#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 4.02 -2.17 3.17 0.00 0.38 -4.83 120.51 121.09 1dgq n ALA 125 Ca 0.00 -3.52 -0.43 0.00 0.00 0.00 0.00 53.44 49.50 1dgq n ALA 125 Cb 0.00 -3.60 -0.02 0.00 0.00 0.00 0.00 19.45 15.83 1dgq n ALA 125 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dgq s SER 126 N 4.42 6.48 -0.40 0.00 0.01 -1.26 -4.64 113.70 118.31 1dgq s SER 126 Ca 0.54 1.61 -0.01 0.00 1.31 0.00 0.00 55.95 59.40 1dgq s SER 126 Cb 0.13 -2.53 0.22 0.00 0.21 0.00 0.00 66.02 64.05 1dgq s SER 126 CO 0.05 -1.18 1.01 2.29 0.41 0.00 0.00 173.24 175.82 1dgq n LYS 127 N 7.51 0.28 0.00 12.44 2.85 -1.25 -4.98 118.16 135.01 1dgq n LYS 127 Ca 0.18 -1.18 0.00 0.00 -1.05 0.00 0.00 58.31 56.25 1dgq n LYS 127 Cb 0.45 -0.49 0.00 0.00 -0.65 0.00 0.00 35.03 34.34 1dgq n LYS 127 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1dgq n GLY 128 N 2.41 1.51 3.63 2.58 0.00 0.40 -4.92 105.19 110.80 1dgq n GLY 128 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1dgq n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dgq s ASN 129 N -0.05 6.44 -0.02 1.61 4.22 -1.26 -4.16 114.94 121.72 1dgq s ASN 129 Ca 0.00 1.70 0.00 0.00 -2.14 0.00 0.00 52.86 52.42 1dgq s ASN 129 Cb 0.00 -2.53 0.03 0.00 1.28 0.00 0.00 41.25 40.03 1dgq s ASN 129 CO 0.00 -1.20 0.02 -0.69 -2.04 0.00 0.00 177.10 173.19 1dgq s VAL 130 N 4.99 0.05 -0.65 3.54 1.01 0.27 -0.64 120.40 128.98 1dgq s VAL 130 Ca 0.71 0.15 -0.16 0.00 0.00 0.00 0.00 61.98 62.69 1dgq s VAL 130 Cb -0.26 -0.17 0.16 0.00 0.00 0.00 0.00 36.38 36.11 1dgq s VAL 130 CO 0.29 0.11 0.62 -1.81 0.00 0.00 0.00 175.10 174.31 1dgq s ASP 131 N 1.03 6.39 -0.44 3.32 1.01 0.42 -0.71 116.67 127.68 1dgq s ASP 131 Ca -0.09 -2.07 -0.16 0.00 0.71 0.00 0.00 52.55 50.94 1dgq s ASP 131 Cb -0.13 -2.22 0.05 0.00 1.01 0.00 0.00 42.92 41.62 1dgq s ASP 131 CO -0.02 -0.79 0.38 -0.22 0.21 0.00 0.00 175.17 174.73 1dgq s LEU 132 N 1.23 5.30 -0.32 1.23 0.20 -0.10 -0.90 118.68 125.32 1dgq s LEU 132 Ca 0.09 -1.07 -0.18 0.00 0.69 0.00 0.00 54.13 53.66 1dgq s LEU 132 Cb -0.22 -2.21 -0.01 0.00 -0.43 0.00 0.00 46.19 43.31 1dgq s LEU 132 CO -0.01 -0.58 0.53 -0.69 -0.29 0.00 0.00 176.35 175.31 1dgq s VAL 133 N 1.77 5.02 -0.65 1.68 1.01 0.20 -0.71 120.40 128.73 1dgq s VAL 133 Ca 0.06 0.54 -0.24 0.00 0.00 0.00 0.00 61.98 62.34 1dgq s VAL 133 Cb -0.21 -3.93 0.06 0.00 0.00 0.00 0.00 36.38 32.29 1dgq s VAL 133 CO 0.09 -0.13 1.02 -0.36 0.00 0.00 0.00 175.10 175.72 1dgq s PHE 134 N 2.41 2.63 -1.01 5.22 0.08 0.20 -0.40 117.98 127.10 1dgq s PHE 134 Ca 0.20 -0.31 -0.16 0.00 0.12 0.00 0.00 56.93 56.78 1dgq s PHE 134 Cb -0.15 -4.30 0.16 0.00 -0.57 0.00 0.00 43.02 38.15 1dgq s PHE 134 CO 0.12 -1.65 1.18 -1.17 -0.10 0.00 0.00 175.22 173.60 1dgq s LEU 135 N 4.36 5.31 -0.16 -0.37 2.96 0.31 -0.53 118.68 130.56 1dgq s LEU 135 Ca 0.27 -2.49 -0.07 0.00 -0.22 0.00 0.00 54.13 51.62 1dgq s LEU 135 Cb -0.14 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 1dgq s LEU 135 CO 0.14 -0.87 0.07 0.72 -1.32 0.00 0.00 176.35 175.09 1dgq s PHE 136 N 1.86 3.32 0.19 5.38 -0.71 -0.05 -0.76 117.98 127.21 1dgq s PHE 136 Ca 0.34 0.20 -0.30 0.00 -1.04 0.00 0.00 56.93 56.13 1dgq s PHE 136 Cb -0.05 -2.02 -0.08 0.00 -1.21 0.00 0.00 43.02 39.66 1dgq s PHE 136 CO -0.07 0.32 0.95 0.34 -1.34 0.00 0.00 175.22 175.42 1dgq s ASP 137 N -0.05 7.60 -0.37 1.98 2.15 0.64 -0.67 116.67 127.94 1dgq s ASP 137 Ca 0.07 1.89 0.13 0.00 0.43 0.00 0.00 52.55 55.07 1dgq s ASP 137 Cb -0.12 -2.60 0.44 0.00 -0.30 0.00 0.00 42.92 40.33 1dgq s ASP 137 CO 0.01 0.08 0.99 0.61 -0.17 0.00 0.00 175.17 176.69 1dgq n GLY 138 N 1.75 3.31 3.75 2.66 0.00 0.63 -4.87 105.19 112.43 1dgq n GLY 138 Ca -0.01 -1.87 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 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 4.08 0.57 1.61 1.04 -1.26 -0.38 113.70 116.12 1dgq s SER 139 Ca 0.36 1.56 0.29 0.00 0.48 0.00 0.00 55.95 58.63 1dgq s SER 139 Cb 0.43 -2.27 1.47 0.00 0.10 0.00 0.00 66.02 65.75 1dgq s SER 139 CO -0.05 -2.27 1.90 0.00 0.98 0.00 0.00 173.24 173.80 1dgq h MET 140 N -1.29 0.00 -0.93 4.02 -0.00 -1.14 0.79 114.93 116.38 1dgq h MET 140 Ca -0.47 0.00 0.18 0.00 -0.00 0.00 0.00 59.70 59.41 1dgq h MET 140 Cb 1.26 0.00 -0.08 0.00 -0.00 0.00 0.00 31.60 32.78 1dgq h MET 140 CO 0.55 0.00 0.60 0.77 -0.00 0.00 0.00 176.91 178.82 1dgq h SER 141 N 0.00 0.59 -2.91 -0.10 0.02 -1.91 -3.40 113.55 105.84 1dgq h SER 141 Ca 0.27 0.05 -0.57 0.00 -0.84 0.00 0.00 61.79 60.71 1dgq h SER 141 Cb 1.31 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.75 1dgq h SER 141 CO -0.00 0.25 0.93 -0.76 -1.14 0.00 0.00 176.83 176.11 1dgq s LEU 142 N -9.77 4.16 0.36 5.07 2.01 0.27 -5.03 118.68 115.75 1dgq s LEU 142 Ca -0.10 1.69 -0.06 0.00 0.01 0.00 0.00 54.13 55.67 1dgq s LEU 142 Cb 0.23 -3.54 -0.05 0.00 0.01 0.00 0.00 46.19 42.84 1dgq s LEU 142 CO 0.79 -0.81 0.65 -1.10 1.01 0.00 0.00 176.35 176.90 1dgq s GLN 143 N 3.61 3.63 0.15 1.70 -1.52 -1.26 -4.86 119.66 121.12 1dgq s GLN 143 Ca 0.56 0.11 -0.30 0.00 -1.95 0.00 0.00 55.36 53.78 1dgq s GLN 143 Cb -0.22 -2.53 -0.05 0.00 -0.22 0.00 0.00 33.01 29.99 1dgq s GLN 143 CO 0.16 0.06 1.55 -1.35 -0.25 0.00 0.00 175.29 175.46 1dgq h PRO 144 N 1.15 -0.21 -0.74 2.91 0.11 -1.97 -0.29 132.00 132.96 1dgq h PRO 144 Ca -0.48 0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.67 1dgq h PRO 144 Cb 1.20 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 1dgq h PRO 144 CO 0.64 -0.14 0.49 0.22 -0.21 0.00 0.00 178.00 179.00 1dgq h ASP 145 N -0.22 0.80 0.05 -2.05 3.58 -1.98 0.18 116.42 116.77 1dgq h ASP 145 Ca 0.13 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1dgq h ASP 145 Cb 0.53 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1dgq h ASP 145 CO -0.74 0.56 -0.02 -0.33 -2.88 0.00 0.00 179.24 175.82 1dgq h GLU 146 N 0.93 -0.06 -0.50 0.28 5.08 -1.51 -1.48 114.58 117.31 1dgq h GLU 146 Ca 0.29 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.67 1dgq h GLU 146 Cb 0.01 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1dgq h GLU 146 CO -0.08 0.16 0.32 0.35 -1.00 0.00 0.00 179.01 178.76 1dgq h PHE 147 N -0.27 0.60 -0.86 4.33 3.57 -0.48 -0.39 116.94 123.44 1dgq h PHE 147 Ca -0.01 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.62 1dgq h PHE 147 Cb 0.25 -0.20 -0.08 0.00 2.79 0.00 0.00 35.95 38.71 1dgq h PHE 147 CO -0.00 0.37 0.49 1.96 -2.23 0.00 0.00 178.31 178.89 1dgq h GLN 148 N 0.65 0.77 -0.35 1.11 1.08 -0.54 0.87 115.11 118.68 1dgq h GLN 148 Ca 0.19 -0.05 -0.11 0.00 -1.45 0.00 0.00 58.65 57.23 1dgq h GLN 148 Cb -0.04 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 1dgq h GLN 148 CO -0.06 0.51 -0.24 0.87 -0.95 0.00 0.00 178.83 178.95 1dgq h LYS 149 N 0.79 0.71 -0.45 1.46 1.57 -0.16 0.21 116.57 120.70 1dgq h LYS 149 Ca 0.43 -0.29 0.07 0.00 -1.87 0.00 0.00 60.65 58.99 1dgq h LYS 149 Cb 0.44 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 1dgq h LYS 149 CO -0.27 0.88 0.08 0.82 -0.57 0.00 0.00 179.45 180.39 1dgq h ILE 150 N 0.62 0.75 -0.03 1.86 1.08 0.27 0.44 117.51 122.50 1dgq h ILE 150 Ca 0.08 -0.07 0.01 0.00 -0.39 0.00 0.00 64.86 64.49 1dgq h ILE 150 Cb 0.73 0.