SER 126 Cb 0.31 -0.48 -0.13 0.00 -1.01 0.00 0.00 64.21 62.90 1dgq n SER 126 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1dgq n LYS 127 N 3.66 2.30 0.00 1.43 3.00 0.32 -4.71 118.16 124.17 1dgq n LYS 127 Ca 0.00 -1.24 0.00 0.00 -0.00 0.00 0.00 58.31 57.07 1dgq n LYS 127 Cb 0.40 -2.17 0.00 0.00 0.00 0.00 0.00 35.03 33.26 1dgq n LYS 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dgq n GLY 128 N 2.80 0.92 1.00 3.14 0.00 -1.26 -4.92 105.19 106.87 1dgq n GLY 128 Ca 0.49 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 46.37 1dgq n GLY 128 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dgq n ASN 129 N 2.23 -0.57 -3.77 1.61 5.15 -1.26 -4.75 115.26 113.90 1dgq n ASN 129 Ca 0.00 0.30 -0.17 0.00 -0.60 0.00 0.00 54.58 54.11 1dgq n ASN 129 Cb 0.00 -0.27 -0.16 0.00 -0.53 0.00 0.00 39.78 38.81 1dgq n ASN 129 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1dgq s VAL 130 N -0.38 0.03 -0.54 3.44 1.01 -0.22 -0.44 120.40 123.31 1dgq s VAL 130 Ca 0.18 0.20 -0.16 0.00 0.00 0.00 0.00 61.98 62.21 1dgq s VAL 130 Cb -0.24 -0.18 0.13 0.00 0.00 0.00 0.00 36.38 36.09 1dgq s VAL 130 CO 0.17 0.13 0.50 -1.81 0.00 0.00 0.00 175.10 174.09 1dgq s ASP 131 N 1.26 6.18 -0.44 3.32 1.01 0.48 -0.37 116.67 128.11 1dgq s ASP 131 Ca -0.07 -1.80 -0.15 0.00 0.71 0.00 0.00 52.55 51.24 1dgq s ASP 131 Cb -0.13 -2.21 0.04 0.00 1.01 0.00 0.00 42.92 41.64 1dgq s ASP 131 CO -0.03 -0.86 0.35 -0.22 0.21 0.00 0.00 175.17 174.63 1dgq s LEU 132 N 1.59 5.32 -0.36 1.23 0.20 0.53 -0.79 118.68 126.39 1dgq s LEU 132 Ca 0.03 -1.07 -0.18 0.00 0.69 0.00 0.00 54.13 53.60 1dgq s LEU 132 Cb -0.30 -2.18 0.00 0.00 -0.43 0.00 0.00 46.19 43.28 1dgq s LEU 132 CO 0.03 -0.54 0.53 -0.69 -0.29 0.00 0.00 176.35 175.39 1dgq s VAL 133 N 1.69 4.99 -0.68 1.68 1.01 0.38 -0.52 120.40 128.95 1dgq s VAL 133 Ca 0.05 0.30 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 1dgq s VAL 133 Cb -0.21 -4.00 0.05 0.00 0.00 0.00 0.00 36.38 32.21 1dgq s VAL 133 CO 0.09 -0.27 1.13 -0.36 0.00 0.00 0.00 175.10 175.69 1dgq s PHE 134 N 2.45 2.49 -0.98 5.22 0.08 0.18 -0.58 117.98 126.84 1dgq s PHE 134 Ca 0.19 -0.18 -0.17 0.00 0.12 0.00 0.00 56.93 56.89 1dgq s PHE 134 Cb -0.15 -4.45 0.16 0.00 -0.57 0.00 0.00 43.02 38.00 1dgq s PHE 134 CO 0.14 -1.82 1.13 -1.17 -0.10 0.00 0.00 175.22 173.40 1dgq s LEU 135 N 4.93 5.35 -0.18 -0.37 2.96 0.30 -0.60 118.68 131.08 1dgq s LEU 135 Ca 0.31 -2.38 -0.07 0.00 -0.22 0.00 0.00 54.13 51.77 1dgq s LEU 135 Cb -0.11 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 1dgq s LEU 135 CO 0.15 -0.90 0.05 0.72 -1.32 0.00 0.00 176.35 175.05 1dgq s PHE 136 N 1.96 3.23 0.35 5.38 -0.71 -0.00 -0.70 117.98 127.49 1dgq s PHE 136 Ca 0.32 0.05 -0.27 0.00 -1.04 0.00 0.00 56.93 55.99 1dgq s PHE 136 Cb -0.05 -2.07 -0.09 0.00 -1.21 0.00 0.00 43.02 39.60 1dgq s PHE 136 CO -0.08 0.14 1.14 0.34 -1.34 0.00 0.00 175.22 175.43 1dgq s ASP 137 N 0.35 6.83 -0.36 1.98 2.15 0.53 -0.74 116.67 127.42 1dgq s ASP 137 Ca 0.02 2.31 0.14 0.00 0.43 0.00 0.00 52.55 55.46 1dgq s ASP 137 Cb -0.12 -2.62 0.42 0.00 -0.30 0.00 0.00 42.92 40.30 1dgq s ASP 137 CO 0.00 -0.45 0.92 0.61 -0.17 0.00 0.00 175.17 176.08 1dgq n GLY 138 N 0.79 2.78 3.85 2.66 0.00 0.85 -4.82 105.19 111.29 1dgq n GLY 138 Ca 0.02 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 1dgq n GLY 138 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dgq s SER 139 N -3.03 5.32 0.55 1.61 1.04 -1.26 -0.49 113.70 117.43 1dgq s SER 139 Ca 0.34 1.31 0.28 0.00 0.48 0.00 0.00 55.95 58.36 1dgq s SER 139 Cb 0.42 -2.15 1.45 0.00 0.10 0.00 0.00 66.02 65.83 1dgq s SER 139 CO -0.03 -1.44 1.95 0.00 0.98 0.00 0.00 173.24 174.70 1dgq h MET 140 N -0.72 0.00 -0.92 4.02 -0.00 -1.24 0.31 114.93 116.37 1dgq h MET 140 Ca -0.45 0.00 0.26 0.00 -0.00 0.00 0.00 59.70 59.51 1dgq h MET 140 Cb 1.24 0.00 -0.14 0.00 -0.00 0.00 0.00 31.60 32.70 1dgq h MET 140 CO 0.61 0.00 0.36 0.77 -0.00 0.00 0.00 176.91 178.65 1dgq h SER 141 N 0.00 0.21 -3.29 -0.10 0.02 -1.92 -3.41 113.55 105.05 1dgq h SER 141 Ca 0.29 0.19 -0.56 0.00 -0.84 0.00 0.00 61.79 60.87 1dgq h SER 141 Cb 1.22 0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.93 1dgq h SER 141 CO -0.00 -0.13 0.51 -0.76 -1.14 0.00 0.00 176.83 175.31 1dgq s LEU 142 N -10.56 4.27 0.37 5.07 1.43 0.10 -5.06 118.68 114.30 1dgq s LEU 142 Ca -0.11 1.54 -0.01 0.00 -1.03 0.00 0.00 54.13 54.52 1dgq s LEU 142 Cb 0.27 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 1dgq s LEU 142 CO 0.78 -0.40 0.60 -1.10 0.23 0.00 0.00 176.35 176.45 1dgq s GLN 143 N 1.79 3.50 0.15 1.70 -1.52 -1.26 -4.86 119.66 119.16 1dgq s GLN 143 Ca 0.48 -0.22 -0.27 0.00 -1.95 0.00 0.00 55.36 53.40 1dgq s GLN 143 Cb -0.19 -2.60 -0.00 0.00 -0.22 0.00 0.00 33.01 30.00 1dgq s GLN 143 CO 0.20 0.08 1.57 -1.35 -0.25 0.00 0.00 175.29 175.53 1dgq h PRO 144 N 0.64 -0.30 -0.85 2.91 0.11 -1.98 -0.28 132.00 132.26 1dgq h PRO 144 Ca -0.49 0.02 0.07 0.00 0.11 0.00 0.00 66.00 65.71 1dgq h PRO 144 Cb 1.22 0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.33 1dgq h PRO 144 CO 0.61 -0.20 0.52 0.38 -0.21 0.00 0.00 178.00 179.10 1dgq h ASP 145 N -0.31 0.79 -0.09 -2.05 2.03 -1.98 0.21 116.42 115.01 1dgq h ASP 145 Ca 0.14 0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 56.46 1dgq h ASP 145 Cb 0.58 -0.14 -0.00 0.00 -0.83 0.00 0.00 39.33 38.94 1dgq h ASP 145 CO -0.60 0.49 0.03 -0.33 -1.03 0.00 0.00 179.24 177.80 1dgq h GLU 146 N 0.92 0.15 -0.62 4.15 5.08 -1.62 -1.00 114.58 121.64 1dgq h GLU 146 Ca 0.38 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.67 1dgq h GLU 146 Cb 0.23 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1dgq h GLU 146 CO -0.19 0.32 0.25 0.35 -1.00 0.00 0.00 179.01 178.73 1dgq h PHE 147 N -0.05 0.93 -0.98 4.33 3.57 -0.57 -0.44 116.94 123.73 1dgq h PHE 147 Ca 0.03 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.56 1dgq h PHE 147 Cb 0.24 -0.28 -0.08 0.00 2.79 0.00 0.00 35.95 38.62 1dgq h PHE 147 CO 0.00 0.74 0.61 1.96 -2.23 0.00 0.00 178.31 179.39 1dgq h GLN 148 N 0.86 0.98 -0.54 1.11 1.08 -0.43 0.48 115.11 118.65 1dgq h GLN 148 Ca 0.21 -0.06 -0.09 0.00 -1.45 0.00 0.00 58.65 57.25 1dgq h GLN 148 Cb 0.20 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 1dgq h GLN 148 CO -0.02 0.65 -0.03 0.87 -0.95 0.00 0.00 178.83 179.35 1dgq h LYS 149 N 1.01 0.95 -0.46 1.46 1.57 -0.04 0.23 116.57 121.28 1dgq h LYS 149 Ca 0.47 -0.30 0.08 0.00 -1.87 0.00 0.00 60.65 59.02 1dgq h LYS 149 Cb 0.39 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.55 1dgq h LYS 149 CO -0.24 0.96 0.10 0.82 -0.57 0.00 0.00 179.45 180.51 1dgq h ILE 