#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tw5 s THR 132 N 0.00 4.49 0.28 -5.08 -1.32 -1.26 -4.70 115.64 108.06 1tw5 s THR 132 Ca 0.00 -0.39 -0.29 0.00 -1.21 0.00 0.00 61.69 59.80 1tw5 s THR 132 Cb 0.00 -3.66 -0.10 0.00 -1.51 0.00 0.00 72.50 67.23 1tw5 s THR 132 CO 0.00 -0.48 1.20 0.00 -2.21 0.00 0.00 174.62 173.13 1tw5 s ALA 133 N -2.50 3.45 0.62 11.08 0.00 -1.26 0.03 121.76 133.17 1tw5 s ALA 133 Ca 0.45 1.05 -0.18 0.00 0.00 0.00 0.00 51.96 53.29 1tw5 s ALA 133 Cb -0.10 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 1tw5 s ALA 133 CO 0.38 -0.39 1.09 0.00 0.00 0.00 0.00 175.76 176.85 1tw5 s PRO 135 N -2.98 1.44 0.26 0.00 0.04 -1.26 -4.89 135.00 127.60 1tw5 s PRO 135 Ca 0.78 1.48 -0.02 0.00 0.04 0.00 0.00 61.00 63.28 1tw5 s PRO 135 Cb -0.40 -1.78 0.45 0.00 0.04 0.00 0.00 34.50 32.81 1tw5 s PRO 135 CO 0.45 -2.31 1.81 1.49 0.04 0.00 0.00 177.00 178.48 1tw5 h GLU 136 N -1.53 0.79 -6.16 4.56 4.81 -2.03 -3.39 114.58 111.65 1tw5 h GLU 136 Ca -0.44 -0.05 -0.69 0.00 -0.13 0.00 0.00 59.36 58.06 1tw5 h GLU 136 Cb 1.26 -0.18 -0.26 0.00 0.63 0.00 0.00 28.75 30.20 1tw5 h GLU 136 CO 0.45 0.52 -0.80 -2.00 -0.73 0.00 0.00 179.01 176.45 1tw5 s GLU 137 N -6.00 2.59 0.12 1.92 2.12 -1.26 -5.11 118.70 113.07 1tw5 s GLU 137 Ca -0.12 -0.76 -0.30 0.00 0.36 0.00 0.00 54.97 54.15 1tw5 s GLU 137 Cb 0.20 -2.34 -0.06 0.00 0.26 0.00 0.00 34.13 32.19 1tw5 s GLU 137 CO 0.79 0.51 1.13 0.45 -0.54 0.00 0.00 175.26 177.60 1tw5 s SER 138 N -0.46 7.20 0.00 -1.70 0.15 -1.26 -4.92 113.70 112.71 1tw5 s SER 138 Ca 0.05 2.02 0.18 0.00 0.70 0.00 0.00 55.95 58.90 1tw5 s SER 138 Cb -0.12 -2.59 0.97 0.00 -1.71 0.00 0.00 66.02 62.57 1tw5 s SER 138 CO 0.02 -0.32 1.64 -0.81 1.20 0.00 0.00 173.24 174.96 1tw5 n PRO 139 N 3.11 1.15 0.00 5.44 -0.04 -1.26 -3.32 135.00 140.08 1tw5 n PRO 139 Ca 0.05 -0.22 0.11 0.00 -0.04 0.00 0.00 63.50 63.40 1tw5 n PRO 139 Cb 0.47 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.64 1tw5 n PRO 139 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1tw5 n LEU 140 N -0.55 1.05 -4.75 1.53 4.77 -1.26 -4.98 117.00 112.81 1tw5 n LEU 140 Ca 0.14 -0.42 -0.42 0.00 -0.03 0.00 0.00 56.01 55.28 1tw5 n LEU 140 Cb 0.11 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1tw5 n LEU 140 CO 0.10 0.24 1.08 0.18 -1.33 0.00 0.00 177.39 177.66 1tw5 n LEU 141 N -1.23 4.39 -0.01 2.23 4.32 -1.21 -4.95 117.00 120.54 1tw5 n LEU 141 Ca 0.06 1.22 0.05 0.00 -0.02 0.00 0.00 56.01 57.31 1tw5 n LEU 141 Cb 0.35 -1.58 -0.08 0.00 -1.62 0.00 0.00 43.42 40.49 1tw5 n LEU 141 CO 0.38 -0.03 -0.63 1.33 -1.22 0.00 0.00 177.39 177.22 1tw5 n VAL 142 N 0.56 0.01 -1.31 4.08 0.24 -1.26 -5.11 118.33 115.54 1tw5 n VAL 142 Ca 0.03 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1tw5 n VAL 142 Cb 0.38 0.23 0.00 0.00 -1.47 0.00 0.00 33.84 32.98 1tw5 n VAL 142 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tw5 n GLY 143 N 1.89 0.81 3.70 7.63 0.00 -1.26 -4.95 105.19 113.02 1tw5 n GLY 143 Ca -0.02 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.15 1tw5 n GLY 143 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tw5 n PRO 144 N 3.77 2.31 -4.31 1.61 -0.04 -1.26 -2.99 135.00 134.08 1tw5 n PRO 144 Ca 0.00 0.82 -0.17 0.00 -0.04 0.00 0.00 63.50 64.11 1tw5 n PRO 144 Cb 0.00 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 30.85 1tw5 n PRO 144 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1tw5 s MET 145 N -0.71 1.24 -0.32 0.54 -1.94 0.30 -4.97 119.30 113.44 1tw5 s MET 145 Ca 0.64 -1.54 -0.21 0.00 -1.71 0.00 0.00 55.69 52.88 1tw5 s MET 145 Cb -0.58 -0.95 -0.01 0.00 2.01 0.00 0.00 34.83 35.31 1tw5 s MET 145 CO 0.51 0.15 0.65 -1.17 -0.01 0.00 0.00 175.02 175.15 1tw5 s LEU 146 N -3.26 4.16 -0.21 -0.03 0.20 -1.26 -4.86 118.68 113.41 1tw5 s LEU 146 Ca 0.20 0.38 -0.03 0.00 0.69 0.00 0.00 54.13 55.38 1tw5 s LEU 146 Cb 0.00 -2.84 -0.00 0.00 -0.43 0.00 0.00 46.19 42.93 1tw5 s LEU 146 CO 0.05 -0.52 -0.08 -0.63 -0.29 0.00 0.00 176.35 174.88 1tw5 s ILE 147 N 2.67 3.09 0.05 6.68 -1.09 -1.26 -5.11 121.20 126.24 1tw5 s ILE 147 Ca 0.26 -0.59 -0.00 0.00 -2.23 0.00 0.00 60.65 58.09 1tw5 s ILE 147 Cb -0.15 -2.39 -0.04 0.00 -1.58 0.00 0.00 42.46 38.31 1tw5 s ILE 147 CO 0.13 0.45 -0.04 -1.61 -1.23 0.00 0.00 174.94 172.63 1tw5 s GLU 148 N 1.44 0.60 -0.11 2.79 2.02 -1.26 -5.07 118.70 119.10 1tw5 s GLU 148 Ca 0.06 -1.11 0.15 0.00 0.02 0.00 0.00 54.97 54.09 1tw5 s GLU 148 Cb -0.14 0.08 0.34 0.00 0.10 0.00 0.00 34.13 34.51 1tw5 s GLU 148 CO -0.05 -0.07 1.16 1.19 0.02 0.00 0.00 175.26 177.51 1tw5 n PHE 149 N 0.43 0.00 -0.01 1.61 3.01 -1.26 -4.63 117.46 116.62 1tw5 n PHE 149 Ca -0.16 -0.95 -0.06 0.00 1.01 0.00 0.00 57.45 57.30 1tw5 n PHE 149 Cb 0.59 -0.18 -0.12 0.00 -0.01 0.00 0.00 39.48 39.76 1tw5 n PHE 149 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1tw5 n ASN 150 N -0.64 0.82 -4.71 4.37 6.94 -1.26 -4.91 115.26 115.86 1tw5 n ASN 150 Ca 0.13 0.38 -0.39 0.00 -0.02 0.00 0.00 54.58 54.68 1tw5 n ASN 150 Cb 0.79 0.07 0.04 0.00 -2.36 0.00 0.00 39.78 38.33 1tw5 n ASN 150 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1tw5 n ILE 151 N -2.98 3.65 -3.36 1.53 -0.00 -1.26 -5.01 119.36 111.94 1tw5 n ILE 151 Ca -0.15 -0.50 -0.33 0.00 -0.00 0.00 0.00 62.75 61.77 1tw5 n ILE 151 Cb 0.99 -1.55 -0.06 0.00 -0.00 0.00 0.00 39.64 39.02 1tw5 n ILE 151 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 1tw5 s PRO 152 N -2.77 3.86 -0.00 0.38 0.04 -1.26 -5.09 135.00 130.16 1tw5 s PRO 152 Ca 0.71 0.37 0.06 0.00 0.04 0.00 0.00 61.00 62.19 1tw5 s PRO 152 Cb -0.43 -2.66 -0.02 0.00 0.04 0.00 0.00 34.50 31.43 1tw5 s PRO 152 CO 0.50 0.32 -0.19 0.54 0.04 0.00 0.00 177.00 178.20 1tw5 s VAL 153 N -1.79 1.52 -0.14 -0.36 0.11 -1.26 -5.11 120.40 113.37 1tw5 s VAL 153 Ca 0.47 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.63 1tw5 s VAL 153 Cb -0.12 -1.28 0.02 0.00 -1.53 0.00 0.00 36.38 33.48 1tw5 s VAL 153 CO 0.20 0.37 -0.14 -0.62 -3.33 0.00 0.00 175.10 171.59 1tw5 s ASP 154 N -0.61 2.62 0.55 3.54 -1.08 -1.26 -5.01 116.67 115.42 1tw5 s ASP 154 Ca 0.07 -0.46 0.33 0.00 -0.52 0.00 0.00 52.55 51.96 1tw5 s ASP 154 Cb -0.08 -1.14 1.50 0.00 -1.46 0.00 0.00 42.92 41.74 1tw5 s ASP 154 CO -0.00 -0.06 2.05 -0.07 0.52 0.00 0.00 175.17 177.61 1tw5 h LEU 155 N 8.02 0.00 -0.16 -1.34 3.38 -1.98 -2.24 115.31 120.99 1tw5 h LEU 155 Ca -0.37 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 1tw5 h LEU 155 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1tw5 h LEU 155 CO 0.52 0.07 -0.02 0.11 0.09 0.00 0.00 178.44 179.20 1tw5 h LYS 156 N 0.00 0.29 -0.41 1.13 6.56 -1.98 0.88 116.57 123.04 1tw5 h LYS 156 Ca -0.00 -0.10 0.01 0.00 -1.06 0.00 0.00 60.65 59.49 1tw5 h LYS 156 Cb 0.42 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.04 1tw5 h LYS 156 CO 0.01 0.54 0.27 -0.07 -2.06 0.00 0.00 179.45 178.14 1tw5 h LEU 157 N 0.01 0.46 -0.24 2.94 4.07 -1.90 0.48 115.31 121.13 1tw5 h LEU 157 Ca 0.04 -0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.01 1tw5 h LEU 157 Cb 0.42 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.03 1tw5 h LEU 157 CO 0.01 0.33 0.11 