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 1dgq h ILE 150 CO 0.06 0.04 -0.01 -0.07 -0.69 0.00 0.00 178.15 177.48 1dgq h LEU 151 N 0.21 -0.03 -0.71 1.44 3.38 -0.46 -2.86 115.31 116.29 1dgq h LEU 151 Ca 0.22 0.01 0.12 0.00 0.09 0.00 0.00 57.88 58.32 1dgq h LEU 151 Cb 0.28 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 1dgq h LEU 151 CO -0.29 -0.01 0.28 -0.78 0.09 0.00 0.00 178.44 177.73 1dgq h ASP 152 N -0.00 0.28 0.24 -0.43 3.58 -0.01 0.47 116.42 120.55 1dgq h ASP 152 Ca 0.01 0.09 0.01 0.00 0.42 0.00 0.00 57.03 57.57 1dgq h ASP 152 Cb 0.02 0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.11 1dgq h ASP 152 CO -0.03 0.13 -0.35 0.15 -2.88 0.00 0.00 179.24 176.26 1dgq h PHE 153 N 0.45 -0.97 0.08 0.28 3.57 -0.78 0.28 116.94 119.85 1dgq h PHE 153 Ca 0.37 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.90 1dgq h PHE 153 Cb 0.52 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.63 1dgq h PHE 153 CO -0.16 -0.48 -0.14 0.52 -2.23 0.00 0.00 178.31 175.82 1dgq h MET 154 N -0.66 -0.26 -0.63 1.11 2.86 -1.11 -0.55 114.93 115.68 1dgq h MET 154 Ca 0.00 0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.79 1dgq h MET 154 Cb 0.64 0.06 -0.11 0.00 0.06 0.00 0.00 31.60 32.25 1dgq h MET 154 CO -0.13 -0.17 -0.02 -0.22 1.06 0.00 0.00 176.91 177.42 1dgq h LYS 155 N -0.27 0.09 0.38 1.72 3.64 -0.84 -0.18 116.57 121.10 1dgq h LYS 155 Ca 0.02 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1dgq h LYS 155 Cb 0.29 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1dgq h LYS 155 CO -0.08 0.06 -0.19 0.22 -2.27 0.00 0.00 179.45 177.19 1dgq h ASP 156 N 0.09 -0.46 -0.35 4.20 3.58 0.46 0.13 116.42 124.07 1dgq h ASP 156 Ca 0.33 0.02 0.08 0.00 0.42 0.00 0.00 57.03 57.87 1dgq h ASP 156 Cb 0.53 0.12 -0.08 0.00 1.72 0.00 0.00 39.33 41.63 1dgq h ASP 156 CO -0.56 -0.32 -0.20 0.58 -2.88 0.00 0.00 179.24 175.86 1dgq h VAL 157 N -0.52 0.43 -0.84 2.25 2.07 -0.68 -0.78 116.25 118.16 1dgq h VAL 157 Ca -0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.50 1dgq h VAL 157 Cb 0.41 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 1dgq h VAL 157 CO 0.08 0.00 0.55 0.24 0.02 0.00 0.00 177.57 178.45 1dgq h MET 158 N -0.15 1.05 0.06 1.57 2.86 -0.65 0.68 114.93 120.35 1dgq h MET 158 Ca 0.18 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1dgq h MET 158 Cb 0.42 -0.24 0.00 0.00 0.06 0.00 0.00 31.60 31.85 1dgq h MET 158 CO -0.44 0.69 -0.03 0.87 1.06 0.00 0.00 176.91 179.06 1dgq h LYS 159 N 1.08 -0.08 -0.35 1.72 1.79 -0.01 -1.05 116.57 119.67 1dgq h LYS 159 Ca 0.33 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 1dgq h LYS 159 Cb -0.03 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1dgq h LYS 159 CO -0.10 0.00 0.23 0.87 -1.08 0.00 0.00 179.45 179.37 1dgq h LYS 160 N -0.14 0.45 -1.17 3.15 6.56 -0.68 -3.08 116.57 121.65 1dgq h LYS 160 Ca -0.01 -0.03 -0.67 0.00 -1.06 0.00 0.00 60.65 58.88 1dgq h LYS 160 Cb 0.12 -0.10 -0.32 0.00 -0.57 0.00 0.00 32.23 31.36 1dgq h LYS 160 CO 0.01 0.30 0.53 1.28 -2.06 0.00 0.00 179.45 179.52 1dgq n LEU 161 N -4.85 7.04 -3.43 2.94 4.77 0.19 -4.90 117.00 118.76 1dgq n LEU 161 Ca -0.00 -4.52 -0.35 0.00 -0.03 0.00 0.00 56.01 51.10 1dgq n LEU 161 Cb 0.03 -0.86 -0.03 0.00 -2.33 0.00 0.00 43.42 40.23 1dgq n LEU 161 CO 0.34 1.68 2.56 -1.54 -1.33 0.00 0.00 177.39 179.10 1dgq n SER 162 N -0.79 4.84 -3.68 -1.43 3.41 -0.41 -4.59 113.62 110.98 1dgq n SER 162 Ca 0.57 -2.56 -0.13 0.00 -0.26 0.00 0.00 58.87 56.49 1dgq n SER 162 Cb 0.63 -1.30 -0.06 0.00 -0.26 0.00 0.00 64.21 63.22 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 3.56 -0.27 0.53 4.04 2.47 -1.26 -5.04 114.94 118.97 1dgq s ASN 163 Ca 0.52 -0.01 0.42 0.00 0.42 0.00 0.00 52.86 54.21 1dgq s ASN 163 Cb 0.14 0.41 1.62 0.00 -1.45 0.00 0.00 41.25 41.97 1dgq s ASN 163 CO -0.01 -0.65 1.67 0.74 -3.72 0.00 0.00 177.10 175.13 1dgq h THR 164 N 3.06 0.19 -0.97 -5.21 2.02 -1.97 0.19 112.91 110.21 1dgq h THR 164 Ca -0.31 -0.01 0.15 0.00 0.77 0.00 0.00 66.41 67.01 1dgq h THR 164 Cb 1.20 0.16 -0.16 0.00 -1.74 0.00 0.00 68.15 67.62 1dgq h THR 164 CO 0.44 0.00 -0.39 0.28 0.37 0.00 0.00 175.52 176.22 1dgq h SER 165 N 0.02 -1.42 -3.39 4.18 0.02 -1.92 -3.21 113.55 107.84 1dgq h SER 165 Ca 0.78 0.31 -0.73 0.00 -0.84 0.00 0.00 61.79 61.30 1dgq h SER 165 Cb 3.00 0.75 -0.24 0.00 0.14 0.00 0.00 62.40 66.05 1dgq h SER 165 CO -0.07 -0.29 -0.39 -0.31 -1.14 0.00 0.00 176.83 174.63 1dgq s TYR 166 N -5.95 3.27 -0.19 3.45 1.51 0.05 -0.57 117.35 118.93 1dgq s TYR 166 Ca -0.14 -1.08 -0.14 0.00 -1.01 0.00 0.00 57.07 54.70 1dgq s TYR 166 Cb 0.20 -2.99 -0.04 0.00 -0.11 0.00 0.00 41.96 39.01 1dgq s TYR 166 CO 0.71 -0.78 0.33 1.14 -1.11 0.00 0.00 175.55 175.84 1dgq s GLN 167 N 1.57 4.20 0.16 -0.62 0.00 0.11 -4.54 119.66 120.54 1dgq s GLN 167 Ca 0.04 0.11 0.05 0.00 -0.00 0.00 0.00 55.36 55.56 1dgq s GLN 167 Cb -0.23 -3.49 -0.04 0.00 0.00 0.00 0.00 33.01 29.25 1dgq s GLN 167 CO 0.06 0.09 0.10 -0.06 0.00 0.00 0.00 175.29 175.47 1dgq s PHE 168 N 0.93 3.08 0.09 9.60 0.40 -1.26 -0.92 117.98 129.90 1dgq s PHE 168 Ca 0.17 -0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.48 1dgq s PHE 168 Cb -0.14 -1.49 -0.04 0.00 0.51 0.00 0.00 43.02 41.87 1dgq s PHE 168 CO 0.06 0.52 -0.08 0.00 0.70 0.00 0.00 175.22 176.42 1dgq s ALA 169 N -1.71 0.96 -0.02 5.36 0.00 0.11 -3.34 121.76 123.12 1dgq s ALA 169 Ca 0.30 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.04 1dgq s ALA 169 Cb -0.10 0.10 0.03 0.00 0.00 0.00 0.00 23.12 23.15 1dgq s ALA 169 CO 0.22 -0.15 0.02 0.00 0.00 0.00 0.00 175.76 175.85 1dgq s ALA 170 N -2.95 0.17 -0.24 0.00 0.00 0.11 -0.63 121.76 118.21 1dgq s ALA 170 Ca 0.07 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1dgq s ALA 170 Cb 0.01 -0.27 0.04 0.00 0.00 0.00 0.00 23.12 22.90 1dgq s ALA 170 CO -0.03 -0.09 -0.09 0.08 0.00 0.00 0.00 175.76 175.63 1dgq s VAL 171 N 