150 N 0.87 0.75 -0.15 1.86 1.08 0.15 -0.22 117.51 121.84 1dgq h ILE 150 Ca 0.15 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.56 1dgq h ILE 150 Cb 0.55 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 1dgq h ILE 150 CO 0.03 0.04 0.05 -0.07 -0.69 0.00 0.00 178.15 177.52 1dgq h LEU 151 N 0.23 0.06 -0.55 1.44 3.38 -0.43 -2.94 115.31 116.51 1dgq h LEU 151 Ca 0.23 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.31 1dgq h LEU 151 Cb 0.29 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 1dgq h LEU 151 CO -0.30 0.06 0.08 -0.78 0.09 0.00 0.00 178.44 177.60 1dgq h ASP 152 N 0.13 -0.06 0.00 -0.43 3.58 0.09 0.66 116.42 120.39 1dgq h ASP 152 Ca 0.07 0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.66 1dgq h ASP 152 Cb 0.04 0.16 -0.05 0.00 1.72 0.00 0.00 39.33 41.20 1dgq h ASP 152 CO -0.07 -0.01 -0.35 0.15 -2.88 0.00 0.00 179.24 176.08 1dgq h PHE 153 N 0.21 -0.98 0.22 0.28 3.04 -0.94 0.15 116.94 118.93 1dgq h PHE 153 Ca 0.28 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 62.26 1dgq h PHE 153 Cb 0.41 0.43 -0.01 0.00 2.56 0.00 0.00 35.95 39.34 1dgq h PHE 153 CO -0.26 -0.44 -0.15 0.52 -2.02 0.00 0.00 178.31 175.96 1dgq h MET 154 N -0.51 -0.35 -0.71 1.11 2.86 -1.19 -2.45 114.93 113.69 1dgq h MET 154 Ca 0.06 0.02 0.16 0.00 -2.06 0.00 0.00 59.70 57.88 1dgq h MET 154 Cb 0.59 0.08 -0.12 0.00 0.06 0.00 0.00 31.60 32.21 1dgq h MET 154 CO -0.28 -0.23 0.01 -0.22 1.06 0.00 0.00 176.91 177.25 1dgq h LYS 155 N -0.36 0.11 -0.40 1.72 3.11 -0.68 -0.71 116.57 119.36 1dgq h LYS 155 Ca -0.02 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.82 1dgq h LYS 155 Cb 0.31 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.49 1dgq h LYS 155 CO 0.01 0.08 0.26 0.22 -2.81 0.00 0.00 179.45 177.21 1dgq h ASP 156 N 0.12 0.46 0.14 4.20 1.82 -0.23 0.11 116.42 123.04 1dgq h ASP 156 Ca 0.38 -0.02 0.01 0.00 -0.39 0.00 0.00 57.03 57.02 1dgq h ASP 156 Cb 0.66 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 40.54 1dgq h ASP 156 CO -0.61 0.34 -0.17 0.58 -1.61 0.00 0.00 179.24 177.77 1dgq h VAL 157 N 0.54 0.62 -0.73 2.25 2.07 -1.03 -2.54 116.25 117.42 1dgq h VAL 157 Ca 0.15 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.75 1dgq h VAL 157 Cb -0.06 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 30.27 1dgq h VAL 157 CO -0.03 0.00 0.40 0.24 0.02 0.00 0.00 177.57 178.20 1dgq h MET 158 N -0.35 0.68 0.39 1.57 2.86 -0.49 -0.08 114.93 119.50 1dgq h MET 158 Ca 0.01 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1dgq h MET 158 Cb 0.35 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1dgq h MET 158 CO -0.06 0.45 -0.43 0.87 1.06 0.00 0.00 176.91 178.80 1dgq h LYS 159 N 0.70 -0.81 -0.12 1.72 1.79 -0.67 -2.02 116.57 117.16 1dgq h LYS 159 Ca 0.35 0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.76 1dgq h LYS 159 Cb 0.29 0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1dgq h LYS 159 CO -0.23 -0.54 -0.41 0.87 -1.08 0.00 0.00 179.45 178.06 1dgq h LYS 160 N -0.84 0.27 -0.92 3.15 1.57 -0.99 -2.69 116.57 116.12 1dgq h LYS 160 Ca -0.03 -0.13 -0.61 0.00 -1.87 0.00 0.00 60.65 58.01 1dgq h LYS 160 Cb 0.76 -0.00 -0.30 0.00 0.08 0.00 0.00 32.23 32.77 1dgq h LYS 160 CO -0.09 0.65 0.53 1.28 -0.57 0.00 0.00 179.45 181.25 1dgq n LEU 161 N -4.02 6.94 -4.69 2.94 4.77 -0.10 -5.00 117.00 117.85 1dgq n LEU 161 Ca -0.02 -4.24 -0.55 0.00 -0.03 0.00 0.00 56.01 51.17 1dgq n LEU 161 Cb 0.49 -0.84 -0.07 0.00 -2.33 0.00 0.00 43.42 40.67 1dgq n LEU 161 CO 0.42 1.50 1.40 -1.20 -1.33 0.00 0.00 177.39 178.18 1dgq n SER 162 N -0.93 2.57 0.00 -1.43 7.64 -0.76 -3.77 113.62 116.94 1dgq n SER 162 Ca 0.58 1.01 0.00 0.00 1.01 0.00 0.00 58.87 61.47 1dgq n SER 162 Cb 0.87 -1.19 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1dgq n SER 162 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1dgq n ASN 163 N 5.97 0.00 -1.87 6.43 5.15 -1.26 -4.83 115.26 124.84 1dgq n ASN 163 Ca 0.27 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 1dgq n ASN 163 Cb 0.16 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.41 1dgq n ASN 163 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1dgq n THR 164 N 0.00 0.00 -3.65 -0.44 -1.04 -1.25 -0.39 114.28 107.52 1dgq n THR 164 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 1dgq n THR 164 Cb 0.00 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1dgq n THR 164 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1dgq n SER 165 N -0.95 -3.94 -4.07 8.00 7.64 -1.26 -4.92 113.62 114.12 1dgq n SER 165 Ca 0.00 -0.60 -0.34 0.00 1.01 0.00 0.00 58.87 58.94 1dgq n SER 165 Cb 0.34 -3.22 -0.13 0.00 -1.01 0.00 0.00 64.21 60.19 1dgq n SER 165 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1dgq s TYR 166 N -3.08 3.61 -0.49 1.43 2.02 0.48 -1.05 117.35 120.26 1dgq s TYR 166 Ca 0.53 -2.73 -0.26 0.00 -0.37 0.00 0.00 57.07 54.25 1dgq s TYR 166 Cb -0.28 -3.08 0.03 0.00 -0.40 0.00 0.00 41.96 38.23 1dgq s TYR 166 CO 0.65 -0.93 0.96 -0.65 -1.57 0.00 0.00 175.55 174.01 1dgq s GLN 167 N 0.82 3.49 0.33 -0.62 1.11 0.50 -4.65 119.66 120.64 1dgq s GLN 167 Ca 0.11 0.09 -0.07 0.00 0.01 0.00 0.00 55.36 55.50 1dgq s GLN 167 Cb -0.21 -3.96 -0.06 0.00 -1.01 0.00 0.00 33.01 27.77 1dgq s GLN 167 CO -0.05 -1.33 0.64 -0.06 0.01 0.00 0.00 175.29 174.50 1dgq s PHE 168 N 3.93 3.47 0.05 0.91 0.08 -1.26 -0.35 117.98 124.81 1dgq s PHE 168 Ca 0.37 0.80 -0.03 0.00 0.12 0.00 0.00 56.93 58.18 1dgq s PHE 168 Cb -0.10 -2.24 -0.02 0.00 -0.57 0.00 0.00 43.02 40.09 1dgq s PHE 168 CO 0.25 0.07 0.04 0.00 -0.10 0.00 0.00 175.22 175.48 1dgq s ALA 169 N -2.19 0.19 -0.02 5.36 0.00 0.32 -3.58 121.76 121.84 1dgq s ALA 169 Ca 0.47 -0.87 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 1dgq s ALA 169 Cb -0.11 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.32 1dgq s ALA 169 CO 0.30 -0.36 0.04 0.00 0.00 0.00 0.00 175.76 175.74 1dgq s ALA 170 N -3.32 -0.02 -0.22 0.00 0.00 0.14 -0.65 121.76 117.68 1dgq s ALA 170 Ca 0.01 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.24 1dgq s ALA 170 Cb 0.03 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 23.01 1dgq s ALA 170 CO -0.08 -0.07 -0.14 0.08 0.00 0.00 0.00 175.76 175.55 1dgq s VAL 171 N 0.61 2.08 0.29 0.00 1.01 0.23 -0.23 120.40 124.40 1dgq s VAL 171 Ca -0.05 -1.31 -0.29 0.00 0.00 0.00 0.00 61.98 60.33 1dgq s VAL 171 Cb -0.07 -2.07 -0.09 0.00 0.00 0.00 0.00 36.38 34.15 1dgq s VAL 171 CO -0.02 0.21 1.08 -1.58 0.00 0.00 0.00 175.10 174.79 1dgq s GLN 172 N 1.20 4.61 0.06 2.72 0.74 0.29 -0.82 119.66 128.45 1dgq s GLN 172 Ca -0.03 1.74 0.02 0.00 0.05 0.00 0.00 55.36 57.14 1dgq