#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 2.63 -1.46 3.04 0.00 -1.26 -4.44 120.51 119.02 1dgq n ALA 125 Ca 0.00 -3.15 -0.40 0.00 0.00 0.00 0.00 53.44 49.89 1dgq n ALA 125 Cb 0.00 -3.63 -0.02 0.00 0.00 0.00 0.00 19.45 15.81 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 9.04 6.22 0.00 0.00 7.64 -0.75 -4.70 113.62 131.06 1dgq n SER 126 Ca 0.48 -2.68 0.00 0.00 1.01 0.00 0.00 58.87 57.68 1dgq n SER 126 Cb 0.42 -1.56 0.00 0.00 -1.01 0.00 0.00 64.21 62.05 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 4.84 0.00 -0.03 1.43 4.81 -1.23 -3.71 118.16 124.27 1dgq n LYS 127 Ca 0.64 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1dgq n LYS 127 Cb 0.30 -0.26 0.00 0.00 0.02 0.00 0.00 35.03 35.09 1dgq n LYS 127 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1dgq n GLY 128 N 0.00 0.34 3.66 3.14 0.00 -1.22 -4.79 105.19 106.32 1dgq n GLY 128 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.44 6.71 -0.04 1.61 0.01 -1.24 -4.45 114.94 115.09 1dgq s ASN 129 Ca 0.00 0.87 -0.02 0.00 -0.71 0.00 0.00 52.86 53.00 1dgq s ASN 129 Cb 0.00 -2.36 0.03 0.00 0.41 0.00 0.00 41.25 39.33 1dgq s ASN 129 CO 0.00 -0.30 0.05 -0.69 -1.51 0.00 0.00 177.10 174.66 1dgq s VAL 130 N 1.98 -0.07 -0.62 1.60 1.01 -0.20 -0.49 120.40 123.61 1dgq s VAL 130 Ca 0.30 0.39 -0.22 0.00 0.00 0.00 0.00 61.98 62.45 1dgq s VAL 130 Cb -0.16 -0.17 0.07 0.00 0.00 0.00 0.00 36.38 36.12 1dgq s VAL 130 CO 0.10 0.18 0.87 -1.81 0.00 0.00 0.00 175.10 174.44 1dgq s ASP 131 N 2.07 6.20 -0.43 3.32 1.01 0.62 0.17 116.67 129.64 1dgq s ASP 131 Ca 0.04 -1.01 -0.14 0.00 0.71 0.00 0.00 52.55 52.14 1dgq s ASP 131 Cb -0.12 -2.38 0.04 0.00 1.01 0.00 0.00 42.92 41.47 1dgq s ASP 131 CO -0.03 -1.29 0.32 -0.22 0.21 0.00 0.00 175.17 174.16 1dgq s LEU 132 N 3.60 5.25 -0.34 1.23 0.20 0.45 -0.55 118.68 128.52 1dgq s LEU 132 Ca 0.20 -1.08 -0.17 0.00 0.69 0.00 0.00 54.13 53.76 1dgq s LEU 132 Cb -0.18 -2.15 -0.01 0.00 -0.43 0.00 0.00 46.19 43.42 1dgq s LEU 132 CO 0.10 -0.51 0.47 -0.69 -0.29 0.00 0.00 176.35 175.43 1dgq s VAL 133 N 1.64 5.06 -0.70 1.68 1.01 0.25 -0.55 120.40 128.81 1dgq s VAL 133 Ca 0.04 0.27 -0.25 0.00 0.00 0.00 0.00 61.98 62.04 1dgq s VAL 133 Cb -0.21 -3.92 0.05 0.00 0.00 0.00 0.00 36.38 32.30 1dgq s VAL 133 CO 0.08 -0.17 1.14 -0.36 0.00 0.00 0.00 175.10 175.80 1dgq s PHE 134 N 2.28 2.46 -0.97 5.22 0.08 0.28 -0.35 117.98 126.98 1dgq s PHE 134 Ca 0.17 -0.22 -0.17 0.00 0.12 0.00 0.00 56.93 56.83 1dgq s PHE 134 Cb -0.16 -4.48 0.16 0.00 -0.57 0.00 0.00 43.02 37.97 1dgq s PHE 134 CO 0.13 -1.87 1.13 -1.17 -0.10 0.00 0.00 175.22 173.34 1dgq s LEU 135 N 5.00 5.37 -0.13 -0.37 2.96 0.30 -0.62 118.68 131.21 1dgq s LEU 135 Ca 0.30 -2.39 -0.05 0.00 -0.22 0.00 0.00 54.13 51.77 1dgq s LEU 135 Cb -0.12 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 1dgq s LEU 135 CO 0.14 -0.89 0.05 0.72 -1.32 0.00 0.00 176.35 175.04 1dgq s PHE 136 N 1.91 3.28 0.21 5.38 -0.71 -0.11 -0.71 117.98 127.22 1dgq s PHE 136 Ca 0.32 0.21 -0.26 0.00 -1.04 0.00 0.00 56.93 56.16 1dgq s PHE 136 Cb -0.05 -1.92 -0.08 0.00 -1.21 0.00 0.00 43.02 39.75 1dgq s PHE 136 CO -0.08 0.41 0.83 0.34 -1.34 0.00 0.00 175.22 175.38 1dgq s ASP 137 N -0.47 7.42 -0.35 1.98 2.15 0.65 -0.60 116.67 127.46 1dgq s ASP 137 Ca 0.10 1.72 0.15 0.00 0.43 0.00 0.00 52.55 54.95 1dgq s ASP 137 Cb -0.12 -2.53 0.45 0.00 -0.30 0.00 0.00 42.92 40.43 1dgq s ASP 137 CO 0.02 0.16 1.00 0.61 -0.17 0.00 0.00 175.17 176.78 1dgq n GLY 138 N 1.39 2.66 3.67 2.66 0.00 0.73 -4.86 105.19 111.44 1dgq n GLY 138 Ca -0.04 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.03 1dgq n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dgq s SER 139 N -3.26 3.00 0.59 1.61 0.01 -1.26 -0.46 113.70 113.94 1dgq s SER 139 Ca 0.32 1.85 0.29 0.00 1.31 0.00 0.00 55.95 59.72 1dgq s SER 139 Cb 0.44 -2.43 1.46 0.00 0.21 0.00 0.00 66.02 65.70 1dgq s SER 139 CO -0.02 -2.99 1.87 0.00 0.41 0.00 0.00 173.24 172.51 1dgq h MET 140 N -1.79 0.00 -1.00 12.44 -0.00 -1.13 0.78 114.93 124.23 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 1.28 0.00 -0.09 0.00 -0.00 0.00 0.00 31.60 32.79 1dgq h MET 140 CO 0.48 0.00 0.63 0.77 -0.00 0.00 0.00 176.91 178.78 1dgq h SER 141 N 0.00 0.89 -2.97 -0.10 0.02 -1.91 -3.40 113.55 106.08 1dgq h SER 141 Ca 0.22 0.05 -0.56 0.00 -0.84 0.00 0.00 61.79 60.66 1dgq h SER 141 Cb 1.24 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 1dgq h SER 141 CO -0.00 0.46 0.82 -0.76 -1.14 0.00 0.00 176.83 176.20 1dgq s LEU 142 N -10.20 4.23 0.32 5.07 2.01 0.27 -5.04 118.68 115.34 1dgq s LEU 142 Ca -0.12 1.78 -0.06 0.00 0.01 0.00 0.00 54.13 55.74 1dgq s LEU 142 Cb 0.23 -3.55 -0.05 0.00 0.01 0.00 0.00 46.19 42.82 1dgq s LEU 142 CO 0.81 -0.69 0.61 -1.10 1.01 0.00 0.00 176.35 176.99 1dgq s GLN 143 N 2.93 3.67 0.19 1.70 -1.52 -1.26 -4.85 119.66 120.51 1dgq s GLN 143 Ca 0.56 0.12 -0.22 0.00 -1.95 0.00 0.00 55.36 53.87 1dgq s GLN 143 Cb -0.24 -2.58 0.11 0.00 -0.22 0.00 0.00 33.01 30.09 1dgq s GLN 143 CO 0.19 0.14 1.57 -1.35 -0.25 0.00 0.00 175.29 175.59 1dgq h PRO 144 N 1.53 -0.14 -0.99 2.91 0.11 -1.97 0.69 132.00 134.14 1dgq h PRO 144 Ca -0.48 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.72 1dgq h PRO 144 Cb 1.19 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1dgq h PRO 144 CO 0.65 -0.09 0.63 0.38 -0.21 0.00 0.00 178.00 179.36 1dgq h ASP 145 N -0.15 0.99 -0.16 -2.05 2.03 -1.98 0.14 116.42 115.24 1dgq h ASP 145 Ca 0.23 0.02 -0.04 0.00 -0.73 0.00 0.00 57.03 56.52 1dgq h ASP 145 Cb 0.56 -0.19 -0.00 0.00 -0.83 0.00 0.00 39.33 38.87 1dgq h ASP 145 CO -0.76 0.61 -0.04 -0.33 -1.03 0.00 0.00 179.24 177.69 1dgq h GLU 146 N 1.11 0.30 -0.44 4.15 5.08 -1.34 -1.35 114.58 122.10 1dgq h GLU 146 Ca 0.44 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.72 1dgq h GLU 146 Cb 0.25 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 1dgq h GLU 146 CO -0.20 0.58 0.23 0.35 -1.00 0.00 0.00 179.01 178.97 1dgq h PHE 147 N 0.01 0.42 -1.00 4.33 3.57 -0.43 0.17 116.94 124.00 1dgq h PHE 147 Ca 0.04 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.64 1dgq h PHE 147 Cb 0.47 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.01 1dgq h PHE 147 CO 0.05 0.22 0.64 1.96 -2.23 0.00 0.00 178.31 178.96 1dgq h GLN 148 N 0.46 1.07 -0.71 1.11 1.08 -0.60 0.14 115.11 117.66 1dgq h GLN 148 Ca 0.18 -0.06 -0.06 0.00 -1.45 0.00 0.00 58.65 57.26 1dgq h GLN 148 Cb 0.07 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.23 1dgq h GLN 148 CO -0.12 0.70 0.23 0.87 -0.95 0.00 