1.01 2.56 0.26 0.00 1.01 0.31 -0.16 120.40 125.39 1dgq s VAL 171 Ca -0.09 -1.20 -0.30 0.00 0.00 0.00 0.00 61.98 60.40 1dgq s VAL 171 Cb -0.13 -2.33 -0.09 0.00 0.00 0.00 0.00 36.38 33.83 1dgq s VAL 171 CO -0.02 0.17 1.08 -1.58 0.00 0.00 0.00 175.10 174.75 1dgq s GLN 172 N 1.26 4.66 0.08 2.72 0.74 0.23 -0.87 119.66 128.48 1dgq s GLN 172 Ca -0.02 1.75 0.04 0.00 0.05 0.00 0.00 55.36 57.18 1dgq s GLN 172 Cb -0.17 -3.22 -0.03 0.00 1.10 0.00 0.00 33.01 30.69 1dgq s GLN 172 CO -0.06 0.23 -0.11 -0.59 -0.55 0.00 0.00 175.29 174.22 1dgq s PHE 173 N -1.02 1.03 0.00 1.67 -0.71 0.16 -0.23 117.98 118.87 1dgq s PHE 173 Ca 0.45 -0.56 0.00 0.00 -1.04 0.00 0.00 56.93 55.78 1dgq s PHE 173 Cb -0.31 -0.58 0.00 0.00 -1.21 0.00 0.00 43.02 40.93 1dgq s PHE 173 CO 0.39 0.00 0.00 0.45 -1.34 0.00 0.00 175.22 174.72 1dgq n SER 174 N 0.98 0.00 -0.34 1.98 2.88 -1.26 -0.27 113.62 117.59 1dgq n SER 174 Ca -0.19 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.42 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 -2.81 2.46 2.02 -1.79 0.14 112.91 113.81 1dgq h THR 175 Ca 0.00 -0.30 -0.60 0.00 0.77 0.00 0.00 66.41 66.28 1dgq h THR 175 Cb 0.00 -0.08 -0.11 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 4.71 0.15 4.18 0.01 -1.26 -4.51 113.70 111.38 1dgq s SER 176 Ca -0.12 -0.43 -0.08 0.00 1.31 0.00 0.00 55.95 56.62 1dgq s SER 176 Cb 0.22 -0.98 -0.06 0.00 0.21 0.00 0.00 66.02 65.41 1dgq s SER 176 CO 0.80 0.08 0.45 -0.72 0.41 0.00 0.00 173.24 174.26 1dgq s TYR 177 N -1.79 3.50 -0.24 2.43 -0.85 -1.26 -4.40 117.35 114.74 1dgq s TYR 177 Ca 0.28 0.75 -0.03 0.00 -0.52 0.00 0.00 57.07 57.55 1dgq s TYR 177 Cb -0.09 -2.15 0.12 0.00 0.38 0.00 0.00 41.96 40.21 1dgq s TYR 177 CO 0.18 0.40 0.28 0.21 -1.52 0.00 0.00 175.55 175.11 1dgq s LYS 178 N -2.46 0.27 -0.29 -3.49 2.20 0.68 -4.98 119.74 111.66 1dgq s LYS 178 Ca 0.41 0.20 -0.28 0.00 -0.36 0.00 0.00 55.97 55.94 1dgq s LYS 178 Cb -0.13 -0.87 -0.06 0.00 -1.51 0.00 0.00 37.83 35.26 1dgq s LYS 178 CO 0.21 -0.75 2.27 2.41 -0.36 0.00 0.00 175.35 179.13 1dgq n THR 179 N 5.33 0.24 -0.04 3.43 -1.04 -1.26 -0.60 114.28 120.34 1dgq n THR 179 Ca -0.04 -0.53 -0.14 0.00 -2.04 0.00 0.00 64.05 61.30 1dgq n THR 179 Cb 0.49 -2.57 -0.08 0.00 -1.82 0.00 0.00 70.33 66.35 1dgq n THR 179 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1dgq h GLU 180 N 15.95 0.41 -2.84 -2.82 4.39 -0.90 -3.48 114.58 125.30 1dgq h GLU 180 Ca -0.36 -0.29 -0.03 0.00 0.34 0.00 0.00 59.36 59.02 1dgq h GLU 180 Cb 1.25 0.04 -0.13 0.00 -0.10 0.00 0.00 28.75 29.81 1dgq h GLU 180 CO 1.01 0.90 0.20 -0.59 -1.16 0.00 0.00 179.01 179.37 1dgq s PHE 181 N -3.90 -0.56 0.47 4.33 -0.12 -0.92 -4.86 117.98 112.42 1dgq s PHE 181 Ca -0.14 0.46 0.04 0.00 -0.05 0.00 0.00 56.93 57.24 1dgq s PHE 181 Cb 0.05 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1dgq s PHE 181 CO 0.78 -0.81 0.04 0.34 -0.05 0.00 0.00 175.22 175.52 1dgq s ASP 182 N -2.49 4.08 0.15 1.98 -1.08 -1.26 -0.72 116.67 117.34 1dgq s ASP 182 Ca -0.01 -1.49 -0.21 0.00 -0.52 0.00 0.00 52.55 50.32 1dgq s ASP 182 Cb -0.01 0.10 0.04 0.00 -1.46 0.00 0.00 42.92 41.59 1dgq s ASP 182 CO -0.09 -0.69 1.64 -0.26 0.52 0.00 0.00 175.17 176.29 1dgq h PHE 183 N 1.48 -0.53 -0.92 -5.34 0.04 -1.51 0.00 116.94 110.16 1dgq h PHE 183 Ca -0.44 0.04 0.14 0.00 2.80 0.00 0.00 57.97 60.51 1dgq h PHE 183 Cb 1.28 0.28 -0.08 0.00 2.20 0.00 0.00 35.95 39.63 1dgq h PHE 183 CO 1.14 -0.28 0.59 0.77 -0.60 0.00 0.00 178.31 179.92 1dgq h SER 184 N -0.19 0.73 -0.02 2.17 0.02 -1.16 0.19 113.55 115.28 1dgq h SER 184 Ca 0.15 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1dgq h SER 184 Cb 0.42 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 1dgq h SER 184 CO -0.39 0.37 0.00 0.44 -1.14 0.00 0.00 176.83 176.12 1dgq h ASP 185 N 0.77 0.03 -0.38 3.07 3.32 -1.31 0.87 116.42 122.78 1dgq h ASP 185 Ca 0.47 -0.22 0.04 0.00 0.02 0.00 0.00 57.03 57.33 1dgq h ASP 185 Cb 0.67 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.18 1dgq h ASP 185 CO -0.23 0.24 0.17 0.22 -1.72 0.00 0.00 179.24 177.92 1dgq h TYR 186 N -0.19 0.31 -0.71 4.55 3.20 -0.45 0.11 116.97 123.79 1dgq h TYR 186 Ca 0.01 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.96 1dgq h TYR 186 Cb 0.22 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.35 1dgq h TYR 186 CO -0.00 0.15 0.40 0.28 -1.64 0.00 0.00 178.16 177.35 1dgq h VAL 187 N 0.35 0.96 0.61 1.81 2.07 -0.38 0.44 116.25 122.12 1dgq h VAL 187 Ca 0.17 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1dgq h VAL 187 Cb 0.10 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1dgq h VAL 187 CO -0.14 0.13 -0.29 0.50 0.02 0.00 0.00 177.57 177.79 1dgq h LYS 188 N 0.73 -0.79 0.14 1.57 3.64 -0.47 -3.39 116.57 118.00 1dgq h LYS 188 Ca 0.32 0.05 -0.34 0.00 -1.27 0.00 0.00 60.65 59.42 1dgq h LYS 188 Cb 0.21 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1dgq h LYS 188 CO -0.19 -0.53 -1.74 -1.49 -2.27 0.00 0.00 179.45 173.23 1dgq h TRP 189 N -1.10 0.54 0.00 1.91 4.06 -0.66 -3.48 115.95 117.22 1dgq h TRP 189 Ca -0.08 -0.40 0.00 0.00 2.06 0.00 0.00 58.89 60.47 1dgq h TRP 189 Cb 0.63 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.77 1dgq h TRP 189 CO 0.02 1.57 0.00 1.63 -3.56 0.00 0.00 178.44 178.10 1dgq n LYS 190 N -3.49 0.00 -3.70 0.49 4.76 0.15 -4.93 118.16 111.45 1dgq n LYS 190 Ca -0.23 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 54.83 1dgq n LYS 190 Cb 1.06 -4.23 -0.12 0.00 -1.84 0.00 0.00 35.03 29.90 1dgq n LYS 190 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1dgq s ASP 191 N -2.06 5.38 0.16 4.39 -1.08 -1.26 -4.98 116.67 117.21 1dgq s ASP 191 Ca 0.00 -0.59 -0.16 0.00 -0.52 0.00 0.00 52.55 51.28 1dgq s ASP 191 Cb 0.00 -1.95 0.02 0.00 -1.46 0.00 0.00 42.92 39.53 1dgq s ASP 191 CO 0.00 -0.19 1.80 1.55 0.52 0.00 0.00 175.17 178.85 1dgq h PRO 192 N 8.30 0.58 -0.23 4.34 0.13 -1.92 -2.74 132.00 140.47 1dgq h PRO 192 Ca -0.32 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 64.78 1dgq h PRO 192 Cb 1.14 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1dgq h PRO 192 CO 0.61 0.41 0.09 0.22 -0.23 0.00 0.00 178.00 179.10 1dgq h ASP 193 N 0.58 0.12 -0.80 1.44 3.58 -1.96 0.15 116.42 119.52 1dgq h ASP 193 Ca 0.16 0.02 0.08 0.00 0.42 0.00 0.00 57.03 57.71 1dgq h ASP 193 Cb -0.03 -0.00 -0.07 0.00 1.72 0.00 0.00 39.33 40.95 1dgq h ASP 193 CO -0.03 0.10 0.47 0.00 -2.88 0.00 0.00 179.24 176.90 1dgq h ALA 194 N 1.13 1.13 0.40 -0.78 0.00 -1.92 0.18 119.26 119.40 1dgq h ALA 194 Ca 0.10 