s GLN 172 Cb -0.17 -3.12 -0.03 0.00 1.10 0.00 0.00 33.01 30.79 1dgq s GLN 172 CO -0.08 0.20 -0.08 -0.59 -0.55 0.00 0.00 175.29 174.19 1dgq s PHE 173 N -1.22 0.78 0.00 1.67 -0.71 0.08 -0.18 117.98 118.40 1dgq s PHE 173 Ca 0.46 -0.64 0.00 0.00 -1.04 0.00 0.00 56.93 55.71 1dgq s PHE 173 Cb -0.30 -0.46 0.00 0.00 -1.21 0.00 0.00 43.02 41.05 1dgq s PHE 173 CO 0.39 -0.10 0.00 0.45 -1.34 0.00 0.00 175.22 174.62 1dgq n SER 174 N 0.94 0.00 -0.35 1.98 2.88 -1.26 -0.11 113.62 117.70 1dgq n SER 174 Ca -0.19 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.45 1dgq n SER 174 Cb 0.57 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 64.30 1dgq n SER 174 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1dgq h THR 175 N 0.00 0.79 -2.57 2.46 2.02 -1.80 0.17 112.91 113.98 1dgq h THR 175 Ca 0.00 -0.28 -0.59 0.00 0.77 0.00 0.00 66.41 66.30 1dgq h THR 175 Cb 0.00 -0.11 -0.12 0.00 -1.74 0.00 0.00 68.15 66.19 1dgq h THR 175 CO 0.00 0.15 -0.69 -0.44 0.37 0.00 0.00 175.52 174.91 1dgq s SER 176 N -5.52 4.36 0.21 4.18 0.01 -1.26 -4.50 113.70 111.19 1dgq s SER 176 Ca -0.12 -0.63 -0.08 0.00 1.31 0.00 0.00 55.95 56.43 1dgq s SER 176 Cb 0.23 -0.76 -0.06 0.00 0.21 0.00 0.00 66.02 65.64 1dgq s SER 176 CO 0.80 0.05 0.50 -0.72 0.41 0.00 0.00 173.24 174.29 1dgq s TYR 177 N -2.05 3.44 -0.25 2.43 -0.85 -1.26 -4.41 117.35 114.41 1dgq s TYR 177 Ca 0.28 0.76 -0.02 0.00 -0.52 0.00 0.00 57.07 57.57 1dgq s TYR 177 Cb -0.07 -2.17 0.12 0.00 0.38 0.00 0.00 41.96 40.22 1dgq s TYR 177 CO 0.17 0.30 0.29 0.21 -1.52 0.00 0.00 175.55 175.00 1dgq s LYS 178 N -2.88 0.28 -0.28 -3.49 2.20 0.75 -4.98 119.74 111.35 1dgq s LYS 178 Ca 0.45 0.14 -0.29 0.00 -0.36 0.00 0.00 55.97 55.91 1dgq s LYS 178 Cb -0.11 -0.82 -0.06 0.00 -1.51 0.00 0.00 37.83 35.32 1dgq s LYS 178 CO 0.23 -0.81 2.25 2.41 -0.36 0.00 0.00 175.35 179.07 1dgq n THR 179 N 5.33 0.27 -0.02 3.43 -1.04 -1.26 -0.55 114.28 120.43 1dgq n THR 179 Ca -0.04 -0.47 -0.16 0.00 -2.04 0.00 0.00 64.05 61.34 1dgq n THR 179 Cb 0.48 -2.44 -0.10 0.00 -1.82 0.00 0.00 70.33 66.46 1dgq n THR 179 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1dgq h GLU 180 N 15.17 0.43 -2.23 -2.82 4.39 -0.95 -3.48 114.58 125.11 1dgq h GLU 180 Ca -0.37 -0.38 -0.04 0.00 0.34 0.00 0.00 59.36 58.91 1dgq h GLU 180 Cb 1.26 0.09 -0.17 0.00 -0.10 0.00 0.00 28.75 29.82 1dgq h GLU 180 CO 0.99 1.03 0.21 -0.59 -1.16 0.00 0.00 179.01 179.50 1dgq s PHE 181 N -3.50 -0.62 0.50 4.33 -0.12 -0.83 -4.90 117.98 112.83 1dgq s PHE 181 Ca -0.13 0.91 0.05 0.00 -0.05 0.00 0.00 56.93 57.71 1dgq s PHE 181 Cb 0.04 0.45 0.05 0.00 -0.63 0.00 0.00 43.02 42.93 1dgq s PHE 181 CO 0.81 -0.66 0.39 -0.40 -0.05 0.00 0.00 175.22 175.32 1dgq n ASP 182 N 0.58 2.56 0.01 1.98 5.68 -1.26 -0.69 116.55 125.42 1dgq n ASP 182 Ca -0.18 -2.70 -0.10 0.00 -0.50 0.00 0.00 54.79 51.31 1dgq n ASP 182 Cb 0.59 -0.06 -0.04 0.00 -1.14 0.00 0.00 41.12 40.47 1dgq n ASP 182 CO 0.00 0.00 0.00 -0.26 -1.33 0.00 0.00 177.20 175.61 1dgq h PHE 183 N 0.62 -0.23 -0.65 2.11 0.04 -1.54 -0.82 116.94 116.48 1dgq h PHE 183 Ca -0.31 0.01 0.10 0.00 2.80 0.00 0.00 57.97 60.57 1dgq h PHE 183 Cb 1.16 0.12 -0.07 0.00 2.20 0.00 0.00 35.95 39.35 1dgq h PHE 183 CO 0.00 -0.14 0.26 0.77 -0.60 0.00 0.00 178.31 178.60 1dgq h SER 184 N -0.12 0.29 0.18 2.17 0.02 -1.23 0.23 113.55 115.09 1dgq h SER 184 Ca 0.07 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1dgq h SER 184 Cb 0.21 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1dgq h SER 184 CO -0.16 0.16 -0.21 0.44 -1.14 0.00 0.00 176.83 175.92 1dgq h ASP 185 N 0.46 -0.57 -0.30 3.07 3.32 -1.70 0.19 116.42 120.89 1dgq h ASP 185 Ca 0.33 0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.48 1dgq h ASP 185 Cb 0.40 0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.11 1dgq h ASP 185 CO -0.31 -0.30 0.02 0.22 -1.72 0.00 0.00 179.24 177.15 1dgq h TYR 186 N -0.43 0.03 -0.94 4.55 3.20 -0.54 0.40 116.97 123.23 1dgq h TYR 186 Ca 0.01 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.96 1dgq h TYR 186 Cb 0.42 0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.66 1dgq h TYR 186 CO -0.17 -0.02 0.60 0.28 -1.64 0.00 0.00 178.16 177.21 1dgq h VAL 187 N 0.12 1.06 0.61 1.81 2.07 -0.18 0.46 116.25 122.21 1dgq h VAL 187 Ca 0.14 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 1dgq h VAL 187 Cb 0.18 -0.12 0.01 0.00 -1.52 0.00 0.00 31.29 29.83 1dgq h VAL 187 CO -0.22 0.20 -0.29 0.50 0.02 0.00 0.00 177.57 177.78 1dgq h LYS 188 N 1.09 -0.79 0.14 1.57 3.64 -0.05 -3.39 116.57 118.77 1dgq h LYS 188 Ca 0.41 0.05 -0.35 0.00 -1.27 0.00 0.00 60.65 59.49 1dgq h LYS 188 Cb 0.17 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1dgq h LYS 188 CO -0.18 -0.49 -1.87 -1.49 -2.27 0.00 0.00 179.45 173.16 1dgq h TRP 189 N -1.16 0.52 0.00 1.91 4.06 -0.75 -3.48 115.95 117.05 1dgq h TRP 189 Ca -0.08 -0.38 0.00 0.00 2.06 0.00 0.00 58.89 60.48 1dgq h TRP 189 Cb 0.66 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.80 1dgq h TRP 189 CO 0.00 1.67 0.00 1.63 -3.56 0.00 0.00 178.44 178.18 1dgq n LYS 190 N -3.48 -0.01 -3.64 0.49 4.76 0.16 -4.93 118.16 111.49 1dgq n LYS 190 Ca -0.27 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 54.77 1dgq n LYS 190 Cb 1.06 -4.48 -0.11 0.00 -1.84 0.00 0.00 35.03 29.66 1dgq n LYS 190 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1dgq s ASP 191 N -2.01 5.61 0.21 4.39 -1.08 -1.26 -4.93 116.67 117.60 1dgq s ASP 191 Ca 0.00 -1.06 -0.10 0.00 -0.52 0.00 0.00 52.55 50.87 1dgq s ASP 191 Cb 0.00 -1.98 0.16 0.00 -1.46 0.00 0.00 42.92 39.64 1dgq s ASP 191 CO 0.00 -0.38 1.86 1.55 0.52 0.00 0.00 175.17 178.72 1dgq h PRO 192 N 8.37 1.04 -0.16 4.34 0.13 -1.93 -1.00 132.00 142.78 1dgq h PRO 192 Ca -0.25 -0.09 0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1dgq h PRO 192 Cb 1.10 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 1dgq h PRO 192 CO 0.65 0.73 0.01 0.22 -0.23 0.00 0.00 178.00 179.38 1dgq h ASP 193 N 1.05 -0.04 -0.33 1.44 3.58 -1.97 0.24 116.42 120.40 1dgq h ASP 193 Ca 0.28 0.03 0.03 0.00 0.42 0.00 0.00 57.03 57.80 1dgq h ASP 193 Cb -0.05 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1dgq h ASP 193 CO -0.05 0.00 0.12 0.00 -2.88 0.00 0.00 179.24 176.43 1dgq h ALA 194 N 1.13 0.39 -0.62 -0.78 0.00 -1.84 0.17 119.26 117.71 1dgq h ALA 194 Ca 0.08 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1dgq h ALA 194 Cb 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1dgq h ALA 194 CO -0.12 -0.27 0.19 -0.07 0.00 0.00 0.00 179.25 178.98 1dgq h LEU 195 N 0.27 0.87 0.00 0.00 3.38 -0.84 -3.17 115.31 115.83 1dgq h LEU 195 Ca 