0.58 -1.08 0.00 0.00 178.44 178.39 1tw5 h VAL 158 N 0.55 0.98 -0.60 1.22 2.07 -1.08 1.52 116.25 120.90 1tw5 h VAL 158 Ca 0.15 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.65 1tw5 h VAL 158 Cb -0.06 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.38 1tw5 h VAL 158 CO -0.04 0.04 0.31 -0.08 0.02 0.00 0.00 177.57 177.83 1tw5 h GLU 159 N 0.24 0.57 -0.50 1.57 4.81 0.12 0.11 114.58 121.50 1tw5 h GLU 159 Ca 0.10 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1tw5 h GLU 159 Cb 0.04 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1tw5 h GLU 159 CO -0.08 0.37 0.03 0.37 -0.73 0.00 0.00 179.01 178.98 1tw5 h GLN 160 N 0.58 0.86 0.00 1.92 4.15 0.15 -2.87 115.11 119.90 1tw5 h GLN 160 Ca 0.27 -0.26 -0.08 0.00 0.77 0.00 0.00 58.65 59.35 1tw5 h GLN 160 Cb 0.19 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1tw5 h GLN 160 CO -0.19 0.88 -0.39 1.96 -1.93 0.00 0.00 178.83 179.16 1tw5 h GLN 161 N 0.73 0.00 -2.38 1.69 4.20 0.26 -3.33 115.11 116.28 1tw5 h GLN 161 Ca 0.15 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 58.19 1tw5 h GLN 161 Cb 0.47 0.00 -0.38 0.00 0.30 0.00 0.00 27.48 27.87 1tw5 h GLN 161 CO 0.02 0.39 -0.17 0.09 -0.67 0.00 0.00 178.83 178.49 1tw5 n ASN 162 N -3.73 4.74 0.26 1.46 3.02 0.32 -4.91 115.26 116.42 1tw5 n ASN 162 Ca -0.01 -3.49 0.09 0.00 -0.03 0.00 0.00 54.58 51.14 1tw5 n ASN 162 Cb 0.47 -0.83 0.68 0.00 -0.61 0.00 0.00 39.78 39.49 1tw5 n ASN 162 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1tw5 h PRO 163 N 4.32 0.00 0.00 3.52 0.13 -1.68 -2.59 132.00 135.70 1tw5 h PRO 163 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1tw5 h PRO 163 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1tw5 h PRO 163 CO 0.98 0.01 0.00 1.63 -0.23 0.00 0.00 178.00 180.39 1tw5 n LYS 164 N -4.40 0.11 -2.67 0.86 4.76 -1.26 -4.66 118.16 110.90 1tw5 n LYS 164 Ca -0.03 0.31 -0.43 0.00 -2.87 0.00 0.00 58.31 55.29 1tw5 n LYS 164 Cb 0.10 -1.69 -0.02 0.00 -1.84 0.00 0.00 35.03 31.58 1tw5 n LYS 164 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1tw5 s VAL 165 N -3.15 4.60 0.57 -0.18 1.01 -0.98 -4.74 120.40 117.52 1tw5 s VAL 165 Ca 0.06 1.80 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1tw5 s VAL 165 Cb 0.10 -4.35 0.03 0.00 0.00 0.00 0.00 36.38 32.16 1tw5 s VAL 165 CO 0.36 -0.35 0.80 -0.54 0.00 0.00 0.00 175.10 175.37 1tw5 s LYS 166 N 3.43 2.54 0.11 2.72 1.02 -0.10 -4.87 119.74 124.58 1tw5 s LYS 166 Ca 0.44 -0.68 -0.33 0.00 0.02 0.00 0.00 55.97 55.42 1tw5 s LYS 166 Cb -0.13 -2.45 -0.18 0.00 -0.52 0.00 0.00 37.83 34.55 1tw5 s LYS 166 CO 0.12 -0.76 0.75 -0.11 -0.92 0.00 0.00 175.35 174.43 1tw5 n LEU 167 N -2.41 -0.66 -0.10 3.17 0.00 -1.26 -0.72 117.00 115.02 1tw5 n LEU 167 Ca 0.07 1.11 -0.01 0.00 0.00 0.00 0.00 56.01 57.19 1tw5 n LEU 167 Cb 0.60 -0.91 -0.01 0.00 0.00 0.00 0.00 43.42 43.10 1tw5 n LEU 167 CO 0.46 -2.43 -0.01 0.61 0.00 0.00 0.00 177.39 176.02 1tw5 n GLY 168 N 1.73 0.51 2.98 -3.96 0.00 0.11 -3.84 105.19 102.71 1tw5 n GLY 168 Ca 0.18 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 1tw5 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tw5 n GLY 169 N -2.52 -0.11 3.90 -0.02 0.00 0.44 -2.70 105.19 104.18 1tw5 n GLY 169 Ca -0.01 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1tw5 n GLY 169 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1tw5 s ARG 170 N -5.92 3.42 -0.17 1.61 1.81 -0.96 -2.96 118.95 115.79 1tw5 s ARG 170 Ca 0.41 -0.30 -0.12 0.00 -1.72 0.00 0.00 55.73 54.00 1tw5 s ARG 170 Cb -0.18 -3.10 0.05 0.00 -0.45 0.00 0.00 34.95 31.27 1tw5 s ARG 170 CO 0.52 0.69 0.42 -0.47 -0.68 0.00 0.00 175.30 175.77 1tw5 s TYR 171 N -1.28 -0.54 -0.02 -0.53 5.04 -0.20 -0.92 117.35 118.89 1tw5 s TYR 171 Ca 0.26 1.22 0.02 0.00 -2.44 0.00 0.00 57.07 56.13 1tw5 s TYR 171 Cb -0.13 0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.41 1tw5 s TYR 171 CO 0.17 -0.29 -0.06 0.99 -1.34 0.00 0.00 175.55 175.01 1tw5 s THR 172 N 0.86 0.56 0.32 4.34 2.01 -1.26 -0.55 115.64 121.92 1tw5 s THR 172 Ca -0.05 -0.25 -0.29 0.00 0.31 0.00 0.00 61.69 61.41 1tw5 s THR 172 Cb -0.06 -0.51 -0.11 0.00 0.01 0.00 0.00 72.50 71.83 1tw5 s THR 172 CO -0.07 0.18 1.57 -2.84 -0.69 0.00 0.00 174.62 172.78 1tw5 s PRO 173 N 0.20 4.11 0.01 4.92 0.02 -1.26 -4.90 135.00 138.10 1tw5 s PRO 173 Ca -0.02 2.59 0.22 0.00 0.02 0.00 0.00 61.00 63.81 1tw5 s PRO 173 Cb -0.07 -3.00 -0.19 0.00 0.02 0.00 0.00 34.50 31.26 1tw5 s PRO 173 CO -0.00 -0.62 0.75 -0.12 -0.33 0.00 0.00 177.00 176.68 1tw5 n MET 174 N 1.69 0.42 -0.02 5.54 1.56 -1.26 -4.40 117.12 120.64 1tw5 n MET 174 Ca 0.06 -0.08 0.05 0.00 -0.27 0.00 0.00 57.70 57.46 1tw5 n MET 174 Cb 0.38 -1.56 0.05 0.00 2.15 0.00 0.00 33.22 34.24 1tw5 n MET 174 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1tw5 n ASP 175 N -2.05 1.93 -3.60 6.12 5.75 -1.26 -5.04 116.55 118.40 1tw5 n ASP 175 Ca -0.00 -1.48 -0.09 0.00 -0.01 0.00 0.00 54.79 53.21 1tw5 n ASP 175 Cb 0.48 -0.03 -0.02 0.00 -1.03 0.00 0.00 41.12 40.52 1tw5 n ASP 175 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1tw5 s ILE 177 N -3.62 5.31 -0.14 0.00 -1.09 0.10 -4.59 121.20 117.18 1tw5 s ILE 177 Ca 0.06 0.17 -0.12 0.00 -2.23 0.00 0.00 60.65 58.53 1tw5 s ILE 177 Cb -0.02 -3.50 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 1tw5 s ILE 177 CO -0.05 0.31 0.25 -0.55 -1.23 0.00 0.00 174.94 173.67 1tw5 s SER 178 N 1.33 6.43 0.20 3.58 0.15 -1.26 -0.43 113.70 123.70 1tw5 s SER 178 Ca 0.07 0.51 0.26 0.00 0.70 0.00 0.00 55.95 57.49 1tw5 s SER 178 Cb -0.14 -2.15 0.86 0.00 -1.71 0.00 0.00 66.02 62.87 1tw5 s SER 178 CO 0.07 0.20 1.78 -0.81 1.20 0.00 0.00 173.24 175.67 1tw5 n PRO 179 N 3.06 0.23 -3.20 5.44 -0.04 -1.26 -4.66 135.00 134.57 1tw5 n PRO 179 Ca -0.14 0.23 -0.45 0.00 -0.04 0.00 0.00 63.50 63.10 1tw5 n PRO 179 Cb 0.52 -1.79 -0.06 0.00 -0.04 0.00 0.00 33.50 32.14 1tw5 n PRO 179 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1tw5 s HIS 180 N -3.12 3.09 -0.82 0.54 3.76 -1.26 -4.97 115.29 112.51 1tw5 s HIS 180 Ca 0.10 -0.88 -0.17 0.00 -0.15 0.00 0.00 55.06 53.97 1tw5 s HIS 180 Cb 0.12 -3.69 0.16 0.00 1.11 0.00 0.00 32.58 30.28 1tw5 s HIS 180 CO 0.56 -1.09 0.89 0.15 -0.85 0.00 0.00 174.74 174.41 1tw5 s LYS 181 N 2.33 3.48 -0.17 1.40 1.02 -1.26 -2.02 119.74 124.52 1tw5 s LYS 181 Ca 0.10 -1.95 -0.11 0.00 0.02 0.00 0.00 55.97 54.03 1tw5 s LYS 181 Cb -0.24 -4.59 -0.05 0.00 -0.52 0.00 0.00 37.83 32.44 1tw5 s LYS 181 CO 0.08 -1.53 0.20 0.08 -0.92 0.00 0.00 175.35 173.25 1tw5 s VAL 182 N 1.67 5.37 -0.24 3.17 1.01 -0.58 -1.19 120.40 129.61 1tw5 s VAL 182 Ca 0.22 0.34 -0.06 0.00 0.00 0.00 0.00 61.98 62.49 1tw5 s VAL 182 Cb -0.11 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 1tw5 s VAL 182 CO -0.06 0.44 0.03 0.00 0.00 0.00 0.00 175.10 175.50 1tw5 s ALA 183 N 0.26 3.02 -0.32 5.51 0.00 -0.45 -1.54 121.76 128.23 1tw5 s ALA 183 Ca 0.12 -1.16 -0.12 0.00 0.00 0.00 0.00 51.96 50.79 1tw5 s ALA 183 Cb -0.12 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.04 1tw5 s ALA 183 CO 0.01 -0.49 0.22 0.42 0.00 0.00 0.00 175.76 175.92 1tw5 s ILE 184 N 1.55 5.28 -0.20 0.00 1.01 0.00 -1.15 