0.00 178.83 179.56 1dgq h LYS 149 N 1.10 1.10 -0.30 1.46 1.57 -0.02 0.23 116.57 121.70 1dgq h LYS 149 Ca 0.46 -0.23 0.05 0.00 -1.87 0.00 0.00 60.65 59.05 1dgq h LYS 149 Cb 0.30 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1dgq h LYS 149 CO -0.21 0.94 0.03 0.82 -0.57 0.00 0.00 179.45 180.47 1dgq h ILE 150 N 1.04 0.82 -0.27 1.86 1.08 0.43 0.02 117.51 122.50 1dgq h ILE 150 Ca 0.23 -0.05 0.04 0.00 -0.39 0.00 0.00 64.86 64.70 1dgq h ILE 150 Cb 0.30 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 34.68 1dgq h ILE 150 CO -0.01 0.02 0.02 -0.07 -0.69 0.00 0.00 178.15 177.43 1dgq h LEU 151 N 0.14 -0.05 -0.57 1.44 3.38 -0.47 -2.90 115.31 116.27 1dgq h LEU 151 Ca 0.14 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1dgq h LEU 151 Cb 0.17 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 1dgq h LEU 151 CO -0.21 0.01 0.26 -0.78 0.09 0.00 0.00 178.44 177.80 1dgq h ASP 152 N 0.11 0.32 0.17 -0.43 3.58 0.11 0.71 116.42 120.99 1dgq h ASP 152 Ca 0.13 0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.64 1dgq h ASP 152 Cb 0.15 -0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.16 1dgq h ASP 152 CO -0.20 0.21 -0.44 0.15 -2.88 0.00 0.00 179.24 176.08 1dgq h PHE 153 N 0.48 -1.25 0.16 0.28 3.04 -0.82 0.31 116.94 119.14 1dgq h PHE 153 Ca 0.27 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.25 1dgq h PHE 153 Cb 0.25 0.52 -0.01 0.00 2.56 0.00 0.00 35.95 39.27 1dgq h PHE 153 CO -0.13 -0.55 -0.15 0.52 -2.02 0.00 0.00 178.31 175.99 1dgq h MET 154 N -0.71 -0.31 -0.74 1.11 2.86 -1.24 -1.56 114.93 114.35 1dgq h MET 154 Ca 0.01 0.02 0.17 0.00 -2.06 0.00 0.00 59.70 57.83 1dgq h MET 154 Cb 0.71 0.07 -0.12 0.00 0.06 0.00 0.00 31.60 32.32 1dgq h MET 154 CO -0.23 -0.21 0.09 -0.22 1.06 0.00 0.00 176.91 177.41 1dgq h LYS 155 N -0.33 0.17 0.08 1.72 3.64 -0.75 -1.42 116.57 119.69 1dgq h LYS 155 Ca 0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1dgq h LYS 155 Cb 0.31 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1dgq h LYS 155 CO -0.03 0.11 -0.04 0.22 -2.27 0.00 0.00 179.45 177.44 1dgq h ASP 156 N 0.18 -0.09 -0.35 4.20 3.58 0.56 0.25 116.42 124.75 1dgq h ASP 156 Ca 0.41 -0.11 0.08 0.00 0.42 0.00 0.00 57.03 57.83 1dgq h ASP 156 Cb 0.72 0.02 -0.08 0.00 1.72 0.00 0.00 39.33 41.71 1dgq h ASP 156 CO -0.58 0.05 -0.26 0.58 -2.88 0.00 0.00 179.24 176.14 1dgq h VAL 157 N -0.23 0.33 -0.23 2.25 2.07 -0.81 -0.45 116.25 119.18 1dgq h VAL 157 Ca -0.01 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 1dgq h VAL 157 Cb 0.19 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1dgq h VAL 157 CO 0.02 0.00 -0.03 0.24 0.02 0.00 0.00 177.57 177.82 1dgq h MET 158 N -0.22 0.34 0.13 1.57 2.86 -0.80 0.78 114.93 119.60 1dgq h MET 158 Ca 0.17 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1dgq h MET 158 Cb 0.49 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1dgq h MET 158 CO -0.48 0.40 -0.06 0.87 1.06 0.00 0.00 176.91 178.69 1dgq h LYS 159 N 0.33 -0.17 0.17 1.72 1.79 0.77 -1.63 116.57 119.55 1dgq h LYS 159 Ca 0.07 0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.57 1dgq h LYS 159 Cb 0.28 0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 30.94 1dgq h LYS 159 CO 0.01 0.09 -0.24 0.87 -1.08 0.00 0.00 179.45 179.11 1dgq h LYS 160 N -0.44 -0.45 -1.91 3.15 6.56 -0.84 -2.49 116.57 120.14 1dgq h LYS 160 Ca -0.02 0.03 -0.37 0.00 -1.06 0.00 0.00 60.65 59.23 1dgq h LYS 160 Cb 0.35 0.10 -0.14 0.00 -0.57 0.00 0.00 32.23 31.98 1dgq h LYS 160 CO 0.03 -0.30 0.19 1.28 -2.06 0.00 0.00 179.45 178.59 1dgq n LEU 161 N -5.36 6.13 0.00 2.94 4.77 0.24 -4.72 117.00 121.00 1dgq n LEU 161 Ca -0.07 -3.64 0.00 0.00 -0.03 0.00 0.00 56.01 52.27 1dgq n LEU 161 Cb 0.27 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1dgq n LEU 161 CO 0.27 1.60 0.41 -1.54 -1.33 0.00 0.00 177.39 176.81 1dgq n SER 162 N 1.19 0.00 -4.10 -1.43 3.41 -0.62 -3.48 113.62 108.59 1dgq n SER 162 Ca 0.42 0.83 -0.36 0.00 -0.26 0.00 0.00 58.87 59.50 1dgq n SER 162 Cb 0.64 -0.33 -0.11 0.00 -0.26 0.00 0.00 64.21 64.15 1dgq n SER 162 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1dgq s ASN 163 N -2.94 5.20 0.09 4.04 2.47 -1.26 -4.98 114.94 117.55 1dgq s ASN 163 Ca 0.00 -2.23 -0.08 0.00 0.42 0.00 0.00 52.86 50.97 1dgq s ASN 163 Cb 0.00 -1.82 -0.00 0.00 -1.45 0.00 0.00 41.25 37.98 1dgq s ASN 163 CO 0.00 -0.49 0.18 -0.89 -3.72 0.00 0.00 177.10 172.17 1dgq s THR 164 N 0.85 0.15 -0.00 -5.21 2.01 -1.23 -5.04 115.64 107.17 1dgq s THR 164 Ca 0.10 -1.23 -0.03 0.00 0.31 0.00 0.00 61.69 60.84 1dgq s THR 164 Cb -0.22 -1.36 -0.14 0.00 0.01 0.00 0.00 72.50 70.78 1dgq s THR 164 CO -0.04 -0.67 2.86 -1.54 -0.69 0.00 0.00 174.62 174.54 1dgq n SER 165 N -0.05 5.30 -4.16 3.53 3.41 -1.26 -4.60 113.62 115.79 1dgq n SER 165 Ca -0.15 -2.45 -0.38 0.00 -0.26 0.00 0.00 58.87 55.63 1dgq n SER 165 Cb 0.62 -1.28 -0.09 0.00 -0.26 0.00 0.00 64.21 63.20 1dgq n SER 165 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1dgq s TYR 166 N 0.52 3.50 -0.55 7.33 1.51 -1.26 -1.03 117.35 127.37 1dgq s TYR 166 Ca 0.36 -2.30 -0.28 0.00 -1.01 0.00 0.00 57.07 53.84 1dgq s TYR 166 Cb 0.17 -3.35 0.00 0.00 -0.11 0.00 0.00 41.96 38.68 1dgq s TYR 166 CO -0.00 -0.95 1.53 -0.65 -1.11 0.00 0.00 175.55 174.38 1dgq s GLN 167 N 0.82 3.18 0.38 -0.62 1.11 0.13 -4.89 119.66 119.77 1dgq s GLN 167 Ca 0.10 0.57 -0.12 0.00 0.01 0.00 0.00 55.36 55.92 1dgq s GLN 167 Cb -0.22 -4.18 -0.07 0.00 -1.01 0.00 0.00 33.01 27.52 1dgq s GLN 167 CO -0.03 -2.08 0.76 -0.06 0.01 0.00 0.00 175.29 173.89 1dgq s PHE 168 N 6.69 3.44 0.05 0.91 0.08 -1.26 -0.41 117.98 127.47 1dgq s PHE 168 Ca 0.57 1.11 -0.04 0.00 0.12 0.00 0.00 56.93 58.69 1dgq s PHE 168 Cb -0.12 -2.48 -0.02 0.00 -0.57 0.00 0.00 43.02 39.83 1dgq s PHE 168 CO 0.25 -0.05 0.06 0.00 -0.10 0.00 0.00 175.22 175.38 1dgq s ALA 169 N -2.25 0.10 -0.01 5.36 0.00 0.29 -3.22 121.76 122.02 1dgq s ALA 169 Ca 0.52 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1dgq s ALA 169 Cb -0.10 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.32 1dgq s ALA 169 CO 0.27 -0.35 0.01 0.00 0.00 0.00 0.00 175.76 175.69 1dgq s ALA 170 N -3.14 0.07 -0.21 0.00 0.00 0.22 -0.56 121.76 118.15 1dgq s ALA 170 Ca -0.00 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.14 1dgq s ALA 170 Cb 0.02 -0.15 0.04 0.00 0.00 0.00 0.00 23.12 23.03 1dgq s ALA 170 CO -0.07 -0.06 -0.16 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 0.21 -0.25 120.40 124.36 1dgq s VAL 171 Ca -0.05 -1.21 -0.29 0.00 0.00 0.00 0.00 61.98 60.43 