#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 0.00 -1.18 -5.12 0.00 -1.17 -0.49 120.51 112.55 1dgq n ALA 125 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1dgq n ALA 125 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1dgq n ALA 125 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1dgq n SER 126 N 0.53 7.24 -4.26 0.00 3.41 -1.26 -4.51 113.62 114.77 1dgq n SER 126 Ca 0.00 -2.52 -0.32 0.00 -0.26 0.00 0.00 58.87 55.76 1dgq n SER 126 Cb 0.00 -1.43 -0.07 0.00 -0.26 0.00 0.00 64.21 62.45 1dgq n SER 126 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1dgq n LYS 127 N 4.01 -1.71 -0.46 4.33 4.01 -1.00 -0.26 118.16 127.09 1dgq n LYS 127 Ca 0.67 0.20 0.00 0.00 -0.51 0.00 0.00 58.31 58.68 1dgq n LYS 127 Cb 0.22 -4.18 0.00 0.00 -0.51 0.00 0.00 35.03 30.56 1dgq n LYS 127 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1dgq n GLY 128 N -2.04 0.71 3.65 0.72 0.00 0.36 -4.96 105.19 103.63 1dgq n GLY 128 Ca -0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 1dgq n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dgq s ASN 129 N -2.56 6.67 -0.07 1.61 0.01 0.65 -4.47 114.94 116.77 1dgq s ASN 129 Ca 0.00 1.82 -0.02 0.00 -0.71 0.00 0.00 52.86 53.95 1dgq s ASN 129 Cb 0.00 -2.53 0.03 0.00 0.41 0.00 0.00 41.25 39.16 1dgq s ASN 129 CO 0.00 -0.98 0.02 -0.69 -1.51 0.00 0.00 177.10 173.94 1dgq s VAL 130 N 4.23 0.23 -0.55 1.60 1.01 -0.14 -1.31 120.40 125.47 1dgq s VAL 130 Ca 0.66 0.16 -0.23 0.00 0.00 0.00 0.00 61.98 62.57 1dgq s VAL 130 Cb -0.26 -0.46 0.05 0.00 0.00 0.00 0.00 36.38 35.71 1dgq s VAL 130 CO 0.24 0.19 0.87 -1.81 0.00 0.00 0.00 175.10 174.60 1dgq s ASP 131 N 2.03 6.30 -0.38 3.32 1.01 0.33 -0.48 116.67 128.80 1dgq s ASP 131 Ca 0.05 -0.52 -0.10 0.00 0.71 0.00 0.00 52.55 52.68 1dgq s ASP 131 Cb -0.13 -2.40 0.04 0.00 1.01 0.00 0.00 42.92 41.44 1dgq s ASP 131 CO -0.05 -1.17 0.21 -0.22 0.21 0.00 0.00 175.17 174.15 1dgq s LEU 132 N 3.66 4.77 -0.34 1.23 0.20 0.46 -0.18 118.68 128.47 1dgq s LEU 132 Ca 0.26 -1.12 -0.16 0.00 0.69 0.00 0.00 54.13 53.80 1dgq s LEU 132 Cb -0.14 -2.00 -0.01 0.00 -0.43 0.00 0.00 46.19 43.61 1dgq s LEU 132 CO 0.17 -0.41 0.39 -0.69 -0.29 0.00 0.00 176.35 175.52 1dgq s VAL 133 N 1.51 5.14 -0.66 1.68 1.01 0.29 -0.44 120.40 128.93 1dgq s VAL 133 Ca 0.02 0.11 -0.25 0.00 0.00 0.00 0.00 61.98 61.85 1dgq s VAL 133 Cb -0.20 -3.85 0.05 0.00 0.00 0.00 0.00 36.38 32.38 1dgq s VAL 133 CO 0.05 -0.11 1.09 -0.36 0.00 0.00 0.00 175.10 175.77 1dgq s PHE 134 N 2.09 2.56 -0.97 5.22 0.08 0.22 -0.40 117.98 126.78 1dgq s PHE 134 Ca 0.13 -0.19 -0.16 0.00 0.12 0.00 0.00 56.93 56.83 1dgq s PHE 134 Cb -0.16 -4.38 0.17 0.00 -0.57 0.00 0.00 43.02 38.08 1dgq s PHE 134 CO 0.12 -1.73 1.08 -1.17 -0.10 0.00 0.00 175.22 173.42 1dgq s LEU 135 N 4.68 5.62 -0.18 -0.37 2.96 0.35 -0.54 118.68 131.19 1dgq s LEU 135 Ca 0.30 -2.51 -0.08 0.00 -0.22 0.00 0.00 54.13 51.62 1dgq s LEU 135 Cb -0.12 -2.33 -0.04 0.00 0.50 0.00 0.00 46.19 44.19 1dgq s LEU 135 CO 0.15 -0.81 0.07 0.72 -1.32 0.00 0.00 176.35 175.16 1dgq s PHE 136 N 1.49 3.28 0.13 5.38 -0.71 0.00 -0.77 117.98 126.78 1dgq s PHE 136 Ca 0.30 0.12 -0.30 0.00 -1.04 0.00 0.00 56.93 56.01 1dgq s PHE 136 Cb -0.06 -2.09 -0.07 0.00 -1.21 0.00 0.00 43.02 39.59 1dgq s PHE 136 CO -0.08 0.19 1.15 0.34 -1.34 0.00 0.00 175.22 175.48 1dgq s ASP 137 N 0.34 7.17 -0.41 1.98 -1.08 0.56 -0.51 116.67 124.71 1dgq s ASP 137 Ca 0.04 2.07 0.10 0.00 -0.52 0.00 0.00 52.55 54.24 1dgq s ASP 137 Cb -0.12 -2.59 0.41 0.00 -1.46 0.00 0.00 42.92 39.16 1dgq s ASP 137 CO -0.00 -0.34 0.98 0.61 0.52 0.00 0.00 175.17 176.93 1dgq n GLY 138 N 2.54 4.10 3.78 2.66 0.00 0.58 -4.87 105.19 113.98 1dgq n GLY 138 Ca 0.05 -2.12 -0.30 0.00 0.00 0.00 0.00 46.02 43.65 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 -3.24 4.19 0.56 1.61 1.04 -1.26 -0.42 113.70 116.19 1dgq s SER 139 Ca 0.40 1.35 0.30 0.00 0.48 0.00 0.00 55.95 58.48 1dgq s SER 139 Cb 0.40 -2.06 1.46 0.00 0.10 0.00 0.00 66.02 65.91 1dgq s SER 139 CO -0.09 -2.16 1.89 0.00 0.98 0.00 0.00 173.24 173.85 1dgq h MET 140 N -1.22 0.00 -0.93 4.02 -0.00 -1.18 0.59 114.93 116.22 1dgq h MET 140 Ca -0.48 0.00 0.13 0.00 -0.00 0.00 0.00 59.70 59.35 1dgq h MET 140 Cb 1.27 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 32.80 1dgq h MET 140 CO 0.58 0.00 0.59 0.77 -0.00 0.00 0.00 176.91 178.85 1dgq h SER 141 N 0.00 0.76 -3.04 -0.10 0.02 -1.92 -3.40 113.55 105.87 1dgq h SER 141 Ca 0.32 0.04 -0.57 0.00 -0.84 0.00 0.00 61.79 60.75 1dgq h SER 141 Cb 1.46 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.84 1dgq h SER 141 CO -0.00 0.39 0.95 -0.76 -1.14 0.00 0.00 176.83 176.28 1dgq s LEU 142 N -9.96 3.99 0.29 5.07 2.01 0.20 -5.03 118.68 115.25 1dgq s LEU 142 Ca -0.11 1.41 -0.12 0.00 0.01 0.00 0.00 54.13 55.32 1dgq s LEU 142 Cb 0.22 -3.54 -0.08 0.00 0.01 0.00 0.00 46.19 42.80 1dgq s LEU 142 CO 0.80 -0.97 0.65 -1.10 1.01 0.00 0.00 176.35 176.73 1dgq s GLN 143 N 3.95 3.88 0.17 1.70 -1.52 -1.26 -4.84 119.66 121.74 1dgq s GLN 143 Ca 0.56 0.46 -0.28 0.00 -1.95 0.00 0.00 55.36 54.15 1dgq s GLN 143 Cb -0.19 -2.53 -0.01 0.00 -0.22 0.00 0.00 33.01 30.06 1dgq s GLN 143 CO 0.20 0.21 1.54 -1.35 -0.25 0.00 0.00 175.29 175.65 1dgq h PRO 144 N 2.28 -0.03 -0.45 2.91 0.11 -1.97 0.65 132.00 135.50 1dgq h PRO 144 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.68 1dgq h PRO 144 Cb 1.17 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1dgq h PRO 144 CO 0.67 -0.02 0.30 0.22 -0.21 0.00 0.00 178.00 178.96 1dgq h ASP 145 N -0.03 0.38 -0.07 -2.05 3.58 -1.99 0.17 116.42 116.40 1dgq h ASP 145 Ca 0.19 -0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.52 1dgq h ASP 145 Cb 0.46 -0.08 0.01 0.00 1.72 0.00 0.00 39.33 41.43 1dgq h ASP 145 CO -0.92 0.25 -0.41 -0.33 -2.88 0.00 0.00 179.24 174.95 1dgq h GLU 146 N 0.43 0.40 -0.64 0.28 4.39 -1.35 -2.84 114.58 115.26 1dgq h GLU 146 Ca 0.19 -0.34 0.07 0.00 0.34 0.00 0.00 59.36 59.62 1dgq h GLU 146 Cb 0.20 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.87 1dgq h GLU 146 CO -0.05 0.98 0.32 0.35 -1.16 0.00 0.00 179.01 179.46 1dgq h PHE 147 N -0.07 0.59 -0.79 4.33 3.57 0.01 0.59 116.94 125.17 1dgq h PHE 147 Ca -0.03 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.62 1dgq h PHE 147 Cb 1.08 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.59 1dgq h PHE 147 CO 0.13 0.25 0.52 1.96 -2.23 0.00 0.00 178.31 178.94 1dgq h GLN 148 N 0.59 0.56 -0.37 1.11 1.08 -0.70 0.12 115.11 117.49 1dgq h GLN 148 Ca 0.30 -0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 