121.20 127.69 1tw5 s ILE 184 Ca 0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 60.65 60.54 1tw5 s ILE 184 Cb -0.15 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1tw5 s ILE 184 CO 0.01 0.08 0.08 -0.63 0.00 0.00 0.00 174.94 174.47 1tw5 s ILE 185 N 1.73 4.78 -0.18 2.92 -1.09 0.78 -0.65 121.20 129.50 1tw5 s ILE 185 Ca 0.06 -0.03 0.01 0.00 -2.23 0.00 0.00 60.65 58.46 1tw5 s ILE 185 Cb -0.17 -3.18 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 1tw5 s ILE 185 CO 0.11 0.43 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.42 1tw5 s ILE 186 N 0.66 2.02 0.35 2.92 1.01 0.55 -0.92 121.20 127.78 1tw5 s ILE 186 Ca 0.04 -0.95 -0.27 0.00 0.00 0.00 0.00 60.65 59.47 1tw5 s ILE 186 Cb -0.13 -1.85 -0.09 0.00 0.01 0.00 0.00 42.46 40.40 1tw5 s ILE 186 CO 0.02 0.50 1.15 -2.16 0.00 0.00 0.00 174.94 174.45 1tw5 s PRO 187 N 1.30 4.33 0.01 2.79 0.04 -1.26 -0.25 135.00 141.96 1tw5 s PRO 187 Ca 0.04 1.85 -0.20 0.00 0.04 0.00 0.00 61.00 62.74 1tw5 s PRO 187 Cb -0.13 -2.91 0.04 0.00 0.04 0.00 0.00 34.50 31.53 1tw5 s PRO 187 CO -0.12 -0.09 0.44 0.12 0.04 0.00 0.00 177.00 177.39 1tw5 s PHE 188 N -1.31 -0.32 0.00 0.56 5.36 0.30 -4.51 117.98 118.06 1tw5 s PHE 188 Ca 0.51 0.43 0.00 0.00 -0.96 0.00 0.00 56.93 56.91 1tw5 s PHE 188 Cb -0.32 0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.59 1tw5 s PHE 188 CO 0.41 -0.52 0.00 -2.13 -1.46 0.00 0.00 175.22 171.51 1tw5 n ARG 189 N 0.84 0.00 -3.89 10.12 0.63 -1.26 -0.80 116.66 122.30 1tw5 n ARG 189 Ca -0.20 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.47 1tw5 n ARG 189 Cb 0.58 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.50 1tw5 n ARG 189 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1tw5 n ASN 190 N 0.00 -2.30 -2.56 6.15 5.03 -1.26 -4.90 115.26 115.41 1tw5 n ASN 190 Ca 0.00 -0.87 -0.08 0.00 0.87 0.00 0.00 54.58 54.49 1tw5 n ASN 190 Cb 0.00 -3.62 0.04 0.00 -1.02 0.00 0.00 39.78 35.18 1tw5 n ASN 190 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1tw5 n ARG 191 N -4.44 2.37 -0.11 3.52 5.12 -1.26 -4.93 116.66 116.92 1tw5 n ARG 191 Ca -0.16 -3.74 -0.08 0.00 -1.93 0.00 0.00 57.85 51.95 1tw5 n ARG 191 Cb 0.61 -1.83 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 1tw5 n ARG 191 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 1tw5 h GLN 192 N 2.47 0.41 -0.82 5.56 5.75 -1.99 -2.02 115.11 124.46 1tw5 h GLN 192 Ca 0.04 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 1tw5 h GLN 192 Cb 1.36 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.77 1tw5 h GLN 192 CO 0.39 0.27 0.43 0.93 -2.65 0.00 0.00 178.83 178.19 1tw5 h GLU 193 N 0.42 1.15 -0.57 1.69 4.39 -2.00 -1.01 114.58 118.66 1tw5 h GLU 193 Ca 0.14 -0.14 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1tw5 h GLU 193 Cb 0.01 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.42 1tw5 h GLU 193 CO -0.07 0.86 0.23 0.45 -1.16 0.00 0.00 179.01 179.31 1tw5 h HIS 194 N 1.15 0.88 -0.60 4.33 3.86 -1.86 -2.78 115.15 120.13 1tw5 h HIS 194 Ca 0.29 -0.07 0.02 0.00 -1.16 0.00 0.00 60.37 59.45 1tw5 h HIS 194 Cb 0.06 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.23 1tw5 h HIS 194 CO 0.01 0.71 0.38 1.25 0.86 0.00 0.00 177.93 181.14 1tw5 h LEU 195 N 0.79 0.64 -0.25 2.43 6.46 -0.67 0.71 115.31 125.42 1tw5 h LEU 195 Ca 0.19 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 58.00 1tw5 h LEU 195 Cb 0.21 -0.15 -0.06 0.00 -0.73 0.00 0.00 40.66 39.94 1tw5 h LEU 195 CO -0.01 0.45 -0.11 0.11 -0.62 0.00 0.00 178.44 178.26 1tw5 h LYS 196 N 0.76 -0.07 -0.81 1.25 1.57 -1.03 0.39 116.57 118.63 1tw5 h LYS 196 Ca 0.23 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.98 1tw5 h LYS 196 Cb -0.03 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 1tw5 h LYS 196 CO -0.08 -0.05 0.38 1.88 -0.57 0.00 0.00 179.45 181.01 1tw5 h TYR 197 N -0.07 1.18 0.13 -1.35 -1.99 -1.12 0.11 116.97 113.86 1tw5 h TYR 197 Ca 0.13 -0.06 -0.01 0.00 2.00 0.00 0.00 58.73 60.79 1tw5 h TYR 197 Cb 0.27 -0.36 0.00 0.00 2.00 0.00 0.00 36.73 38.64 1tw5 h TYR 197 CO -0.29 0.86 -0.07 2.35 -0.00 0.00 0.00 178.16 181.02 1tw5 h TRP 198 N 1.16 -0.17 -0.31 4.88 7.01 0.57 -0.68 115.95 128.42 1tw5 h TRP 198 Ca 0.28 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.28 1tw5 h TRP 198 Cb 0.14 0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.24 1tw5 h TRP 198 CO 0.02 -0.11 0.19 -0.07 -2.79 0.00 0.00 178.44 175.68 1tw5 h LEU 199 N -0.18 0.31 -0.75 0.65 3.38 -0.04 0.13 115.31 118.81 1tw5 h LEU 199 Ca -0.02 -0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.07 1tw5 h LEU 199 Cb 0.14 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 1tw5 h LEU 199 CO 0.02 0.23 0.37 0.22 0.09 0.00 0.00 178.44 179.37 1tw5 h TYR 200 N 0.39 0.65 0.14 1.13 3.20 -0.40 -2.76 116.97 119.31 1tw5 h TYR 200 Ca 0.12 0.03 -0.36 0.00 3.14 0.00 0.00 58.73 61.66 1tw5 h TYR 200 Cb -0.02 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 1tw5 h TYR 200 CO -0.07 0.20 -1.90 1.88 -1.64 0.00 0.00 178.16 176.62 1tw5 h TYR 201 N 0.59 0.53 -0.13 -3.82 -1.99 -0.86 -3.41 116.97 107.87 1tw5 h TYR 201 Ca 0.39 -0.38 -0.19 0.00 2.00 0.00 0.00 58.73 60.54 1tw5 h TYR 201 Cb 0.47 -0.02 -0.00 0.00 2.00 0.00 0.00 36.73 39.18 1tw5 h TYR 201 CO -0.11 1.75 -0.69 -0.07 -0.00 0.00 0.00 178.16 179.03 1tw5 h LEU 202 N 0.04 0.66 0.00 3.88 -0.00 -0.76 -3.22 115.31 115.91 1tw5 h LEU 202 Ca -0.40 -0.41 0.02 0.00 -0.00 0.00 0.00 57.88 57.09 1tw5 h LEU 202 Cb 2.02 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 42.46 1tw5 h LEU 202 CO 0.10 1.16 -0.13 0.45 -0.00 0.00 0.00 178.44 180.02 1tw5 h HIS 203 N 0.40 -0.34 -0.80 1.13 3.86 -1.69 0.31 115.15 118.02 1tw5 h HIS 203 Ca -0.03 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1tw5 h HIS 203 Cb 1.28 0.15 -0.04 0.00 1.06 0.00 0.00 27.41 29.86 1tw5 h HIS 203 CO 0.06 -0.20 0.52 -1.35 0.86 0.00 0.00 177.93 177.81 1tw5 h PRO 204 N -0.23 1.07 0.02 2.45 0.11 -1.80 -2.37 132.00 131.26 1tw5 h PRO 204 Ca 0.05 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1tw5 h PRO 204 Cb 0.28 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.16 1tw5 h PRO 204 CO -0.13 0.72 -0.01 0.82 -0.21 0.00 0.00 178.00 179.20 1tw5 h ILE 205 N 1.10 1.16 -0.67 4.15 2.04 -1.33 -2.46 117.51 121.50 1tw5 h ILE 205 Ca 0.29 -0.52 0.03 0.00 1.00 0.00 0.00 64.86 65.66 1tw5 h ILE 205 Cb -0.10 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 1tw5 h ILE 205 CO -0.06 0.13 0.42 -0.07 0.00 0.00 0.00 178.15 178.57 1tw5 h LEU 206 N -0.25 0.70 -0.49 1.44 3.38 -0.28 -1.44 115.31 118.36 1tw5 h LEU 206 Ca -0.00 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 1tw5 h LEU 206 Cb 0.24 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1tw5 h LEU 206 CO 0.00 0.49 0.25 1.56 0.09 0.00 0.00 178.44 180.83 1tw5 h GLN 207 N 0.83 0.48 0.00 1.13 4.20 -1.42 -0.94 115.11 119.39 1tw5 h GLN 207 Ca 0.26 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 1tw5 h GLN 207 Cb 0.00 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 1tw5 h GLN 207 CO -0.10 0.32 -0.08 0.00 -0.67 0.00 0.00 178.83 178.30 1tw5 h ARG 208 N 0.49 0.00 -0.03 1.46 3.08 -0.80 