0.15 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1dgq h LEU 195 Cb 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1dgq h LEU 195 CO -0.14 0.82 -0.72 0.18 0.09 0.00 0.00 178.44 178.67 1dgq n LEU 196 N -4.28 0.66 0.25 1.67 4.77 0.83 -3.94 117.00 116.97 1dgq n LEU 196 Ca 0.05 0.16 0.18 0.00 -0.03 0.00 0.00 56.01 56.37 1dgq n LEU 196 Cb 0.21 -0.17 0.88 0.00 -2.33 0.00 0.00 43.42 42.02 1dgq n LEU 196 CO 0.40 -0.02 1.15 0.11 -1.33 0.00 0.00 177.39 177.70 1dgq h LYS 197 N 0.00 0.00 0.00 3.23 1.57 -0.65 0.30 116.57 121.02 1dgq h LYS 197 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1dgq h LYS 197 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1dgq h LYS 197 CO 0.00 0.00 0.00 1.25 -0.57 0.00 0.00 179.45 180.13 1dgq h HIS 198 N 0.00 0.00 -0.69 -1.35 2.76 -1.76 -3.42 115.15 110.68 1dgq h HIS 198 Ca 0.06 0.00 -0.36 0.00 -2.20 0.00 0.00 60.37 57.88 1dgq h HIS 198 Cb 0.52 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.42 1dgq h HIS 198 CO 0.00 0.00 0.98 0.08 -1.30 0.00 0.00 177.93 177.69 1dgq s VAL 199 N -3.65 3.56 -0.39 5.26 1.01 0.09 -4.91 120.40 121.37 1dgq s VAL 199 Ca -0.01 -0.65 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1dgq s VAL 199 Cb 0.09 -4.34 0.01 0.00 0.00 0.00 0.00 36.38 32.14 1dgq s VAL 199 CO 0.35 -1.12 0.79 -0.54 0.00 0.00 0.00 175.10 174.58 1dgq s LYS 200 N 6.50 3.66 -0.04 2.72 1.02 -1.26 -5.01 119.74 127.34 1dgq s LYS 200 Ca 0.66 0.21 -0.30 0.00 0.02 0.00 0.00 55.97 56.56 1dgq s LYS 200 Cb -0.04 -3.84 -0.06 0.00 -0.52 0.00 0.00 37.83 33.36 1dgq s LYS 200 CO 0.03 -0.93 1.76 -1.58 -0.92 0.00 0.00 175.35 173.71 1dgq s HIS 201 N 3.17 1.75 0.01 3.18 2.46 -1.26 -4.92 115.29 119.66 1dgq s HIS 201 Ca 0.31 0.01 -0.25 0.00 0.47 0.00 0.00 55.06 55.60 1dgq s HIS 201 Cb -0.13 -4.02 -0.19 0.00 -0.13 0.00 0.00 32.58 28.11 1dgq s HIS 201 CO 0.19 -4.36 1.36 0.52 -2.47 0.00 0.00 174.74 169.97 1dgq h MET 202 N 10.03 -0.06 -5.27 2.88 2.86 -1.95 -3.48 114.93 119.94 1dgq h MET 202 Ca -0.42 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 56.95 1dgq h MET 202 Cb 1.20 0.01 0.16 0.00 0.06 0.00 0.00 31.60 33.03 1dgq h MET 202 CO 0.95 0.30 -0.73 1.28 1.06 0.00 0.00 176.91 179.78 1dgq n LEU 203 N -4.94 -4.37 0.00 1.22 4.77 0.35 -4.92 117.00 109.11 1dgq n LEU 203 Ca -0.08 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1dgq n LEU 203 Cb 0.21 -2.91 0.00 0.00 -2.33 0.00 0.00 43.42 38.39 1dgq n LEU 203 CO 0.33 0.25 0.00 0.18 -1.33 0.00 0.00 177.39 176.82 1dgq n LEU 204 N -3.55 0.00 0.00 2.23 4.77 -1.25 -3.96 117.00 115.24 1dgq n LEU 204 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1dgq n LEU 204 Cb 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1dgq n LEU 204 CO 0.54 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.78 1dgq n LEU 205 N 0.00 0.00 -3.34 2.23 4.77 -1.26 -1.10 117.00 118.30 1dgq n LEU 205 Ca 0.00 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 1dgq n LEU 205 Cb 0.00 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.00 1dgq n LEU 205 CO 0.00 0.00 -0.25 -0.89 -1.33 0.00 0.00 177.39 174.92 1dgq s THR 206 N 0.76 0.04 -1.37 -5.08 2.01 -1.25 -2.77 115.64 107.98 1dgq s THR 206 Ca 0.00 -1.99 -0.08 0.00 0.31 0.00 0.00 61.69 59.92 1dgq s THR 206 Cb 0.00 -0.99 0.10 0.00 0.01 0.00 0.00 72.50 71.61 1dgq s THR 206 CO 0.00 -0.95 2.27 -3.20 -0.69 0.00 0.00 174.62 172.05 1dgq n ASN 207 N 3.35 6.61 -0.05 3.53 2.85 0.60 -0.55 115.26 131.60 1dgq n ASN 207 Ca 0.22 -3.01 -0.11 0.00 -0.11 0.00 0.00 54.58 51.56 1dgq n ASN 207 Cb 0.46 -1.47 -0.05 0.00 1.24 0.00 0.00 39.78 39.96 1dgq n ASN 207 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1dgq h THR 208 N 3.23 1.19 0.32 -0.44 2.02 -1.86 0.30 112.91 117.66 1dgq h THR 208 Ca 0.60 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1dgq h THR 208 Cb 0.46 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 1dgq h THR 208 CO 1.63 0.19 -0.52 -0.26 0.37 0.00 0.00 175.52 176.92 1dgq h PHE 209 N 0.10 -1.48 -0.95 3.16 0.04 -1.85 0.19 116.94 116.16 1dgq h PHE 209 Ca 0.06 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.86 1dgq h PHE 209 Cb 0.24 0.60 -0.05 0.00 2.20 0.00 0.00 35.95 38.95 1dgq h PHE 209 CO 0.00 -0.64 0.62 0.78 -0.60 0.00 0.00 178.31 178.47 1dgq h GLY 210 N -0.89 1.34 1.18 -1.45 0.00 -1.78 -0.79 103.07 100.68 1dgq h GLY 210 Ca -0.04 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 46.68 1dgq h GLY 210 CO -0.17 0.50 -0.05 0.00 0.00 0.00 0.00 176.54 176.82 1dgq h ALA 211 N 1.39 0.88 -0.02 3.60 0.00 -0.57 0.11 119.26 124.64 1dgq h ALA 211 Ca 0.35 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1dgq h ALA 211 Cb -0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1dgq h ALA 211 CO -0.07 0.65 0.01 0.82 0.00 0.00 0.00 179.25 180.66 1dgq h ILE 212 N 0.88 1.04 -0.24 0.00 2.04 -0.00 0.49 117.51 121.72 1dgq h ILE 212 Ca 0.15 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.96 1dgq h ILE 212 Cb 0.59 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.68 1dgq h ILE 212 CO 0.04 0.03 -0.12 0.78 0.00 0.00 0.00 178.15 178.88 1dgq h ASN 213 N -0.01 -0.40 -0.13 1.72 2.35 -0.87 -0.22 115.58 118.01 1dgq h ASN 213 Ca 0.01 0.10 0.05 0.00 -0.55 0.00 0.00 56.30 55.90 1dgq h ASN 213 Cb 0.04 0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.57 1dgq h ASN 213 CO -0.00 -0.15 -0.30 0.22 -1.65 0.00 0.00 177.43 175.54 1dgq h TYR 214 N -0.09 -0.83 0.26 1.19 3.20 -0.55 -2.46 116.97 117.68 1dgq h TYR 214 Ca 0.13 0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.04 1dgq h TYR 214 Cb 0.28 0.39 -0.03 0.00 1.54 0.00 0.00 36.73 38.91 1dgq h TYR 214 CO -0.29 -0.38 -0.32 0.28 -1.64 0.00 0.00 178.16 175.81 1dgq h VAL 215 N -0.37 0.34 -0.81 1.81 2.07 -0.49 0.26 116.25 119.05 1dgq h VAL 215 Ca 0.10 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.81 1dgq h VAL 215 Cb 0.53 0.34 -0.14 0.00 -1.52 0.00 0.00 31.29 30.49 1dgq h VAL 215 CO -0.35 0.00 0.05 0.00 0.02 0.00 0.00 177.57 177.30 1dgq h ALA 216 N -0.05 0.92 0.02 1.67 0.00 -0.84 -0.59 119.26 120.39 1dgq h ALA 216 Ca -0.00 0.25 -0.39 0.00 0.00 0.00 0.00 54.91 54.76 1dgq h ALA 216 Cb 0.59 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1dgq h ALA 216 CO -0.10 -0.44 -2.37 0.25 0.00 0.00 0.00 179.25 176.59 1dgq n THR 217 N -5.34 1.54 -0.10 0.00 -2.24 -0.94 -4.36 114.28 102.84 1dgq n THR 217 Ca 0.16 -0.53 -0.23 0.00 -2.27 0.00 0.00 64.05 61.18 1dgq n THR 217 Cb 0.54 -1.58 -0.12 0.00 -2.10 0.00 0.00 70.33 67.08 1dgq n THR 217 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1dgq n GLU 218 N -3.52 0.64 -0.02 -0.78 -0.58 0.89 -4.63 120.64 112.64 