57.33 1dgq h GLN 148 Cb 0.24 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1dgq h GLN 148 CO -0.21 0.37 -0.30 0.87 -0.95 0.00 0.00 178.83 178.61 1dgq h LYS 149 N 0.57 0.81 -0.23 1.46 1.57 -0.67 0.19 116.57 120.27 1dgq h LYS 149 Ca 0.38 -0.37 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1dgq h LYS 149 Cb 0.69 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 1dgq h LYS 149 CO -0.15 1.00 -0.00 0.82 -0.57 0.00 0.00 179.45 180.55 1dgq h ILE 150 N 0.68 0.83 -0.07 1.86 1.08 0.04 0.42 117.51 122.36 1dgq h ILE 150 Ca 0.08 -0.02 0.03 0.00 -0.39 0.00 0.00 64.86 64.55 1dgq h ILE 150 Cb 0.84 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 1dgq h ILE 150 CO 0.07 0.01 -0.10 -0.07 -0.69 0.00 0.00 178.15 177.38 1dgq h LEU 151 N 0.07 -0.29 -0.55 1.44 3.38 -0.66 -2.65 115.31 116.04 1dgq h LEU 151 Ca 0.11 0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.22 1dgq h LEU 151 Cb 0.14 0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 1dgq h LEU 151 CO -0.19 -0.13 0.19 -0.78 0.09 0.00 0.00 178.44 177.62 1dgq h ASP 152 N -0.13 0.18 0.06 -0.43 3.58 -0.27 0.57 116.42 119.99 1dgq h ASP 152 Ca 0.06 0.07 0.03 0.00 0.42 0.00 0.00 57.03 57.61 1dgq h ASP 152 Cb 0.22 0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.28 1dgq h ASP 152 CO -0.15 0.12 -0.30 0.15 -2.88 0.00 0.00 179.24 176.18 1dgq h PHE 153 N 0.37 -0.81 0.13 0.28 3.04 -0.71 0.32 116.94 119.56 1dgq h PHE 153 Ca 0.27 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.25 1dgq h PHE 153 Cb 0.33 0.35 -0.01 0.00 2.56 0.00 0.00 35.95 39.18 1dgq h PHE 153 CO -0.17 -0.40 -0.11 0.52 -2.02 0.00 0.00 178.31 176.13 1dgq h MET 154 N -0.48 -0.25 -0.83 1.11 2.86 -1.07 -2.29 114.93 113.99 1dgq h MET 154 Ca 0.05 0.02 0.17 0.00 -2.06 0.00 0.00 59.70 57.87 1dgq h MET 154 Cb 0.54 0.06 -0.11 0.00 0.06 0.00 0.00 31.60 32.15 1dgq h MET 154 CO -0.21 -0.17 0.36 -0.22 1.06 0.00 0.00 176.91 177.72 1dgq h LYS 155 N -0.26 0.45 0.59 1.72 3.64 -0.65 -0.83 116.57 121.24 1dgq h LYS 155 Ca -0.00 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1dgq h LYS 155 Cb 0.24 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1dgq h LYS 155 CO -0.02 0.30 -0.35 -0.44 -2.27 0.00 0.00 179.45 176.67 1dgq h ASP 156 N 0.46 -0.88 -0.39 4.20 3.32 0.18 0.11 116.42 123.42 1dgq h ASP 156 Ca 0.48 0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.66 1dgq h ASP 156 Cb 0.79 0.26 -0.08 0.00 0.22 0.00 0.00 39.33 40.51 1dgq h ASP 156 CO -0.45 -0.56 -0.16 0.58 -1.72 0.00 0.00 179.24 176.93 1dgq h VAL 157 N -0.89 0.48 -0.23 -1.35 2.07 -0.87 0.67 116.25 116.13 1dgq h VAL 157 Ca -0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.48 1dgq h VAL 157 Cb 0.72 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1dgq h VAL 157 CO 0.08 0.00 0.02 0.24 0.02 0.00 0.00 177.57 177.93 1dgq h MET 158 N -0.09 0.09 0.56 1.57 2.86 -0.97 -1.01 114.93 117.94 1dgq h MET 158 Ca 0.19 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.80 1dgq h MET 158 Cb 0.38 -0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.02 1dgq h MET 158 CO -0.45 0.06 -0.27 0.87 1.06 0.00 0.00 176.91 178.19 1dgq h LYS 159 N 0.09 -0.72 -0.59 1.72 1.79 0.00 0.34 116.57 119.20 1dgq h LYS 159 Ca 0.11 0.05 0.06 0.00 -2.18 0.00 0.00 60.65 58.69 1dgq h LYS 159 Cb 0.13 0.16 -0.05 0.00 -1.58 0.00 0.00 32.23 30.89 1dgq h LYS 159 CO -0.17 -0.46 0.31 0.87 -1.08 0.00 0.00 179.45 178.92 1dgq h LYS 160 N -0.80 0.56 0.00 3.15 6.56 -0.73 -1.74 116.57 123.56 1dgq h LYS 160 Ca -0.08 -0.03 -0.19 0.00 -1.06 0.00 0.00 60.65 59.29 1dgq h LYS 160 Cb 0.60 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 32.10 1dgq h LYS 160 CO 0.13 0.37 -0.91 -0.07 -2.06 0.00 0.00 179.45 176.90 1dgq h LEU 161 N 0.57 0.00 0.00 2.94 3.38 -1.19 -3.47 115.31 117.54 1dgq h LEU 161 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1dgq h LEU 161 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1dgq h LEU 161 CO -0.19 0.91 0.00 -1.20 0.09 0.00 0.00 178.44 178.06 1dgq n SER 162 N -3.44 0.00 0.05 -0.43 7.64 0.12 -2.73 113.62 114.83 1dgq n SER 162 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1dgq n SER 162 Cb 0.87 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.07 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 0.69 -0.06 0.00 6.43 5.15 -1.26 -4.88 115.26 121.33 1dgq n ASN 163 Ca 0.00 0.17 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 1dgq n ASN 163 Cb 0.00 0.15 0.00 0.00 -0.53 0.00 0.00 39.78 39.40 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 -2.84 0.00 -2.55 -0.44 -1.04 -1.10 -0.44 114.28 105.86 1dgq n THR 164 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 1dgq n THR 164 Cb 0.00 0.00 0.04 0.00 -1.82 0.00 0.00 70.33 68.55 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 3.28 0.22 -4.60 8.00 7.64 -1.26 -5.08 113.62 121.81 1dgq n SER 165 Ca 0.00 -2.06 -0.35 0.00 1.01 0.00 0.00 58.87 57.47 1dgq n SER 165 Cb 0.00 -0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.09 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 -1.15 3.22 -0.46 1.43 1.51 0.41 -0.97 117.35 121.34 1dgq s TYR 166 Ca 0.19 -0.00 -0.12 0.00 -1.01 0.00 0.00 57.07 56.13 1dgq s TYR 166 Cb 0.31 -2.11 0.09 0.00 -0.11 0.00 0.00 41.96 40.14 1dgq s TYR 166 CO -0.09 0.06 0.34 -0.65 -1.11 0.00 0.00 175.55 174.11 1dgq s GLN 167 N 0.61 2.71 0.41 -0.62 1.11 0.37 -4.80 119.66 119.45 1dgq s GLN 167 Ca 0.03 -1.53 -0.10 0.00 0.01 0.00 0.00 55.36 53.78 1dgq s GLN 167 Cb -0.13 -3.96 -0.06 0.00 -1.01 0.00 0.00 33.01 27.85 1dgq s GLN 167 CO 0.01 -1.07 0.77 -0.06 0.01 0.00 0.00 175.29 174.96 1dgq s PHE 168 N 1.48 3.48 0.08 0.91 0.08 -1.26 -0.40 117.98 122.35 1dgq s PHE 168 Ca 0.04 1.01 -0.08 0.00 0.12 0.00 0.00 56.93 58.02 1dgq s PHE 168 Cb -0.25 -2.42 -0.00 0.00 -0.57 0.00 0.00 43.02 39.77 1dgq s PHE 168 CO 0.03 -0.13 0.17 0.00 -0.10 0.00 0.00 175.22 175.18 1dgq s ALA 169 N -2.42 -0.17 -0.02 5.36 0.00 0.41 -3.68 121.76 121.24 1dgq s ALA 169 Ca 0.51 -0.62 -0.01 0.00 0.00 0.00 0.00 51.96 51.84 1dgq s ALA 169 Cb -0.10 0.42 0.02 0.00 0.00 0.00 0.00 23.12 23.46 1dgq s ALA 169 CO 0.33 -0.47 0.05 0.00 0.00 0.00 0.00 175.76 175.67 1dgq s ALA 170 N -3.62 -0.03 -0.22 0.00 0.00 0.17 -0.61 121.76 117.45 1dgq s ALA 170 Ca 0.03 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.28 1dgq s ALA 170 Cb 0.04 -0.20 0.04 0.00 0.00 0.00 0.00 23.12 23.00 1dgq s ALA 170 CO -0.10 -0.08 -0.14 0.08 0.00 0.00 0.00 175.76 175.52 1dgq s VAL 171 N 0.66 2.04 0.35 0.00 1.01 0.30 -0.32 120.40 124.43 1dgq s VAL 171 