0.18 114.38 118.75 1tw5 h ARG 208 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1tw5 h ARG 208 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1tw5 h ARG 208 CO -0.15 0.08 0.00 1.04 -1.07 0.00 0.00 179.97 179.88 1tw5 n GLN 209 N -3.71 1.11 -3.84 0.04 6.02 -0.37 -4.43 117.38 112.20 1tw5 n GLN 209 Ca -0.02 -0.17 -0.26 0.00 -0.01 0.00 0.00 57.00 56.54 1tw5 n GLN 209 Cb 0.19 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1tw5 n GLN 209 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1tw5 n GLN 210 N -0.57 -3.12 -4.10 -1.09 6.02 0.05 -4.88 117.38 109.68 1tw5 n GLN 210 Ca 0.12 0.45 -0.32 0.00 -0.01 0.00 0.00 57.00 57.24 1tw5 n GLN 210 Cb 0.09 -4.55 -0.07 0.00 1.02 0.00 0.00 30.24 26.73 1tw5 n GLN 210 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1tw5 s LEU 211 N -6.80 3.79 -0.80 1.08 1.43 -1.22 -4.75 118.68 111.42 1tw5 s LEU 211 Ca 0.11 0.05 -0.15 0.00 -1.03 0.00 0.00 54.13 53.11 1tw5 s LEU 211 Cb -0.04 -2.33 0.20 0.00 0.03 0.00 0.00 46.19 44.05 1tw5 s LEU 211 CO 0.87 0.23 0.77 -0.62 0.23 0.00 0.00 176.35 177.83 1tw5 s ASP 212 N -2.01 6.66 0.42 2.29 2.15 -0.86 -4.37 116.67 120.95 1tw5 s ASP 212 Ca 0.25 -2.47 0.04 0.00 0.43 0.00 0.00 52.55 50.79 1tw5 s ASP 212 Cb -0.12 -2.23 -0.04 0.00 -0.30 0.00 0.00 42.92 40.23 1tw5 s ASP 212 CO 0.17 -0.68 0.06 -0.72 -0.17 0.00 0.00 175.17 173.83 1tw5 s TYR 213 N 0.68 1.97 -0.04 -5.34 -0.85 0.29 -1.52 117.35 112.54 1tw5 s TYR 213 Ca 0.17 -1.01 -0.11 0.00 -0.52 0.00 0.00 57.07 55.61 1tw5 s TYR 213 Cb -0.12 -1.42 0.02 0.00 0.38 0.00 0.00 41.96 40.81 1tw5 s TYR 213 CO -0.07 0.05 0.24 0.20 -1.52 0.00 0.00 175.55 174.45 1tw5 s GLY 214 N -3.67 -0.11 -0.18 5.49 0.00 -0.59 -1.03 107.32 107.22 1tw5 s GLY 214 Ca 0.23 0.34 -0.05 0.00 0.00 0.00 0.00 44.72 45.25 1tw5 s GLY 214 CO 0.12 0.19 -0.01 -0.42 0.00 0.00 0.00 173.10 172.98 1tw5 s ILE 215 N -0.81 3.97 -0.15 0.90 -1.09 -1.16 -0.82 121.20 122.05 1tw5 s ILE 215 Ca -0.09 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1tw5 s ILE 215 Cb -0.05 -2.78 0.02 0.00 -1.58 0.00 0.00 42.46 38.08 1tw5 s ILE 215 CO 0.02 0.45 -0.14 -0.31 -1.23 0.00 0.00 174.94 173.73 1tw5 s TYR 216 N 0.76 2.13 -0.38 3.97 1.51 0.18 -1.48 117.35 124.04 1tw5 s TYR 216 Ca -0.00 -1.19 -0.11 0.00 -1.01 0.00 0.00 57.07 54.76 1tw5 s TYR 216 Cb -0.14 -1.57 0.04 0.00 -0.11 0.00 0.00 41.96 40.17 1tw5 s TYR 216 CO 0.02 -0.66 0.22 0.08 -1.11 0.00 0.00 175.55 174.10 1tw5 s VAL 217 N 1.47 4.51 -0.66 0.71 1.01 -0.21 -0.33 120.40 126.91 1tw5 s VAL 217 Ca 0.04 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 1tw5 s VAL 217 Cb -0.13 -3.56 0.11 0.00 0.00 0.00 0.00 36.38 32.80 1tw5 s VAL 217 CO -0.10 -0.29 0.81 -0.63 0.00 0.00 0.00 175.10 174.89 1tw5 s ILE 218 N 1.53 4.77 -0.20 2.22 -1.09 0.66 -1.34 121.20 127.74 1tw5 s ILE 218 Ca 0.02 -1.04 -0.25 0.00 -2.23 0.00 0.00 60.65 57.15 1tw5 s ILE 218 Cb -0.20 -4.56 -0.01 0.00 -1.58 0.00 0.00 42.46 36.11 1tw5 s ILE 218 CO 0.06 -1.23 0.84 0.21 -1.23 0.00 0.00 174.94 173.59 1tw5 s ASN 219 N 3.55 6.91 -0.26 3.58 2.47 -0.25 -0.54 114.94 130.40 1tw5 s ASN 219 Ca 0.16 1.12 -0.27 0.00 0.42 0.00 0.00 52.86 54.29 1tw5 s ASN 219 Cb -0.20 -2.45 0.01 0.00 -1.45 0.00 0.00 41.25 37.16 1tw5 s ASN 219 CO 0.04 -0.46 0.97 -1.58 -3.72 0.00 0.00 177.10 172.35 1tw5 s GLN 220 N 2.51 4.18 0.63 0.43 0.74 0.02 -0.48 119.66 127.68 1tw5 s GLN 220 Ca 0.37 1.14 -0.13 0.00 0.05 0.00 0.00 55.36 56.79 1tw5 s GLN 220 Cb -0.16 -3.67 -0.03 0.00 1.10 0.00 0.00 33.01 30.26 1tw5 s GLN 220 CO 0.10 -0.65 1.04 0.00 -0.55 0.00 0.00 175.29 175.22 1tw5 s ALA 221 N 3.17 2.86 0.00 1.58 0.00 -0.13 -4.85 121.76 124.39 1tw5 s ALA 221 Ca 0.41 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.49 1tw5 s ALA 221 Cb -0.14 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.82 1tw5 s ALA 221 CO 0.09 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.41 1tw5 n GLY 222 N -1.91 -1.95 0.92 0.00 0.00 -1.26 -4.73 105.19 96.26 1tw5 n GLY 222 Ca 0.07 -1.40 0.03 0.00 0.00 0.00 0.00 46.02 44.73 1tw5 n GLY 222 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1tw5 n GLU 223 N -0.01 0.25 -2.16 1.61 -0.58 -1.26 -5.09 120.64 113.40 1tw5 n GLU 223 Ca 0.00 -1.78 -0.27 0.00 -0.42 0.00 0.00 57.16 54.69 1tw5 n GLU 223 Cb 0.00 -0.46 0.13 0.00 -0.57 0.00 0.00 31.44 30.54 1tw5 n GLU 223 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1tw5 s SER 224 N -1.80 3.98 0.16 1.62 0.01 -1.26 -4.93 113.70 111.49 1tw5 s SER 224 Ca 0.21 0.21 -0.32 0.00 1.31 0.00 0.00 55.95 57.37 1tw5 s SER 224 Cb 0.23 -0.54 -0.17 0.00 0.21 0.00 0.00 66.02 65.75 1tw5 s SER 224 CO -0.08 -2.15 0.86 0.80 0.41 0.00 0.00 173.24 173.08 1tw5 n MET 225 N -3.28 0.48 -2.26 12.44 1.56 -1.26 -4.90 117.12 119.90 1tw5 n MET 225 Ca 0.13 0.17 -0.36 0.00 -0.27 0.00 0.00 57.70 57.37 1tw5 n MET 225 Cb 0.60 -1.45 -0.00 0.00 2.15 0.00 0.00 33.22 34.52 1tw5 n MET 225 CO 0.00 0.00 0.00 0.12 -0.73 0.00 0.00 175.97 175.36 1tw5 s PHE 226 N -0.59 2.78 -0.40 1.12 5.36 0.20 -4.77 117.98 121.67 1tw5 s PHE 226 Ca 0.71 1.54 0.02 0.00 -0.96 0.00 0.00 56.93 58.24 1tw5 s PHE 226 Cb -0.95 -3.33 0.15 0.00 -0.34 0.00 0.00 43.02 38.55 1tw5 s PHE 226 CO 0.56 -1.53 0.27 1.21 -1.46 0.00 0.00 175.22 174.27 1tw5 s ASN 227 N -1.56 2.75 0.13 6.13 3.04 -1.26 -1.01 114.94 123.15 1tw5 s ASN 227 Ca 0.68 -2.61 -0.32 0.00 0.04 0.00 0.00 52.86 50.65 1tw5 s ASN 227 Cb -0.26 -0.60 -0.09 0.00 -1.54 0.00 0.00 41.25 38.76 1tw5 s ASN 227 CO 0.31 -0.25 1.56 -0.09 -3.04 0.00 0.00 177.10 175.59 1tw5 h ARG 228 N 6.48 -0.50 -0.80 0.43 2.43 -1.88 -2.38 114.38 118.16 1tw5 h ARG 228 Ca 0.11 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1tw5 h ARG 228 Cb 0.93 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.56 1tw5 h ARG 228 CO 0.36 -0.33 0.45 0.00 -1.51 0.00 0.00 179.97 178.94 1tw5 h ALA 229 N -0.09 1.02 -0.56 2.80 0.00 -1.86 -2.17 119.26 118.41 1tw5 h ALA 229 Ca 0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1tw5 h ALA 229 Cb 0.65 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1tw5 h ALA 229 CO -0.46 0.52 0.09 -0.22 0.00 0.00 0.00 179.25 179.17 1tw5 h LYS 230 N 1.10 0.89 -0.98 0.00 3.64 -1.63 -0.52 116.57 119.08 1tw5 h LYS 230 Ca 0.28 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1tw5 h LYS 230 Cb 0.01 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 1tw5 h LYS 230 CO -0.05 0.83 0.64 -0.07 -2.27 0.00 0.00 179.45 178.53 1tw5 h LEU 231 N 0.84 1.13 -0.48 5.20 4.07 -0.99 -0.91 115.31 124.17 1tw5 h LEU 231 Ca 0.17 -0.04 -0.12 0.00 0.08 0.00 0.00 57.88 57.98 1tw5 h LEU 231 Cb 0.38 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 1tw5 h LEU 231 CO 0.01 0.82 -0.16 -0.07 -1.08 0.00 0.00 178.44 177.96 1tw5 h LEU 232 N 1.33 0.97 -0.58 1.67 3.38 -0.71 -1.52 115.31 119.84 1tw5 h LEU 232 Ca 0.36 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1tw5 h LEU 232 Cb -0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.31 1tw5 h LEU 232 CO -0.08 1.13 0.38 0.78 0.09 0.00 0.00 178.44 180.74 1tw5 h ASN 233 N 0.80 0.68 -0.48 -0.43 2.35 -0.64 -1.73 115.58 116.14 1tw5 h ASN 233 Ca 0.12 -0.03 0.05 0.00 -0.55 