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1dgq h ALA 194 Cb 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1dgq h ALA 194 CO -0.09 0.13 -0.19 -0.07 0.00 0.00 0.00 179.25 179.03 1dgq h LEU 195 N 0.81 -0.46 -2.14 0.00 3.38 -1.27 -3.31 115.31 112.33 1dgq h LEU 195 Ca 0.37 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1dgq h LEU 195 Cb 0.29 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1dgq h LEU 195 CO -0.22 -0.04 0.00 -0.07 0.09 0.00 0.00 178.44 178.20 1dgq h LEU 196 N -0.98 0.00 -1.98 1.67 3.38 0.09 -1.90 115.31 115.59 1dgq h LEU 196 Ca -0.06 0.00 0.33 0.00 0.09 0.00 0.00 57.88 58.24 1dgq h LEU 196 Cb 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1dgq h LEU 196 CO 0.09 0.00 0.83 0.11 0.09 0.00 0.00 178.44 179.56 1dgq h LYS 197 N 0.00 0.00 0.00 1.13 1.57 -0.76 0.37 116.57 118.87 1dgq h LYS 197 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1dgq h LYS 197 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1dgq h LYS 197 CO 0.00 0.00 0.00 1.25 -0.57 0.00 0.00 179.45 180.13 1dgq h HIS 198 N 0.00 0.00 -0.70 -1.35 2.76 -1.59 -3.42 115.15 110.86 1dgq h HIS 198 Ca 0.53 0.00 -0.35 0.00 -2.20 0.00 0.00 60.37 58.35 1dgq h HIS 198 Cb 2.18 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 31.09 1dgq h HIS 198 CO 0.00 0.00 0.96 0.08 -1.30 0.00 0.00 177.93 177.67 1dgq s VAL 199 N -3.65 3.55 -0.39 5.26 1.01 0.12 -4.91 120.40 121.38 1dgq s VAL 199 Ca -0.01 -0.62 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 1dgq s VAL 199 Cb 0.09 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 32.17 1dgq s VAL 199 CO 0.34 -1.10 0.69 -0.54 0.00 0.00 0.00 175.10 174.48 1dgq s LYS 200 N 6.55 3.55 -0.01 2.72 1.02 -1.26 -5.02 119.74 127.29 1dgq s LYS 200 Ca 0.67 -0.03 -0.30 0.00 0.02 0.00 0.00 55.97 56.33 1dgq s LYS 200 Cb -0.04 -3.86 -0.07 0.00 -0.52 0.00 0.00 37.83 33.34 1dgq s LYS 200 CO 0.02 -0.89 1.69 -1.58 -0.92 0.00 0.00 175.35 173.67 1dgq s HIS 201 N 2.91 2.03 -0.01 3.18 2.46 -1.26 -4.94 115.29 119.65 1dgq s HIS 201 Ca 0.26 0.16 -0.24 0.00 0.47 0.00 0.00 55.06 55.71 1dgq s HIS 201 Cb -0.14 -3.96 -0.17 0.00 -0.13 0.00 0.00 32.58 28.18 1dgq s HIS 201 CO 0.18 -4.03 1.14 0.52 -2.47 0.00 0.00 174.74 170.08 1dgq h MET 202 N 9.31 -0.29 -5.17 2.88 2.86 -1.95 -3.49 114.93 119.08 1dgq h MET 202 Ca -0.41 0.02 -0.27 0.00 -2.06 0.00 0.00 59.70 56.98 1dgq h MET 202 Cb 1.19 0.07 0.16 0.00 0.06 0.00 0.00 31.60 33.07 1dgq h MET 202 CO 0.94 0.07 -0.70 1.28 1.06 0.00 0.00 176.91 179.57 1dgq n LEU 203 N -5.04 -4.20 0.00 1.22 4.77 0.49 -4.92 117.00 109.32 1dgq n LEU 203 Ca -0.09 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.33 1dgq n LEU 203 Cb 0.26 -2.82 0.00 0.00 -2.33 0.00 0.00 43.42 38.53 1dgq n LEU 203 CO 0.29 0.26 0.00 0.18 -1.33 0.00 0.00 177.39 176.79 1dgq n LEU 204 N -3.52 0.00 0.00 2.23 4.77 -1.25 -3.92 117.00 115.31 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 0.64 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1dgq n LEU 204 CO 0.53 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.77 1dgq n LEU 205 N 0.00 0.00 -3.24 2.23 4.77 -1.26 -0.91 117.00 118.59 1dgq n LEU 205 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 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 -0.27 0.41 -1.33 0.00 0.00 177.39 176.20 1dgq n THR 206 N 0.00 -0.87 -1.52 -5.08 -1.04 -1.25 -2.66 114.28 101.86 1dgq n THR 206 Ca 0.00 -3.52 -0.40 0.00 -2.04 0.00 0.00 64.05 58.10 1dgq n THR 206 Cb 0.00 -1.55 -0.02 0.00 -1.82 0.00 0.00 70.33 66.94 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 2.11 8.08 -0.04 8.00 5.15 0.51 -0.42 115.26 138.64 1dgq n ASN 207 Ca 0.24 -2.73 -0.10 0.00 -0.60 0.00 0.00 54.58 51.39 1dgq n ASN 207 Cb 0.51 -1.53 -0.04 0.00 -0.53 0.00 0.00 39.78 38.20 1dgq n ASN 207 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1dgq h THR 208 N 3.03 1.10 -0.22 -0.44 2.02 -1.91 0.29 112.91 116.79 1dgq h THR 208 Ca 0.80 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 67.65 1dgq h THR 208 Cb 0.33 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1dgq h THR 208 CO 1.73 0.10 -0.09 -0.26 0.37 0.00 0.00 175.52 177.37 1dgq h PHE 209 N 0.20 0.51 -0.98 3.16 -1.00 -1.87 0.22 116.94 117.18 1dgq h PHE 209 Ca 0.07 -0.12 0.02 0.00 2.81 0.00 0.00 57.97 60.74 1dgq h PHE 209 Cb 0.07 -0.12 -0.05 0.00 3.61 0.00 0.00 35.95 39.46 1dgq h PHE 209 CO -0.04 0.72 0.65 0.78 -1.61 0.00 0.00 178.31 178.80 1dgq h GLY 210 N 0.15 1.39 1.20 -1.45 0.00 -1.80 0.24 103.07 102.79 1dgq h GLY 210 Ca 0.05 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 1dgq h GLY 210 CO 0.03 0.48 -0.07 0.00 0.00 0.00 0.00 176.54 176.98 1dgq h ALA 211 N 1.37 0.89 -0.06 3.60 0.00 -0.49 0.13 119.26 124.69 1dgq h ALA 211 Ca 0.37 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1dgq h ALA 211 Cb -0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 1dgq h ALA 211 CO -0.09 0.65 0.04 0.82 0.00 0.00 0.00 179.25 180.67 1dgq h ILE 212 N 0.86 1.04 -0.37 0.00 2.04 0.06 0.45 117.51 121.60 1dgq h ILE 212 Ca 0.15 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 65.92 1dgq h ILE 212 Cb 0.60 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1dgq h ILE 212 CO 0.04 0.04 0.19 0.78 0.00 0.00 0.00 178.15 179.19 1dgq h ASN 213 N 0.06 0.28 -0.09 1.72 2.35 -0.70 0.48 115.58 119.67 1dgq h ASN 213 Ca 0.02 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 1dgq h ASN 213 Cb 0.03 -0.04 -0.06 0.00 0.05 0.00 0.00 38.32 38.30 1dgq h ASN 213 CO -0.00 0.21 -0.34 0.22 -1.65 0.00 0.00 177.43 175.87 1dgq h TYR 214 N 0.39 -0.93 -0.12 1.19 3.20 -0.51 -1.95 116.97 118.24 1dgq h TYR 214 Ca 0.15 0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.11 1dgq h TYR 214 Cb 0.05 0.43 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 1dgq h TYR 214 CO -0.09 -0.42 -0.26 0.28 -1.64 0.00 0.00 178.16 176.03 1dgq h VAL 215 N -0.43 0.39 -0.75 1.81 2.07 -0.57 0.27 116.25 119.03 1dgq h VAL 215 Ca 0.08 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.77 1dgq h VAL 215 Cb 0.56 0.39 -0.12 0.00 -1.52 0.00 0.00 31.29 30.61 1dgq h VAL 215 CO -0.34 0.00 0.16 0.00 0.02 0.00 0.00 177.57 177.41 1dgq h ALA 216 N 0.58 0.96 0.02 1.67 0.00 -0.42 -0.87 119.26 121.21 1dgq h ALA 216 Ca 0.10 0.19 -0.39 0.00 0.00 0.00 0.00 54.91 54.80 1dgq h ALA 216 Cb 0.48 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1dgq h ALA 216 CO -0.31 -0.37 -2.32 0.25 0.00 0.00 0.00 179.25 176.50 1dgq n THR 217 N -5.19 1.55 -0.07 0.00 -2.24 -0.78 -4.32 114.28 103.24 1dgq n THR 217 Ca 0.15 -0.50 -0.18 