1dgq s VAL 171 Cb -0.08 -2.01 -0.09 0.00 0.00 0.00 0.00 36.38 34.20 1dgq s VAL 171 CO -0.02 0.30 1.07 -1.58 0.00 0.00 0.00 175.10 174.88 1dgq s GLN 172 N 1.22 4.60 0.06 2.72 0.74 0.31 -0.94 119.66 128.37 1dgq s GLN 172 Ca -0.01 1.73 0.03 0.00 0.05 0.00 0.00 55.36 57.16 1dgq s GLN 172 Cb -0.16 -3.11 -0.03 0.00 1.10 0.00 0.00 33.01 30.82 1dgq s GLN 172 CO -0.10 0.20 -0.09 -0.59 -0.55 0.00 0.00 175.29 174.16 1dgq s PHE 173 N -1.24 0.81 0.00 1.67 -0.71 0.23 -0.19 117.98 118.55 1dgq s PHE 173 Ca 0.46 -0.57 0.00 0.00 -1.04 0.00 0.00 56.93 55.78 1dgq s PHE 173 Cb -0.30 -0.47 0.00 0.00 -1.21 0.00 0.00 43.02 41.04 1dgq s PHE 173 CO 0.38 -0.06 0.00 0.45 -1.34 0.00 0.00 175.22 174.65 1dgq n SER 174 N 1.14 0.00 -0.34 1.98 2.88 -1.26 -0.19 113.62 117.83 1dgq n SER 174 Ca -0.20 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.41 1dgq n SER 174 Cb 0.56 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.25 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 0.87 -2.26 2.46 2.02 -1.76 0.16 112.91 114.40 1dgq h THR 175 Ca 0.00 -0.30 -0.57 0.00 0.77 0.00 0.00 66.41 66.31 1dgq h THR 175 Cb 0.00 -0.09 -0.10 0.00 -1.74 0.00 0.00 68.15 66.22 1dgq h THR 175 CO 0.00 0.16 -0.66 -0.44 0.37 0.00 0.00 175.52 174.95 1dgq s SER 176 N -5.61 4.46 0.16 4.18 0.01 -1.26 -4.51 113.70 111.13 1dgq s SER 176 Ca -0.12 -0.67 -0.04 0.00 1.31 0.00 0.00 55.95 56.44 1dgq s SER 176 Cb 0.22 -0.80 -0.05 0.00 0.21 0.00 0.00 66.02 65.60 1dgq s SER 176 CO 0.80 0.01 0.38 -0.72 0.41 0.00 0.00 173.24 174.12 1dgq s TYR 177 N -2.29 3.48 -0.24 2.43 -0.85 -1.26 -4.40 117.35 114.21 1dgq s TYR 177 Ca 0.31 0.50 -0.02 0.00 -0.52 0.00 0.00 57.07 57.33 1dgq s TYR 177 Cb -0.06 -1.97 0.12 0.00 0.38 0.00 0.00 41.96 40.43 1dgq s TYR 177 CO 0.19 0.41 0.29 0.21 -1.52 0.00 0.00 175.55 175.13 1dgq s LYS 178 N -2.86 0.28 -0.22 -3.49 2.20 0.73 -4.98 119.74 111.39 1dgq s LYS 178 Ca 0.40 0.19 -0.29 0.00 -0.36 0.00 0.00 55.97 55.91 1dgq s LYS 178 Cb -0.12 -0.84 -0.06 0.00 -1.51 0.00 0.00 37.83 35.30 1dgq s LYS 178 CO 0.26 -0.77 2.21 2.41 -0.36 0.00 0.00 175.35 179.10 1dgq n THR 179 N 5.33 0.34 -0.01 3.43 -1.04 -1.26 -0.53 114.28 120.54 1dgq n THR 179 Ca -0.04 -0.42 -0.17 0.00 -2.04 0.00 0.00 64.05 61.38 1dgq n THR 179 Cb 0.49 -2.43 -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 14.50 0.40 -2.27 -2.82 4.39 -0.97 -3.48 114.58 124.33 1dgq h GLU 180 Ca -0.40 -0.40 -0.03 0.00 0.34 0.00 0.00 59.36 58.88 1dgq h GLU 180 Cb 1.25 0.11 -0.17 0.00 -0.10 0.00 0.00 28.75 29.84 1dgq h GLU 180 CO 0.97 1.06 0.24 -0.59 -1.16 0.00 0.00 179.01 179.53 1dgq s PHE 181 N -3.31 -0.58 0.50 4.33 -0.12 -0.88 -4.84 117.98 113.06 1dgq s PHE 181 Ca -0.13 0.81 0.04 0.00 -0.05 0.00 0.00 56.93 57.60 1dgq s PHE 181 Cb 0.04 0.46 0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1dgq s PHE 181 CO 0.81 -0.65 0.37 -0.40 -0.05 0.00 0.00 175.22 175.30 1dgq n ASP 182 N 0.46 2.58 0.06 1.98 5.68 -1.26 -0.61 116.55 125.43 1dgq n ASP 182 Ca -0.17 -2.70 -0.13 0.00 -0.50 0.00 0.00 54.79 51.29 1dgq n ASP 182 Cb 0.60 -0.04 -0.06 0.00 -1.14 0.00 0.00 41.12 40.48 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 0.65 -1.08 -0.89 2.11 0.04 -1.51 -0.28 116.94 115.98 1dgq h PHE 183 Ca -0.31 0.04 0.11 0.00 2.80 0.00 0.00 57.97 60.60 1dgq h PHE 183 Cb 1.15 0.47 -0.08 0.00 2.20 0.00 0.00 35.95 39.69 1dgq h PHE 183 CO 0.00 -0.47 0.53 0.77 -0.60 0.00 0.00 178.31 178.54 1dgq h SER 184 N -0.54 0.76 0.24 2.17 0.02 -1.07 0.24 113.55 115.36 1dgq h SER 184 Ca 0.05 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1dgq h SER 184 Cb 0.62 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1dgq h SER 184 CO -0.30 0.42 -0.22 0.44 -1.14 0.00 0.00 176.83 176.02 1dgq h ASP 185 N 0.86 -0.58 -0.26 3.07 3.32 -1.62 0.22 116.42 121.43 1dgq h ASP 185 Ca 0.44 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.60 1dgq h ASP 185 Cb 0.42 0.20 -0.07 0.00 0.22 0.00 0.00 39.33 40.10 1dgq h ASP 185 CO -0.26 -0.33 -0.22 0.22 -1.72 0.00 0.00 179.24 176.93 1dgq h TYR 186 N -0.49 -0.57 -0.73 4.55 3.20 -0.33 0.41 116.97 123.01 1dgq h TYR 186 Ca -0.01 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.95 1dgq h TYR 186 Cb 0.45 0.29 -0.05 0.00 1.54 0.00 0.00 36.73 38.95 1dgq h TYR 186 CO -0.15 -0.29 0.44 0.28 -1.64 0.00 0.00 178.16 176.79 1dgq h VAL 187 N -0.21 1.02 0.32 1.81 2.07 -0.68 0.27 116.25 120.84 1dgq h VAL 187 Ca 0.14 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1dgq h VAL 187 Cb 0.43 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1dgq h VAL 187 CO -0.38 0.15 -0.15 0.50 0.02 0.00 0.00 177.57 177.70 1dgq h LYS 188 N 0.81 -0.41 0.13 1.57 3.64 0.03 -3.38 116.57 118.96 1dgq h LYS 188 Ca 0.32 0.03 -0.32 0.00 -1.27 0.00 0.00 60.65 59.41 1dgq h LYS 188 Cb 0.15 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.06 1dgq h LYS 188 CO -0.16 -0.08 -1.68 -1.49 -2.27 0.00 0.00 179.45 173.76 1dgq h TRP 189 N -0.81 0.49 -6.51 1.91 4.06 -0.84 -3.48 115.95 110.77 1dgq h TRP 189 Ca -0.04 -0.36 -0.51 0.00 2.06 0.00 0.00 58.89 60.04 1dgq h TRP 189 Cb 0.52 -0.02 -0.20 0.00 -1.00 0.00 0.00 29.16 28.45 1dgq h TRP 189 CO 0.03 1.66 -0.76 1.63 -3.56 0.00 0.00 178.44 177.44 1dgq n LYS 190 N -3.74 -2.85 -3.68 0.49 5.02 0.95 -4.95 118.16 109.40 1dgq n LYS 190 Ca -0.28 0.34 -0.28 0.00 -2.02 0.00 0.00 58.31 56.07 1dgq n LYS 190 Cb 0.97 -5.04 -0.16 0.00 -0.02 0.00 0.00 35.03 30.78 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 -3.12 3.20 0.29 4.39 2.15 -1.26 -5.01 116.67 117.30 1dgq s ASP 191 Ca 0.67 -1.06 0.03 0.00 0.43 0.00 0.00 52.55 52.62 1dgq s ASP 191 Cb -0.37 -0.56 0.72 0.00 -0.30 0.00 0.00 42.92 42.41 1dgq s ASP 191 CO 0.82 -0.36 1.67 -0.65 -0.17 0.00 0.00 175.17 176.49 1dgq h PRO 192 N 8.27 0.30 0.13 4.34 0.11 -1.92 -0.88 132.00 142.34 1dgq h PRO 192 Ca -0.16 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.93 1dgq h PRO 192 Cb 1.08 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1dgq h PRO 192 CO 0.38 0.20 -0.10 0.22 -0.21 0.00 0.00 178.00 178.49 1dgq h ASP 193 N 0.31 -0.25 -0.39 -2.05 3.58 -1.97 0.19 116.42 115.83 1dgq h ASP 193 Ca 0.55 0.02 0.04 0.00 0.42 0.00 0.00 57.03 58.06 1dgq h ASP 193 Cb 1.09 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 42.18 1dgq h ASP 193 CO -0.58 -0.16 0.17 0.00 -2.88 0.00 0.00 179.24 175.79 1dgq h ALA 194 N 0.63 0.48 -0.72 -0.78 0.00 -1.70 0.15 119.26 117.31 1dgq h ALA 194 Ca -0.01 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1dgq h ALA 194 Cb 0.21 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1dgq