0.00 0.00 56.30 55.88 1tw5 h ASN 233 Cb 0.73 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.88 1tw5 h ASN 233 CO 0.06 0.50 0.23 0.58 -1.65 0.00 0.00 177.43 177.15 1tw5 h VAL 234 N 0.79 0.93 -0.73 2.81 2.07 -0.94 -0.86 116.25 120.32 1tw5 h VAL 234 Ca 0.21 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.68 1tw5 h VAL 234 Cb -0.07 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 1tw5 h VAL 234 CO -0.04 0.08 0.48 1.23 0.02 0.00 0.00 177.57 179.34 1tw5 h GLY 235 N 0.44 0.88 0.76 2.17 0.00 -0.48 0.22 103.07 107.07 1tw5 h GLY 235 Ca 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 1tw5 h GLY 235 CO -0.17 0.15 -0.03 -2.75 0.00 0.00 0.00 176.54 173.74 1tw5 h PHE 236 N 0.61 -0.08 -0.45 5.60 3.57 -0.35 -0.67 116.94 125.17 1tw5 h PHE 236 Ca 0.34 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.76 1tw5 h PHE 236 Cb 0.49 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1tw5 h PHE 236 CO -0.00 0.17 -0.02 0.87 -2.23 0.00 0.00 178.31 177.10 1tw5 h LYS 237 N -0.33 0.82 -0.34 1.11 1.57 -0.54 -2.95 116.57 115.90 1tw5 h LYS 237 Ca -0.01 -0.27 -0.13 0.00 -1.87 0.00 0.00 60.65 58.37 1tw5 h LYS 237 Cb 0.29 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1tw5 h LYS 237 CO 0.01 0.88 -0.32 0.93 -0.57 0.00 0.00 179.45 180.39 1tw5 h GLU 238 N 0.66 0.75 -0.82 3.15 4.39 -0.59 -3.15 114.58 118.96 1tw5 h GLU 238 Ca 0.13 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.44 1tw5 h GLU 238 Cb 0.53 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 1tw5 h GLU 238 CO 0.03 0.96 0.38 0.00 -1.16 0.00 0.00 179.01 179.22 1tw5 h ALA 239 N 1.01 1.12 0.00 3.43 0.00 -1.09 -2.13 119.26 121.60 1tw5 h ALA 239 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1tw5 h ALA 239 Cb 0.84 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1tw5 h ALA 239 CO 0.07 0.66 -0.05 -0.07 0.00 0.00 0.00 179.25 179.86 1tw5 h LEU 240 N 1.18 0.00 -1.66 0.00 3.38 -1.48 -1.23 115.31 115.49 1tw5 h LEU 240 Ca 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1tw5 h LEU 240 Cb 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1tw5 h LEU 240 CO -0.03 0.05 -0.03 0.11 0.09 0.00 0.00 178.44 178.62 1tw5 h LYS 241 N 0.00 0.00 0.10 1.13 1.57 -1.39 -3.26 116.57 114.72 1tw5 h LYS 241 Ca -0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 1tw5 h LYS 241 Cb 0.16 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1tw5 h LYS 241 CO 0.01 0.03 -2.09 -0.25 -0.57 0.00 0.00 179.45 176.59 1tw5 n ASP 242 N -3.16 2.10 -3.64 0.86 9.92 -0.48 -5.05 116.55 117.11 1tw5 n ASP 242 Ca -0.00 0.15 -0.10 0.00 -0.53 0.00 0.00 54.79 54.31 1tw5 n ASP 242 Cb 0.28 -0.78 -0.02 0.00 -0.64 0.00 0.00 41.12 39.96 1tw5 n ASP 242 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1tw5 s TYR 243 N -2.55 -0.33 -1.36 1.24 5.04 -1.15 -5.05 117.35 113.19 1tw5 s TYR 243 Ca -0.25 0.00 -0.09 0.00 -2.44 0.00 0.00 57.07 54.30 1tw5 s TYR 243 Cb 0.07 0.57 0.11 0.00 0.35 0.00 0.00 41.96 43.06 1tw5 s TYR 243 CO 0.74 -0.99 2.21 -0.40 -1.34 0.00 0.00 175.55 175.77 1tw5 n ASP 244 N -0.40 6.28 -4.75 4.32 5.75 -1.26 -4.35 116.55 122.15 1tw5 n ASP 244 Ca -0.11 -3.02 -0.38 0.00 -0.01 0.00 0.00 54.79 51.27 1tw5 n ASP 244 Cb 0.62 -1.47 0.05 0.00 -1.03 0.00 0.00 41.12 39.29 1tw5 n ASP 244 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1tw5 s TYR 245 N 0.48 2.26 0.00 2.11 1.51 -1.26 -4.90 117.35 117.55 1tw5 s TYR 245 Ca 0.49 1.43 0.00 0.00 -1.01 0.00 0.00 57.07 57.98 1tw5 s TYR 245 Cb 0.14 -3.72 0.00 0.00 -0.11 0.00 0.00 41.96 38.27 1tw5 s TYR 245 CO -0.05 -2.78 0.31 0.27 -1.11 0.00 0.00 175.55 172.20 1tw5 n ASN 246 N -1.33 0.62 -3.88 2.29 0.23 -0.33 -4.89 115.26 107.97 1tw5 n ASN 246 Ca 0.12 -0.81 -0.11 0.00 -0.53 0.00 0.00 54.58 53.25 1tw5 n ASN 246 Cb 0.47 0.38 -0.13 0.00 -2.08 0.00 0.00 39.78 38.42 1tw5 n ASN 246 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1tw5 s PHE 248 N -0.36 1.48 -0.19 0.00 0.08 -0.12 -1.34 117.98 117.53 1tw5 s PHE 248 Ca -0.04 -0.64 -0.06 0.00 0.12 0.00 0.00 56.93 56.31 1tw5 s PHE 248 Cb -0.03 -1.15 -0.03 0.00 -0.57 0.00 0.00 43.02 41.24 1tw5 s PHE 248 CO -0.00 -0.40 0.02 0.08 -0.10 0.00 0.00 175.22 174.83 1tw5 s VAL 249 N 1.17 4.29 -0.28 -0.44 1.01 -0.30 -0.69 120.40 125.16 1tw5 s VAL 249 Ca -0.05 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 1tw5 s VAL 249 Cb -0.14 -2.94 0.01 0.00 0.00 0.00 0.00 36.38 33.31 1tw5 s VAL 249 CO -0.02 0.44 0.05 -0.36 0.00 0.00 0.00 175.10 175.21 1tw5 s PHE 250 N 0.72 3.12 -0.08 5.22 0.40 0.01 -0.15 117.98 127.22 1tw5 s PHE 250 Ca 0.01 -1.02 0.01 0.00 -0.60 0.00 0.00 56.93 55.33 1tw5 s PHE 250 Cb -0.14 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.20 1tw5 s PHE 250 CO 0.02 -0.58 -0.08 0.45 0.70 0.00 0.00 175.22 175.73 1tw5 s SER 251 N 1.48 1.75 0.69 1.36 0.15 -0.10 -1.62 113.70 117.41 1tw5 s SER 251 Ca 0.03 -0.25 -0.17 0.00 0.70 0.00 0.00 55.95 56.26 1tw5 s SER 251 Cb -0.17 -0.74 0.01 0.00 -1.71 0.00 0.00 66.02 63.42 1tw5 s SER 251 CO 0.01 -0.05 1.18 0.47 1.20 0.00 0.00 173.24 176.05 1tw5 n ASP 252 N 4.33 1.41 0.28 5.45 8.00 -0.88 -4.14 116.55 131.00 1tw5 n ASP 252 Ca -0.19 0.74 0.16 0.00 0.71 0.00 0.00 54.79 56.21 1tw5 n ASP 252 Cb 0.51 -1.50 0.76 0.00 -0.02 0.00 0.00 41.12 40.87 1tw5 n ASP 252 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1tw5 h VAL 253 N 0.07 0.29 -0.54 2.53 3.04 -1.94 -3.25 116.25 116.45 1tw5 h VAL 253 Ca -0.49 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 1tw5 h VAL 253 Cb 1.33 1.40 0.00 0.00 -2.01 0.00 0.00 31.29 32.01 1tw5 h VAL 253 CO 0.50 0.08 0.00 -0.90 -1.01 0.00 0.00 177.57 176.24 1tw5 n ASP 254 N -3.33 4.46 -4.39 3.17 3.85 -1.26 -4.43 116.55 114.61 1tw5 n ASP 254 Ca -0.01 -2.52 -0.33 0.00 -0.71 0.00 0.00 54.79 51.22 1tw5 n ASP 254 Cb 0.26 -0.53 -0.14 0.00 -1.35 0.00 0.00 41.12 39.35 1tw5 n ASP 254 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 1tw5 s LEU 255 N -1.96 2.79 -0.11 -2.12 2.01 -1.23 -0.82 118.68 117.25 1tw5 s LEU 255 Ca 0.46 -0.30 0.01 0.00 0.01 0.00 0.00 54.13 54.31 1tw5 s LEU 255 Cb 0.31 -1.64 0.02 0.00 0.01 0.00 0.00 46.19 44.89 1tw5 s LEU 255 CO 0.20 0.16 -0.13 -0.63 1.01 0.00 0.00 176.35 176.96 1tw5 s ILE 256 N 0.37 1.37 0.35 -0.59 -1.09 -0.07 -4.93 121.20 116.62 1tw5 s ILE 256 Ca -0.10 -0.56 -0.28 0.00 -2.23 0.00 0.00 60.65 57.49 1tw5 s ILE 256 Cb -0.16 -1.27 -0.10 0.00 -1.58 0.00 0.00 42.46 39.35 1tw5 s ILE 256 CO 0.05 0.42 1.29 -2.16 -1.23 0.00 0.00 174.94 173.30 1tw5 s PRO 257 N 1.10 4.25 0.00 2.79 0.04 -1.26 -1.34 135.00 140.58 1tw5 s PRO 257 Ca -0.05 2.15 0.26 0.00 0.04 0.00 0.00 61.00 63.40 1tw5 s PRO 257 Cb -0.14 -2.97 0.55 0.00 0.04 0.00 0.00 34.50 31.98 1tw5 s PRO 257 CO -0.03 -0.26 1.45 -1.33 0.04 0.00 0.00 177.00 176.88 1tw5 n MET 258 N 0.59 1.60 -3.64 4.56 2.81 -0.40 -4.83 117.12 117.81 1tw5 n MET 258 Ca 0.01 -1.15 -0.12 0.00 -1.81 0.00 0.00 57.70 54.63 1tw5 n MET 258 Cb 0.43 -1.48 -0.12 0.00 -0.71 0.00 0.00 33.22 31.34 1tw5 n MET 258 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1tw5 s ASN 259 N -2.19 0.25 0.00 7.83 3.84 -1.26 -0.54 114.94 122.87 1tw5 s ASN 259 Ca 0.29 0.63 0.12 0.00 