Ca -0.05 -1.26 -0.26 0.00 0.00 0.00 0.00 61.98 60.40 1dgq s VAL 171 Cb -0.08 -2.02 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 1dgq s VAL 171 CO -0.02 0.22 1.07 -1.58 0.00 0.00 0.00 175.10 174.79 1dgq s GLN 172 N 1.22 4.37 0.06 2.72 0.74 0.26 -0.82 119.66 128.21 1dgq s GLN 172 Ca -0.02 1.64 0.02 0.00 0.05 0.00 0.00 55.36 57.04 1dgq s GLN 172 Cb -0.17 -2.82 -0.03 0.00 1.10 0.00 0.00 33.01 31.09 1dgq s GLN 172 CO -0.09 0.01 -0.07 -0.59 -0.55 0.00 0.00 175.29 174.01 1dgq s PHE 173 N -1.44 0.67 0.00 1.67 -0.71 0.33 -0.01 117.98 118.50 1dgq s PHE 173 Ca 0.52 -0.66 0.00 0.00 -1.04 0.00 0.00 56.93 55.75 1dgq s PHE 173 Cb -0.26 -0.41 0.00 0.00 -1.21 0.00 0.00 43.02 41.14 1dgq s PHE 173 CO 0.33 -0.14 0.00 0.45 -1.34 0.00 0.00 175.22 174.53 1dgq n SER 174 N 0.95 0.00 -0.35 1.98 2.88 -1.26 -0.30 113.62 117.52 1dgq n SER 174 Ca -0.19 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.45 1dgq n SER 174 Cb 0.57 0.00 0.29 0.00 -0.75 0.00 0.00 64.21 64.32 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 0.81 -2.06 2.46 2.02 -1.81 0.15 112.91 114.48 1dgq h THR 175 Ca 0.00 -0.29 -0.59 0.00 0.77 0.00 0.00 66.41 66.30 1dgq h THR 175 Cb 0.00 -0.12 -0.11 0.00 -1.74 0.00 0.00 68.15 66.17 1dgq h THR 175 CO 0.00 0.16 -0.66 -0.55 0.37 0.00 0.00 175.52 174.83 1dgq s SER 176 N -5.56 4.10 0.52 4.18 0.15 -1.26 -4.51 113.70 111.31 1dgq s SER 176 Ca -0.11 -0.93 -0.07 0.00 0.70 0.00 0.00 55.95 55.54 1dgq s SER 176 Cb 0.24 -0.54 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 1dgq s SER 176 CO 0.80 -0.11 0.85 -0.72 1.20 0.00 0.00 173.24 175.27 1dgq s TYR 177 N -2.47 3.58 -0.28 3.44 -0.85 -1.26 -4.41 117.35 115.10 1dgq s TYR 177 Ca 0.33 0.95 0.01 0.00 -0.52 0.00 0.00 57.07 57.84 1dgq s TYR 177 Cb -0.03 -2.42 0.16 0.00 0.38 0.00 0.00 41.96 40.05 1dgq s TYR 177 CO 0.18 -0.39 0.43 0.21 -1.52 0.00 0.00 175.55 174.47 1dgq s LYS 178 N -4.84 0.42 -0.30 -3.49 2.20 0.98 -4.94 119.74 109.77 1dgq s LYS 178 Ca 0.50 0.38 -0.30 0.00 -0.36 0.00 0.00 55.97 56.19 1dgq s LYS 178 Cb -0.10 -0.22 -0.07 0.00 -1.51 0.00 0.00 37.83 35.92 1dgq s LYS 178 CO 0.47 -0.88 2.25 2.41 -0.36 0.00 0.00 175.35 179.25 1dgq n THR 179 N 5.37 0.24 -0.02 3.43 -1.04 -1.26 -0.57 114.28 120.43 1dgq n THR 179 Ca -0.00 -0.45 -0.16 0.00 -2.04 0.00 0.00 64.05 61.40 1dgq n THR 179 Cb 0.50 -2.32 -0.11 0.00 -1.82 0.00 0.00 70.33 66.59 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 14.94 0.31 -2.12 -2.82 4.39 -1.02 -3.48 114.58 124.79 1dgq h GLU 180 Ca -0.34 -0.31 -0.06 0.00 0.34 0.00 0.00 59.36 58.98 1dgq h GLU 180 Cb 1.27 0.08 -0.20 0.00 -0.10 0.00 0.00 28.75 29.80 1dgq h GLU 180 CO 1.01 0.99 0.12 -0.59 -1.16 0.00 0.00 179.01 179.38 1dgq s PHE 181 N -3.30 -0.63 0.57 4.33 -0.12 -0.83 -4.82 117.98 113.19 1dgq s PHE 181 Ca -0.14 1.20 0.07 0.00 -0.05 0.00 0.00 56.93 58.00 1dgq s PHE 181 Cb 0.03 0.34 0.07 0.00 -0.63 0.00 0.00 43.02 42.83 1dgq s PHE 181 CO 0.78 -0.53 0.54 -3.47 -0.05 0.00 0.00 175.22 172.49 1dgq n ASP 182 N 1.35 2.62 0.11 1.98 -0.08 -1.26 -0.66 116.55 120.61 1dgq n ASP 182 Ca -0.18 -2.84 -0.13 0.00 -1.51 0.00 0.00 54.79 50.13 1dgq n ASP 182 Cb 0.57 -0.16 -0.06 0.00 2.34 0.00 0.00 41.12 43.81 1dgq n ASP 182 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1dgq h PHE 183 N 0.50 -0.73 -0.58 -0.67 0.04 -1.62 0.17 116.94 114.05 1dgq h PHE 183 Ca -0.33 0.02 0.12 0.00 2.80 0.00 0.00 57.97 60.57 1dgq h PHE 183 Cb 1.30 0.31 -0.10 0.00 2.20 0.00 0.00 35.95 39.66 1dgq h PHE 183 CO 0.00 -0.37 -0.02 0.66 -0.60 0.00 0.00 178.31 177.98 1dgq h SER 184 N -0.47 -0.29 0.10 2.17 4.64 -0.99 0.12 113.55 118.82 1dgq h SER 184 Ca 0.03 0.15 0.02 0.00 -0.47 0.00 0.00 61.79 61.52 1dgq h SER 184 Cb 0.51 0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 1dgq h SER 184 CO -0.17 -0.11 -0.22 0.44 -0.87 0.00 0.00 176.83 175.90 1dgq h ASP 185 N 0.10 -0.63 -0.35 4.97 3.32 -1.64 0.18 116.42 122.37 1dgq h ASP 185 Ca 0.30 0.08 0.07 0.00 0.02 0.00 0.00 57.03 57.50 1dgq h ASP 185 Cb 0.47 0.24 -0.07 0.00 0.22 0.00 0.00 39.33 40.19 1dgq h ASP 185 CO -0.51 -0.31 -0.14 0.22 -1.72 0.00 0.00 179.24 176.78 1dgq h TYR 186 N -0.41 -0.34 -0.83 4.55 3.20 -0.25 0.18 116.97 123.07 1dgq h TYR 186 Ca 0.03 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.95 1dgq h TYR 186 Cb 0.44 0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.87 1dgq h TYR 186 CO -0.22 -0.22 0.55 0.28 -1.64 0.00 0.00 178.16 176.91 1dgq h VAL 187 N -0.08 1.20 0.52 1.81 2.07 -0.39 0.33 116.25 121.71 1dgq h VAL 187 Ca 0.18 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1dgq h VAL 187 Cb 0.34 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1dgq h VAL 187 CO -0.40 0.20 -0.25 0.50 0.02 0.00 0.00 177.57 177.64 1dgq h LYS 188 N 1.11 -0.67 0.09 1.57 3.64 0.17 -3.37 116.57 119.11 1dgq h LYS 188 Ca 0.31 0.05 -0.32 0.00 -1.27 0.00 0.00 60.65 59.41 1dgq h LYS 188 Cb -0.11 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1dgq h LYS 188 CO -0.07 -0.37 -1.75 -1.49 -2.27 0.00 0.00 179.45 173.50 1dgq h TRP 189 N -0.92 0.34 -6.65 1.91 4.06 -0.92 -3.49 115.95 110.28 1dgq h TRP 189 Ca -0.07 -0.25 -0.53 0.00 2.06 0.00 0.00 58.89 60.10 1dgq h TRP 189 Cb 0.61 -0.01 -0.15 0.00 -1.00 0.00 0.00 29.16 28.61 1dgq h TRP 189 CO 0.00 1.42 -0.85 1.63 -3.56 0.00 0.00 178.44 177.08 1dgq n LYS 190 N -3.35 -3.25 -3.50 0.49 5.02 0.12 -4.96 118.16 108.72 1dgq n LYS 190 Ca -0.22 0.38 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 1dgq n LYS 190 Cb 1.05 -4.86 -0.10 0.00 -0.02 0.00 0.00 35.03 31.10 1dgq n LYS 190 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1dgq s ASP 191 N -3.71 0.22 0.17 4.39 -1.08 -1.26 -5.06 116.67 110.33 1dgq s ASP 191 Ca 0.45 0.47 -0.15 0.00 -0.52 0.00 0.00 52.55 52.81 1dgq s ASP 191 Cb -0.25 1.05 0.05 0.00 -1.46 0.00 0.00 42.92 42.32 1dgq s ASP 191 CO 0.91 -0.27 1.83 1.55 0.52 0.00 0.00 175.17 179.71 1dgq h PRO 192 N 8.21 0.64 -0.81 4.34 0.13 -1.93 -0.70 132.00 141.88 1dgq h PRO 192 Ca -0.17 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 64.93 1dgq h PRO 192 Cb 1.13 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.08 1dgq h PRO 192 CO 0.21 0.42 0.53 -0.44 -0.23 0.00 0.00 178.00 178.49 1dgq h ASP 193 N 0.66 0.91 0.36 1.44 5.19 -1.97 0.21 116.42 123.22 1dgq h ASP 193 Ca 0.18 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.56 1dgq h ASP 193 Cb -0.07 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.23 1dgq h ASP 193 CO -0.05 0.65 -0.17 0.00 -3.12 0.00 0.00 179.24 176.55 1dgq h ALA 194 N 1.31 -0.49 -0.71 3.45 