0.00 -2.27 0.00 0.00 64.05 61.25 1dgq n THR 217 Cb 0.49 -1.63 -0.13 0.00 -2.10 0.00 0.00 70.33 66.96 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 -3.62 0.69 -0.06 -0.78 -0.58 0.94 -4.62 120.64 112.62 1dgq n GLU 218 Ca -0.45 0.19 -0.22 0.00 -0.42 0.00 0.00 57.16 56.27 1dgq n GLU 218 Cb 0.95 -1.61 -0.13 0.00 -0.57 0.00 0.00 31.44 30.09 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 0.03 0.87 -0.08 2.62 2.07 -1.30 -3.39 116.25 117.08 1dgq h VAL 219 Ca -0.50 -2.26 -0.62 0.00 0.82 0.00 0.00 66.70 64.14 1dgq h VAL 219 Cb 1.99 2.39 0.03 0.00 -1.52 0.00 0.00 31.29 34.18 1dgq h VAL 219 CO 0.00 0.53 2.25 0.49 0.02 0.00 0.00 177.57 180.86 1dgq n PHE 220 N -4.11 2.22 -4.61 1.57 3.72 -0.42 -4.73 117.46 111.10 1dgq n PHE 220 Ca -0.31 -1.92 -0.24 0.00 -0.05 0.00 0.00 57.45 54.93 1dgq n PHE 220 Cb 0.81 -1.92 -0.16 0.00 -0.94 0.00 0.00 39.48 37.26 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 4.96 1.58 0.18 -1.08 0.52 -1.26 -4.82 118.95 119.02 1dgq s ARG 221 Ca 0.57 -0.44 -0.13 0.00 -0.52 0.00 0.00 55.73 55.22 1dgq s ARG 221 Cb 0.12 -1.34 0.17 0.00 0.52 0.00 0.00 34.95 34.42 1dgq s ARG 221 CO 0.10 0.10 1.75 0.93 0.02 0.00 0.00 175.30 178.20 1dgq h GLU 222 N 6.67 0.35 -0.65 3.54 3.07 -1.89 0.02 114.58 125.69 1dgq h GLU 222 Ca -0.32 -0.02 0.09 0.00 -0.50 0.00 0.00 59.36 58.61 1dgq h GLU 222 Cb 1.18 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.97 1dgq h GLU 222 CO 0.48 0.23 0.43 1.05 -1.40 0.00 0.00 179.01 179.80 1dgq h GLU 223 N 0.36 0.52 -0.20 2.33 9.09 -1.97 0.20 114.58 124.91 1dgq h GLU 223 Ca 0.24 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.62 1dgq h GLU 223 Cb 0.25 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.24 1dgq h GLU 223 CO -0.24 0.34 0.00 1.28 0.05 0.00 0.00 179.01 180.44 1dgq n LEU 224 N -4.48 1.22 0.00 3.06 4.77 -0.21 -4.88 117.00 116.47 1dgq n LEU 224 Ca 0.10 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 1dgq n LEU 224 Cb 0.32 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1dgq n LEU 224 CO 0.34 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1dgq n GLY 225 N 0.92 0.89 3.56 -0.72 0.00 0.70 -0.68 105.19 109.85 1dgq n GLY 225 Ca 0.10 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 2.22 -0.03 4.61 0.00 -0.18 -4.64 121.76 121.75 1dgq s ALA 226 Ca 0.00 -1.86 -0.31 0.00 0.00 0.00 0.00 51.96 49.79 1dgq s ALA 226 Cb 0.00 -4.53 -0.10 0.00 0.00 0.00 0.00 23.12 18.49 1dgq s ALA 226 CO 0.00 -4.16 1.98 0.54 0.00 0.00 0.00 175.76 174.11 1dgq n ARG 227 N 8.89 2.56 -0.08 0.00 1.74 -1.26 -3.96 116.66 124.56 1dgq n ARG 227 Ca 0.35 0.92 -0.01 0.00 -0.77 0.00 0.00 57.85 58.34 1dgq n ARG 227 Cb 0.49 -2.91 0.25 0.00 -1.02 0.00 0.00 32.46 29.27 1dgq n ARG 227 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1dgq h PRO 228 N 10.61 0.70 -0.61 5.56 0.13 -1.97 -1.56 132.00 144.86 1dgq h PRO 228 Ca -0.48 -0.13 -0.05 0.00 -0.87 0.00 0.00 66.00 64.47 1dgq h PRO 228 Cb 1.25 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1dgq h PRO 228 CO 0.95 0.64 0.17 0.38 -0.23 0.00 0.00 178.00 179.91 1dgq h ASP 229 N 0.68 0.87 -3.98 1.44 2.03 -1.92 -1.80 116.42 113.74 1dgq h ASP 229 Ca 0.15 -0.15 -0.53 0.00 -0.73 0.00 0.00 57.03 55.77 1dgq h ASP 229 Cb 0.25 -0.23 0.10 0.00 -0.83 0.00 0.00 39.33 38.63 1dgq h ASP 229 CO -0.00 0.82 0.63 0.00 -1.03 0.00 0.00 179.24 179.66 1dgq s ALA 230 N -5.29 3.16 -0.00 4.15 0.00 -0.59 -0.47 121.76 122.71 1dgq s ALA 230 Ca -0.10 1.29 -0.33 0.00 0.00 0.00 0.00 51.96 52.82 1dgq s ALA 230 Cb 0.15 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.64 1dgq s ALA 230 CO 0.81 -1.01 1.85 2.41 0.00 0.00 0.00 175.76 179.82 1dgq n THR 231 N -0.21 0.50 -2.09 0.00 -1.04 0.19 -1.16 114.28 110.47 1dgq n THR 231 Ca 0.05 -0.09 -0.42 0.00 -2.04 0.00 0.00 64.05 61.56 1dgq n THR 231 Cb 0.44 -1.94 -0.01 0.00 -1.82 0.00 0.00 70.33 67.00 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 6.21 2.87 -3.53 -2.82 4.76 -1.26 -0.44 118.16 123.95 1dgq n LYS 232 Ca 0.21 -2.86 -0.37 0.00 -2.87 0.00 0.00 58.31 52.42 1dgq n LYS 232 Cb 0.32 -3.39 -0.08 0.00 -1.84 0.00 0.00 35.03 30.05 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 4.14 5.29 -0.35 -0.18 1.01 -0.08 -0.71 120.40 129.52 1dgq s VAL 233 Ca 0.52 0.49 0.03 0.00 0.00 0.00 0.00 61.98 63.02 1dgq s VAL 233 Cb 0.09 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.95 1dgq s VAL 233 CO 0.01 0.34 0.07 -0.22 0.00 0.00 0.00 175.10 175.30 1dgq s LEU 234 N 0.86 4.38 -0.58 3.92 2.96 0.40 -0.63 118.68 130.00 1dgq s LEU 234 Ca 0.15 -2.14 -0.20 0.00 -0.22 0.00 0.00 54.13 51.72 1dgq s LEU 234 Cb -0.13 -1.52 0.08 0.00 0.50 0.00 0.00 46.19 45.12 1dgq s LEU 234 CO 0.05 -0.38 0.74 -0.63 -1.32 0.00 0.00 176.35 174.81 1dgq s ILE 235 N 0.92 4.72 -0.00 6.68 1.01 0.46 -0.73 121.20 134.27 1dgq s ILE 235 Ca 0.11 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.77 1dgq s ILE 235 Cb -0.19 -4.48 -0.03 0.00 0.01 0.00 0.00 42.46 37.77 1dgq s ILE 235 CO -0.10 -1.10 1.04 -0.63 0.00 0.00 0.00 174.94 174.15 1dgq s ILE 236 N 2.98 4.65 -0.25 2.92 1.09 0.67 -0.53 121.20 132.73 1dgq s ILE 236 Ca 0.15 1.90 0.02 0.00 -1.10 0.00 0.00 60.65 61.62 1dgq s ILE 236 Cb -0.21 -4.22 0.05 0.00 -1.06 0.00 0.00 42.46 37.02 1dgq s ILE 236 CO 0.09 0.12 -0.12 -0.63 -0.10 0.00 0.00 174.94 174.31 1dgq s ILE 237 N 1.19 2.24 -0.01 2.92 1.01 0.06 -0.68 121.20 127.93 1dgq s ILE 237 Ca 0.53 -1.47 -0.05 0.00 0.00 0.00 0.00 60.65 59.66 1dgq s ILE 237 Cb -0.23 -2.25 0.00 0.00 0.01 0.00 0.00 42.46 40.00 1dgq s ILE 237 CO 0.27 0.07 0.11 0.28 0.00 0.00 0.00 174.94 175.67 1dgq s THR 238 N 1.15 0.06 -0.72 2.92 -1.32 -0.29 -0.26 115.64 117.19 1dgq s THR 238 Ca -0.06 -0.47 0.23 0.00 -1.21 0.00 0.00 61.69 60.18 1dgq s THR 238 Cb -0.19 -0.32 -0.10 0.00 -1.51 0.00 0.00 72.50 70.39 1dgq s THR 238 CO -0.06 -0.26 1.09 -0.90 -2.21 0.00 0.00 174.62 172.28 1dgq n ASP 239 N 2.04 0.64 -4.17 8.08 5.75 -1.26 -0.47 116.55 127.15 1dgq n ASP 239 Ca -0.19 -0.28 -0.13 0.00 -0.01 0.00 0.00 54.79 54.18 1dgq n ASP 239 Cb 0.57 0.70 -0.10 0.00 -1.03 0.00 0.00 41.12 41.25 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 -3.48 0.82 0.82 6.12 0.00 -1.26 -2.36 107.32 107.98 1dgq s GLY 240 Ca 0.05 -1.26 -0.12 0.00 0.00 0.00 0.00 44.72 43.40 1dgq s GLY 240 CO 0.79 -1.34 1.17 -0.54 0.00 0.00 0.00 173.10 173.18 1dgq s GLU 241 N -3.22 1.60 -0.41 2.90 8.01 -1.26 -4.93 118.70 121.38 1dgq s GLU 241 Ca 0.08 1.63 -0.28 0.00 0.01 0.00 0.00 54.97 56.41 1dgq s GLU 241 Cb 0.00 -1.78 -0.01 0.00 -4.31 0.00 0.00 