1dgq n GLU 218 Ca -0.45 0.27 -0.17 0.00 -0.42 0.00 0.00 57.16 56.39 1dgq n GLU 218 Cb 0.97 -1.58 -0.14 0.00 -0.57 0.00 0.00 31.44 30.12 1dgq n GLU 218 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1dgq h VAL 219 N -0.45 1.56 -0.18 2.62 2.07 -1.27 -3.38 116.25 117.22 1dgq h VAL 219 Ca -0.56 -2.41 -0.58 0.00 0.82 0.00 0.00 66.70 63.97 1dgq h VAL 219 Cb 1.75 3.18 0.01 0.00 -1.52 0.00 0.00 31.29 34.70 1dgq h VAL 219 CO -0.18 0.64 2.08 0.49 0.02 0.00 0.00 177.57 180.61 1dgq n PHE 220 N -4.36 2.47 -4.25 1.57 3.72 -0.30 -4.77 117.46 111.55 1dgq n PHE 220 Ca -0.14 -1.92 -0.17 0.00 -0.05 0.00 0.00 57.45 55.16 1dgq n PHE 220 Cb 0.66 -2.10 -0.14 0.00 -0.94 0.00 0.00 39.48 36.96 1dgq n PHE 220 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1dgq s ARG 221 N 5.12 0.60 0.26 -1.08 0.52 -1.26 -4.82 118.95 118.29 1dgq s ARG 221 Ca 0.59 -0.35 -0.02 0.00 -0.52 0.00 0.00 55.73 55.42 1dgq s ARG 221 Cb 0.10 -0.56 0.48 0.00 0.52 0.00 0.00 34.95 35.49 1dgq s ARG 221 CO 0.10 0.15 1.79 0.93 0.02 0.00 0.00 175.30 178.29 1dgq h GLU 222 N 5.71 0.73 -0.79 3.54 3.07 -1.89 0.03 114.58 124.98 1dgq h GLU 222 Ca -0.31 -0.04 0.14 0.00 -0.50 0.00 0.00 59.36 58.65 1dgq h GLU 222 Cb 1.19 -0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.88 1dgq h GLU 222 CO 0.48 0.48 0.52 1.05 -1.40 0.00 0.00 179.01 180.15 1dgq h GLU 223 N 0.75 0.50 -0.43 2.33 4.11 -1.96 0.20 114.58 120.08 1dgq h GLU 223 Ca 0.44 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1dgq h GLU 223 Cb 0.50 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1dgq h GLU 223 CO -0.30 0.33 0.00 1.28 0.07 0.00 0.00 179.01 180.39 1dgq n LEU 224 N -4.50 2.47 0.00 3.06 4.77 -0.15 -4.91 117.00 117.73 1dgq n LEU 224 Ca 0.15 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 1dgq n LEU 224 Cb 0.49 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1dgq n LEU 224 CO 0.32 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.59 1dgq n GLY 225 N 1.25 0.87 3.55 -0.72 0.00 0.69 -0.82 105.19 110.02 1dgq n GLY 225 Ca 0.16 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1dgq n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dgq s ALA 226 N -2.00 2.37 0.07 4.61 0.00 -0.34 -4.62 121.76 121.85 1dgq s ALA 226 Ca 0.00 -1.02 -0.31 0.00 0.00 0.00 0.00 51.96 50.63 1dgq s ALA 226 Cb 0.00 -4.31 -0.08 0.00 0.00 0.00 0.00 23.12 18.73 1dgq s ALA 226 CO 0.00 -3.73 1.63 1.03 0.00 0.00 0.00 175.76 174.69 1dgq s ARG 227 N 6.50 4.20 0.53 0.00 0.52 -1.26 -3.85 118.95 125.58 1dgq s ARG 227 Ca 0.55 2.30 0.31 0.00 -0.52 0.00 0.00 55.73 58.37 1dgq s ARG 227 Cb -0.10 -3.58 1.41 0.00 0.52 0.00 0.00 34.95 33.19 1dgq s ARG 227 CO 0.16 -0.72 2.02 -1.00 0.02 0.00 0.00 175.30 175.78 1dgq h PRO 228 N 8.24 0.00 -0.02 3.54 0.13 -1.97 -0.24 132.00 141.67 1dgq h PRO 228 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1dgq h PRO 228 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1dgq h PRO 228 CO 0.93 0.10 0.00 -0.40 -0.23 0.00 0.00 178.00 178.39 1dgq n ASP 229 N -3.34 1.11 -4.85 1.44 5.75 -1.26 -0.10 116.55 115.30 1dgq n ASP 229 Ca -0.01 -1.39 -0.37 0.00 -0.01 0.00 0.00 54.79 53.02 1dgq n ASP 229 Cb 0.29 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.31 1dgq n ASP 229 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dgq s ALA 230 N -1.99 3.68 0.15 2.12 0.00 -0.10 -0.52 121.76 125.10 1dgq s ALA 230 Ca 0.40 -0.23 -0.31 0.00 0.00 0.00 0.00 51.96 51.81 1dgq s ALA 230 Cb 0.21 -2.39 -0.11 0.00 0.00 0.00 0.00 23.12 20.83 1dgq s ALA 230 CO 0.34 0.50 1.76 0.99 0.00 0.00 0.00 175.76 179.34 1dgq s THR 231 N -1.24 2.43 -1.40 0.00 2.01 0.42 -0.48 115.64 117.38 1dgq s THR 231 Ca 0.29 0.12 -0.16 0.00 0.31 0.00 0.00 61.69 62.25 1dgq s THR 231 Cb -0.16 -3.08 0.05 0.00 0.01 0.00 0.00 72.50 69.33 1dgq s THR 231 CO 0.16 0.00 2.04 0.29 -0.69 0.00 0.00 174.62 176.43 1dgq n LYS 232 N 4.98 2.98 -3.19 4.92 4.76 -1.26 -0.38 118.16 130.97 1dgq n LYS 232 Ca 0.17 -2.86 -0.40 0.00 -2.87 0.00 0.00 58.31 52.35 1dgq n LYS 232 Cb 0.37 -3.37 -0.07 0.00 -1.84 0.00 0.00 35.03 30.13 1dgq n LYS 232 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1dgq s VAL 233 N 3.61 5.04 -0.38 -0.18 1.01 0.03 -0.71 120.40 128.82 1dgq s VAL 233 Ca 0.50 1.00 -0.02 0.00 0.00 0.00 0.00 61.98 63.45 1dgq s VAL 233 Cb 0.10 -3.87 0.09 0.00 0.00 0.00 0.00 36.38 32.70 1dgq s VAL 233 CO -0.02 0.08 0.15 -0.22 0.00 0.00 0.00 175.10 175.08 1dgq s LEU 234 N 2.26 4.91 -0.56 3.92 2.96 0.44 -0.47 118.68 132.15 1dgq s LEU 234 Ca 0.24 -1.84 -0.19 0.00 -0.22 0.00 0.00 54.13 52.12 1dgq s LEU 234 Cb -0.16 -1.80 0.09 0.00 0.50 0.00 0.00 46.19 44.83 1dgq s LEU 234 CO 0.09 -0.47 0.65 -0.63 -1.32 0.00 0.00 176.35 174.67 1dgq s ILE 235 N 1.16 4.89 -0.21 6.68 1.01 0.26 -0.61 121.20 134.38 1dgq s ILE 235 Ca 0.05 -0.90 -0.28 0.00 0.00 0.00 0.00 60.65 59.53 1dgq s ILE 235 Cb -0.22 -4.40 0.00 0.00 0.01 0.00 0.00 42.46 37.85 1dgq s ILE 235 CO -0.03 -0.98 0.96 -0.63 0.00 0.00 0.00 174.94 174.26 1dgq s ILE 236 N 2.52 4.75 -0.27 2.92 1.09 0.51 -0.54 121.20 132.19 1dgq s ILE 236 Ca 0.11 1.88 -0.06 0.00 -1.10 0.00 0.00 60.65 61.48 1dgq s ILE 236 Cb -0.23 -4.25 -0.00 0.00 -1.06 0.00 0.00 42.46 36.92 1dgq s ILE 236 CO 0.08 -0.10 0.05 -0.63 -0.10 0.00 0.00 174.94 174.23 1dgq s ILE 237 N 2.82 3.87 -0.04 2.92 1.01 0.12 -0.63 121.20 131.28 1dgq s ILE 237 Ca 0.42 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.41 1dgq s ILE 237 Cb -0.16 -2.91 0.02 0.00 0.01 0.00 0.00 42.46 39.42 1dgq s ILE 237 CO 0.09 0.21 0.24 0.28 0.00 0.00 0.00 174.94 175.76 1dgq s THR 238 N 1.51 0.05 -0.88 2.92 -1.32 -0.27 -0.35 115.64 117.29 1dgq s THR 238 Ca 0.04 -0.37 0.21 0.00 -1.21 0.00 0.00 61.69 60.36 1dgq s THR 238 Cb -0.16 -0.47 -0.24 0.00 -1.51 0.00 0.00 72.50 70.12 1dgq s THR 238 CO 0.01 -0.21 0.85 -0.90 -2.21 0.00 0.00 174.62 172.17 1dgq n ASP 239 N 1.92 0.88 -4.29 8.08 5.75 -1.26 -0.67 116.55 126.96 1dgq n ASP 239 Ca -0.19 -0.88 -0.24 0.00 -0.01 0.00 0.00 54.79 53.47 1dgq n ASP 239 Cb 0.57 1.12 -0.12 0.00 -1.03 0.00 0.00 41.12 41.65 1dgq n ASP 239 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1dgq s GLY 240 N -3.17 1.24 0.82 6.12 0.00 -1.26 -2.86 107.32 108.21 1dgq s GLY 240 Ca 0.06 -1.25 -0.13 0.00 0.00 0.00 0.00 44.72 43.40 1dgq s GLY 240 CO 0.87 -1.26 1.06 1.18 0.00 0.00 0.00 173.10 174.95 1dgq n GLU 241 N 1.06 0.09 -2.39 2.90 4.71 -1.26 -4.88 120.64 120.87 1dgq n GLU 241 Ca -0.19 0.10 -0.37 0.00 -0.01 0.00 0.00 57.16 56.69 1dgq n GLU 241 Cb 0.54 -2.32 -0.03 0.00 -1.01 0.00 0.00 31.44 28.62 1dgq n GLU 241 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1dgq s ALA 