0.00 -1.89 -2.89 119.26 118.04 1dgq h ALA 194 Ca 0.30 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.14 1dgq h ALA 194 Cb -0.09 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1dgq h ALA 194 CO -0.08 -0.74 0.47 -0.07 0.00 0.00 0.00 179.25 178.83 1dgq h LEU 195 N -0.56 0.67 -0.06 0.00 3.38 -0.35 -0.73 115.31 117.66 1dgq h LEU 195 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1dgq h LEU 195 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1dgq h LEU 195 CO 0.08 0.44 -0.01 0.18 0.09 0.00 0.00 178.44 179.23 1dgq n LEU 196 N -4.47 0.09 0.09 1.67 4.77 0.66 -3.90 117.00 115.91 1dgq n LEU 196 Ca 0.10 0.05 0.17 0.00 -0.03 0.00 0.00 56.01 56.31 1dgq n LEU 196 Cb 0.20 -0.09 0.71 0.00 -2.33 0.00 0.00 43.42 41.92 1dgq n LEU 196 CO 0.34 0.02 1.16 0.07 -1.33 0.00 0.00 177.39 177.64 1dgq h LYS 197 N 0.14 0.00 0.00 3.23 2.10 -0.91 -1.00 116.57 120.12 1dgq h LYS 197 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1dgq h LYS 197 Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 1dgq h LYS 197 CO 0.00 0.00 0.00 1.58 -2.00 0.00 0.00 179.45 179.03 1dgq n HIS 198 N -4.24 0.45 -2.07 0.07 -0.00 -1.25 -4.73 115.22 103.44 1dgq n HIS 198 Ca 0.06 0.18 -0.28 0.00 0.46 0.00 0.00 57.72 58.14 1dgq n HIS 198 Cb 0.46 -0.79 -0.05 0.00 -0.12 0.00 0.00 29.99 29.49 1dgq n HIS 198 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1dgq s VAL 199 N -3.18 3.49 -0.56 3.57 1.01 -0.38 -4.90 120.40 119.44 1dgq s VAL 199 Ca 0.05 -0.50 -0.23 0.00 0.00 0.00 0.00 61.98 61.31 1dgq s VAL 199 Cb 0.09 -4.15 0.05 0.00 0.00 0.00 0.00 36.38 32.37 1dgq s VAL 199 CO 0.33 -1.00 0.87 -0.54 0.00 0.00 0.00 175.10 174.76 1dgq s LYS 200 N 6.82 3.24 -0.06 2.72 1.02 -1.26 -5.01 119.74 127.22 1dgq s LYS 200 Ca 0.69 -0.52 -0.29 0.00 0.02 0.00 0.00 55.97 55.87 1dgq s LYS 200 Cb -0.05 -4.10 -0.07 0.00 -0.52 0.00 0.00 37.83 33.09 1dgq s LYS 200 CO 0.01 -1.49 1.97 -1.58 -0.92 0.00 0.00 175.35 173.35 1dgq s HIS 201 N 3.66 1.38 -0.01 3.18 2.46 -1.26 -4.91 115.29 119.79 1dgq s HIS 201 Ca 0.25 -0.08 -0.25 0.00 0.47 0.00 0.00 55.06 55.45 1dgq s HIS 201 Cb -0.15 -4.12 -0.20 0.00 -0.13 0.00 0.00 32.58 27.99 1dgq s HIS 201 CO 0.16 -4.84 1.30 0.52 -2.47 0.00 0.00 174.74 169.41 1dgq h MET 202 N 11.61 0.02 -5.12 2.88 2.86 -1.95 -3.48 114.93 121.75 1dgq h MET 202 Ca -0.45 -0.01 -0.27 0.00 -2.06 0.00 0.00 59.70 56.90 1dgq h MET 202 Cb 1.23 -0.00 0.15 0.00 0.06 0.00 0.00 31.60 33.03 1dgq h MET 202 CO 0.95 0.47 -0.67 1.28 1.06 0.00 0.00 176.91 180.01 1dgq n LEU 203 N -4.85 -3.95 0.00 1.22 4.77 0.44 -4.91 117.00 109.71 1dgq n LEU 203 Ca -0.08 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1dgq n LEU 203 Cb 0.24 -2.76 0.00 0.00 -2.33 0.00 0.00 43.42 38.57 1dgq n LEU 203 CO 0.34 0.29 0.00 0.18 -1.33 0.00 0.00 177.39 176.87 1dgq n LEU 204 N -3.58 0.00 0.00 2.23 4.77 -1.25 -3.87 117.00 115.30 1dgq n LEU 204 Ca -0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 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 0.52 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.76 1dgq n LEU 205 N 0.00 0.00 -3.23 2.23 4.77 -1.26 -1.00 117.00 118.51 1dgq n LEU 205 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1dgq n LEU 205 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1dgq n LEU 205 CO 0.00 0.00 -0.21 0.41 -1.33 0.00 0.00 177.39 176.26 1dgq n THR 206 N 0.00 -0.92 -1.78 -5.08 -1.04 -1.25 -2.90 114.28 101.31 1dgq n THR 206 Ca 0.00 -2.82 -0.40 0.00 -2.04 0.00 0.00 64.05 58.79 1dgq n THR 206 Cb 0.00 -0.99 -0.01 0.00 -1.82 0.00 0.00 70.33 67.51 1dgq n THR 206 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1dgq n ASN 207 N 2.86 7.56 -0.10 8.00 2.85 0.54 -0.26 115.26 136.71 1dgq n ASN 207 Ca 0.27 -2.91 -0.09 0.00 -0.11 0.00 0.00 54.58 51.73 1dgq n ASN 207 Cb 0.50 -1.47 -0.02 0.00 1.24 0.00 0.00 39.78 40.03 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 3.01 1.14 -0.22 -0.44 2.02 -1.90 0.12 112.91 116.64 1dgq h THR 208 Ca 0.71 -0.38 -0.06 0.00 0.77 0.00 0.00 66.41 67.45 1dgq h THR 208 Cb 0.37 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1dgq h THR 208 CO 1.64 0.14 -0.12 -0.26 0.37 0.00 0.00 175.52 177.30 1dgq h PHE 209 N 0.40 0.54 -0.83 3.16 -1.00 -1.86 0.21 116.94 117.55 1dgq h PHE 209 Ca 0.11 -0.14 0.01 0.00 2.81 0.00 0.00 57.97 60.77 1dgq h PHE 209 Cb 0.08 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 39.47 1dgq h PHE 209 CO -0.03 0.75 0.55 0.78 -1.61 0.00 0.00 178.31 178.76 1dgq h GLY 210 N 0.17 1.18 1.06 -1.45 0.00 -1.79 0.15 103.07 102.39 1dgq h GLY 210 Ca 0.05 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1dgq h GLY 210 CO 0.03 0.41 0.15 0.00 0.00 0.00 0.00 176.54 177.13 1dgq h ALA 211 N 1.32 0.89 -0.04 3.60 0.00 -0.58 0.88 119.26 125.33 1dgq h ALA 211 Ca 0.31 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dgq h ALA 211 Cb -0.10 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 1dgq h ALA 211 CO -0.08 0.63 0.02 0.82 0.00 0.00 0.00 179.25 180.65 1dgq h ILE 212 N 1.02 1.01 -0.28 0.00 2.04 -0.02 0.55 117.51 121.83 1dgq h ILE 212 Ca 0.21 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 66.09 1dgq h ILE 212 Cb 0.39 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 1dgq h ILE 212 CO 0.01 0.01 0.05 0.78 0.00 0.00 0.00 178.15 179.00 1dgq h ASN 213 N 0.05 0.00 -0.12 1.72 2.35 -0.69 0.86 115.58 119.75 1dgq h ASN 213 Ca 0.01 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 55.85 1dgq h ASN 213 Cb -0.00 0.06 -0.06 0.00 0.05 0.00 0.00 38.32 38.37 1dgq h ASN 213 CO -0.00 0.04 -0.30 0.22 -1.65 0.00 0.00 177.43 175.74 1dgq h TYR 214 N 0.15 -0.81 -0.10 1.19 3.20 -0.57 -1.87 116.97 118.16 1dgq h TYR 214 Ca 0.13 0.04 0.04 0.00 3.14 0.00 0.00 58.73 62.07 1dgq h TYR 214 Cb 0.13 0.38 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 1dgq h TYR 214 CO -0.17 -0.38 -0.15 0.28 -1.64 0.00 0.00 178.16 176.11 1dgq h VAL 215 N -0.37 0.61 -0.74 1.81 2.07 -0.55 0.25 116.25 119.33 1dgq h VAL 215 Ca 0.10 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.78 1dgq h VAL 215 Cb 0.52 0.61 -0.11 0.00 -1.52 0.00 0.00 31.29 30.79 1dgq h VAL 215 CO -0.33 0.00 0.18 0.00 0.02 0.00 0.00 177.57 177.43 1dgq h ALA 216 N 0.83 0.96 0.02 1.67 0.00 -0.34 -0.80 119.26 121.61 1dgq h ALA 216 Ca 0.08 0.17 -0.39 0.00 0.00 0.00 0.00 54.91 54.77 1dgq h ALA 216 Cb 0.31 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1dgq h ALA 216 CO -0.21 -0.34 -2.28 0.25 0.00 0.00 0.00 179.25 176.66 1dgq n THR 217 N -5.16 1.55 -0.09 0.00 -2.24 -0.75 -4.37 114.28 103.23 1dgq n