h ALA 194 CO -0.01 -0.20 0.36 -0.07 0.00 0.00 0.00 179.25 179.33 1dgq h LEU 195 N 0.35 0.94 0.00 0.00 3.38 -0.91 -3.16 115.31 115.92 1dgq h LEU 195 Ca 0.17 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1dgq h LEU 195 Cb 0.12 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1dgq h LEU 195 CO -0.15 0.80 -0.70 -0.07 0.09 0.00 0.00 178.44 178.42 1dgq h LEU 196 N 1.01 0.00 -2.24 1.67 3.38 -0.16 -3.34 115.31 115.63 1dgq h LEU 196 Ca 0.25 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.17 1dgq h LEU 196 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1dgq h LEU 196 CO -0.03 0.03 0.26 0.11 0.09 0.00 0.00 178.44 178.90 1dgq h LYS 197 N 0.00 0.00 0.00 1.13 1.57 -0.67 0.57 116.57 119.17 1dgq h LYS 197 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1dgq h LYS 197 Cb 0.91 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 1dgq h LYS 197 CO 0.00 0.00 -0.06 1.25 -0.57 0.00 0.00 179.45 180.07 1dgq h HIS 198 N 0.00 0.00 -2.11 -1.35 2.76 -1.75 -3.45 115.15 109.25 1dgq h HIS 198 Ca 0.03 0.00 -0.59 0.00 -2.20 0.00 0.00 60.37 57.61 1dgq h HIS 198 Cb 0.54 0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.52 1dgq h HIS 198 CO 0.00 0.06 1.17 0.28 -1.30 0.00 0.00 177.93 178.14 1dgq n VAL 199 N -3.45 0.63 -3.92 5.26 0.31 0.19 -4.96 118.33 112.38 1dgq n VAL 199 Ca -0.02 -0.13 -0.30 0.00 -0.01 0.00 0.00 64.34 63.87 1dgq n VAL 199 Cb 0.19 -2.05 -0.15 0.00 -0.91 0.00 0.00 33.84 30.91 1dgq n VAL 199 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1dgq s LYS 200 N 4.36 1.48 -0.04 5.55 1.02 -1.26 -5.10 119.74 125.75 1dgq s LYS 200 Ca 0.92 -1.11 -0.30 0.00 0.02 0.00 0.00 55.97 55.51 1dgq s LYS 200 Cb -0.60 -2.59 -0.07 0.00 -0.52 0.00 0.00 37.83 34.05 1dgq s LYS 200 CO 0.48 -0.69 1.88 -1.58 -0.92 0.00 0.00 175.35 174.51 1dgq s HIS 201 N 1.36 1.54 -0.01 3.18 2.46 -1.26 -4.92 115.29 117.64 1dgq s HIS 201 Ca -0.02 -0.07 -0.25 0.00 0.47 0.00 0.00 55.06 55.19 1dgq s HIS 201 Cb -0.19 -4.09 -0.20 0.00 -0.13 0.00 0.00 32.58 27.97 1dgq s HIS 201 CO -0.09 -4.67 1.33 0.52 -2.47 0.00 0.00 174.74 169.35 1dgq h MET 202 N 10.85 0.01 -5.04 2.88 2.86 -1.94 -3.48 114.93 121.05 1dgq h MET 202 Ca -0.44 -0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 56.93 1dgq h MET 202 Cb 1.21 -0.00 0.15 0.00 0.06 0.00 0.00 31.60 33.02 1dgq h MET 202 CO 0.95 0.43 -0.66 1.28 1.06 0.00 0.00 176.91 179.98 1dgq n LEU 203 N -4.88 -4.00 0.00 1.22 4.77 0.39 -4.91 117.00 109.59 1dgq n LEU 203 Ca -0.08 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 1dgq n LEU 203 Cb 0.23 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 38.61 1dgq n LEU 203 CO 0.34 0.26 0.00 0.18 -1.33 0.00 0.00 177.39 176.84 1dgq n LEU 204 N -3.46 0.00 0.00 2.23 4.77 -1.25 -3.88 117.00 115.41 1dgq n LEU 204 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1dgq n LEU 204 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1dgq n LEU 204 CO 0.50 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.74 1dgq n LEU 205 N 0.00 0.00 -3.40 2.23 4.77 -1.26 -0.90 117.00 118.44 1dgq n LEU 205 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.72 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 -0.21 0.41 -1.33 0.00 0.00 177.39 176.26 1dgq n THR 206 N 0.00 -0.05 -1.60 -5.08 -1.04 -1.26 -2.45 114.28 102.81 1dgq n THR 206 Ca 0.00 -4.13 -0.40 0.00 -2.04 0.00 0.00 64.05 57.48 1dgq n THR 206 Cb 0.00 -1.91 -0.02 0.00 -1.82 0.00 0.00 70.33 66.58 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 1.88 7.50 -0.10 8.00 2.85 0.57 -0.26 115.26 135.71 1dgq n ASN 207 Ca 0.25 -2.78 -0.11 0.00 -0.11 0.00 0.00 54.58 51.84 1dgq n ASN 207 Cb 0.47 -1.53 -0.03 0.00 1.24 0.00 0.00 39.78 39.93 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 3.15 1.23 0.31 -0.44 2.02 -1.89 0.37 112.91 117.66 1dgq h THR 208 Ca 0.75 -0.78 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1dgq h THR 208 Cb 0.37 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 1dgq h THR 208 CO 1.73 0.26 -0.49 -0.26 0.37 0.00 0.00 175.52 177.13 1dgq h PHE 209 N 0.31 -1.39 -1.01 3.16 0.04 -1.84 0.26 116.94 116.47 1dgq h PHE 209 Ca 0.09 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.91 1dgq h PHE 209 Cb 0.33 0.57 -0.06 0.00 2.20 0.00 0.00 35.95 38.99 1dgq h PHE 209 CO 0.02 -0.61 0.66 0.78 -0.60 0.00 0.00 178.31 178.57 1dgq h GLY 210 N -0.85 1.45 1.27 -1.45 0.00 -1.78 -0.75 103.07 100.96 1dgq h GLY 210 Ca -0.04 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 46.67 1dgq h GLY 210 CO -0.16 0.46 -0.15 0.00 0.00 0.00 0.00 176.54 176.69 1dgq h ALA 211 N 1.40 0.88 -0.14 3.60 0.00 -0.56 0.13 119.26 124.57 1dgq h ALA 211 Ca 0.39 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1dgq h ALA 211 Cb -0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1dgq h ALA 211 CO -0.11 0.63 0.08 0.82 0.00 0.00 0.00 179.25 180.67 1dgq h ILE 212 N 0.75 1.09 -0.29 0.00 2.04 0.14 0.46 117.51 121.70 1dgq h ILE 212 Ca 0.12 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.78 1dgq h ILE 212 Cb 0.67 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 1dgq h ILE 212 CO 0.05 0.08 0.06 0.78 0.00 0.00 0.00 178.15 179.12 1dgq h ASN 213 N 0.13 0.02 -0.14 1.72 2.35 -0.81 0.80 115.58 119.66 1dgq h ASN 213 Ca 0.05 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 55.89 1dgq h ASN 213 Cb 0.06 0.06 -0.06 0.00 0.05 0.00 0.00 38.32 38.43 1dgq h ASN 213 CO -0.01 0.05 -0.27 0.22 -1.65 0.00 0.00 177.43 175.77 1dgq h TYR 214 N 0.17 -0.72 -0.03 1.19 3.20 -0.52 -1.13 116.97 119.12 1dgq h TYR 214 Ca 0.13 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.07 1dgq h TYR 214 Cb 0.13 0.34 -0.05 0.00 1.54 0.00 0.00 36.73 38.70 1dgq h TYR 214 CO -0.16 -0.35 -0.24 0.28 -1.64 0.00 0.00 178.16 176.05 1dgq h VAL 215 N -0.34 0.44 -0.58 1.81 2.07 -0.59 0.28 116.25 119.35 1dgq h VAL 215 Ca 0.10 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.74 1dgq h VAL 215 Cb 0.49 0.44 -0.10 0.00 -1.52 0.00 0.00 31.29 30.61 1dgq h VAL 215 CO -0.33 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.28 1dgq h ALA 216 N 0.52 0.58 0.03 1.67 0.00 -0.28 -0.28 119.26 121.49 1dgq h ALA 216 Ca 0.07 0.17 -0.36 0.00 0.00 0.00 0.00 54.91 54.79 1dgq h ALA 216 Cb 0.45 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1dgq h ALA 216 CO -0.24 -0.38 -2.05 0.25 0.00 0.00 0.00 179.25 176.84 1dgq n THR 217 N -5.25 1.59 -0.08 0.00 -2.24 -0.48 -4.33 114.28 103.49 1dgq n THR 217 Ca 0.08 -0.39 -0.22 0.00 -2.27 0.00 0.00 64.05 61.24 1dgq n THR 217 Cb 0.33 -1.79 -0.12 0.00 -2.10 0.00 0.00 70.33 66.65 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 -3.90 0.65 0.00 -0.78 -0.58 0.98 -4.61 120.64 112.41 1dgq n GLU 218 Ca -0.41 0.31 -0.19 0.00 -0.42 0.00 0.00 57.16 56.45 1dgq n GLU 218 Cb 0.89 -1.63 -0.14 0.00 -0.57 0.00 0.00 31.44 29.99 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 -0.41 1.46 -0.03 2.62 2.07 -1.22 -3.37 116.25 117.38 1dgq h VAL 219 Ca -0.50 -2.44 -0.65 0.00 0.82 0.00 0.00 66.70 63.93 1dgq h VAL 219 Cb 1.75 3.10 0.03 0.00 -1.52 0.00 0.00 31.29 34.65 1dgq h VAL 219 CO -0.13 0.66 2.36 0.49 0.02 0.00 0.00 177.57 180.97 1dgq n PHE 220 N -4.23 2.15 -4.51 1.57 3.72 -0.17 -4.76 117.46 111.24 1dgq n PHE 220 Ca -0.16 -1.96 -0.21 0.00 -0.05 0.00 0.00 57.45 55.08 1dgq n PHE 220 Cb 0.74 -1.87 -0.15 0.00 -0.94 0.00 0.00 39.48 37.27 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 4.81 0.96 0.22 -1.08 0.52 -1.26 -4.83 118.95 118.30 1dgq s ARG 221 Ca 0.56 -0.47 -0.08 0.00 -0.52 0.00 0.00 55.73 55.23 1dgq s ARG 221 Cb 0.14 -0.93 0.28 0.00 0.52 0.00 0.00 34.95 34.96 1dgq s ARG 221 CO 0.09 0.25 1.82 0.93 0.02 0.00 0.00 175.30 178.41 1dgq h GLU 222 N 5.74 0.73 -0.73 3.54 5.08 -1.89 -0.71 114.58 126.33 1dgq h GLU 222 Ca -0.33 -0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.13 1dgq h GLU 222 Cb 1.17 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 30.21 1dgq h GLU 222 CO 0.49 0.48 0.49 1.05 -1.00 0.00 0.00 179.01 180.52 1dgq h GLU 223 N 0.75 0.38 -0.01 2.33 9.09 -1.96 0.22 114.58 125.39 1dgq h GLU 223 Ca 0.33 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.72 1dgq h GLU 223 Cb 0.21 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 1dgq h GLU 223 CO -0.19 0.25 -0.10 1.28 0.05 0.00 0.00 179.01 180.30 1dgq n LEU 224 N -4.47 0.72 0.00 3.06 4.77 -0.42 -4.90 117.00 115.76 1dgq n LEU 224 Ca 0.14 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1dgq n LEU 224 Cb 0.52 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1dgq n LEU 224 CO 0.33 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1dgq n GLY 225 N 1.23 1.16 3.56 -0.72 0.00 0.79 -0.54 105.19 110.68 1dgq n GLY 225 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 2.24 -0.04 4.61 0.00 -0.41 -4.63 121.76 121.52 1dgq s ALA 226 Ca 0.00 -1.89 -0.29 0.00 0.00 0.00 0.00 51.96 49.78 1dgq s ALA 226 Cb 0.00 -4.53 -0.07 0.00 0.00 0.00 0.00 23.12 18.51 1dgq s ALA 226 CO 0.00 -4.15 1.95 1.03 0.00 0.00 0.00 175.76 174.59 1dgq s ARG 227 N 5.92 3.92 0.38 0.00 0.52 -1.26 -3.95 118.95 124.49 1dgq s ARG 227 Ca 0.57 2.38 0.05 0.00 -0.52 0.00 0.00 55.73 58.20 1dgq s ARG 227 Cb -0.03 -4.17 0.75 0.00 0.52 0.00 0.00 34.95 32.01 1dgq s ARG 227 CO -0.05 -1.19 2.03 -1.00 0.02 0.00 0.00 175.30 175.10 1dgq h PRO 228 N 11.36 0.65 0.00 3.54 0.13 -1.98 -0.91 132.00 144.79 1dgq h PRO 228 Ca -0.45 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1dgq h PRO 228 Cb 1.22 -0.14 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1dgq h PRO 228 CO 0.95 0.45 -0.07 0.38 -0.23 0.00 0.00 178.00 179.48 1dgq h ASP 229 N 0.67 0.00 -3.87 1.44 2.03 -1.98 -3.45 116.42 111.26 1dgq h ASP 229 Ca 0.18 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.97 1dgq h ASP 229 Cb -0.05 0.00 0.04 0.00 -0.83 0.00 0.00 39.33 38.50 1dgq h ASP 229 CO -0.04 0.07 0.54 0.00 -1.03 0.00 0.00 179.24 178.79 1dgq s ALA 230 N -3.46 3.36 0.04 4.15 0.00 -0.35 -4.89 121.76 120.62 1dgq s ALA 230 Ca 0.03 1.05 -0.32 0.00 0.00 0.00 0.00 51.96 52.72 1dgq s ALA 230 Cb 0.08 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.69 1dgq s ALA 230 CO 0.61 -0.44 1.85 2.41 0.00 0.00 0.00 175.76 180.19 1dgq n THR 231 N 0.71 0.47 -2.36 0.00 -1.04 0.35 -4.43 114.28 107.98 1dgq n THR 231 Ca 0.01 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 1dgq n THR 231 Cb 0.44 -2.01 -0.01 0.00 -1.82 0.00 0.00 70.33 66.94 1dgq n THR 231 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1dgq n LYS 232 N 6.05 2.96 -3.63 -2.82 4.76 -1.26 -0.27 118.16 123.94 1dgq n LYS 232 Ca 0.20 -3.06 -0.36 0.00 -2.87 0.00 0.00 58.31 52.22 1dgq n LYS 232 Cb 0.34 -3.47 -0.08 0.00 -1.84 0.00 0.00 35.03 29.98 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 4.69 5.36 -0.33 -0.18 1.01 0.29 -0.62 120.40 130.63 1dgq s VAL 233 Ca 0.54 0.36 0.03 0.00 0.00 0.00 0.00 61.98 62.91 1dgq s VAL 233 Cb 0.05 -3.55 0.10 0.00 0.00 0.00 0.00 36.38 32.98 1dgq s VAL 233 CO 0.06 0.41 0.06 -0.22 0.00 0.00 0.00 175.10 175.41 1dgq s LEU 234 N 0.46 4.01 -0.52 3.92 2.96 0.46 -0.58 118.68 129.39 1dgq s LEU 234 Ca 0.12 -1.99 -0.19 0.00 -0.22 0.00 0.00 54.13 51.85 1dgq s LEU 234 Cb -0.12 -1.41 0.07 0.00 0.50 0.00 0.00 46.19 45.23 1dgq s LEU 234 CO 0.01 -0.39 0.63 -0.63 -1.32 0.00 0.00 176.35 174.65 1dgq s ILE 235 N 1.11 4.88 -0.09 6.68 1.01 0.53 -0.50 121.20 134.82 1dgq s ILE 235 Ca 0.10 -0.59 -0.25 0.00 0.00 0.00 0.00 60.65 59.91 1dgq s ILE 235 Cb -0.19 -4.32 -0.03 0.00 0.01 0.00 0.00 42.46 37.94 1dgq s ILE 235 CO -0.13 -0.85 0.79 -0.63 0.00 0.00 0.00 174.94 174.13 1dgq s ILE 236 N 2.60 4.96 -0.26 2.92 1.01 0.41 -0.54 121.20 132.31 1dgq s ILE 236 Ca 0.14 1.60 0.01 0.00 0.00 0.00 0.00 60.65 62.41 1dgq s ILE 236 Cb -0.20 -4.12 0.05 0.00 0.01 0.00 0.00 42.46 38.20 1dgq s ILE 236 CO 0.11 0.16 -0.09 -0.63 0.00 0.00 0.00 174.94 174.48 1dgq s ILE 237 N 1.31 2.44 -0.01 2.92 1.01 0.11 -0.69 121.20 128.29 1dgq s ILE 237 Ca 0.40 -1.40 -0.10 0.00 0.00 0.00 0.00 60.65 59.55 1dgq s ILE 237 Cb -0.18 -2.34 0.01 0.00 0.01 0.00 0.00 42.46 39.96 1dgq s ILE 237 CO 0.18 0.07 0.21 0.28 0.00 0.00 0.00 174.94 175.67 1dgq s THR 238 N 1.19 0.07 -0.76 2.92 -1.32 -0.65 -0.25 115.64 116.84 1dgq s THR 238 Ca -0.05 -0.57 0.22 0.00 -1.21 0.00 0.00 61.69 60.08 1dgq s THR 238 Cb -0.18 -0.49 -0.20 0.00 -1.51 0.00 0.00 72.50 70.11 1dgq s THR 238 CO -0.05 -0.31 0.91 -0.90 -2.21 0.00 0.00 174.62 172.06 1dgq n ASP 239 N 1.49 0.71 -4.16 8.08 5.75 -1.26 -0.58 116.55 126.58 1dgq n ASP 239 Ca -0.22 -0.60 -0.16 0.00 -0.01 0.00 0.00 54.79 53.81 1dgq n ASP 239 Cb 0.56 1.05 -0.11 0.00 -1.03 0.00 0.00 41.12 41.58 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 -3.38 0.81 0.74 6.12 0.00 -1.26 -2.25 107.32 108.10 1dgq s GLY 240 Ca 0.05 -1.07 -0.15 0.00 0.00 0.00 0.00 44.72 43.55 1dgq s GLY 240 CO 0.85 -1.12 1.18 1.18 0.00 0.00 0.00 173.10 175.19 1dgq n GLU 241 N 0.93 0.55 -2.07 2.90 4.71 -1.26 -4.90 120.64 121.48 1dgq n GLU 241 Ca -0.19 0.25 -0.41 0.00 -0.01 0.00 0.00 57.16 56.81 1dgq n GLU 241 Cb 0.56 -2.42 -0.03 0.00 -1.01 0.00 0.00 31.44 28.54 