0.21 0.00 0.00 52.86 54.11 1tw5 s ASN 259 Cb 0.20 0.86 0.72 0.00 -0.55 0.00 0.00 41.25 42.48 1tw5 s ASN 259 CO 0.41 -0.24 1.16 -0.90 -2.79 0.00 0.00 177.10 174.73 1tw5 n ASP 260 N 5.36 0.00 0.07 -4.21 5.68 -1.16 -1.34 116.55 120.95 1tw5 n ASP 260 Ca -0.07 -0.37 0.13 0.00 -0.50 0.00 0.00 54.79 53.98 1tw5 n ASP 260 Cb 0.50 -0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.93 1tw5 n ASP 260 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1tw5 n HIS 261 N -1.00 0.63 -2.56 2.11 8.25 -1.26 -4.29 115.22 117.09 1tw5 n HIS 261 Ca 0.09 0.18 -0.43 0.00 -0.26 0.00 0.00 57.72 57.31 1tw5 n HIS 261 Cb 0.04 -0.79 -0.00 0.00 1.12 0.00 0.00 29.99 30.36 1tw5 n HIS 261 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1tw5 n ASN 262 N -2.02 4.89 -4.70 0.41 2.85 -0.45 -4.94 115.26 111.31 1tw5 n ASN 262 Ca 0.06 -2.91 -0.42 0.00 -0.11 0.00 0.00 54.58 51.19 1tw5 n ASN 262 Cb 0.40 -1.75 -0.03 0.00 1.24 0.00 0.00 39.78 39.64 1tw5 n ASN 262 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1tw5 s THR 263 N 4.37 2.70 -1.45 -0.44 2.01 -1.26 -4.92 115.64 116.64 1tw5 s THR 263 Ca 0.54 0.32 -0.11 0.00 0.31 0.00 0.00 61.69 62.76 1tw5 s THR 263 Cb 0.04 -3.21 0.04 0.00 0.01 0.00 0.00 72.50 69.39 1tw5 s THR 263 CO 0.08 0.01 2.38 -1.22 -0.69 0.00 0.00 174.62 175.18 1tw5 n TYR 264 N 5.01 2.96 -3.96 4.92 4.02 -1.26 -4.86 117.16 123.99 1tw5 n TYR 264 Ca 0.16 -2.95 -0.06 0.00 -0.01 0.00 0.00 57.90 55.04 1tw5 n TYR 264 Cb 0.39 -2.31 -0.02 0.00 -0.02 0.00 0.00 39.34 37.38 1tw5 n TYR 264 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 176.86 178.74 1tw5 n ARG 265 N 4.29 0.18 -3.98 -0.72 1.85 -1.26 -4.93 116.66 112.09 1tw5 n ARG 265 Ca 0.58 -1.08 -0.22 0.00 -1.00 0.00 0.00 57.85 56.14 1tw5 n ARG 265 Cb 0.32 0.94 -0.03 0.00 -1.05 0.00 0.00 32.46 32.64 1tw5 n ARG 265 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1tw5 n PHE 267 N -1.20 -0.00 0.26 0.00 3.01 -1.26 -5.01 117.46 113.26 1tw5 n PHE 267 Ca -0.08 -2.30 0.17 0.00 1.01 0.00 0.00 57.45 56.24 1tw5 n PHE 267 Cb 0.56 0.03 0.89 0.00 -0.01 0.00 0.00 39.48 40.95 1tw5 n PHE 267 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1tw5 h SER 268 N 1.47 0.00 -4.47 4.37 4.64 -2.01 -3.42 113.55 114.13 1tw5 h SER 268 Ca -0.27 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.72 1tw5 h SER 268 Cb 1.06 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.91 1tw5 h SER 268 CO 0.42 0.00 -0.76 -1.10 -0.87 0.00 0.00 176.83 174.52 1tw5 s GLN 269 N -3.82 0.63 0.21 4.77 -1.52 -1.26 -5.04 119.66 113.63 1tw5 s GLN 269 Ca -0.03 -0.67 -0.29 0.00 -1.95 0.00 0.00 55.36 52.42 1tw5 s GLN 269 Cb 0.10 -0.52 -0.16 0.00 -0.22 0.00 0.00 33.01 32.20 1tw5 s GLN 269 CO 0.32 0.12 0.66 -2.30 -0.25 0.00 0.00 175.29 173.85 1tw5 n PRO 270 N 1.82 0.34 -4.37 2.91 -0.02 -1.23 -4.34 135.00 130.10 1tw5 n PRO 270 Ca -0.20 0.12 -0.34 0.00 -2.02 0.00 0.00 63.50 61.06 1tw5 n PRO 270 Cb 0.55 -1.23 -0.13 0.00 -0.02 0.00 0.00 33.50 32.67 1tw5 n PRO 270 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1tw5 s ARG 271 N -1.08 3.54 -0.29 -0.52 6.06 -0.02 -0.13 118.95 126.51 1tw5 s ARG 271 Ca 0.64 -0.58 -0.13 0.00 -2.50 0.00 0.00 55.73 53.16 1tw5 s ARG 271 Cb -0.89 -2.88 -0.04 0.00 0.06 0.00 0.00 34.95 31.21 1tw5 s ARG 271 CO 0.57 0.13 0.29 -1.58 -2.50 0.00 0.00 175.30 172.20 1tw5 s HIS 272 N 0.64 3.23 -0.16 5.12 5.65 0.24 0.04 115.29 130.04 1tw5 s HIS 272 Ca -0.03 0.20 -0.12 0.00 0.25 0.00 0.00 55.06 55.35 1tw5 s HIS 272 Cb -0.15 -2.50 -0.23 0.00 -1.18 0.00 0.00 32.58 28.53 1tw5 s HIS 272 CO 0.02 -0.23 0.26 -0.89 -0.65 0.00 0.00 174.74 173.25 1tw5 n ILE 273 N 5.11 1.67 -2.49 0.89 5.41 -0.08 -4.33 119.36 125.53 1tw5 n ILE 273 Ca -0.11 -0.41 -0.43 0.00 1.00 0.00 0.00 62.75 62.80 1tw5 n ILE 273 Cb 0.51 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.60 1tw5 n ILE 273 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1tw5 n SER 274 N -3.86 4.98 0.11 4.38 3.41 -1.03 -4.70 113.62 116.91 1tw5 n SER 274 Ca -0.33 -3.02 -0.03 0.00 -0.26 0.00 0.00 58.87 55.23 1tw5 n SER 274 Cb 0.90 -1.55 0.03 0.00 -0.26 0.00 0.00 64.21 63.33 1tw5 n SER 274 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 1tw5 h VAL 275 N 4.23 1.46 -2.49 -3.33 -1.51 -1.80 -3.39 116.25 109.41 1tw5 h VAL 275 Ca 0.39 -2.70 -0.60 0.00 -1.23 0.00 0.00 66.70 62.57 1tw5 h VAL 275 Cb 0.73 2.49 -0.41 0.00 -2.13 0.00 0.00 31.29 31.98 1tw5 h VAL 275 CO 1.51 0.75 -0.77 0.00 -1.23 0.00 0.00 177.57 177.83 1tw5 n ALA 276 N -2.35 3.28 -2.16 5.19 0.00 -0.80 -4.11 120.51 119.56 1tw5 n ALA 276 Ca -0.00 -4.06 -0.41 0.00 0.00 0.00 0.00 53.44 48.97 1tw5 n ALA 276 Cb 0.77 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.29 1tw5 n ALA 276 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1tw5 s MET 277 N -1.33 4.63 0.48 0.00 -1.94 -1.26 -1.39 119.30 118.49 1tw5 s MET 277 Ca 0.32 1.61 0.14 0.00 -1.71 0.00 0.00 55.69 56.05 1tw5 s MET 277 Cb 0.06 -3.32 1.13 0.00 2.01 0.00 0.00 34.83 34.71 1tw5 s MET 277 CO -0.13 0.12 2.08 0.38 -0.01 0.00 0.00 175.02 177.47 1tw5 h ASP 278 N 5.37 0.19 0.00 3.03 3.04 -1.30 0.41 116.42 127.16 1tw5 h ASP 278 Ca -0.44 -0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 1tw5 h ASP 278 Cb 1.21 -0.04 0.00 0.00 -1.04 0.00 0.00 39.33 39.46 1tw5 h ASP 278 CO 0.73 0.13 0.13 0.50 -2.04 0.00 0.00 179.24 178.68 1tw5 h LYS 279 N 0.22 0.00 0.00 4.15 3.64 -1.91 0.49 116.57 123.17 1tw5 h LYS 279 Ca 0.11 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1tw5 h LYS 279 Cb 0.17 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1tw5 h LYS 279 CO -0.02 0.00 -0.09 1.19 -2.27 0.00 0.00 179.45 178.26 1tw5 n PHE 280 N -2.77 0.00 -3.62 1.91 0.99 -0.01 -4.99 117.46 108.96 1tw5 n PHE 280 Ca -0.02 -0.95 -0.26 0.00 -0.00 0.00 0.00 57.45 56.22 1tw5 n PHE 280 Cb 0.18 -0.15 0.05 0.00 -1.00 0.00 0.00 39.48 38.56 1tw5 n PHE 280 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1tw5 n GLY 281 N -1.28 -0.52 2.60 1.37 0.00 0.17 -1.97 105.19 105.56 1tw5 n GLY 281 Ca 0.15 0.20 -0.05 0.00 0.00 0.00 0.00 46.02 46.32 1tw5 n GLY 281 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1tw5 n PHE 282 N -4.74 0.00 -4.25 1.61 0.99 -0.34 -4.98 117.46 105.76 1tw5 n PHE 282 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.45 57.20 1tw5 n PHE 282 Cb 0.55 -1.76 -0.08 0.00 -1.00 0.00 0.00 39.48 37.19 1tw5 n PHE 282 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1tw5 s SER 283 N -2.27 4.60 0.01 4.37 0.01 -0.83 -4.60 113.70 114.99 1tw5 s SER 283 Ca 0.00 -0.51 -0.30 0.00 1.31 0.00 0.00 55.95 56.45 1tw5 s SER 283 Cb 0.00 -0.90 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 1tw5 s SER 283 CO 0.00 0.06 0.99 -0.76 0.41 0.00 0.00 173.24 173.94 1tw5 s LEU 284 N -3.16 4.38 0.60 2.44 1.43 -1.26 -4.53 118.68 118.58 1tw5 s LEU 284 Ca 0.28 1.68 0.31 0.00 -1.03 0.00 0.00 54.13 55.37 1tw5 s LEU 284 Cb -0.08 -3.57 1.79 0.00 0.03 0.00 0.00 46.19 44.35 1tw5 s LEU 284 CO 0.18 -0.26 2.17 1.55 0.23 0.00 0.00 176.35 180.23 1tw5 h PRO 285 N 6.73 0.00 -1.43 1.29 0.13 -1.91 -3.43 132.00 133.38 1tw5 h PRO 285 Ca -0.41 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.83 