THR 217 Ca 0.14 -0.45 -0.23 0.00 -2.27 0.00 0.00 64.05 61.24 1dgq n THR 217 Cb 0.47 -1.70 -0.12 0.00 -2.10 0.00 0.00 70.33 66.88 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 -3.77 0.63 -0.04 -0.78 -0.58 0.86 -4.60 120.64 112.35 1dgq n GLU 218 Ca -0.45 0.37 -0.15 0.00 -0.42 0.00 0.00 57.16 56.51 1dgq n GLU 218 Cb 0.93 -1.64 -0.13 0.00 -0.57 0.00 0.00 31.44 30.03 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 -0.63 1.68 -0.03 2.62 2.07 -1.35 -3.37 116.25 117.25 1dgq h VAL 219 Ca -0.49 -2.23 -0.65 0.00 0.82 0.00 0.00 66.70 64.14 1dgq h VAL 219 Cb 1.63 3.18 0.03 0.00 -1.52 0.00 0.00 31.29 34.61 1dgq h VAL 219 CO -0.19 0.59 2.41 0.49 0.02 0.00 0.00 177.57 180.90 1dgq n PHE 220 N -4.53 2.22 -4.51 1.57 3.72 -0.36 -4.74 117.46 110.84 1dgq n PHE 220 Ca -0.10 -2.01 -0.21 0.00 -0.05 0.00 0.00 57.45 55.07 1dgq n PHE 220 Cb 0.52 -1.90 -0.15 0.00 -0.94 0.00 0.00 39.48 37.02 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 4.72 1.02 0.22 -1.08 0.52 -1.26 -4.83 118.95 118.26 1dgq s ARG 221 Ca 0.56 -0.40 -0.08 0.00 -0.52 0.00 0.00 55.73 55.29 1dgq s ARG 221 Cb 0.14 -0.97 0.32 0.00 0.52 0.00 0.00 34.95 34.97 1dgq s ARG 221 CO 0.08 0.21 1.77 0.93 0.02 0.00 0.00 175.30 178.31 1dgq h GLU 222 N 6.04 0.52 -0.89 3.54 5.08 -1.89 -0.37 114.58 126.62 1dgq h GLU 222 Ca -0.33 -0.03 0.19 0.00 -1.00 0.00 0.00 59.36 58.19 1dgq h GLU 222 Cb 1.17 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 30.24 1dgq h GLU 222 CO 0.49 0.34 0.58 1.05 -1.00 0.00 0.00 179.01 180.48 1dgq h GLU 223 N 0.54 0.44 -0.01 2.33 4.11 -1.96 0.18 114.58 120.20 1dgq h GLU 223 Ca 0.34 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.74 1dgq h GLU 223 Cb 0.38 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1dgq h GLU 223 CO -0.28 0.29 -0.08 1.28 0.07 0.00 0.00 179.01 180.29 1dgq n LEU 224 N -4.52 1.21 0.00 3.06 4.77 -0.33 -4.91 117.00 116.28 1dgq n LEU 224 Ca 0.19 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1dgq n LEU 224 Cb 0.65 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 1dgq n LEU 224 CO 0.30 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1dgq n GLY 225 N 1.22 1.24 3.55 -0.72 0.00 0.63 -0.41 105.19 110.71 1dgq n GLY 225 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 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 2.46 0.04 4.61 0.00 -0.30 -4.63 121.76 121.93 1dgq s ALA 226 Ca 0.00 -1.27 -0.30 0.00 0.00 0.00 0.00 51.96 50.39 1dgq s ALA 226 Cb 0.00 -4.34 -0.08 0.00 0.00 0.00 0.00 23.12 18.70 1dgq s ALA 226 CO 0.00 -3.67 1.84 1.03 0.00 0.00 0.00 175.76 174.96 1dgq s ARG 227 N 6.18 4.16 0.28 0.00 0.52 -1.26 -3.76 118.95 125.06 1dgq s ARG 227 Ca 0.50 2.49 -0.01 0.00 -0.52 0.00 0.00 55.73 58.19 1dgq s ARG 227 Cb -0.08 -3.96 0.40 0.00 0.52 0.00 0.00 34.95 31.82 1dgq s ARG 227 CO 0.12 -0.89 1.80 -1.00 0.02 0.00 0.00 175.30 175.35 1dgq h PRO 228 N 9.77 0.75 -0.52 3.54 0.13 -1.98 -2.12 132.00 141.57 1dgq h PRO 228 Ca -0.46 -0.18 -0.03 0.00 -0.87 0.00 0.00 66.00 64.47 1dgq h PRO 228 Cb 1.22 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 1dgq h PRO 228 CO 0.94 0.74 0.22 0.22 -0.23 0.00 0.00 178.00 179.89 1dgq h ASP 229 N 0.72 0.67 -4.03 1.44 3.58 -1.97 -3.45 116.42 113.38 1dgq h ASP 229 Ca 0.15 -0.07 -0.54 0.00 0.42 0.00 0.00 57.03 56.98 1dgq h ASP 229 Cb 0.38 -0.17 0.12 0.00 1.72 0.00 0.00 39.33 41.38 1dgq h ASP 229 CO 0.01 0.60 0.61 0.00 -2.88 0.00 0.00 179.24 177.58 1dgq s ALA 230 N -5.37 2.92 0.16 -0.78 0.00 -0.80 -4.76 121.76 113.14 1dgq s ALA 230 Ca -0.09 1.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.86 1dgq s ALA 230 Cb 0.16 -3.55 -0.11 0.00 0.00 0.00 0.00 23.12 19.63 1dgq s ALA 230 CO 0.77 -1.24 1.76 0.99 0.00 0.00 0.00 175.76 178.04 1dgq s THR 231 N -1.31 2.32 -1.31 0.00 2.01 -0.43 -4.59 115.64 112.32 1dgq s THR 231 Ca 0.68 0.07 -0.16 0.00 0.31 0.00 0.00 61.69 62.59 1dgq s THR 231 Cb -0.40 -3.05 0.09 0.00 0.01 0.00 0.00 72.50 69.16 1dgq s THR 231 CO 0.48 0.00 1.78 0.29 -0.69 0.00 0.00 174.62 176.48 1dgq n LYS 232 N 4.78 3.19 -3.30 4.92 4.76 -1.26 -0.51 118.16 130.74 1dgq n LYS 232 Ca 0.17 -3.27 -0.38 0.00 -2.87 0.00 0.00 58.31 51.95 1dgq n LYS 232 Cb 0.37 -3.35 -0.06 0.00 -1.84 0.00 0.00 35.03 30.14 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 3.38 5.16 -0.33 -0.18 1.01 0.74 -0.42 120.40 129.77 1dgq s VAL 233 Ca 0.50 0.94 0.03 0.00 0.00 0.00 0.00 61.98 63.45 1dgq s VAL 233 Cb 0.05 -3.82 0.09 0.00 0.00 0.00 0.00 36.38 32.71 1dgq s VAL 233 CO 0.03 0.28 0.04 -0.22 0.00 0.00 0.00 175.10 175.22 1dgq s LEU 234 N 0.97 4.31 -0.57 3.92 2.96 0.44 -0.55 118.68 130.16 1dgq s LEU 234 Ca 0.25 -2.00 -0.19 0.00 -0.22 0.00 0.00 54.13 51.97 1dgq s LEU 234 Cb -0.15 -1.53 0.09 0.00 0.50 0.00 0.00 46.19 45.11 1dgq s LEU 234 CO 0.10 -0.36 0.68 -0.63 -1.32 0.00 0.00 176.35 174.82 1dgq s ILE 235 N 1.01 4.84 -0.08 6.68 1.01 0.46 -0.68 121.20 134.44 1dgq s ILE 235 Ca 0.08 -0.91 -0.30 0.00 0.00 0.00 0.00 60.65 59.53 1dgq s ILE 235 Cb -0.19 -4.45 -0.02 0.00 0.01 0.00 0.00 42.46 37.82 1dgq s ILE 235 CO -0.10 -1.06 1.01 -0.63 0.00 0.00 0.00 174.94 174.17 1dgq s ILE 236 N 2.65 4.76 -0.25 2.92 1.09 0.61 -0.50 121.20 132.48 1dgq s ILE 236 Ca 0.12 2.02 -0.03 0.00 -1.10 0.00 0.00 60.65 61.66 1dgq s ILE 236 Cb -0.23 -4.30 0.02 0.00 -1.06 0.00 0.00 42.46 36.89 1dgq s ILE 236 CO 0.07 0.04 -0.04 -0.63 -0.10 0.00 0.00 174.94 174.28 1dgq s ILE 237 N 1.80 3.07 -0.04 2.92 1.01 0.05 -0.74 121.20 129.27 1dgq s ILE 237 Ca 0.50 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 60.06 1dgq s ILE 237 Cb -0.19 -2.56 0.02 0.00 0.01 0.00 0.00 42.46 39.75 1dgq s ILE 237 CO 0.20 0.19 0.31 0.28 0.00 0.00 0.00 174.94 175.92 1dgq s THR 238 N 1.36 0.04 -0.57 2.92 -1.32 -0.45 -0.33 115.64 117.30 1dgq s THR 238 Ca 0.01 -0.36 0.22 0.00 -1.21 0.00 0.00 61.69 60.35 1dgq s THR 238 Cb -0.17 -0.57 -0.19 0.00 -1.51 0.00 0.00 72.50 70.06 1dgq s THR 238 CO -0.03 -0.20 0.87 -0.90 -2.21 0.00 0.00 174.62 172.15 1dgq n ASP 239 N 1.69 0.57 -4.27 8.08 5.75 -1.26 -0.61 116.55 126.50 1dgq n ASP 239 Ca -0.19 -0.35 -0.21 0.00 -0.01 0.00 0.00 54.79 54.02 1dgq n ASP 239 Cb 0.56 1.12 -0.12 0.00 -1.03 0.00 0.00 41.12 41.66 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 -3.70 1.20 0.89 6.12 0.00 -1.26 -2.72 107.32 107.85 1dgq s GLY 240 Ca 0.02 -1.30 -0.12 0.00 0.00 0.00 0.00 44.72 43.31 1dgq s GLY 240 CO 0.84 -1.34 0.83 1.18 0.00 0.00 0.00 173.10 174.62 1dgq n GLU 241 N 0.71 -0.22 -1.87 2.90 4.71 -1.26 -4.89 120.64 120.72 1dgq n GLU 241 Ca -0.17 -0.00 -0.34 0.00 -0.01 