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 -1.82 2.62 0.21 0.62 0.00 -1.26 -4.72 121.76 117.40 1dgq s ALA 242 Ca 0.76 -0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 1dgq s ALA 242 Cb -0.33 -4.12 0.17 0.00 0.00 0.00 0.00 23.12 18.84 1dgq s ALA 242 CO 0.47 -3.10 1.55 1.79 0.00 0.00 0.00 175.76 176.47 1dgq h THR 243 N 6.78 1.31 -0.17 0.00 1.35 -0.97 -3.30 112.91 117.90 1dgq h THR 243 Ca -0.30 -1.69 0.05 0.00 -0.55 0.00 0.00 66.41 63.92 1dgq h THR 243 Cb 1.16 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 69.25 1dgq h THR 243 CO 1.12 0.53 0.13 -0.78 -0.25 0.00 0.00 175.52 176.27 1dgq h ASP 244 N 0.43 0.00 -5.87 5.36 3.58 -1.90 -3.46 116.42 114.56 1dgq h ASP 244 Ca 0.02 0.00 -0.40 0.00 0.42 0.00 0.00 57.03 57.07 1dgq h ASP 244 Cb 1.00 0.00 0.13 0.00 1.72 0.00 0.00 39.33 42.18 1dgq h ASP 244 CO 0.09 0.00 -0.69 -1.20 -2.88 0.00 0.00 179.24 174.56 1dgq n SER 245 N -4.41 -6.11 0.00 2.28 7.64 -1.25 -4.99 113.62 106.79 1dgq n SER 245 Ca 0.01 -0.56 0.00 0.00 1.01 0.00 0.00 58.87 59.33 1dgq n SER 245 Cb 0.26 -4.98 0.00 0.00 -1.01 0.00 0.00 64.21 58.48 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 -1.96 0.65 3.68 0.23 0.00 -1.26 -5.13 105.19 101.39 1dgq n GLY 246 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 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 0.01 0.00 1.61 2.20 -1.26 -5.08 114.94 111.42 1dgq s ASN 247 Ca 0.00 -0.96 0.08 0.00 -0.94 0.00 0.00 52.86 51.05 1dgq s ASN 247 Cb 0.00 0.67 0.14 0.00 -2.00 0.00 0.00 41.25 40.06 1dgq s ASN 247 CO 0.00 -1.30 1.00 2.30 -2.94 0.00 0.00 177.10 176.16 1dgq n ILE 248 N -0.45 0.00 -0.31 0.54 -5.35 -1.26 -4.57 119.36 107.96 1dgq n ILE 248 Ca -0.03 -0.32 0.05 0.00 -0.27 0.00 0.00 62.75 62.18 1dgq n ILE 248 Cb 0.61 0.60 0.20 0.00 -1.74 0.00 0.00 39.64 39.31 1dgq n ILE 248 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 1dgq h ASP 249 N 0.32 0.69 -1.33 7.28 3.58 -1.98 0.80 116.42 125.78 1dgq h ASP 249 Ca -0.12 0.06 0.39 0.00 0.42 0.00 0.00 57.03 57.78 1dgq h ASP 249 Cb 1.52 -0.07 -0.08 0.00 1.72 0.00 0.00 39.33 42.42 1dgq h ASP 249 CO 0.01 0.36 0.93 0.00 -2.88 0.00 0.00 179.24 177.66 1dgq h ALA 250 N 1.50 3.03 -0.44 -0.78 0.00 -1.96 -0.18 119.26 120.43 1dgq h ALA 250 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1dgq h ALA 250 Cb 0.47 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1dgq h ALA 250 CO -0.28 -1.48 0.00 0.00 0.00 0.00 0.00 179.25 177.49 1dgq n ALA 251 N -2.70 2.30 -0.31 0.00 0.00 0.26 -4.75 120.51 115.31 1dgq n ALA 251 Ca 0.31 -1.26 0.18 0.00 0.00 0.00 0.00 53.44 52.67 1dgq n ALA 251 Cb 1.36 -0.58 0.44 0.00 0.00 0.00 0.00 19.45 20.66 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 2.62 0.53 0.00 0.00 2.10 -0.85 0.58 116.57 121.55 1dgq h LYS 252 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1dgq h LYS 252 Cb 0.86 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 1dgq h LYS 252 CO 0.02 0.35 -0.41 -0.25 -2.00 0.00 0.00 179.45 177.16 1dgq n ASP 253 N -4.64 0.71 -4.82 7.07 8.00 -1.26 -4.87 116.55 116.74 1dgq n ASP 253 Ca 0.22 0.26 -0.35 0.00 0.71 0.00 0.00 54.79 55.63 1dgq n ASP 253 Cb 0.70 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.58 1dgq n ASP 253 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1dgq s ILE 254 N -3.13 4.55 -0.91 0.53 1.01 0.19 -4.95 121.20 118.48 1dgq s ILE 254 Ca 0.08 1.26 -0.23 0.00 0.00 0.00 0.00 60.65 61.76 1dgq s ILE 254 Cb 0.13 -3.78 0.06 0.00 0.01 0.00 0.00 42.46 38.88 1dgq s ILE 254 CO 0.68 0.04 1.32 -0.63 0.00 0.00 0.00 174.94 176.34 1dgq s ILE 255 N -1.72 4.04 -0.90 2.92 -1.09 0.21 -4.83 121.20 119.84 1dgq s ILE 255 Ca 0.49 -0.60 -0.24 0.00 -2.23 0.00 0.00 60.65 58.06 1dgq s ILE 255 Cb -0.14 -4.95 0.01 0.00 -1.58 0.00 0.00 42.46 35.79 1dgq s ILE 255 CO 0.20 -1.81 1.64 -0.13 -1.23 0.00 0.00 174.94 173.61 1dgq s ARG 256 N 4.69 3.08 0.27 2.79 3.00 -1.26 -0.40 118.95 131.12 1dgq s ARG 256 Ca 0.39 -0.52 -0.23 0.00 0.00 0.00 0.00 55.73 55.37 1dgq s ARG 256 Cb -0.04 -4.99 -0.09 0.00 0.00 0.00 0.00 34.95 29.83 1dgq s ARG 256 CO -0.03 -2.66 0.83 -0.47 0.00 0.00 0.00 175.30 172.98 1dgq s TYR 257 N 7.27 3.66 -0.03 -0.53 6.14 0.34 -1.06 117.35 133.15 1dgq s TYR 257 Ca 0.55 1.58 -0.01 0.00 0.64 0.00 0.00 57.07 59.83 1dgq s TYR 257 Cb -0.05 -2.77 0.02 0.00 0.42 0.00 0.00 41.96 39.59 1dgq s TYR 257 CO -0.00 0.27 0.06 -1.50 0.64 0.00 0.00 175.55 175.02 1dgq s ILE 258 N -1.58 -0.03 -0.32 3.14 2.07 0.21 -0.44 121.20 124.24 1dgq s ILE 258 Ca 0.47 0.11 -0.11 0.00 -1.41 0.00 0.00 60.65 59.71 1dgq s ILE 258 Cb -0.17 -0.11 -0.01 0.00 0.13 0.00 0.00 42.46 42.30 1dgq s ILE 258 CO 0.22 0.05 0.18 -0.63 -1.91 0.00 0.00 174.94 172.85 1dgq s ILE 259 N 0.62 4.78 -0.54 2.00 1.09 0.13 -0.62 121.20 128.67 1dgq s ILE 259 Ca -0.05 -0.40 -0.17 0.00 -1.10 0.00 0.00 60.65 58.93 1dgq s ILE 259 Cb -0.07 -3.46 0.11 0.00 -1.06 0.00 0.00 42.46 37.98 1dgq s ILE 259 CO -0.02 0.02 0.54 -0.83 -0.10 0.00 0.00 174.94 174.55 1dgq s GLY 260 N 1.64 1.98 0.21 6.18 0.00 0.19 -1.63 107.32 115.88 1dgq s GLY 260 Ca 0.05 -2.31 -0.30 0.00 0.00 0.00 0.00 44.72 42.15 1dgq s GLY 260 CO 0.07 1.29 1.38 -0.42 0.00 0.00 0.00 173.10 175.42 1dgq s ILE 261 N 1.96 2.97 0.00 0.90 -1.09 0.25 -0.61 121.20 125.58 1dgq s ILE 261 Ca 0.06 0.79 0.00 0.00 -2.23 0.00 0.00 60.65 59.28 1dgq s ILE 261 Cb -0.27 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 1dgq s ILE 261 CO 0.05 0.12 1.71 0.61 -1.23 0.00 0.00 174.94 176.19 1dgq n GLY 262 N 2.41 2.24 0.07 6.18 0.00 0.81 -2.81 105.19 114.08 1dgq n GLY 262 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 1dgq n GLY 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dgq h LYS 263 N 1.22 0.00 0.07 1.61 1.79 -1.77 -3.35 116.57 116.14 1dgq h LYS 263 Ca 0.00 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.15 1dgq h LYS 263 Cb 0.89 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.52 1dgq h LYS 263 CO 0.00 0.14 -1.76 0.72 -1.08 0.00 0.00 179.45 177.47 1dgq n HIS 264 N -4.65 1.09 0.54 -1.35 8.25 -0.95 -4.42 115.22 113.73 1dgq n HIS 264 Ca -0.08 0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.70 1dgq n HIS 264 Cb 0.23 -1.13 0.00 0.00 1.12 0.00 0.00 29.99 30.21 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 -3.86 0.00 0.09 4.41 3.72 -1.12 -1.08 117.46 119.61 1dgq n PHE 265 Ca -0.33 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.08 1dgq n PHE 265 Cb 0.90 -0.05 -0.03 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 0.46 0.00 -6.15 -1.08 3.07 -1.77 -3.42 115.11 106.22 1dgq h