1tw5 h PRO 285 Cb 1.22 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.08 1tw5 h PRO 285 CO 0.75 0.00 0.62 1.52 -0.23 0.00 0.00 178.00 180.66 1tw5 s TYR 286 N -4.56 -0.31 0.34 1.56 -0.85 -1.26 -5.05 117.35 107.21 1tw5 s TYR 286 Ca -0.05 0.67 0.15 0.00 -0.52 0.00 0.00 57.07 57.32 1tw5 s TYR 286 Cb 0.15 0.43 1.11 0.00 0.38 0.00 0.00 41.96 44.03 1tw5 s TYR 286 CO 0.52 -0.21 1.63 -0.24 -1.52 0.00 0.00 175.55 175.74 1tw5 h VAL 287 N 2.98 0.21 -0.37 -3.49 3.04 -2.02 0.12 116.25 116.71 1tw5 h VAL 287 Ca -0.22 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1tw5 h VAL 287 Cb 1.18 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1tw5 h VAL 287 CO 0.20 0.04 0.00 0.00 -1.01 0.00 0.00 177.57 176.80 1tw5 n GLN 288 N -5.14 1.87 -1.68 4.17 3.00 -1.26 -4.94 117.38 113.39 1tw5 n GLN 288 Ca 0.32 -1.35 -0.44 0.00 -0.01 0.00 0.00 57.00 55.52 1tw5 n GLN 288 Cb 1.03 -1.29 -0.04 0.00 0.00 0.00 0.00 30.24 29.94 1tw5 n GLN 288 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.06 178.04 1tw5 n TYR 289 N 0.60 2.48 -2.04 1.08 9.36 0.41 -4.87 117.16 124.18 1tw5 n TYR 289 Ca 0.13 -0.02 0.04 0.00 3.32 0.00 0.00 57.90 61.37 1tw5 n TYR 289 Cb 0.32 -2.67 0.08 0.00 -0.63 0.00 0.00 39.34 36.43 1tw5 n TYR 289 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1tw5 n PHE 290 N 5.34 0.00 -2.95 2.98 7.35 -1.26 -5.02 117.46 123.90 1tw5 n PHE 290 Ca 0.19 -0.73 -0.20 0.00 -0.76 0.00 0.00 57.45 55.95 1tw5 n PHE 290 Cb 0.34 -0.16 0.07 0.00 0.35 0.00 0.00 39.48 40.08 1tw5 n PHE 290 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1tw5 s GLY 291 N -2.24 1.73 0.00 7.13 0.00 -1.26 -4.84 107.32 107.84 1tw5 s GLY 291 Ca 0.29 -2.09 0.00 0.00 0.00 0.00 0.00 44.72 42.93 1tw5 s GLY 291 CO -0.10 -1.59 0.00 0.61 0.00 0.00 0.00 173.10 172.02 1tw5 n GLY 292 N -2.37 1.41 3.08 0.20 0.00 -1.26 -4.69 105.19 101.55 1tw5 n GLY 292 Ca 0.16 -0.48 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1tw5 n GLY 292 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1tw5 s VAL 293 N 0.00 1.41 0.26 1.61 1.01 -1.26 -2.07 120.40 121.35 1tw5 s VAL 293 Ca 0.00 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 1tw5 s VAL 293 Cb 0.00 -1.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.10 1tw5 s VAL 293 CO 0.00 0.42 0.33 -0.94 0.00 0.00 0.00 175.10 174.91 1tw5 s SER 294 N 0.63 0.35 -0.11 3.32 1.04 -0.64 -0.91 113.70 117.38 1tw5 s SER 294 Ca -0.15 -1.28 -0.06 0.00 0.48 0.00 0.00 55.95 54.94 1tw5 s SER 294 Cb -0.16 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.52 1tw5 s SER 294 CO 0.04 -1.05 0.27 0.00 0.98 0.00 0.00 173.24 173.48 1tw5 s ALA 295 N -3.83 -0.63 -0.03 5.32 0.00 0.11 -0.81 121.76 121.89 1tw5 s ALA 295 Ca 0.32 1.00 0.03 0.00 0.00 0.00 0.00 51.96 53.30 1tw5 s ALA 295 Cb 0.03 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.53 1tw5 s ALA 295 CO 0.14 -0.19 -0.11 -0.51 0.00 0.00 0.00 175.76 175.10 1tw5 s LEU 296 N 1.02 1.78 0.89 0.00 1.02 0.13 -0.84 118.68 122.68 1tw5 s LEU 296 Ca -0.07 -0.22 -0.11 0.00 0.02 0.00 0.00 54.13 53.74 1tw5 s LEU 296 Cb -0.08 -0.65 0.13 0.00 0.02 0.00 0.00 46.19 45.61 1tw5 s LEU 296 CO -0.07 0.07 1.09 -0.94 0.02 0.00 0.00 176.35 176.53 1tw5 s SER 297 N 0.24 3.49 0.25 2.29 1.04 -1.26 -0.94 113.70 118.81 1tw5 s SER 297 Ca -0.05 1.56 -0.04 0.00 0.48 0.00 0.00 55.95 57.90 1tw5 s SER 297 Cb -0.10 -2.23 0.37 0.00 0.10 0.00 0.00 66.02 64.16 1tw5 s SER 297 CO 0.01 -2.64 1.86 0.50 0.98 0.00 0.00 173.24 173.95 1tw5 h LYS 298 N -1.55 1.01 -0.27 4.02 3.64 -1.08 -1.09 116.57 121.25 1tw5 h LYS 298 Ca -0.49 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 58.65 1tw5 h LYS 298 Cb 1.28 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1tw5 h LYS 298 CO 0.53 0.67 -0.55 1.96 -2.27 0.00 0.00 179.45 179.80 1tw5 h GLN 299 N 1.04 0.84 -0.74 1.90 1.08 -1.91 -1.73 115.11 115.59 1tw5 h GLN 299 Ca 0.40 -0.55 -0.01 0.00 -1.45 0.00 0.00 58.65 57.05 1tw5 h GLN 299 Cb 0.19 0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 1tw5 h GLN 299 CO -0.18 1.18 0.44 1.96 -0.95 0.00 0.00 178.83 181.28 1tw5 h GLN 300 N 0.62 1.01 -0.06 1.46 4.20 -1.83 0.23 115.11 120.73 1tw5 h GLN 300 Ca 0.01 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1tw5 h GLN 300 Cb 1.16 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.73 1tw5 h GLN 300 CO 0.12 0.72 0.03 0.35 -0.67 0.00 0.00 178.83 179.38 1tw5 h PHE 301 N 1.01 0.09 -0.56 2.96 3.57 -1.16 -2.47 116.94 120.38 1tw5 h PHE 301 Ca 0.27 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 1tw5 h PHE 301 Cb -0.03 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 1tw5 h PHE 301 CO -0.01 0.16 0.26 -0.07 -2.23 0.00 0.00 178.31 176.42 1tw5 h LEU 302 N -0.02 0.72 -1.95 0.59 3.38 -0.97 -1.26 115.31 115.80 1tw5 h LEU 302 Ca 0.02 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1tw5 h LEU 302 Cb 0.11 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1tw5 h LEU 302 CO -0.00 0.62 0.04 0.77 0.09 0.00 0.00 178.44 179.96 1tw5 h SER 303 N 0.79 0.06 -0.54 -0.43 4.64 -0.07 -1.62 113.55 116.39 1tw5 h SER 303 Ca 0.20 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1tw5 h SER 303 Cb 0.10 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1tw5 h SER 303 CO -0.02 0.04 0.00 2.30 -0.87 0.00 0.00 176.83 178.28 1tw5 n ILE 304 N -4.53 0.71 -2.78 0.95 -5.35 -1.05 -4.91 119.36 102.40 1tw5 n ILE 304 Ca -0.02 -0.79 -0.13 0.00 -0.27 0.00 0.00 62.75 61.54 1tw5 n ILE 304 Cb 0.10 0.59 0.03 0.00 -1.74 0.00 0.00 39.64 38.61 1tw5 n ILE 304 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1tw5 n ASN 305 N 1.34 -4.21 0.00 7.28 5.15 -0.61 -4.76 115.26 119.45 1tw5 n ASN 305 Ca 0.21 -0.19 0.00 0.00 -0.60 0.00 0.00 54.58 53.99 1tw5 n ASN 305 Cb 0.55 -3.02 0.00 0.00 -0.53 0.00 0.00 39.78 36.77 1tw5 n ASN 305 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1tw5 n GLY 306 N -1.22 0.71 3.90 8.20 0.00 -0.50 -1.21 105.19 115.07 1tw5 n GLY 306 Ca -0.05 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 1tw5 n GLY 306 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tw5 s PHE 307 N 0.00 2.94 0.51 1.61 0.08 -1.26 -4.84 117.98 117.02 1tw5 s PHE 307 Ca 0.00 -0.30 -0.19 0.00 0.12 0.00 0.00 56.93 56.56 1tw5 s PHE 307 Cb 0.00 -1.91 -0.07 0.00 -0.57 0.00 0.00 43.02 40.47 1tw5 s PHE 307 CO 0.00 0.08 1.04 -1.25 -0.10 0.00 0.00 175.22 174.99 1tw5 s PRO 308 N -4.07 3.68 0.00 0.24 0.04 -1.26 -4.08 135.00 129.55 1tw5 s PRO 308 Ca 0.43 1.32 0.14 0.00 0.04 0.00 0.00 61.00 62.93 1tw5 s PRO 308 Cb -0.07 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 1tw5 s PRO 308 CO 0.28 -0.52 0.69 0.09 0.04 0.00 0.00 177.00 177.58 1tw5 n ASN 309 N -1.24 1.09 -1.60 6.66 3.02 -1.26 -3.78 115.26 118.14 1tw5 n ASN 309 Ca 0.09 -1.04 0.06 0.00 -0.03 0.00 0.00 54.58 53.65 1tw5 n ASN 309 Cb 0.53 0.73 0.32 0.00 -0.61 0.00 0.00 39.78 40.75 1tw5 n ASN 309 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1tw5 n ASN 310 N -0.73 4.75 -4.24 6.41 3.02 -1.26 -4.80 115.26 118.40 1tw5 n ASN 310 Ca 0.04 -2.73 -0.39 0.00 -0.03 0.00 0.00 54.58 51.47 1tw5 n ASN 310 Cb 0.26 -0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 