0.00 0.00 57.16 56.64 1dgq n GLU 241 Cb 0.56 -2.15 -0.04 0.00 -1.01 0.00 0.00 31.44 28.80 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 -2.39 1.82 0.37 0.62 0.00 -1.26 -4.68 121.76 116.24 1dgq s ALA 242 Ca 0.64 -0.61 0.39 0.00 0.00 0.00 0.00 51.96 52.39 1dgq s ALA 242 Cb -0.24 -4.38 1.89 0.00 0.00 0.00 0.00 23.12 20.38 1dgq s ALA 242 CO 0.60 -4.36 2.17 1.79 0.00 0.00 0.00 175.76 175.96 1dgq h THR 243 N 7.23 0.00 0.02 0.00 1.35 -0.97 -3.19 112.91 117.35 1dgq h THR 243 Ca -0.18 -0.26 -0.38 0.00 -0.55 0.00 0.00 66.41 65.03 1dgq h THR 243 Cb 1.15 1.26 -0.05 0.00 -1.73 0.00 0.00 68.15 68.78 1dgq h THR 243 CO 1.18 0.00 -2.18 -0.90 -0.25 0.00 0.00 175.52 173.38 1dgq n ASP 244 N -3.08 1.98 -4.04 5.36 5.75 -1.25 -5.00 116.55 116.26 1dgq n ASP 244 Ca -0.01 0.20 -0.29 0.00 -0.01 0.00 0.00 54.79 54.68 1dgq n ASP 244 Cb 0.19 -0.74 -0.04 0.00 -1.03 0.00 0.00 41.12 39.50 1dgq n ASP 244 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1dgq n SER 245 N -3.87 -0.61 0.00 -1.12 7.64 -1.21 -4.96 113.62 109.49 1dgq n SER 245 Ca -0.44 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.34 1dgq n SER 245 Cb 0.90 -2.57 0.00 0.00 -1.01 0.00 0.00 64.21 61.53 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 -2.14 1.71 3.42 0.23 0.00 -1.26 -5.08 105.19 102.07 1dgq n GLY 246 Ca -0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.03 -0.02 0.00 1.61 2.20 -1.26 -5.07 114.94 111.37 1dgq s ASN 247 Ca 0.00 -0.90 0.04 0.00 -0.94 0.00 0.00 52.86 51.06 1dgq s ASN 247 Cb 0.00 0.49 0.07 0.00 -2.00 0.00 0.00 41.25 39.81 1dgq s ASN 247 CO 0.00 -0.97 1.01 2.30 -2.94 0.00 0.00 177.10 176.50 1dgq n ILE 248 N -0.28 0.00 -0.30 0.54 -5.35 -1.26 -4.62 119.36 108.08 1dgq n ILE 248 Ca -0.05 -0.16 0.03 0.00 -0.27 0.00 0.00 62.75 62.31 1dgq n ILE 248 Cb 0.63 0.56 0.18 0.00 -1.74 0.00 0.00 39.64 39.27 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 0.16 0.72 -1.38 7.28 5.19 -1.97 0.60 116.42 127.01 1dgq h ASP 249 Ca -0.04 0.05 0.43 0.00 -0.62 0.00 0.00 57.03 56.84 1dgq h ASP 249 Cb 1.47 -0.09 -0.11 0.00 0.18 0.00 0.00 39.33 40.78 1dgq h ASP 249 CO 0.01 0.41 0.93 0.00 -3.12 0.00 0.00 179.24 177.47 1dgq h ALA 250 N 1.46 2.91 -0.62 3.45 0.00 -1.96 -0.18 119.26 124.32 1dgq h ALA 250 Ca 0.41 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1dgq h ALA 250 Cb 0.37 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1dgq h ALA 250 CO -0.25 -1.47 0.00 0.00 0.00 0.00 0.00 179.25 177.53 1dgq n ALA 251 N -2.61 2.46 -0.33 0.00 0.00 0.20 -4.76 120.51 115.47 1dgq n ALA 251 Ca 0.36 -1.35 0.17 0.00 0.00 0.00 0.00 53.44 52.62 1dgq n ALA 251 Cb 1.44 -0.82 0.35 0.00 0.00 0.00 0.00 19.45 20.42 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 3.67 0.06 0.00 0.00 -0.00 -1.01 0.82 116.57 120.12 1dgq h LYS 252 Ca 0.00 -0.00 -0.12 0.00 -0.00 0.00 0.00 60.65 60.53 1dgq h LYS 252 Cb 1.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 32.23 33.22 1dgq h LYS 252 CO 0.05 0.04 -0.72 0.38 -0.00 0.00 0.00 179.45 179.19 1dgq h ASP 253 N 0.06 0.00 -3.85 7.07 2.03 -1.85 -3.46 116.42 116.42 1dgq h ASP 253 Ca 0.63 0.00 -0.50 0.00 -0.73 0.00 0.00 57.03 56.43 1dgq h ASP 253 Cb 1.40 0.00 0.03 0.00 -0.83 0.00 0.00 39.33 39.92 1dgq h ASP 253 CO -0.82 0.51 0.49 -0.63 -1.03 0.00 0.00 179.24 177.76 1dgq s ILE 254 N -2.96 3.37 -0.76 4.15 1.01 0.28 -4.87 121.20 121.41 1dgq s ILE 254 Ca 0.02 1.32 -0.25 0.00 0.00 0.00 0.00 60.65 61.74 1dgq s ILE 254 Cb 0.08 -3.81 0.05 0.00 0.01 0.00 0.00 42.46 38.78 1dgq s ILE 254 CO 0.76 0.27 1.20 -0.63 0.00 0.00 0.00 174.94 176.54 1dgq s ILE 255 N -1.24 3.99 -0.88 2.92 -1.09 0.44 -4.87 121.20 120.46 1dgq s ILE 255 Ca 0.48 -0.10 -0.25 0.00 -2.23 0.00 0.00 60.65 58.55 1dgq s ILE 255 Cb -0.32 -4.86 -0.00 0.00 -1.58 0.00 0.00 42.46 35.70 1dgq s ILE 255 CO 0.41 -1.73 1.68 -0.13 -1.23 0.00 0.00 174.94 173.94 1dgq s ARG 256 N 4.95 3.00 0.03 2.79 3.00 -1.26 -0.42 118.95 131.05 1dgq s ARG 256 Ca 0.32 -0.45 -0.23 0.00 0.00 0.00 0.00 55.73 55.38 1dgq s ARG 256 Cb -0.09 -4.97 -0.06 0.00 0.00 0.00 0.00 34.95 29.84 1dgq s ARG 256 CO 0.09 -2.73 0.68 -0.47 0.00 0.00 0.00 175.30 172.87 1dgq s TYR 257 N 7.63 3.72 -0.05 -0.53 6.14 0.14 -1.12 117.35 133.29 1dgq s TYR 257 Ca 0.57 1.35 0.00 0.00 0.64 0.00 0.00 57.07 59.63 1dgq s TYR 257 Cb -0.05 -2.71 0.02 0.00 0.42 0.00 0.00 41.96 39.64 1dgq s TYR 257 CO 0.01 0.33 -0.03 -1.50 0.64 0.00 0.00 175.55 175.01 1dgq s ILE 258 N -0.21 0.42 -0.38 3.14 2.07 0.25 -0.28 121.20 126.21 1dgq s ILE 258 Ca 0.35 -0.03 -0.15 0.00 -1.41 0.00 0.00 60.65 59.41 1dgq s ILE 258 Cb -0.20 -0.48 0.00 0.00 0.13 0.00 0.00 42.46 41.91 1dgq s ILE 258 CO 0.20 0.21 0.33 -0.63 -1.91 0.00 0.00 174.94 173.14 1dgq s ILE 259 N 1.12 5.21 -0.54 2.00 1.09 0.08 -0.63 121.20 129.53 1dgq s ILE 259 Ca -0.08 -0.34 -0.18 0.00 -1.10 0.00 0.00 60.65 58.95 1dgq s ILE 259 Cb -0.14 -3.87 0.08 0.00 -1.06 0.00 0.00 42.46 37.47 1dgq s ILE 259 CO -0.01 -0.21 0.62 -0.83 -0.10 0.00 0.00 174.94 174.41 1dgq s GLY 260 N 1.73 1.82 0.31 6.18 0.00 0.41 -1.34 107.32 116.43 1dgq s GLY 260 Ca 0.08 -2.01 -0.29 0.00 0.00 0.00 0.00 44.72 42.50 1dgq s GLY 260 CO 0.11 1.45 1.38 -0.42 0.00 0.00 0.00 173.10 175.62 1dgq s ILE 261 N 2.48 2.59 0.00 0.90 -1.09 0.22 -0.44 121.20 125.86 1dgq s ILE 261 Ca 0.12 0.56 -0.03 0.00 -2.23 0.00 0.00 60.65 59.07 1dgq s ILE 261 Cb -0.22 -3.35 -0.12 0.00 -1.58 0.00 0.00 42.46 37.18 1dgq s ILE 261 CO 0.09 0.12 2.43 0.61 -1.23 0.00 0.00 174.94 176.96 1dgq n GLY 262 N 1.18 2.43 0.10 6.18 0.00 0.63 -3.33 105.19 112.38 1dgq n GLY 262 Ca 0.02 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.35 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 2.12 0.54 -0.11 1.61 4.76 -1.26 -4.26 118.16 121.56 1dgq n LYS 263 Ca 0.19 0.31 -0.24 0.00 -2.87 0.00 0.00 58.31 55.69 1dgq n LYS 263 Cb 0.60 -1.52 -0.11 0.00 -1.84 0.00 0.00 35.03 32.17 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 -4.42 0.72 0.71 2.13 8.25 -1.10 -4.46 115.22 117.05 1dgq n HIS 264 Ca -0.27 0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1dgq n HIS 264 Cb 0.61 -1.07 0.03 0.00 1.12 0.00 0.00 29.99 30.67 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 -4.38 0.00 0.12 4.41 3.72 -1.21 -1.10 117.46 119.02 1dgq n PHE 265 Ca -0.39 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.00 1dgq n PHE 265 Cb 0.74 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.37 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 0.00 0.00 -6.14 -1.08 3.07 -1.78 -3.36 115.11 105.81 1dgq h GLN 266 