242 N -2.18 2.69 0.40 0.62 0.00 -1.26 -4.61 121.76 117.42 1dgq s ALA 242 Ca 0.71 -2.53 0.17 0.00 0.00 0.00 0.00 51.96 50.30 1dgq s ALA 242 Cb -0.28 -4.64 1.05 0.00 0.00 0.00 0.00 23.12 19.24 1dgq s ALA 242 CO 0.54 -4.02 1.82 1.79 0.00 0.00 0.00 175.76 175.88 1dgq h THR 243 N 5.98 0.63 0.00 0.00 1.35 -1.16 -2.53 112.91 117.17 1dgq h THR 243 Ca 0.33 -0.15 -0.02 0.00 -0.55 0.00 0.00 66.41 66.01 1dgq h THR 243 Cb 0.91 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.47 1dgq h THR 243 CO 1.37 0.08 -0.11 -0.78 -0.25 0.00 0.00 175.52 175.83 1dgq h ASP 244 N 0.45 0.00 -5.50 5.36 3.58 -1.88 -3.47 116.42 114.96 1dgq h ASP 244 Ca 0.53 0.00 -0.41 0.00 0.42 0.00 0.00 57.03 57.57 1dgq h ASP 244 Cb 1.26 0.00 0.08 0.00 1.72 0.00 0.00 39.33 42.40 1dgq h ASP 244 CO -0.24 0.11 -0.67 -1.20 -2.88 0.00 0.00 179.24 174.36 1dgq n SER 245 N -4.00 -6.02 0.00 2.28 7.64 -0.96 -4.97 113.62 107.60 1dgq n SER 245 Ca -0.02 -0.49 0.00 0.00 1.01 0.00 0.00 58.87 59.36 1dgq n SER 245 Cb 0.20 -4.78 0.00 0.00 -1.01 0.00 0.00 64.21 58.62 1dgq n SER 245 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dgq n GLY 246 N -1.80 0.51 3.56 0.23 0.00 -1.26 -5.13 105.19 101.29 1dgq n GLY 246 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 1dgq n GLY 246 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgq s ASN 247 N -1.00 0.11 0.00 1.61 2.20 -1.26 -5.08 114.94 111.51 1dgq s ASN 247 Ca 0.00 -1.07 0.03 0.00 -0.94 0.00 0.00 52.86 50.88 1dgq s ASN 247 Cb 0.00 0.60 0.05 0.00 -2.00 0.00 0.00 41.25 39.90 1dgq s ASN 247 CO 0.00 -1.18 0.97 2.30 -2.94 0.00 0.00 177.10 176.25 1dgq n ILE 248 N -0.41 0.00 -0.37 0.54 -5.35 -1.26 -4.55 119.36 107.96 1dgq n ILE 248 Ca -0.01 -0.11 0.04 0.00 -0.27 0.00 0.00 62.75 62.39 1dgq n ILE 248 Cb 0.62 0.50 0.19 0.00 -1.74 0.00 0.00 39.64 39.22 1dgq n ILE 248 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1dgq h ASP 249 N 0.11 1.01 -1.17 7.28 5.19 -1.98 0.10 116.42 126.97 1dgq h ASP 249 Ca -0.03 0.02 0.33 0.00 -0.62 0.00 0.00 57.03 56.73 1dgq h ASP 249 Cb 1.41 -0.19 -0.06 0.00 0.18 0.00 0.00 39.33 40.67 1dgq h ASP 249 CO 0.01 0.62 0.82 0.00 -3.12 0.00 0.00 179.24 177.57 1dgq h ALA 250 N 1.48 2.91 -0.60 3.45 0.00 -1.95 -0.57 119.26 123.97 1dgq h ALA 250 Ca 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1dgq h ALA 250 Cb 0.25 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1dgq h ALA 250 CO -0.20 -1.28 0.00 0.00 0.00 0.00 0.00 179.25 177.78 1dgq n ALA 251 N -2.69 2.67 -0.32 0.00 0.00 0.36 -4.72 120.51 115.80 1dgq n ALA 251 Ca 0.26 -1.46 0.22 0.00 0.00 0.00 0.00 53.44 52.46 1dgq n ALA 251 Cb 1.18 -0.85 0.49 0.00 0.00 0.00 0.00 19.45 20.26 1dgq n ALA 251 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1dgq h LYS 252 N 3.64 0.42 0.00 0.00 2.10 -1.03 0.10 116.57 121.80 1dgq h LYS 252 Ca 0.00 -0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.57 1dgq h LYS 252 Cb 1.16 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 32.39 1dgq h LYS 252 CO 0.11 0.28 -0.37 0.38 -2.00 0.00 0.00 179.45 177.84 1dgq h ASP 253 N 0.43 0.00 -4.05 7.07 2.03 -1.84 -3.46 116.42 116.60 1dgq h ASP 253 Ca 0.59 0.00 -0.48 0.00 -0.73 0.00 0.00 57.03 56.41 1dgq h ASP 253 Cb 1.43 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 39.96 1dgq h ASP 253 CO -0.30 0.27 0.41 -0.63 -1.03 0.00 0.00 179.24 177.95 1dgq s ILE 254 N -3.09 3.62 -0.79 4.15 -1.09 0.35 -4.92 121.20 119.44 1dgq s ILE 254 Ca 0.05 1.07 -0.22 0.00 -2.23 0.00 0.00 60.65 59.31 1dgq s ILE 254 Cb 0.07 -3.47 0.08 0.00 -1.58 0.00 0.00 42.46 37.56 1dgq s ILE 254 CO 0.72 -0.16 1.12 -0.63 -1.23 0.00 0.00 174.94 174.76 1dgq s ILE 255 N -1.85 4.28 -0.92 2.92 -1.09 0.12 -4.85 121.20 119.81 1dgq s ILE 255 Ca 0.66 -0.61 -0.24 0.00 -2.23 0.00 0.00 60.65 58.23 1dgq s ILE 255 Cb -0.20 -4.80 0.03 0.00 -1.58 0.00 0.00 42.46 35.92 1dgq s ILE 255 CO 0.24 -1.60 1.49 -0.13 -1.23 0.00 0.00 174.94 173.71 1dgq s ARG 256 N 4.09 3.33 0.05 2.79 3.00 -1.26 -0.42 118.95 130.53 1dgq s ARG 256 Ca 0.30 -0.74 -0.22 0.00 0.00 0.00 0.00 55.73 55.07 1dgq s ARG 256 Cb -0.10 -5.01 -0.06 0.00 0.00 0.00 0.00 34.95 29.78 1dgq s ARG 256 CO 0.03 -2.36 0.66 -0.47 0.00 0.00 0.00 175.30 173.15 1dgq s TYR 257 N 5.97 3.75 -0.02 -0.53 6.14 0.22 -1.16 117.35 131.72 1dgq s TYR 257 Ca 0.47 1.34 0.00 0.00 0.64 0.00 0.00 57.07 59.53 1dgq s TYR 257 Cb -0.03 -2.66 0.03 0.00 0.42 0.00 0.00 41.96 39.72 1dgq s TYR 257 CO -0.02 0.40 0.03 -1.50 0.64 0.00 0.00 175.55 175.10 1dgq s ILE 258 N -0.47 -0.03 -0.27 3.14 2.07 0.19 -0.37 121.20 125.46 1dgq s ILE 258 Ca 0.33 0.20 -0.09 0.00 -1.41 0.00 0.00 60.65 59.68 1dgq s ILE 258 Cb -0.20 -0.10 -0.03 0.00 0.13 0.00 0.00 42.46 42.26 1dgq s ILE 258 CO 0.20 0.09 0.13 -0.63 -1.91 0.00 0.00 174.94 172.82 1dgq s ILE 259 N 1.04 4.74 -0.44 2.00 1.09 0.20 -0.47 121.20 129.37 1dgq s ILE 259 Ca -0.09 -0.06 -0.11 0.00 -1.10 0.00 0.00 60.65 59.28 1dgq s ILE 259 Cb -0.13 -3.26 0.08 0.00 -1.06 0.00 0.00 42.46 38.09 1dgq s ILE 259 CO -0.03 0.27 0.31 -0.83 -0.10 0.00 0.00 174.94 174.57 1dgq s GLY 260 N 1.67 2.00 0.26 6.18 0.00 0.08 -1.11 107.32 116.40 1dgq s GLY 260 Ca 0.06 -2.15 -0.29 0.00 0.00 0.00 0.00 44.72 42.34 1dgq s GLY 260 CO 0.07 1.00 1.19 -0.42 0.00 0.00 0.00 173.10 174.94 1dgq s ILE 261 N 1.50 3.31 0.00 0.90 -1.09 0.15 -0.11 121.20 125.85 1dgq s ILE 261 Ca 0.03 1.23 -0.02 0.00 -2.23 0.00 0.00 60.65 59.67 1dgq s ILE 261 Cb -0.24 -3.78 -0.08 0.00 -1.58 0.00 0.00 42.46 36.78 1dgq s ILE 261 CO 0.04 0.26 2.38 0.61 -1.23 0.00 0.00 174.94 177.00 1dgq n GLY 262 N 1.47 2.56 0.10 6.18 0.00 0.20 -2.78 105.19 112.91 1dgq n GLY 262 Ca 0.01 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1dgq n GLY 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgq n LYS 263 N 1.83 0.52 -0.08 1.61 4.76 -1.26 -4.18 118.16 121.36 1dgq n LYS 263 Ca 0.12 0.39 -0.22 0.00 -2.87 0.00 0.00 58.31 55.73 1dgq n LYS 263 Cb 0.60 -1.59 -0.12 0.00 -1.84 0.00 0.00 35.03 32.08 1dgq n LYS 263 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1dgq n HIS 264 N -4.46 0.71 0.55 2.13 8.25 -1.14 -4.46 115.22 116.80 1dgq n HIS 264 Ca -0.23 0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1dgq n HIS 264 Cb 0.54 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.57 1dgq n HIS 264 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1dgq n PHE 265 N -3.84 0.00 0.16 4.41 3.72 -1.12 -1.24 117.46 119.56 1dgq n PHE 265 Ca -0.39 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.11 1dgq n PHE 265 Cb 0.91 -0.05 0.09 0.00 -0.94 0.00 0.00 39.48 39.49 1dgq n PHE 265 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1dgq