GLN 266 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 58.65 58.18 1dgq h GLN 266 Cb 0.23 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.74 1dgq h GLN 266 CO 0.00 0.42 0.46 0.95 0.09 0.00 0.00 178.83 180.75 1dgq s THR 267 N -2.94 4.84 0.26 1.86 -4.23 -0.24 -4.95 115.64 110.23 1dgq s THR 267 Ca 0.01 1.87 -0.02 0.00 -1.18 0.00 0.00 61.69 62.37 1dgq s THR 267 Cb 0.08 -4.24 0.24 0.00 1.34 0.00 0.00 72.50 69.92 1dgq s THR 267 CO 0.78 0.04 1.73 0.50 -0.54 0.00 0.00 174.62 177.13 1dgq h LYS 268 N 7.13 0.48 -1.00 3.99 3.64 -1.88 0.47 116.57 129.40 1dgq h LYS 268 Ca -0.32 -0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.14 1dgq h LYS 268 Cb 1.15 -0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 32.78 1dgq h LYS 268 CO 0.84 0.32 0.64 1.05 -2.27 0.00 0.00 179.45 180.02 1dgq h GLU 269 N 0.49 1.03 -0.06 1.90 9.09 -1.95 0.55 114.58 125.63 1dgq h GLU 269 Ca 0.45 -0.06 -0.03 0.00 0.05 0.00 0.00 59.36 59.77 1dgq h GLU 269 Cb 0.71 -0.23 -0.00 0.00 -1.65 0.00 0.00 28.75 27.58 1dgq h GLU 269 CO -0.41 0.68 -0.07 0.77 0.05 0.00 0.00 179.01 180.03 1dgq h SER 270 N 1.06 0.17 -0.62 3.06 0.02 -1.28 -3.28 113.55 112.68 1dgq h SER 270 Ca 0.47 -0.50 0.13 0.00 -0.84 0.00 0.00 61.79 61.05 1dgq h SER 270 Cb 0.37 -0.05 -0.11 0.00 0.14 0.00 0.00 62.40 62.76 1dgq h SER 270 CO -0.23 0.63 -0.01 1.56 -1.14 0.00 0.00 176.83 177.64 1dgq h GLN 271 N -0.29 0.10 -1.06 3.45 4.20 0.04 0.54 115.11 122.09 1dgq h GLN 271 Ca 0.01 -0.01 0.28 0.00 0.06 0.00 0.00 58.65 59.00 1dgq h GLN 271 Cb 0.59 -0.02 -0.11 0.00 0.30 0.00 0.00 27.48 28.24 1dgq h GLN 271 CO 0.02 0.07 0.66 0.93 -0.67 0.00 0.00 178.83 179.84 1dgq h GLU 272 N 0.10 0.39 -0.45 1.46 5.08 -0.99 0.16 114.58 120.33 1dgq h GLU 272 Ca 0.32 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.56 1dgq h GLU 272 Cb 0.52 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1dgq h GLU 272 CO -0.54 0.26 -0.10 1.79 -1.00 0.00 0.00 179.01 179.42 1dgq h THR 273 N 0.40 1.26 -0.65 1.13 1.35 -0.96 -2.68 112.91 112.76 1dgq h THR 273 Ca 0.64 -1.17 0.11 0.00 -0.55 0.00 0.00 66.41 65.44 1dgq h THR 273 Cb 1.57 1.02 -0.08 0.00 -1.73 0.00 0.00 68.15 68.92 1dgq h THR 273 CO -0.38 0.40 0.23 -0.07 -0.25 0.00 0.00 175.52 175.45 1dgq h LEU 274 N 0.74 0.20 -1.32 3.87 3.38 -0.95 -0.35 115.31 120.88 1dgq h LEU 274 Ca 0.13 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.27 1dgq h LEU 274 Cb 0.59 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 1dgq h LEU 274 CO 0.04 0.11 0.52 0.45 0.09 0.00 0.00 178.44 179.64 1dgq h HIS 275 N 0.39 0.81 -0.11 1.13 3.86 -1.42 0.13 115.15 119.95 1dgq h HIS 275 Ca 0.34 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.52 1dgq h HIS 275 Cb 0.46 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 1dgq h HIS 275 CO -0.18 0.40 -0.14 0.87 0.86 0.00 0.00 177.93 179.74 1dgq h LYS 276 N 0.78 0.29 -0.35 2.45 1.57 -1.06 -3.26 116.57 116.98 1dgq h LYS 276 Ca 0.36 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 1dgq h LYS 276 Cb 0.37 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1dgq h LYS 276 CO -0.13 0.72 0.11 0.74 -0.57 0.00 0.00 179.45 180.31 1dgq h PHE 277 N -0.13 0.57 -3.82 -1.35 0.04 -0.77 -3.45 116.94 108.03 1dgq h PHE 277 Ca 0.01 -0.06 -0.47 0.00 2.80 0.00 0.00 57.97 60.25 1dgq h PHE 277 Cb 0.68 -0.17 0.18 0.00 2.20 0.00 0.00 35.95 38.84 1dgq h PHE 277 CO 0.09 0.56 0.16 0.00 -0.60 0.00 0.00 178.31 178.52 1dgq s ALA 278 N -5.39 0.78 0.70 2.45 0.00 0.38 -4.78 121.76 115.91 1dgq s ALA 278 Ca -0.13 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 51.77 1dgq s ALA 278 Cb 0.09 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.96 1dgq s ALA 278 CO 0.75 -3.00 1.07 -1.12 0.00 0.00 0.00 175.76 173.46 1dgq s SER 279 N -2.93 5.38 0.03 0.00 0.01 -0.22 -4.88 113.70 111.08 1dgq s SER 279 Ca 0.66 1.42 -0.00 0.00 1.31 0.00 0.00 55.95 59.34 1dgq s SER 279 Cb -0.22 -2.29 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 1dgq s SER 279 CO 0.60 -1.42 0.13 -0.54 0.41 0.00 0.00 173.24 172.42 1dgq s LYS 280 N -5.15 3.17 0.09 12.44 -0.14 -1.26 -3.52 119.74 125.37 1dgq s LYS 280 Ca 0.58 -0.49 -0.31 0.00 -1.36 0.00 0.00 55.97 54.39 1dgq s LYS 280 Cb -0.13 -2.91 -0.06 0.00 -1.68 0.00 0.00 37.83 33.04 1dgq s LYS 280 CO 0.54 0.63 1.24 -2.14 -0.76 0.00 0.00 175.35 174.86 1dgq s PRO 281 N -2.08 4.42 0.48 -1.68 0.02 -1.26 -4.99 135.00 129.91 1dgq s PRO 281 Ca 0.28 1.85 0.19 0.00 0.02 0.00 0.00 61.00 63.34 1dgq s PRO 281 Cb -0.12 -3.31 1.20 0.00 0.02 0.00 0.00 34.50 32.29 1dgq s PRO 281 CO 0.20 -0.27 1.99 0.00 -0.33 0.00 0.00 177.00 178.58 1dgq h ALA 282 N 6.57 2.23 -0.84 -1.55 0.00 -1.88 0.83 119.26 124.63 1dgq h ALA 282 Ca -0.42 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 54.63 1dgq h ALA 282 Cb 1.21 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1dgq h ALA 282 CO 0.81 -0.37 0.55 0.66 0.00 0.00 0.00 179.25 180.90 1dgq h SER 283 N 0.22 0.52 0.09 0.00 4.64 -1.89 0.18 113.55 117.32 1dgq h SER 283 Ca 0.26 0.03 -0.19 0.00 -0.47 0.00 0.00 61.79 61.43 1dgq h SER 283 Cb 0.75 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1dgq h SER 283 CO -0.05 0.26 -0.92 -0.33 -0.87 0.00 0.00 176.83 174.92 1dgq h GLU 284 N 0.55 0.20 0.00 4.77 4.39 -1.20 -3.39 114.58 119.90 1dgq h GLU 284 Ca 0.42 -0.34 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 1dgq h GLU 284 Cb 0.81 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.58 1dgq h GLU 284 CO -0.17 1.16 -0.80 0.74 -1.16 0.00 0.00 179.01 178.78 1dgq h PHE 285 N -0.52 0.00 -3.40 4.33 0.04 -1.13 -3.45 116.94 112.81 1dgq h PHE 285 Ca -0.19 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.98 1dgq h PHE 285 Cb 1.54 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 39.57 1dgq h PHE 285 CO 0.18 0.29 -0.37 0.08 -0.60 0.00 0.00 178.31 177.89 1dgq s VAL 286 N -3.11 5.31 -0.26 -0.55 1.01 0.60 -0.62 120.40 122.78 1dgq s VAL 286 Ca 0.01 0.44 0.03 0.00 0.00 0.00 0.00 61.98 62.46 1dgq s VAL 286 Cb 0.08 -3.60 0.06 0.00 0.00 0.00 0.00 36.38 32.92 1dgq s VAL 286 CO 0.76 0.35 -0.11 -0.54 0.00 0.00 0.00 175.10 175.57 1dgq s LYS 287 N 0.79 2.26 0.06 2.72 -0.14 0.21 -4.80 119.74 120.84 1dgq s LYS 287 Ca 0.13 -1.34 -0.31 0.00 -1.36 0.00 0.00 55.97 53.10 1dgq s LYS 287 Cb -0.13 -2.89 -0.06 0.00 -1.68 0.00 0.00 37.83 33.07 1dgq s LYS 287 CO 0.04 -0.56 1.20 0.42 -0.76 0.00 0.00 175.35 175.69 1dgq s ILE 288 N 1.11 4.04 -0.32 2.17 -1.09 -1.26 -0.64 121.20 125.21 1dgq s ILE 288 Ca -0.09 1.46 0.00 0.00 -2.23 0.00 0.00 60.65 59.80 1dgq s ILE 288 Cb -0.20 -3.94 0.10 0.00 -1.58 0.00 0.00 42.46 36.84 1dgq s ILE 288 CO -0.05 0.11 0.09 -0.22 -1.23 0.00 0.00 174.94 173.64 1dgq s LEU 289 N 1.10 2.76 0.29 2.97 2.96 0.22 -4.91 118.68 124.07 1dgq s LEU 289 Ca 0.59 -1.74 0.02 0.00 -0.22 0.00 0.00 54.13 52.77 1dgq s LEU 289 Cb -0.29 -1.02 0.71 0.00 0.50 0.00 0.00 46.19 46.08 1dgq s LEU 289 CO 0.29 -0.41 1.63 -2.24 -1.32 0.00 0.00 176.35 174.30 1dgq h ASP 290 N 7.99 -0.10 -5.00 3.68 3.04 -1.90 0.23 116.42 124.36 1dgq h ASP 290 Ca -0.12 0.21 -0.15 0.00 -3.24 0.00 0.00 57.03 53.73 1dgq h ASP 290 Cb 1.02 0.31 -0.20 0.00 -1.04 0.00 0.00 39.33 39.41 1dgq h ASP 290 CO 0.48 -0.20 -0.60 0.42 -2.04 0.00 0.00 179.24 177.30 1dgq s THR 291 N -5.95 0.10 0.34 1.15 -4.23 -1.26 -3.59 115.64 102.21 1dgq s THR 291 Ca -0.12 -0.86 0.12 0.00 -1.18 0.00 0.00 61.69 59.64 1dgq s THR 291 Cb 0.26 -0.42 0.34 0.00 1.34 0.00 0.00 72.50 74.02 1dgq s THR 291 CO 0.77 -0.47 1.75 -0.26 -0.54 0.00 0.00 174.62 175.87 1dgq h PHE 292 N 4.37 0.91 -0.98 3.99 0.04 -1.97 0.59 116.94 123.89 1dgq h PHE 292 Ca -0.32 0.03 0.26 0.00 2.80 0.00 0.00 57.97 60.75 1dgq h PHE 292 Cb 1.20 -0.26 -0.18 0.00 2.20 0.00 0.00 35.95 38.90 1dgq h PHE 292 CO 0.62 0.09 0.01 0.93 -0.60 0.00 0.00 178.31 179.36 1dgq h GLU 293 N 0.55 0.01 0.00 1.51 3.07 -1.97 0.95 114.58 118.70 1dgq h GLU 293 Ca 0.62 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.48 1dgq h GLU 293 Cb 1.27 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 1dgq h GLU 293 CO -0.40 0.01 0.00 1.63 -1.40 0.00 0.00 179.01 178.84 1dgq n LYS 294 N -5.49 0.43 -0.22 2.33 4.76 0.20 -3.38 118.16 116.79 1dgq n LYS 294 Ca 0.22 0.06 0.20 0.00 -2.87 0.00 0.00 58.31 55.92 1dgq n LYS 294 Cb 0.73 -1.50 0.54 0.00 -1.84 0.00 0.00 35.03 32.96 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 0.35 -0.32 -0.35 3.38 -0.91 0.96 115.31 118.42 1dgq h LEU 295 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1dgq h LEU 295 Cb 0.14 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1dgq h LEU 295 CO 0.00 0.14 0.14 0.11 0.09 0.00 0.00 178.44 178.93 1dgq h LYS 296 N 0.35 0.47 0.19 1.13 1.57 -1.77 0.27 116.57 118.77 1dgq h LYS 296 Ca 0.45 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 59.14 1dgq h LYS 296 Cb 1.19 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.42 1dgq h LYS 296 CO -0.15 0.45 -0.09 0.22 -0.57 0.00 0.00 179.45 179.32 1dgq h ASP 297 N 0.37 -0.21 -0.42 0.86 3.58 -1.26 -1.76 116.42 117.58 1dgq h ASP 297 Ca 0.11 -0.22 0.08 0.00 0.42 0.00 0.00 57.03 57.42 1dgq h ASP 297 Cb 0.15 0.05 -0.07 0.00 1.72 0.00 0.00 39.33 41.18 1dgq h ASP 297 CO -0.01 0.12 -0.05 0.25 -2.88 0.00 0.00 179.24 176.67 1dgq h LEU 298 N -0.56 -0.28 -0.35 2.28 5.85 -0.91 -0.45 115.31 120.89 1dgq h LEU 298 Ca -0.03 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.88 1dgq h LEU 298 Cb 0.42 0.22 -0.09 0.00 0.37 0.00 0.00 40.66 41.58 1dgq h LEU 298 CO 0.04 -0.10 -0.30 0.15 -0.34 0.00 0.00 178.44 177.90 1dgq h PHE 299 N 0.05 -0.82 -0.60 1.25 3.57 -0.38 0.17 116.94 120.19 1dgq h PHE 299 Ca 0.21 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.80 1dgq h PHE 299 Cb 0.31 0.41 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 1dgq h PHE 299 CO -0.32 -0.37 0.33 1.15 -2.23 0.00 0.00 178.31 176.88 1dgq h THR 300 N -0.26 0.99 0.40 4.41 2.02 -0.31 0.31 112.91 120.49 1dgq h THR 300 Ca 0.16 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1dgq h THR 300 Cb 0.52 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1dgq h THR 300 CO -0.49 0.12 -0.20 -0.08 0.37 0.00 0.00 175.52 175.24 1dgq h GLU 301 N 0.64 -0.52 -0.67 6.66 4.57 -0.26 0.14 114.58 125.13 1dgq h GLU 301 Ca 0.26 0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.49 1dgq h GLU 301 Cb 0.12 0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.79 1dgq h GLU 301 CO -0.15 -0.35 0.44 -0.07 -1.18 0.00 0.00 179.01 177.70 1dgq h LEU 302 N -0.54 0.75 -0.61 1.64 3.38 -0.34 -0.62 115.31 118.97 1dgq h LEU 302 Ca -0.05 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 57.96 1dgq h LEU 302 Cb 0.42 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1dgq h LEU 302 CO 0.09 0.53 0.32 -0.61 0.09 0.00 0.00 178.44 178.86 1dgq h GLN 303 N 0.88 0.58 0.66 1.13 5.75 -0.18 0.22 115.11 124.15 1dgq h GLN 303 Ca 0.25 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.69 1dgq h GLN 303 Cb -0.07 -0.13 0.01 0.00 1.07 0.00 0.00 27.48 28.36 1dgq h GLN 303 CO -0.07 0.38 -0.32 -0.22 -2.65 0.00 0.00 178.83 175.96 1dgq h LYS 304 N 0.60 -0.85 -0.47 1.69 1.63 -0.48 -3.02 116.57 115.67 1dgq h LYS 304 Ca 0.28 0.06 0.09 0.00 -0.85 0.00 0.00 60.65 60.23 1dgq h LYS 304 Cb 0.19 0.19 -0.08 0.00 -0.60 0.00 0.00 32.23 31.93 1dgq h LYS 304 CO -0.19 -0.56 -0.05 0.87 -3.45 0.00 0.00 179.45 176.07 1dgq h LYS 305 N -0.90 0.06 -1.05 1.90 1.57 -0.48 -0.09 116.57 117.59 1dgq h LYS 305 Ca -0.09 -0.00 0.27 0.00 -1.87 0.00 0.00 60.65 58.96 1dgq h LYS 305 Cb 0.68 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.89 1dgq h LYS 305 CO 0.15 0.04 0.68 0.82 -0.57 0.00 0.00 179.45 180.56 1dgq h ILE 306 N 0.06 0.52 -0.81 1.86 2.04 -0.59 -0.28 117.51 120.30 1dgq h ILE 306 Ca 0.23 -0.13 0.18 0.00 1.00 0.00 0.00 64.86 66.15 1dgq h ILE 306 Cb 0.35 0.11 -0.05 0.00 -0.74 0.00 0.00 36.82 36.49 1dgq h ILE 306 CO -0.43 0.07 0.55 0.22 0.00 0.00 0.00 178.15 178.55 1dgq h TYR 307 N 0.37 0.41 0.00 1.37 5.03 -0.87 0.64 116.97 123.92 1dgq h TYR 307 Ca 0.59 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.92 1dgq h TYR 307 Cb 1.54 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 39.70 1dgq h TYR 307 CO -0.00 0.13 -0.00 0.28 -1.32 0.00 0.00 178.16 177.24 1dgq h VAL 308 N 0.33 0.93 0.25 1.81 2.07 -1.17 0.20 116.25 120.68 1dgq h VAL 308 Ca 0.41 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.90 1dgq h VAL 308 Cb 1.10 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1dgq h VAL 308 CO -0.12 0.00 -0.12 0.40 0.02 0.00 0.00 177.57 177.75 1dgq h ILE 309 N 0.00 0.76 -0.01 4.57 1.08 -1.02 -2.95 117.51 119.94 1dgq h ILE 309 Ca -0.00 -0.04 -0.20 0.00 -0.39 0.00 0.00 64.86 64.23 1dgq h ILE 309 Cb 0.01 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 34.53 1dgq h ILE 309 CO 0.00 0.01 -0.87 1.05 -0.69 0.00 0.00 178.15 177.65 1dgq h GLU 310 N -0.36 0.29 0.00 2.37 4.11 -1.59 -1.98 114.58 117.42 1dgq h GLU 310 Ca -0.03 -0.30 0.00 0.00 0.07 0.00 0.00 59.36 59.10 1dgq h GLU 310 Cb 0.28 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1dgq h GLU 310 CO 0.06 0.99 0.00 0.41 0.07 0.00 0.00 179.01 180.54