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 58.65 58.17 1dgq h GLN 266 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.52 1dgq h GLN 266 CO 0.00 0.69 0.88 0.95 0.09 0.00 0.00 178.83 181.44 1dgq s THR 267 N -3.26 4.35 0.27 1.86 -4.23 -0.26 -4.92 115.64 109.45 1dgq s THR 267 Ca 0.00 1.63 -0.04 0.00 -1.18 0.00 0.00 61.69 62.10 1dgq s THR 267 Cb 0.11 -4.05 0.35 0.00 1.34 0.00 0.00 72.50 70.24 1dgq s THR 267 CO 0.77 -0.14 1.60 0.50 -0.54 0.00 0.00 174.62 176.81 1dgq h LYS 268 N 8.05 0.05 -0.88 3.99 1.63 -1.89 0.21 116.57 127.73 1dgq h LYS 268 Ca -0.25 -0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.61 1dgq h LYS 268 Cb 1.10 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.65 1dgq h LYS 268 CO 0.97 0.04 0.55 1.05 -3.45 0.00 0.00 179.45 178.60 1dgq h GLU 269 N 0.06 0.96 0.13 1.90 4.11 -1.96 -0.13 114.58 119.65 1dgq h GLU 269 Ca 0.48 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.85 1dgq h GLU 269 Cb 0.89 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1dgq h GLU 269 CO -0.80 0.63 -0.06 1.03 0.07 0.00 0.00 179.01 179.88 1dgq h SER 270 N 0.99 -0.15 -0.96 3.06 0.87 -1.11 -3.30 113.55 112.95 1dgq h SER 270 Ca 0.39 -0.39 0.17 0.00 -1.23 0.00 0.00 61.79 60.73 1dgq h SER 270 Cb 0.20 0.04 -0.17 0.00 -0.44 0.00 0.00 62.40 62.03 1dgq h SER 270 CO -0.18 0.38 -0.31 -0.61 -0.53 0.00 0.00 176.83 175.58 1dgq h GLN 271 N -0.75 -0.01 -1.01 2.24 -0.00 -0.25 0.87 115.11 116.20 1dgq h GLN 271 Ca -0.02 0.00 0.14 0.00 -0.00 0.00 0.00 58.65 58.78 1dgq h GLN 271 Cb 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 27.48 27.92 1dgq h GLN 271 CO 0.03 -0.01 0.63 0.93 0.00 0.00 0.00 178.83 180.41 1dgq h GLU 272 N -0.01 0.90 -0.81 1.69 5.08 -1.11 -3.00 114.58 117.32 1dgq h GLU 272 Ca 0.41 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.81 1dgq h GLU 272 Cb 0.66 -0.20 -0.08 0.00 0.50 0.00 0.00 28.75 29.63 1dgq h GLU 272 CO -0.98 0.59 0.45 1.79 -1.00 0.00 0.00 179.01 179.86 1dgq h THR 273 N 0.92 0.87 -0.93 1.13 1.35 -0.91 -0.42 112.91 114.92 1dgq h THR 273 Ca 0.53 -0.25 0.28 0.00 -0.55 0.00 0.00 66.41 66.41 1dgq h THR 273 Cb 0.63 0.07 -0.15 0.00 -1.73 0.00 0.00 68.15 66.96 1dgq h THR 273 CO -0.31 0.13 0.29 -0.07 -0.25 0.00 0.00 175.52 175.32 1dgq h LEU 274 N 0.74 0.04 -1.83 3.87 3.38 -1.64 0.64 115.31 120.51 1dgq h LEU 274 Ca 0.40 0.22 0.08 0.00 0.09 0.00 0.00 57.88 58.67 1dgq h LEU 274 Cb 0.41 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 1dgq h LEU 274 CO -0.27 -0.22 0.28 0.45 0.09 0.00 0.00 178.44 178.77 1dgq h HIS 275 N 0.17 0.21 -0.30 1.13 3.86 -1.23 0.14 115.15 119.13 1dgq h HIS 275 Ca 0.62 0.01 -0.18 0.00 -1.16 0.00 0.00 60.37 59.65 1dgq h HIS 275 Cb 1.35 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 29.75 1dgq h HIS 275 CO -0.24 0.11 -0.53 0.87 0.86 0.00 0.00 177.93 179.00 1dgq h LYS 276 N 0.21 0.88 -0.03 2.45 1.57 -0.98 -3.32 116.57 117.35 1dgq h LYS 276 Ca 0.18 -0.55 -0.03 0.00 -1.87 0.00 0.00 60.65 58.38 1dgq h LYS 276 Cb 0.46 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1dgq h LYS 276 CO -0.03 1.19 -0.10 0.74 -0.57 0.00 0.00 179.45 180.67 1dgq h PHE 277 N 0.68 0.16 -4.22 -1.35 0.04 -1.02 -3.46 116.94 107.78 1dgq h PHE 277 Ca 0.02 -0.07 -0.53 0.00 2.80 0.00 0.00 57.97 60.19 1dgq h PHE 277 Cb 1.14 -0.03 0.18 0.00 2.20 0.00 0.00 35.95 39.45 1dgq h PHE 277 CO 0.07 0.72 0.31 0.00 -0.60 0.00 0.00 178.31 178.82 1dgq s ALA 278 N -3.73 1.78 0.88 2.45 0.00 0.30 -4.77 121.76 118.66 1dgq s ALA 278 Ca -0.16 0.77 -0.12 0.00 0.00 0.00 0.00 51.96 52.45 1dgq s ALA 278 Cb 0.02 -3.48 0.12 0.00 0.00 0.00 0.00 23.12 19.78 1dgq s ALA 278 CO 0.71 -2.37 1.11 -1.12 0.00 0.00 0.00 175.76 174.10 1dgq s SER 279 N -2.31 3.74 0.01 0.00 0.01 -0.28 -4.90 113.70 109.97 1dgq s SER 279 Ca 0.71 1.16 0.01 0.00 1.31 0.00 0.00 55.95 59.14 1dgq s SER 279 Cb -0.27 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.11 1dgq s SER 279 CO 0.52 -2.43 0.04 -0.54 0.41 0.00 0.00 173.24 171.24 1dgq s LYS 280 N -5.17 2.89 0.03 12.44 -0.14 -1.26 -3.45 119.74 125.08 1dgq s LYS 280 Ca 0.63 -0.58 -0.30 0.00 -1.36 0.00 0.00 55.97 54.35 1dgq s LYS 280 Cb -0.15 -2.74 -0.05 0.00 -1.68 0.00 0.00 37.83 33.20 1dgq s LYS 280 CO 0.54 0.62 1.27 -2.14 -0.76 0.00 0.00 175.35 174.89 1dgq s PRO 281 N -1.73 4.37 0.54 -1.68 0.02 -1.26 -4.99 135.00 130.27 1dgq s PRO 281 Ca 0.22 1.83 0.22 0.00 0.02 0.00 0.00 61.00 63.29 1dgq s PRO 281 Cb -0.12 -3.43 1.42 0.00 0.02 0.00 0.00 34.50 32.40 1dgq s PRO 281 CO 0.13 -0.39 2.12 0.00 -0.33 0.00 0.00 177.00 178.53 1dgq h ALA 282 N 7.16 2.02 -0.76 -1.55 0.00 -1.90 0.11 119.26 124.34 1dgq h ALA 282 Ca -0.39 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.61 1dgq h ALA 282 Cb 1.19 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 1dgq h ALA 282 CO 0.85 -0.19 0.50 0.66 0.00 0.00 0.00 179.25 181.08 1dgq h SER 283 N 0.00 0.62 0.05 0.00 4.64 -1.89 0.16 113.55 117.13 1dgq h SER 283 Ca 0.07 0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.23 1dgq h SER 283 Cb 0.29 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 1dgq h SER 283 CO -0.00 0.37 -0.92 -0.33 -0.87 0.00 0.00 176.83 175.09 1dgq h GLU 284 N 0.69 0.10 0.00 4.77 4.39 -1.20 -3.41 114.58 119.92 1dgq h GLU 284 Ca 0.35 -0.17 -0.16 0.00 0.34 0.00 0.00 59.36 59.72 1dgq h GLU 284 Cb 0.44 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 1dgq h GLU 284 CO -0.13 1.08 -0.77 0.74 -1.16 0.00 0.00 179.01 178.77 1dgq h PHE 285 N -0.73 0.00 -3.45 4.33 0.04 -1.05 -3.43 116.94 112.65 1dgq h PHE 285 Ca -0.22 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.95 1dgq h PHE 285 Cb 1.39 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 39.44 1dgq h PHE 285 CO 0.17 0.77 -0.03 0.08 -0.60 0.00 0.00 178.31 178.69 1dgq s VAL 286 N -2.85 5.11 -0.29 -0.55 1.01 0.55 -0.58 120.40 122.80 1dgq s VAL 286 Ca 0.02 0.98 0.01 0.00 0.00 0.00 0.00 61.98 62.99 1dgq s VAL 286 Cb 0.09 -3.85 0.06 0.00 0.00 0.00 0.00 36.38 32.68 1dgq s VAL 286 CO 0.79 0.19 -0.05 -0.54 0.00 0.00 0.00 175.10 175.48 1dgq s LYS 287 N 1.56 2.23 -0.51 2.72 -0.14 0.19 -4.79 119.74 121.00 1dgq s LYS 287 Ca 0.25 -1.39 -0.27 0.00 -1.36 0.00 0.00 55.97 53.20 1dgq s LYS 287 Cb -0.15 -3.04 0.03 0.00 -1.68 0.00 0.00 37.83 32.98 1dgq s LYS 287 CO 0.10 -0.64 1.06 0.42 -0.76 0.00 0.00 175.35 175.53 1dgq s ILE 288 N 1.13 4.26 -0.53 2.17 -1.09 -1.26 -0.44 121.20 125.44 1dgq s ILE 288 Ca -0.05 0.89 -0.06 0.00 -2.23 0.00 0.00 60.65 59.19 1dgq s ILE 288 Cb -0.20 -4.58 0.14 0.00 -1.58 0.00 0.00 42.46 36.24 1dgq s ILE 288 CO -0.04 -1.05 