h GLN 266 N 0.45 0.00 -6.36 -1.08 -0.00 -1.78 -3.42 115.11 102.91 1dgq h GLN 266 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 58.65 58.08 1dgq h GLN 266 Cb 0.23 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.65 1dgq h GLN 266 CO 0.00 0.05 0.90 0.95 -0.00 0.00 0.00 178.83 180.74 1dgq s THR 267 N -3.23 4.33 0.35 1.86 -4.23 -0.37 -4.92 115.64 109.43 1dgq s THR 267 Ca 0.04 1.51 0.06 0.00 -1.18 0.00 0.00 61.69 62.12 1dgq s THR 267 Cb 0.07 -4.33 0.30 0.00 1.34 0.00 0.00 72.50 69.88 1dgq s THR 267 CO 0.72 -0.53 1.92 0.50 -0.54 0.00 0.00 174.62 176.70 1dgq h LYS 268 N 8.68 0.74 -0.98 3.99 3.64 -1.89 0.14 116.57 130.89 1dgq h LYS 268 Ca -0.23 -0.04 0.15 0.00 -1.27 0.00 0.00 60.65 59.26 1dgq h LYS 268 Cb 1.08 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.63 1dgq h LYS 268 CO 1.04 0.49 0.59 1.05 -2.27 0.00 0.00 179.45 180.36 1dgq h GLU 269 N 0.76 0.82 -0.10 1.90 4.11 -1.97 0.46 114.58 120.57 1dgq h GLU 269 Ca 0.37 -0.05 -0.08 0.00 0.07 0.00 0.00 59.36 59.67 1dgq h GLU 269 Cb 0.41 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1dgq h GLU 269 CO -0.14 0.54 -0.25 0.77 0.07 0.00 0.00 179.01 180.01 1dgq h SER 270 N 0.85 0.40 -0.54 3.06 0.02 -1.11 -3.22 113.55 113.00 1dgq h SER 270 Ca 0.53 -0.58 0.11 0.00 -0.84 0.00 0.00 61.79 61.00 1dgq h SER 270 Cb 0.68 -0.11 -0.11 0.00 0.14 0.00 0.00 62.40 62.99 1dgq h SER 270 CO -0.33 0.91 -0.22 1.56 -1.14 0.00 0.00 176.83 177.61 1dgq h GLN 271 N -0.10 -0.08 -1.02 3.45 4.20 -0.26 -0.69 115.11 120.62 1dgq h GLN 271 Ca -0.00 0.01 0.25 0.00 0.06 0.00 0.00 58.65 58.96 1dgq h GLN 271 Cb 0.85 0.02 -0.11 0.00 0.30 0.00 0.00 27.48 28.54 1dgq h GLN 271 CO 0.05 -0.06 0.63 0.93 -0.67 0.00 0.00 178.83 179.72 1dgq h GLU 272 N -0.09 0.51 -0.73 1.46 5.08 -0.96 0.02 114.58 119.87 1dgq h GLU 272 Ca 0.25 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1dgq h GLU 272 Cb 0.48 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 1dgq h GLU 272 CO -0.60 0.33 0.40 1.79 -1.00 0.00 0.00 179.01 179.93 1dgq h THR 273 N 0.52 1.22 -0.71 1.13 1.35 -1.14 -2.71 112.91 112.58 1dgq h THR 273 Ca 0.61 -0.55 0.05 0.00 -0.55 0.00 0.00 66.41 65.97 1dgq h THR 273 Cb 1.30 0.26 -0.05 0.00 -1.73 0.00 0.00 68.15 67.93 1dgq h THR 273 CO -0.38 0.24 0.42 -0.07 -0.25 0.00 0.00 175.52 175.48 1dgq h LEU 274 N 1.00 0.64 -1.90 3.87 3.38 -0.96 0.25 115.31 121.59 1dgq h LEU 274 Ca 0.26 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.33 1dgq h LEU 274 Cb 0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1dgq h LEU 274 CO -0.04 0.42 0.25 0.45 0.09 0.00 0.00 178.44 179.60 1dgq h HIS 275 N 0.77 0.12 -0.05 1.13 3.86 -1.36 0.16 115.15 119.78 1dgq h HIS 275 Ca 0.31 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.48 1dgq h HIS 275 Cb 0.15 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.59 1dgq h HIS 275 CO -0.06 0.06 -0.13 0.87 0.86 0.00 0.00 177.93 179.53 1dgq h LYS 276 N 0.12 0.18 -0.31 2.45 1.57 -0.85 -3.33 116.57 116.39 1dgq h LYS 276 Ca 0.16 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1dgq h LYS 276 Cb 0.50 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1dgq h LYS 276 CO -0.02 0.73 0.06 0.74 -0.57 0.00 0.00 179.45 180.40 1dgq h PHE 277 N -0.35 0.53 -4.02 -1.35 0.04 -0.80 -3.45 116.94 107.55 1dgq h PHE 277 Ca -0.00 -0.07 -0.54 0.00 2.80 0.00 0.00 57.97 60.16 1dgq h PHE 277 Cb 0.74 -0.15 0.18 0.00 2.20 0.00 0.00 35.95 38.93 1dgq h PHE 277 CO 0.13 0.57 0.20 0.00 -0.60 0.00 0.00 178.31 178.61 1dgq n ALA 278 N -2.32 -0.27 -1.24 2.45 0.00 0.48 -4.77 120.51 114.83 1dgq n ALA 278 Ca -0.02 -0.31 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 1dgq n ALA 278 Cb 0.20 -2.18 0.10 0.00 0.00 0.00 0.00 19.45 17.57 1dgq n ALA 278 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dgq s SER 279 N -1.97 4.35 0.02 0.00 0.01 -0.31 -4.90 113.70 110.91 1dgq s SER 279 Ca 0.72 1.79 -0.03 0.00 1.31 0.00 0.00 55.95 59.74 1dgq s SER 279 Cb -0.30 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.41 1dgq s SER 279 CO 0.52 -2.13 0.22 -0.54 0.41 0.00 0.00 173.24 171.72 1dgq s LYS 280 N -4.90 3.48 0.05 12.44 -0.14 -1.26 -3.47 119.74 125.94 1dgq s LYS 280 Ca 0.61 -0.29 -0.30 0.00 -1.36 0.00 0.00 55.97 54.63 1dgq s LYS 280 Cb -0.17 -3.06 -0.05 0.00 -1.68 0.00 0.00 37.83 32.86 1dgq s LYS 280 CO 0.56 0.64 1.16 -2.14 -0.76 0.00 0.00 175.35 174.82 1dgq s PRO 281 N -2.08 4.45 0.51 -1.68 0.02 -1.26 -4.98 135.00 129.98 1dgq s PRO 281 Ca 0.30 1.72 0.22 0.00 0.02 0.00 0.00 61.00 63.26 1dgq s PRO 281 Cb -0.13 -3.36 1.32 0.00 0.02 0.00 0.00 34.50 32.35 1dgq s PRO 281 CO 0.21 -0.22 2.02 0.00 -0.33 0.00 0.00 177.00 178.68 1dgq h ALA 282 N 6.76 2.35 -0.59 -1.55 0.00 -1.86 0.72 119.26 125.09 1dgq h ALA 282 Ca -0.42 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.56 1dgq h ALA 282 Cb 1.22 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1dgq h ALA 282 CO 0.80 -0.48 0.40 0.77 0.00 0.00 0.00 179.25 180.74 1dgq h SER 283 N 0.06 0.42 0.04 0.00 0.02 -1.88 0.17 113.55 112.37 1dgq h SER 283 Ca 0.22 0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.03 1dgq h SER 283 Cb 0.79 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1dgq h SER 283 CO -0.01 0.26 -0.74 -0.33 -1.14 0.00 0.00 176.83 174.86 1dgq h GLU 284 N 0.47 0.09 0.00 3.45 4.39 -1.23 -3.40 114.58 118.35 1dgq h GLU 284 Ca 0.27 -0.15 -0.18 0.00 0.34 0.00 0.00 59.36 59.65 1dgq h GLU 284 Cb 0.44 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1dgq h GLU 284 CO -0.08 1.07 -0.90 0.74 -1.16 0.00 0.00 179.01 178.68 1dgq h PHE 285 N -0.78 0.00 -3.30 4.33 0.04 -1.15 -3.44 116.94 112.63 1dgq h PHE 285 Ca -0.18 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.02 1dgq h PHE 285 Cb 1.32 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.41 1dgq h PHE 285 CO 0.19 0.81 -0.04 0.08 -0.60 0.00 0.00 178.31 178.75 1dgq s VAL 286 N -2.80 4.98 -0.32 -0.55 1.01 0.58 -0.63 120.40 122.67 1dgq s VAL 286 Ca 0.01 1.19 0.02 0.00 0.00 0.00 0.00 61.98 63.20 1dgq s VAL 286 Cb 0.09 -3.91 0.10 0.00 0.00 0.00 0.00 36.38 32.66 1dgq s VAL 286 CO 0.79 0.39 0.05 -0.54 0.00 0.00 0.00 175.10 175.80 1dgq s LYS 287 N 0.01 1.25 -0.70 2.72 -0.14 0.38 -4.79 119.74 118.47 1dgq s LYS 287 Ca 0.30 -1.51 -0.26 0.00 -1.36 0.00 0.00 55.97 53.14 1dgq s LYS 287 Cb -0.17 -2.72 -0.01 0.00 -1.68 0.00 0.00 37.83 33.24 1dgq s LYS 287 CO 0.16 -0.91 1.69 0.42 -0.76 0.00 0.00 175.35 175.94 1dgq s ILE 288 N 1.20 3.50 0.06 2.17 -1.09 -1.26 -0.74 121.20 125.03 1dgq s ILE 288 Ca 0.08 0.14 -0.26 0.00 -2.23 0.00 0.00 60.65 58.38 1dgq s ILE 288 Cb -0.18 -4.28 -0.06 0.00 -1.58 0.00 0.00 