34.13 28.03 1dgq s GLU 241 CO -0.02 -2.22 1.64 0.00 0.01 0.00 0.00 175.26 174.67 1dgq s ALA 242 N -2.35 2.84 0.24 5.21 0.00 -1.26 -4.72 121.76 121.71 1dgq s ALA 242 Ca 0.70 -0.08 0.26 0.00 0.00 0.00 0.00 51.96 52.84 1dgq s ALA 242 Cb -0.26 -4.03 1.15 0.00 0.00 0.00 0.00 23.12 19.98 1dgq s ALA 242 CO 0.52 -2.74 1.92 1.79 0.00 0.00 0.00 175.76 177.26 1dgq h THR 243 N 6.66 0.52 0.04 0.00 1.35 -1.10 -3.27 112.91 117.12 1dgq h THR 243 Ca -0.30 -0.88 -0.27 0.00 -0.55 0.00 0.00 66.41 64.42 1dgq h THR 243 Cb 1.14 1.60 -0.03 0.00 -1.73 0.00 0.00 68.15 69.13 1dgq h THR 243 CO 1.09 0.17 -1.44 -2.24 -0.25 0.00 0.00 175.52 172.85 1dgq h ASP 244 N 0.00 0.14 -6.52 5.36 2.03 -1.90 -3.49 116.42 112.03 1dgq h ASP 244 Ca -0.00 -0.66 -0.50 0.00 -0.73 0.00 0.00 57.03 55.13 1dgq h ASP 244 Cb 0.59 -0.05 0.05 0.00 -0.83 0.00 0.00 39.33 39.09 1dgq h ASP 244 CO 0.02 1.59 -0.97 -1.20 -1.03 0.00 0.00 179.24 177.65 1dgq n SER 245 N -4.15 -4.86 0.00 4.15 7.64 -1.24 -4.99 113.62 110.18 1dgq n SER 245 Ca -0.31 -1.14 0.00 0.00 1.01 0.00 0.00 58.87 58.43 1dgq n SER 245 Cb 0.79 -2.67 0.00 0.00 -1.01 0.00 0.00 64.21 61.32 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 -1.85 0.57 3.17 0.23 0.00 -1.26 -5.09 105.19 100.95 1dgq n GLY 246 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.83 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 0.29 0.00 1.61 2.20 -1.26 -5.07 114.94 111.71 1dgq s ASN 247 Ca 0.00 -1.15 0.12 0.00 -0.94 0.00 0.00 52.86 50.89 1dgq s ASN 247 Cb 0.00 0.31 0.20 0.00 -2.00 0.00 0.00 41.25 39.75 1dgq s ASN 247 CO 0.00 -0.74 1.05 2.30 -2.94 0.00 0.00 177.10 176.77 1dgq n ILE 248 N -0.09 0.00 -0.27 0.54 -5.35 -1.26 -4.65 119.36 108.28 1dgq n ILE 248 Ca -0.06 -0.46 0.04 0.00 -0.27 0.00 0.00 62.75 62.00 1dgq n ILE 248 Cb 0.63 0.70 0.18 0.00 -1.74 0.00 0.00 39.64 39.41 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 0.46 0.46 -1.35 7.28 3.58 -1.98 0.84 116.42 125.72 1dgq h ASP 249 Ca -0.14 0.08 0.40 0.00 0.42 0.00 0.00 57.03 57.79 1dgq h ASP 249 Cb 1.61 0.01 -0.09 0.00 1.72 0.00 0.00 39.33 42.57 1dgq h ASP 249 CO 0.03 0.23 0.92 0.00 -2.88 0.00 0.00 179.24 177.54 1dgq h ALA 250 N 1.50 2.95 -0.39 -0.78 0.00 -1.96 -0.31 119.26 120.25 1dgq h ALA 250 Ca 0.40 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1dgq h ALA 250 Cb 0.51 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1dgq h ALA 250 CO -0.32 -1.44 0.00 0.00 0.00 0.00 0.00 179.25 177.48 1dgq n ALA 251 N -2.65 2.24 -0.30 0.00 0.00 0.27 -4.74 120.51 115.32 1dgq n ALA 251 Ca 0.33 -1.13 0.18 0.00 0.00 0.00 0.00 53.44 52.82 1dgq n ALA 251 Cb 1.38 -0.53 0.45 0.00 0.00 0.00 0.00 19.45 20.74 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 2.52 0.50 0.00 0.00 2.10 -0.78 0.11 116.57 121.03 1dgq h LYS 252 Ca 0.00 -0.03 -0.14 0.00 -2.00 0.00 0.00 60.65 58.48 1dgq h LYS 252 Cb 0.77 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 31.96 1dgq h LYS 252 CO 0.00 0.33 -0.66 0.22 -2.00 0.00 0.00 179.45 177.35 1dgq h ASP 253 N 0.52 0.00 -3.93 7.07 3.58 -1.85 -3.46 116.42 118.35 1dgq h ASP 253 Ca 0.54 0.00 -0.47 0.00 0.42 0.00 0.00 57.03 57.52 1dgq h ASP 253 Cb 1.18 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.22 1dgq h ASP 253 CO -0.28 0.66 0.37 -0.63 -2.88 0.00 0.00 179.24 176.49 1dgq s ILE 254 N -3.20 4.02 -0.89 2.25 1.01 0.39 -4.96 121.20 119.83 1dgq s ILE 254 Ca 0.01 1.59 -0.25 0.00 0.00 0.00 0.00 60.65 62.00 1dgq s ILE 254 Cb 0.10 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.78 1dgq s ILE 254 CO 0.76 0.05 1.35 -0.63 0.00 0.00 0.00 174.94 176.47 1dgq s ILE 255 N -1.68 3.87 -0.90 2.92 -1.09 0.11 -4.83 121.20 119.60 1dgq s ILE 255 Ca 0.54 -0.28 -0.24 0.00 -2.23 0.00 0.00 60.65 58.44 1dgq s ILE 255 Cb -0.19 -4.98 -0.00 0.00 -1.58 0.00 0.00 42.46 35.70 1dgq s ILE 255 CO 0.25 -1.88 1.70 -0.13 -1.23 0.00 0.00 174.94 173.65 1dgq s ARG 256 N 5.20 2.99 -0.02 2.79 3.00 -1.26 -0.45 118.95 131.20 1dgq s ARG 256 Ca 0.40 -0.50 -0.24 0.00 0.00 0.00 0.00 55.73 55.39 1dgq s ARG 256 Cb -0.04 -5.04 -0.04 0.00 0.00 0.00 0.00 34.95 29.83 1dgq s ARG 256 CO 0.01 -2.79 0.72 -0.47 0.00 0.00 0.00 175.30 172.77 1dgq s TYR 257 N 7.77 3.64 -0.11 -0.53 6.14 0.09 -1.31 117.35 133.04 1dgq s TYR 257 Ca 0.58 1.33 -0.01 0.00 0.64 0.00 0.00 57.07 59.61 1dgq s TYR 257 Cb -0.05 -2.80 0.03 0.00 0.42 0.00 0.00 41.96 39.56 1dgq s TYR 257 CO -0.01 0.17 -0.03 -1.50 0.64 0.00 0.00 175.55 174.82 1dgq s ILE 258 N 0.44 0.70 -0.36 3.14 2.07 0.28 -0.24 121.20 127.25 1dgq s ILE 258 Ca 0.38 -0.18 -0.19 0.00 -1.41 0.00 0.00 60.65 59.24 1dgq s ILE 258 Cb -0.19 -0.86 -0.00 0.00 0.13 0.00 0.00 42.46 41.55 1dgq s ILE 258 CO 0.20 0.23 0.55 -0.63 -1.91 0.00 0.00 174.94 173.38 1dgq s ILE 259 N 1.83 4.97 -0.50 2.00 1.09 0.14 -0.60 121.20 130.14 1dgq s ILE 259 Ca 0.04 0.39 -0.20 0.00 -1.10 0.00 0.00 60.65 59.79 1dgq s ILE 259 Cb -0.13 -4.01 0.05 0.00 -1.06 0.00 0.00 42.46 37.31 1dgq s ILE 259 CO -0.07 -0.26 0.64 -0.83 -0.10 0.00 0.00 174.94 174.33 1dgq s GLY 260 N 1.78 1.74 0.32 6.18 0.00 0.51 -1.13 107.32 116.72 1dgq s GLY 260 Ca 0.20 -1.64 -0.29 0.00 0.00 0.00 0.00 44.72 43.00 1dgq s GLY 260 CO 0.14 1.51 1.36 -0.42 0.00 0.00 0.00 173.10 175.69 1dgq s ILE 261 N 2.73 2.60 0.00 0.90 -1.09 0.38 0.00 121.20 126.73 1dgq s ILE 261 Ca 0.17 0.59 -0.01 0.00 -2.23 0.00 0.00 60.65 59.16 1dgq s ILE 261 Cb -0.18 -3.37 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 1dgq s ILE 261 CO 0.13 0.13 1.89 0.61 -1.23 0.00 0.00 174.94 176.48 1dgq n GLY 262 N 1.00 2.19 0.01 6.18 0.00 0.44 -3.21 105.19 111.80 1dgq n GLY 262 Ca 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.81 1dgq n GLY 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dgq n LYS 263 N 1.83 0.05 0.06 1.61 4.76 -1.26 -4.13 118.16 121.09 1dgq n LYS 263 Ca 0.08 0.20 -0.21 0.00 -2.87 0.00 0.00 58.31 55.51 1dgq n LYS 263 Cb 0.47 -0.78 -0.14 0.00 -1.84 0.00 0.00 35.03 32.75 1dgq n LYS 263 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1dgq h HIS 264 N -0.12 0.72 0.00 2.13 3.86 -1.57 -3.34 115.15 116.84 1dgq h HIS 264 Ca 0.00 -0.48 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 1dgq h HIS 264 Cb 0.08 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.50 1dgq h HIS 264 CO -0.03 1.34 0.00 1.19 0.86 0.00 0.00 177.93 181.29 1dgq n PHE 265 N -4.02 0.00 0.13 2.45 3.72 -1.20 -1.86 117.46 116.68 1dgq n PHE 265 Ca -0.13 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.25 1dgq n PHE 265 Cb 0.86 -0.03 0.22 0.00 -0.94 0.00 0.00 39.48 39.59 