0.37 -0.22 -1.23 0.00 0.00 174.94 172.77 1dgq s LEU 289 N 4.30 5.56 0.00 2.97 2.96 0.41 -4.90 118.68 129.99 1dgq s LEU 289 Ca 0.41 -2.27 -0.01 0.00 -0.22 0.00 0.00 54.13 52.04 1dgq s LEU 289 Cb -0.09 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 1dgq s LEU 289 CO 0.27 -0.56 0.09 -0.67 -1.32 0.00 0.00 176.35 174.17 1dgq n ASP 290 N 4.36 -0.03 -4.10 3.68 2.03 -1.26 -0.27 116.55 120.96 1dgq n ASP 290 Ca -0.00 0.10 -0.11 0.00 0.52 0.00 0.00 54.79 55.29 1dgq n ASP 290 Cb 0.41 -0.03 -0.11 0.00 -0.72 0.00 0.00 41.12 40.67 1dgq n ASP 290 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1dgq s THR 291 N -3.67 0.54 0.39 5.18 -4.23 -1.26 -2.95 115.64 109.63 1dgq s THR 291 Ca -0.00 -1.42 0.18 0.00 -1.18 0.00 0.00 61.69 59.27 1dgq s THR 291 Cb 0.00 -1.03 0.39 0.00 1.34 0.00 0.00 72.50 73.20 1dgq s THR 291 CO 0.02 -0.61 1.74 -0.26 -0.54 0.00 0.00 174.62 174.96 1dgq h PHE 292 N 3.87 0.72 -0.94 3.99 0.04 -1.97 0.97 116.94 123.61 1dgq h PHE 292 Ca -0.35 0.03 0.26 0.00 2.80 0.00 0.00 57.97 60.70 1dgq h PHE 292 Cb 1.19 -0.20 -0.17 0.00 2.20 0.00 0.00 35.95 38.96 1dgq h PHE 292 CO 0.62 0.01 0.07 1.49 -0.60 0.00 0.00 178.31 179.89 1dgq h GLU 293 N 0.38 0.05 0.00 1.51 4.81 -1.96 0.53 114.58 119.90 1dgq h GLU 293 Ca 0.64 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.87 1dgq h GLU 293 Cb 1.61 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.98 1dgq h GLU 293 CO -0.37 0.03 0.00 1.63 -0.73 0.00 0.00 179.01 179.57 1dgq n LYS 294 N -5.43 0.44 -0.18 1.92 4.76 0.33 -3.30 118.16 116.70 1dgq n LYS 294 Ca 0.22 0.05 0.20 0.00 -2.87 0.00 0.00 58.31 55.92 1dgq n LYS 294 Cb 0.72 -1.50 0.57 0.00 -1.84 0.00 0.00 35.03 32.99 1dgq n LYS 294 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1dgq h LEU 295 N 0.00 0.28 -0.15 -0.35 3.38 -1.00 0.12 115.31 117.59 1dgq h LEU 295 Ca 0.00 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1dgq h LEU 295 Cb 0.14 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1dgq h LEU 295 CO 0.00 0.12 0.03 0.11 0.09 0.00 0.00 178.44 178.79 1dgq h LYS 296 N 0.28 0.09 0.02 1.13 1.57 -1.77 0.22 116.57 118.12 1dgq h LYS 296 Ca 0.41 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.19 1dgq h LYS 296 Cb 1.18 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1dgq h LYS 296 CO -0.11 0.06 -0.01 0.22 -0.57 0.00 0.00 179.45 179.04 1dgq h ASP 297 N 0.10 -0.02 -0.45 0.86 3.58 -1.21 -2.67 116.42 116.61 1dgq h ASP 297 Ca 0.07 -0.37 0.05 0.00 0.42 0.00 0.00 57.03 57.20 1dgq h ASP 297 Cb 0.06 0.01 -0.05 0.00 1.72 0.00 0.00 39.33 41.06 1dgq h ASP 297 CO -0.09 0.36 0.18 0.25 -2.88 0.00 0.00 179.24 177.06 1dgq h LEU 298 N -0.41 0.22 -0.45 2.28 5.85 -0.81 -0.13 115.31 121.85 1dgq h LEU 298 Ca -0.00 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1dgq h LEU 298 Cb 0.39 0.01 -0.10 0.00 0.37 0.00 0.00 40.66 41.34 1dgq h LEU 298 CO 0.00 0.16 -0.27 0.15 -0.34 0.00 0.00 178.44 178.14 1dgq h PHE 299 N 0.37 -0.74 -0.49 1.25 3.57 -0.53 0.22 116.94 120.59 1dgq h PHE 299 Ca 0.21 0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.80 1dgq h PHE 299 Cb 0.18 0.39 -0.04 0.00 2.79 0.00 0.00 35.95 39.27 1dgq h PHE 299 CO -0.14 -0.35 0.26 1.15 -2.23 0.00 0.00 178.31 177.01 1dgq h THR 300 N -0.18 0.98 0.02 4.41 2.02 -0.90 0.28 112.91 119.54 1dgq h THR 300 Ca 0.20 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.21 1dgq h THR 300 Cb 0.51 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1dgq h THR 300 CO -0.56 0.09 -0.02 -0.08 0.37 0.00 0.00 175.52 175.32 1dgq h GLU 301 N 0.51 -0.05 -0.72 6.66 4.81 0.05 0.25 114.58 126.10 1dgq h GLU 301 Ca 0.21 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 1dgq h GLU 301 Cb 0.10 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1dgq h GLU 301 CO -0.14 -0.03 0.23 -0.07 -0.73 0.00 0.00 179.01 178.27 1dgq h LEU 302 N -0.05 1.05 -0.61 1.64 3.38 -0.28 -1.39 115.31 119.04 1dgq h LEU 302 Ca 0.00 -0.21 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1dgq h LEU 302 Cb 0.05 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 1dgq h LEU 302 CO -0.01 0.98 0.35 -0.61 0.09 0.00 0.00 178.44 179.24 1dgq h GLN 303 N 1.07 0.66 0.12 1.13 5.75 -0.13 0.25 115.11 123.94 1dgq h GLN 303 Ca 0.23 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.71 1dgq h GLN 303 Cb 0.30 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 1dgq h GLN 303 CO -0.01 0.43 -0.18 -0.22 -2.65 0.00 0.00 178.83 176.21 1dgq h LYS 304 N 0.68 -0.34 -0.30 1.69 3.64 -0.62 0.68 116.57 121.99 1dgq h LYS 304 Ca 0.26 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.73 1dgq h LYS 304 Cb 0.10 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.94 1dgq h LYS 304 CO -0.14 -0.23 -0.09 0.87 -2.27 0.00 0.00 179.45 177.60 1dgq h LYS 305 N -0.35 -0.02 -0.80 1.90 1.57 -0.34 -0.73 116.57 117.79 1dgq h LYS 305 Ca 0.02 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1dgq h LYS 305 Cb 0.37 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.62 1dgq h LYS 305 CO -0.09 -0.01 0.48 0.82 -0.57 0.00 0.00 179.45 180.08 1dgq h ILE 306 N -0.02 1.00 -0.73 1.86 2.04 -0.37 0.17 117.51 121.47 1dgq h ILE 306 Ca 0.14 -0.30 0.08 0.00 1.00 0.00 0.00 64.86 65.79 1dgq h ILE 306 Cb 0.24 0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 36.31 1dgq h ILE 306 CO -0.31 0.16 0.39 0.22 0.00 0.00 0.00 178.15 178.60 1dgq h TYR 307 N 0.87 0.71 -0.74 1.37 3.20 0.08 -1.32 116.97 121.14 1dgq h TYR 307 Ca 0.36 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.22 1dgq h TYR 307 Cb 0.21 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 1dgq h TYR 307 CO -0.05 0.30 0.30 0.28 -1.64 0.00 0.00 178.16 177.35 1dgq h VAL 308 N 0.68 1.25 0.04 1.81 2.07 0.52 0.27 116.25 122.89 1dgq h VAL 308 Ca 0.34 -0.79 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1dgq h VAL 308 Cb 0.30 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.41 1dgq h VAL 308 CO -0.23 0.32 -0.29 0.40 0.02 0.00 0.00 177.57 177.79 1dgq h ILE 309 N 1.06 0.36 0.00 4.57 1.08 0.30 -1.92 117.51 122.96 1dgq h ILE 309 Ca 0.25 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.60 1dgq h ILE 309 Cb 0.21 0.36 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 1dgq h ILE 309 CO -0.02 0.00 -0.53 1.05 -0.69 0.00 0.00 178.15 177.96 1dgq h GLU 310 N -0.46 0.00 0.00 2.37 4.11 -1.28 0.19 114.58 119.51 1dgq h GLU 310 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1dgq h GLU 310 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1dgq h GLU 310 CO -0.22 0.53 0.00 0.41 0.07 0.00 0.00 179.01 179.80