42.46 36.36 1dgq s ILE 288 CO -0.14 -1.23 0.81 -0.22 -1.23 0.00 0.00 174.94 172.93 1dgq s LEU 289 N 8.07 4.46 0.08 2.97 0.20 0.84 -4.92 118.68 130.38 1dgq s LEU 289 Ca 0.58 1.53 -0.33 0.00 0.69 0.00 0.00 54.13 56.60 1dgq s LEU 289 Cb -0.10 -3.31 -0.16 0.00 -0.43 0.00 0.00 46.19 42.18 1dgq s LEU 289 CO 0.15 -0.00 1.61 -0.78 -0.29 0.00 0.00 176.35 177.04 1dgq h ASP 290 N 5.64 -0.93 -5.08 3.68 3.58 -1.94 0.57 116.42 121.94 1dgq h ASP 290 Ca -0.44 0.06 -0.09 0.00 0.42 0.00 0.00 57.03 56.98 1dgq h ASP 290 Cb 1.21 0.28 -0.16 0.00 1.72 0.00 0.00 39.33 42.38 1dgq h ASP 290 CO 0.71 -0.56 -0.28 0.42 -2.88 0.00 0.00 179.24 176.65 1dgq s THR 291 N -6.01 0.10 0.30 2.25 -4.23 -1.26 -3.07 115.64 103.71 1dgq s THR 291 Ca -0.17 -0.80 0.06 0.00 -1.18 0.00 0.00 61.69 59.59 1dgq s THR 291 Cb 0.04 -1.02 0.29 0.00 1.34 0.00 0.00 72.50 73.16 1dgq s THR 291 CO 0.62 -0.44 1.71 -0.26 -0.54 0.00 0.00 174.62 175.72 1dgq h PHE 292 N 3.12 0.80 -0.90 3.99 0.04 -1.97 0.31 116.94 122.34 1dgq h PHE 292 Ca -0.32 0.04 0.21 0.00 2.80 0.00 0.00 57.97 60.70 1dgq h PHE 292 Cb 1.20 -0.21 -0.17 0.00 2.20 0.00 0.00 35.95 38.98 1dgq h PHE 292 CO 0.45 0.01 -0.06 0.93 -0.60 0.00 0.00 178.31 179.04 1dgq h GLU 293 N 0.49 0.03 -0.10 1.51 3.07 -1.97 0.12 114.58 117.73 1dgq h GLU 293 Ca 0.59 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 1dgq h GLU 293 Cb 1.09 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.00 1dgq h GLU 293 CO -0.50 0.02 0.00 1.63 -1.40 0.00 0.00 179.01 178.77 1dgq n LYS 294 N -5.48 1.26 -0.22 2.33 5.02 0.09 -3.51 118.16 117.66 1dgq n LYS 294 Ca 0.17 -0.40 0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1dgq n LYS 294 Cb 0.58 -1.15 0.41 0.00 -0.02 0.00 0.00 35.03 34.84 1dgq n LYS 294 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1dgq h LEU 295 N 0.69 0.58 -0.16 -0.35 3.38 -0.75 0.99 115.31 119.69 1dgq h LEU 295 Ca 0.00 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1dgq h LEU 295 Cb 0.16 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1dgq h LEU 295 CO 0.00 0.32 0.09 0.11 0.09 0.00 0.00 178.44 179.05 1dgq h LYS 296 N 0.63 0.22 0.35 1.13 1.79 -1.76 0.24 116.57 119.17 1dgq h LYS 296 Ca 0.39 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.82 1dgq h LYS 296 Cb 0.63 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 1dgq h LYS 296 CO -0.15 0.22 -0.17 0.22 -1.08 0.00 0.00 179.45 178.49 1dgq h ASP 297 N 0.16 -0.39 -0.23 0.86 3.58 -1.58 -1.31 116.42 117.51 1dgq h ASP 297 Ca 0.06 -0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.53 1dgq h ASP 297 Cb 0.06 0.10 -0.05 0.00 1.72 0.00 0.00 39.33 41.16 1dgq h ASP 297 CO -0.01 -0.23 -0.11 0.25 -2.88 0.00 0.00 179.24 176.26 1dgq h LEU 298 N -0.53 -0.38 -0.48 2.28 5.85 -0.77 -0.70 115.31 120.57 1dgq h LEU 298 Ca -0.05 0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.86 1dgq h LEU 298 Cb 0.40 0.21 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 1dgq h LEU 298 CO 0.08 -0.15 -0.26 0.15 -0.34 0.00 0.00 178.44 177.92 1dgq h PHE 299 N -0.09 -0.68 -0.54 1.25 3.57 -0.41 0.19 116.94 120.24 1dgq h PHE 299 Ca 0.12 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1dgq h PHE 299 Cb 0.27 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 1dgq h PHE 299 CO -0.28 -0.33 0.29 1.15 -2.23 0.00 0.00 178.31 176.90 1dgq h THR 300 N -0.15 0.98 0.29 4.41 2.02 -0.18 0.23 112.91 120.52 1dgq h THR 300 Ca 0.22 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1dgq h THR 300 Cb 0.50 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 1dgq h THR 300 CO -0.57 0.10 -0.14 -0.08 0.37 0.00 0.00 175.52 175.20 1dgq h GLU 301 N 0.56 -0.38 -0.10 6.66 4.57 -0.00 0.11 114.58 126.00 1dgq h GLU 301 Ca 0.23 0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.45 1dgq h GLU 301 Cb 0.11 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1dgq h GLU 301 CO -0.14 -0.23 0.00 -0.07 -1.18 0.00 0.00 179.01 177.39 1dgq h LEU 302 N -0.43 -0.03 -0.77 1.64 3.38 -0.34 -1.49 115.31 117.27 1dgq h LEU 302 Ca -0.04 0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.09 1dgq h LEU 302 Cb 0.33 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.02 1dgq h LEU 302 CO 0.07 -0.00 0.34 -0.61 0.09 0.00 0.00 178.44 178.33 1dgq h GLN 303 N 0.04 0.49 0.69 1.13 5.75 -0.45 0.16 115.11 122.92 1dgq h GLN 303 Ca 0.05 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.49 1dgq h GLN 303 Cb 0.05 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.49 1dgq h GLN 303 CO -0.07 0.33 -0.38 -0.22 -2.65 0.00 0.00 178.83 175.83 1dgq h LYS 304 N 0.51 -0.96 -0.70 1.69 1.63 -0.08 0.11 116.57 118.76 1dgq h LYS 304 Ca 0.42 0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 60.26 1dgq h LYS 304 Cb 0.60 0.22 -0.03 0.00 -0.60 0.00 0.00 32.23 32.42 1dgq h LYS 304 CO -0.38 -0.64 0.33 1.57 -3.45 0.00 0.00 179.45 176.88 1dgq h LYS 305 N -1.00 1.00 -0.09 1.90 2.10 -0.61 0.05 116.57 119.92 1dgq h LYS 305 Ca -0.09 -0.14 0.03 0.00 -2.00 0.00 0.00 60.65 58.46 1dgq h LYS 305 Cb 0.79 -0.18 -0.04 0.00 -0.90 0.00 0.00 32.23 31.90 1dgq h LYS 305 CO 0.12 0.78 -0.14 0.82 -2.00 0.00 0.00 179.45 179.03 1dgq h ILE 306 N 1.00 0.63 -0.97 0.07 2.04 -0.64 -2.35 117.51 117.30 1dgq h ILE 306 Ca 0.24 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.18 1dgq h ILE 306 Cb 0.11 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 1dgq h ILE 306 CO -0.03 0.00 0.62 0.22 0.00 0.00 0.00 178.15 178.96 1dgq h TYR 307 N -0.19 1.12 -0.13 1.37 5.03 0.64 0.42 116.97 125.24 1dgq h TYR 307 Ca 0.08 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.46 1dgq h TYR 307 Cb 0.30 -0.37 -0.01 0.00 1.55 0.00 0.00 36.73 38.21 1dgq h TYR 307 CO -0.24 0.55 0.10 0.28 -1.32 0.00 0.00 178.16 177.53 1dgq h VAL 308 N 1.07 0.81 0.78 1.81 2.07 -0.51 0.20 116.25 122.47 1dgq h VAL 308 Ca 0.43 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.92 1dgq h VAL 308 Cb 0.28 0.93 0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1dgq h VAL 308 CO -0.19 0.00 -0.37 0.40 0.02 0.00 0.00 177.57 177.43 1dgq h ILE 309 N 0.00 0.12 -0.14 4.57 1.08 -0.63 -3.19 117.51 119.32 1dgq h ILE 309 Ca 0.06 -0.17 -0.09 0.00 -0.39 0.00 0.00 64.86 64.27 1dgq h ILE 309 Cb 0.26 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.14 1dgq h ILE 309 CO -0.00 0.01 -0.31 1.05 -0.69 0.00 0.00 178.15 178.21 1dgq h GLU 310 N -1.19 0.27 0.00 2.37 4.11 -1.46 -3.50 114.58 115.18 1dgq h GLU 310 Ca -0.11 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1dgq h GLU 310 Cb 0.82 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1dgq h GLU 310 CO 0.18 0.56 0.00 0.41 0.07 0.00 0.00 179.01 180.22