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 0.27 0.10 -5.92 -1.08 3.07 -1.72 -3.42 115.11 106.41 1dgq h GLN 266 Ca 0.00 -0.06 -0.59 0.00 0.09 0.00 0.00 58.65 58.10 1dgq h GLN 266 Cb 0.17 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 27.66 1dgq h GLN 266 CO 0.00 0.58 0.53 0.95 0.09 0.00 0.00 178.83 180.98 1dgq s THR 267 N -3.91 4.81 0.24 1.86 -4.23 -0.78 -4.95 115.64 108.68 1dgq s THR 267 Ca -0.03 1.72 -0.05 0.00 -1.18 0.00 0.00 61.69 62.14 1dgq s THR 267 Cb 0.13 -4.18 0.23 0.00 1.34 0.00 0.00 72.50 70.03 1dgq s THR 267 CO 0.76 -0.07 1.68 0.50 -0.54 0.00 0.00 174.62 176.95 1dgq h LYS 268 N 7.51 0.24 -0.96 3.99 1.63 -1.90 0.19 116.57 127.27 1dgq h LYS 268 Ca -0.24 -0.01 0.14 0.00 -0.85 0.00 0.00 60.65 59.69 1dgq h LYS 268 Cb 1.10 -0.05 -0.09 0.00 -0.60 0.00 0.00 32.23 32.58 1dgq h LYS 268 CO 0.89 0.16 0.58 1.05 -3.45 0.00 0.00 179.45 178.67 1dgq h GLU 269 N 0.24 0.82 -0.04 1.90 9.09 -1.97 0.27 114.58 124.90 1dgq h GLU 269 Ca 0.41 -0.05 -0.01 0.00 0.05 0.00 0.00 59.36 59.76 1dgq h GLU 269 Cb 0.70 -0.19 -0.00 0.00 -1.65 0.00 0.00 28.75 27.61 1dgq h GLU 269 CO -0.52 0.54 -0.01 0.77 0.05 0.00 0.00 179.01 179.84 1dgq h SER 270 N 0.85 0.08 -0.57 3.06 0.02 -1.02 -3.17 113.55 112.80 1dgq h SER 270 Ca 0.50 -0.40 0.11 0.00 -0.84 0.00 0.00 61.79 61.17 1dgq h SER 270 Cb 0.61 -0.02 -0.11 0.00 0.14 0.00 0.00 62.40 63.03 1dgq h SER 270 CO -0.31 0.46 -0.14 1.56 -1.14 0.00 0.00 176.83 177.25 1dgq h GLN 271 N -0.31 -0.00 -0.49 3.45 4.20 -0.21 -0.27 115.11 121.47 1dgq h GLN 271 Ca 0.01 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.86 1dgq h GLN 271 Cb 0.42 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1dgq h GLN 271 CO 0.00 -0.00 0.38 0.93 -0.67 0.00 0.00 178.83 179.48 1dgq h GLU 272 N -0.00 0.00 -0.26 1.46 4.39 -0.96 -0.94 114.58 118.27 1dgq h GLU 272 Ca 0.27 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.95 1dgq h GLU 272 Cb 0.42 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1dgq h GLU 272 CO -0.58 0.00 0.08 1.79 -1.16 0.00 0.00 179.01 179.13 1dgq h THR 273 N 0.00 1.20 -0.91 1.13 1.35 -1.03 -3.06 112.91 111.59 1dgq h THR 273 Ca 0.23 -0.63 0.14 0.00 -0.55 0.00 0.00 66.41 65.61 1dgq h THR 273 Cb 1.00 1.13 -0.09 0.00 -1.73 0.00 0.00 68.15 68.46 1dgq h THR 273 CO -0.00 0.21 0.52 -0.07 -0.25 0.00 0.00 175.52 175.92 1dgq h LEU 274 N 0.25 0.69 -1.47 3.87 3.38 -1.20 0.48 115.31 121.31 1dgq h LEU 274 Ca 0.08 0.08 0.21 0.00 0.09 0.00 0.00 57.88 58.34 1dgq h LEU 274 Cb 0.24 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1dgq h LEU 274 CO -0.00 0.31 0.61 0.45 0.09 0.00 0.00 178.44 179.89 1dgq h HIS 275 N 0.75 0.58 -0.15 1.13 3.86 -1.48 0.17 115.15 120.01 1dgq h HIS 275 Ca 0.49 0.02 -0.21 0.00 -1.16 0.00 0.00 60.37 59.51 1dgq h HIS 275 Cb 0.64 -0.18 0.01 0.00 1.06 0.00 0.00 27.41 28.94 1dgq h HIS 275 CO -0.05 0.15 -0.72 0.87 0.86 0.00 0.00 177.93 179.04 1dgq h LYS 276 N 0.43 0.76 -0.19 2.45 1.57 -0.98 -3.31 116.57 117.31 1dgq h LYS 276 Ca 0.49 -0.61 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 1dgq h LYS 276 Cb 1.18 0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.61 1dgq h LYS 276 CO -0.20 1.22 -0.12 0.74 -0.57 0.00 0.00 179.45 180.52 1dgq h PHE 277 N 0.48 0.49 -3.86 -1.35 -1.00 -0.87 -3.46 116.94 107.38 1dgq h PHE 277 Ca -0.05 -0.13 -0.49 0.00 2.81 0.00 0.00 57.97 60.12 1dgq h PHE 277 Cb 1.35 -0.11 0.20 0.00 3.61 0.00 0.00 35.95 41.00 1dgq h PHE 277 CO 0.09 0.74 0.14 0.00 -1.61 0.00 0.00 178.31 177.67 1dgq s ALA 278 N -4.48 0.66 0.67 2.45 0.00 0.40 -4.81 121.76 116.65 1dgq s ALA 278 Ca -0.14 0.31 -0.12 0.00 0.00 0.00 0.00 51.96 52.01 1dgq s ALA 278 Cb 0.06 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 19.81 1dgq s ALA 278 CO 0.76 -3.22 1.06 -1.12 0.00 0.00 0.00 175.76 173.24 1dgq s SER 279 N -2.60 5.52 0.01 0.00 0.01 -0.43 -4.89 113.70 111.33 1dgq s SER 279 Ca 0.67 1.64 -0.03 0.00 1.31 0.00 0.00 55.95 59.55 1dgq s SER 279 Cb -0.24 -2.50 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 1dgq s SER 279 CO 0.61 -1.35 0.22 -0.54 0.41 0.00 0.00 173.24 172.58 1dgq s LYS 280 N -4.85 3.48 0.05 12.44 -0.14 -1.26 -3.44 119.74 126.02 1dgq s LYS 280 Ca 0.59 -0.28 -0.30 0.00 -1.36 0.00 0.00 55.97 54.62 1dgq s LYS 280 Cb -0.14 -3.07 -0.05 0.00 -1.68 0.00 0.00 37.83 32.89 1dgq s LYS 280 CO 0.51 0.65 1.17 -2.14 -0.76 0.00 0.00 175.35 174.78 1dgq s PRO 281 N -2.04 4.44 0.47 -1.68 0.02 -1.26 -4.99 135.00 129.97 1dgq s PRO 281 Ca 0.29 1.73 0.20 0.00 0.02 0.00 0.00 61.00 63.24 1dgq s PRO 281 Cb -0.13 -3.37 1.19 0.00 0.02 0.00 0.00 34.50 32.22 1dgq s PRO 281 CO 0.20 -0.24 1.94 0.00 -0.33 0.00 0.00 177.00 178.57 1dgq h ALA 282 N 6.82 2.29 -0.63 -1.55 0.00 -1.85 0.46 119.26 124.80 1dgq h ALA 282 Ca -0.41 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.62 1dgq h ALA 282 Cb 1.21 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1dgq h ALA 282 CO 0.81 -0.49 0.43 0.77 0.00 0.00 0.00 179.25 180.76 1dgq h SER 283 N 0.25 0.30 0.02 0.00 0.02 -1.89 0.16 113.55 112.42 1dgq h SER 283 Ca 0.34 0.01 -0.19 0.00 -0.84 0.00 0.00 61.79 61.11 1dgq h SER 283 Cb 0.98 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1dgq h SER 283 CO -0.08 0.17 -1.03 -0.33 -1.14 0.00 0.00 176.83 174.42 1dgq h GLU 284 N 0.32 0.05 0.00 3.45 4.39 -1.28 -3.41 114.58 118.11 1dgq h GLU 284 Ca 0.30 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.87 1dgq h GLU 284 Cb 0.74 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.41 1dgq h GLU 284 CO -0.08 1.04 -0.40 0.74 -1.16 0.00 0.00 179.01 179.16 1dgq h PHE 285 N -0.85 0.00 -3.16 4.33 0.04 -1.05 -3.44 116.94 112.81 1dgq h PHE 285 Ca -0.27 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 59.91 1dgq h PHE 285 Cb 1.34 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 39.43 1dgq h PHE 285 CO 0.14 0.21 -0.17 0.08 -0.60 0.00 0.00 178.31 177.97 1dgq s VAL 286 N -3.13 5.06 -0.27 -0.55 1.01 0.54 -0.55 120.40 122.51 1dgq s VAL 286 Ca 0.04 0.90 0.01 0.00 0.00 0.00 0.00 61.98 62.94 1dgq s VAL 286 Cb 0.07 -3.76 0.07 0.00 0.00 0.00 0.00 36.38 32.76 1dgq s VAL 286 CO 0.72 0.48 -0.01 -0.75 0.00 0.00 0.00 175.10 175.54 1dgq s LYS 287 N -0.42 1.48 -1.13 2.72 2.47 0.23 -4.83 119.74 120.27 1dgq s LYS 287 Ca 0.25 -1.18 -0.21 0.00 -1.56 0.00 0.00 55.97 53.26 1dgq s LYS 287 Cb -0.16 -2.63 0.02 0.00 -1.46 0.00 0.00 37.83 33.61 1dgq s LYS 287 CO 0.12 -0.72 1.69 0.42 0.16 0.00 0.00 175.35 177.03 1dgq s ILE 288 N 1.33 3.88 -0.91 5.43 -1.09 -1.26 -0.36 121.20 128.21 1dgq s ILE 288 Ca -0.01 -1.15 -0.20 0.00 -2.23 0.00 0.00 60.65 57.06 1dgq s ILE 288 Cb -0.19 -4.90 0.10 0.00 -1.58 0.00 0.00 42.46 35.90 1dgq s ILE 288 CO -0.09 -1.71 1.18 -0.22 -1.23 0.00 0.00 174.94 172.87 1dgq s LEU 289 N 6.25 4.60 0.00 2.97 2.96 0.10 -4.79 118.68 130.77 1dgq s LEU 289 Ca 0.55 -1.76 0.00 0.00 -0.22 0.00 0.00 54.13 52.70 1dgq s LEU 289 Cb 0.00 -2.44 0.00 0.00 0.50 0.00 0.00 46.19 44.25 1dgq s LEU 289 CO 0.01 -1.22 0.00 -0.67 -1.32 0.00 0.00 176.35 173.15 1dgq n ASP 290 N 7.25 0.00 -4.06 3.68 2.03 -1.26 -0.42 116.55 123.77 1dgq n ASP 290 Ca 0.22 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.45 1dgq n ASP 290 Cb 0.49 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.79 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 -1.93 0.21 0.35 5.18 -4.23 -1.26 -2.39 115.64 111.57 1dgq s THR 291 Ca 0.00 -1.52 0.12 0.00 -1.18 0.00 0.00 61.69 59.11 1dgq s THR 291 Cb 0.00 -1.12 0.34 0.00 1.34 0.00 0.00 72.50 73.06 1dgq s THR 291 CO 0.00 -0.83 1.77 -0.26 -0.54 0.00 0.00 174.62 174.77 1dgq h PHE 292 N 3.63 0.86 -0.93 3.99 0.04 -1.96 0.75 116.94 123.33 1dgq h PHE 292 Ca -0.33 0.03 0.27 0.00 2.80 0.00 0.00 57.97 60.74 1dgq h PHE 292 Cb 1.16 -0.25 -0.15 0.00 2.20 0.00 0.00 35.95 38.91 1dgq h PHE 292 CO 0.58 0.13 0.30 0.93 -0.60 0.00 0.00 178.31 179.65 1dgq h GLU 293 N 0.56 0.18 0.00 1.51 3.07 -1.95 0.87 114.58 118.82 1dgq h GLU 293 Ca 0.59 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 1dgq h GLU 293 Cb 1.20 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.07 1dgq h GLU 293 CO -0.35 0.12 0.00 1.63 -1.40 0.00 0.00 179.01 179.01 1dgq n LYS 294 N -5.23 0.79 -0.14 2.33 4.76 0.26 -3.35 118.16 117.58 1dgq n LYS 294 Ca 0.25 0.00 0.18 0.00 -2.87 0.00 0.00 58.31 55.87 1dgq n LYS 294 Cb 0.80 -1.47 0.57 0.00 -1.84 0.00 0.00 35.03 33.10 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 0.26 -1.20 -0.35 3.38 -0.92 0.30 115.31 116.79 1dgq h LEU 295 Ca 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1dgq h LEU 295 Cb 0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1dgq h LEU 295 CO 0.00 0.13 0.38 0.11 0.09 0.00 0.00 178.44 179.15 1dgq h LYS 296 N 0.28 0.93 -0.07 1.13 1.57 -1.78 0.01 116.57 118.63 1dgq h LYS 296 Ca 0.36 -0.09 -0.13 0.00 -1.87 0.00 0.00 60.65 58.92 1dgq h LYS 296 Cb 1.02 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 33.15 1dgq h LYS 296 CO -0.09 0.68 -0.47 0.22 -0.57 0.00 0.00 179.45 179.21 1dgq h ASP 297 N 0.94 0.54 -0.59 0.86 3.58 -0.79 -3.24 116.42 117.72 1dgq h ASP 297 Ca 0.24 -0.67 0.12 0.00 0.42 0.00 0.00 57.03 57.14 1dgq h ASP 297 Cb 0.01 -0.16 -0.11 0.00 1.72 0.00 0.00 39.33 40.79 1dgq h ASP 297 CO -0.04 1.13 -0.13 0.25 -2.88 0.00 0.00 179.24 177.56 1dgq h LEU 298 N 0.00 -0.52 -0.29 2.28 5.85 -0.47 0.16 115.31 122.33 1dgq h LEU 298 Ca -0.04 0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1dgq h LEU 298 Cb 1.13 0.36 -0.06 0.00 0.37 0.00 0.00 40.66 42.46 1dgq h LEU 298 CO 0.10 -0.19 -0.44 0.15 -0.34 0.00 0.00 178.44 177.72 1dgq h PHE 299 N 0.01 -1.34 -0.78 1.25 3.57 -1.03 0.31 116.94 118.94 1dgq h PHE 299 Ca 0.29 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.92 1dgq h PHE 299 Cb 0.44 0.62 -0.06 0.00 2.79 0.00 0.00 35.95 39.74 1dgq h PHE 299 CO -0.47 -0.40 0.45 1.15 -2.23 0.00 0.00 178.31 176.81 1dgq h THR 300 N -0.34 0.96 -0.48 4.41 2.02 -1.37 0.19 112.91 118.29 1dgq h THR 300 Ca 0.05 -0.27 -0.09 0.00 0.77 0.00 0.00 66.41 66.87 1dgq h THR 300 Cb 0.48 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 1dgq h THR 300 CO -0.45 0.14 -0.03 -0.08 0.37 0.00 0.00 175.52 175.47 1dgq h GLU 301 N 0.79 0.88 0.06 6.66 4.57 -0.18 0.43 114.58 127.79 1dgq h GLU 301 Ca 0.36 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1dgq h GLU 301 Cb 0.26 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1dgq h GLU 301 CO -0.21 0.93 -0.03 -0.07 -1.18 0.00 0.00 179.01 178.45 1dgq h LEU 302 N 0.73 -0.07 -0.80 1.64 3.38 0.01 -3.19 115.31 117.00 1dgq h LEU 302 Ca 0.13 -0.31 0.19 0.00 0.09 0.00 0.00 57.88 57.98 1dgq h LEU 302 Cb 0.56 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.21 1dgq h LEU 302 CO 0.03 0.28 0.23 -0.61 0.09 0.00 0.00 178.44 178.47 1dgq h GLN 303 N -0.43 0.28 -0.40 1.13 5.75 -0.40 0.26 115.11 121.29 1dgq h GLN 303 Ca -0.01 -0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.55 1dgq h GLN 303 Cb 0.38 -0.06 -0.07 0.00 1.07 0.00 0.00 27.48 28.79 1dgq h GLN 303 CO 0.01 0.19 -0.07 -0.22 -2.65 0.00 0.00 178.83 176.09 1dgq h LYS 304 N 0.29 0.03 -0.10 1.69 3.64 -0.94 0.63 116.57 121.81 1dgq h LYS 304 Ca 0.47 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.79 1dgq h LYS 304 Cb 0.86 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1dgq h LYS 304 CO -0.55 0.02 -0.19 0.87 -2.27 0.00 0.00 179.45 177.33 1dgq h LYS 305 N 0.03 0.32 -0.93 1.90 1.57 -0.75 -3.08 116.57 115.63 1dgq h LYS 305 Ca 0.19 -0.20 0.21 0.00 -1.87 0.00 0.00 60.65 58.99 1dgq h LYS 305 Cb 0.29 0.02 -0.12 0.00 0.08 0.00 0.00 32.23 32.50 1dgq h LYS 305 CO -0.38 0.79 0.48 0.82 -0.57 0.00 0.00 179.45 180.59 1dgq h ILE 306 N -0.12 0.56 -0.88 1.86 2.04 -0.44 0.99 117.51 121.51 1dgq h ILE 306 Ca 0.01 -0.18 0.19 0.00 1.00 0.00 0.00 64.86 65.88 1dgq h ILE 306 Cb 0.77 -0.02 -0.07 0.00 -0.74 0.00 0.00 36.82 36.77 1dgq h ILE 306 CO 0.04 0.10 0.58 0.22 0.00 0.00 0.00 178.15 179.09 1dgq h TYR 307 N 0.53 0.56 -0.66 1.37 3.20 -0.77 0.20 116.97 121.39 1dgq h TYR 307 Ca 0.57 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.42 1dgq h TYR 307 Cb 1.03 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 39.10 1dgq h TYR 307 CO -0.08 0.16 0.24 0.28 -1.64 0.00 0.00 178.16 177.12 1dgq h VAL 308 N 0.43 1.24 -0.32 1.81 2.07 -0.89 0.37 116.25 120.95 1dgq h VAL 308 Ca 0.46 -0.77 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1dgq h VAL 308 Cb 1.10 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1dgq h VAL 308 CO -0.17 0.31 -0.17 0.40 0.02 0.00 0.00 177.57 177.95 1dgq h ILE 309 N 0.96 1.29 -0.56 4.57 1.08 -0.73 -2.37 117.51 121.75 1dgq h ILE 309 Ca 0.22 -1.29 0.06 0.00 -0.39 0.00 0.00 64.86 63.46 1dgq h ILE 309 Cb 0.23 1.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.37 1dgq h ILE 309 CO -0.01 0.42 0.37 -0.08 -0.69 0.00 0.00 178.15 178.15 1dgq h GLU 310 N 0.46 0.51 0.00 2.37 4.81 -0.53 0.11 114.58 122.31 1dgq h GLU 310 Ca 0.07 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1dgq h GLU 310 Cb 0.71 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1dgq h GLU 310 CO 0.05 0.34 0.00 0.41 -0.73 0.00 0.00 179.01 179.08