38.68 1tw5 n ASN 310 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1tw5 s TYR 311 N -2.38 3.36 -0.14 3.10 1.51 -1.26 -5.07 117.35 116.48 1tw5 s TYR 311 Ca 0.43 -1.66 -0.04 0.00 -1.01 0.00 0.00 57.07 54.79 1tw5 s TYR 311 Cb 0.33 -2.94 -0.03 0.00 -0.11 0.00 0.00 41.96 39.20 1tw5 s TYR 311 CO 0.13 -0.86 0.02 -1.58 -1.11 0.00 0.00 175.55 172.15 1tw5 s TRP 312 N 1.38 3.19 0.00 2.71 0.52 -1.26 -4.53 118.94 120.95 1tw5 s TRP 312 Ca 0.03 0.06 0.00 0.00 0.02 0.00 0.00 56.10 56.21 1tw5 s TRP 312 Cb -0.23 -1.94 0.00 0.00 -1.15 0.00 0.00 33.47 30.16 1tw5 s TRP 312 CO 0.01 0.26 0.00 0.41 0.02 0.00 0.00 176.95 177.65 1tw5 n GLY 313 N 2.93 -0.28 3.77 0.98 0.00 -0.18 -4.50 105.19 107.91 1tw5 n GLY 313 Ca -0.18 -1.81 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 1tw5 n GLY 313 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1tw5 s TRP 314 N -1.49 3.58 0.00 1.61 -0.00 -0.18 -4.65 118.94 117.81 1tw5 s TRP 314 Ca 0.00 1.74 0.00 0.00 -0.00 0.00 0.00 56.10 57.84 1tw5 s TRP 314 Cb 0.00 -3.08 0.00 0.00 -0.00 0.00 0.00 33.47 30.39 1tw5 s TRP 314 CO 0.00 -0.18 0.00 0.41 -0.00 0.00 0.00 176.95 177.18 1tw5 n GLY 315 N 0.79 0.17 2.82 5.86 0.00 -1.26 -0.98 105.19 112.58 1tw5 n GLY 315 Ca 0.02 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1tw5 n GLY 315 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tw5 n GLY 316 N 0.67 1.81 0.33 -0.02 0.00 -1.26 -4.80 105.19 101.91 1tw5 n GLY 316 Ca 0.00 -0.21 0.10 0.00 0.00 0.00 0.00 46.02 45.91 1tw5 n GLY 316 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1tw5 h GLU 317 N 0.00 0.63 -0.05 1.61 9.09 -1.94 0.31 114.58 124.23 1tw5 h GLU 317 Ca 0.00 -0.04 -0.09 0.00 0.05 0.00 0.00 59.36 59.28 1tw5 h GLU 317 Cb 0.00 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 26.95 1tw5 h GLU 317 CO 0.00 0.41 -0.40 0.38 0.05 0.00 0.00 179.01 179.45 1tw5 h ASP 318 N 0.65 0.12 0.57 3.06 -0.00 -1.92 -2.19 116.42 116.71 1tw5 h ASP 318 Ca 0.52 -0.05 -0.18 0.00 -0.00 0.00 0.00 57.03 57.33 1tw5 h ASP 318 Cb 0.80 -0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 40.08 1tw5 h ASP 318 CO -0.39 0.51 -0.79 0.44 -0.00 0.00 0.00 179.24 179.01 1tw5 h ASP 319 N 0.10 0.21 0.03 4.15 3.32 -0.85 -2.07 116.42 121.30 1tw5 h ASP 319 Ca 0.01 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1tw5 h ASP 319 Cb 0.76 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1tw5 h ASP 319 CO 0.06 0.91 -0.01 -0.78 -1.72 0.00 0.00 179.24 177.69 1tw5 h ASP 320 N 0.10 -0.03 -0.48 6.45 3.58 -0.78 0.11 116.42 125.37 1tw5 h ASP 320 Ca -0.03 -0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.48 1tw5 h ASP 320 Cb 1.38 0.01 -0.05 0.00 1.72 0.00 0.00 39.33 42.39 1tw5 h ASP 320 CO 0.12 -0.02 0.18 0.40 -2.88 0.00 0.00 179.24 177.04 1tw5 h ILE 321 N -0.04 0.86 -0.93 2.25 2.04 -1.31 0.28 117.51 120.66 1tw5 h ILE 321 Ca -0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1tw5 h ILE 321 Cb 0.03 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 1tw5 h ILE 321 CO 0.01 0.07 0.59 0.22 0.00 0.00 0.00 178.15 179.04 1tw5 h TYR 322 N 0.37 1.20 -0.37 1.37 3.20 -1.02 -1.05 116.97 120.68 1tw5 h TYR 322 Ca 0.22 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.03 1tw5 h TYR 322 Cb 0.22 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1tw5 h TYR 322 CO -0.15 0.77 -0.11 -0.91 -1.64 0.00 0.00 178.16 176.12 1tw5 h ASN 323 N 1.28 0.63 -0.39 -2.11 2.35 0.16 -2.78 115.58 114.71 1tw5 h ASN 323 Ca 0.34 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1tw5 h ASN 323 Cb -0.11 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 1tw5 h ASN 323 CO -0.07 0.77 0.26 0.03 -1.65 0.00 0.00 177.43 176.77 1tw5 h ARG 324 N 0.59 0.51 0.14 0.81 3.08 0.65 -0.96 114.38 119.19 1tw5 h ARG 324 Ca 0.10 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.14 1tw5 h ARG 324 Cb 0.54 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 1tw5 h ARG 324 CO 0.03 0.34 -0.45 -0.07 -1.07 0.00 0.00 179.97 178.75 1tw5 h LEU 325 N 0.52 -1.32 -0.92 3.04 3.38 -1.06 -1.64 115.31 117.31 1tw5 h LEU 325 Ca 0.14 0.14 0.13 0.00 0.09 0.00 0.00 57.88 58.38 1tw5 h LEU 325 Cb -0.06 0.49 -0.09 0.00 0.09 0.00 0.00 40.66 41.10 1tw5 h LEU 325 CO -0.03 -0.51 0.54 0.00 0.09 0.00 0.00 178.44 178.53 1tw5 h ALA 326 N -0.28 1.39 0.00 1.53 0.00 -1.32 -0.49 119.26 120.09 1tw5 h ALA 326 Ca 0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1tw5 h ALA 326 Cb 0.71 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1tw5 h ALA 326 CO -0.25 0.09 -0.06 0.74 0.00 0.00 0.00 179.25 179.78 1tw5 h PHE 327 N 0.83 0.00 -0.60 0.00 0.05 -0.30 -1.32 116.94 115.62 1tw5 h PHE 327 Ca 0.47 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 62.16 1tw5 h PHE 327 Cb 0.54 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 38.43 1tw5 h PHE 327 CO -0.04 0.06 0.11 0.54 -0.18 0.00 0.00 178.31 178.81 1tw5 n ARG 328 N -3.33 4.04 -1.13 1.51 5.12 -0.29 -4.94 116.66 117.63 1tw5 n ARG 328 Ca -0.01 -3.10 -0.05 0.00 -1.93 0.00 0.00 57.85 52.76 1tw5 n ARG 328 Cb 0.22 -2.18 -0.02 0.00 -1.16 0.00 0.00 32.46 29.32 1tw5 n ARG 328 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1tw5 n GLY 329 N 0.07 0.66 3.97 -0.13 0.00 -0.50 -5.03 105.19 104.23 1tw5 n GLY 329 Ca 0.33 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1tw5 n GLY 329 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1tw5 s MET 330 N -1.82 3.22 0.51 1.61 -1.94 -0.60 -4.98 119.30 115.30 1tw5 s MET 330 Ca 0.00 -0.74 0.02 0.00 -1.71 0.00 0.00 55.69 53.27 1tw5 s MET 330 Cb 0.00 -2.75 0.02 0.00 2.01 0.00 0.00 34.83 34.11 1tw5 s MET 330 CO 0.00 0.07 0.18 0.43 -0.01 0.00 0.00 175.02 175.68 1tw5 n SER 331 N -1.72 3.07 -4.27 3.03 7.64 -1.26 -3.87 113.62 116.24 1tw5 n SER 331 Ca -0.02 -3.01 -0.32 0.00 1.01 0.00 0.00 58.87 56.52 1tw5 n SER 331 Cb 0.57 0.17 -0.16 0.00 -1.01 0.00 0.00 64.21 63.79 1tw5 n SER 331 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1tw5 s VAL 332 N -2.71 2.45 -0.04 0.44 1.01 -1.26 -3.51 120.40 116.78 1tw5 s VAL 332 Ca 0.13 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.16 1tw5 s VAL 332 Cb -0.01 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 1tw5 s VAL 332 CO 0.08 0.54 0.25 -0.55 0.00 0.00 0.00 175.10 175.43 1tw5 s SER 333 N 0.44 6.53 -0.02 3.32 0.15 0.82 -4.94 113.70 120.00 1tw5 s SER 333 Ca -0.14 0.62 -0.05 0.00 0.70 0.00 0.00 55.95 57.08 1tw5 s SER 333 Cb -0.17 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 1tw5 s SER 333 CO 0.06 0.33 0.11 -0.13 1.20 0.00 0.00 173.24 174.81 1tw5 s ARG 334 N -1.34 0.31 0.79 5.44 0.52 -1.26 -0.59 118.95 122.81 1tw5 s ARG 334 Ca 0.22 -0.16 -0.12 0.00 -0.52 0.00 0.00 55.73 55.15 1tw5 s ARG 334 Cb -0.14 0.13 0.06 0.00 0.52 0.00 0.00 34.95 35.53 1tw5 s ARG 334 CO 0.11 -0.06 1.10 -1.25 0.02 0.00 0.00 175.30 175.22 1tw5 s PRO 335 N -0.74 2.15 1.10 3.54 0.04 -1.26 -5.01 135.00 134.83 1tw5 s PRO 335 Ca -0.08 0.55 -0.16 0.00 0.04 0.00 0.00 61.00 61.35 1tw5 s PRO 335 Cb -0.05 -1.93 0.24 0.00 0.04 0.00 0.00 34.50 32.80 1tw5 s PRO 335 CO 0.01 -1.55 1.10 0.54 0.04 0.00 0.00 177.00 177.14 1tw5 s ASN 336 N -4.04 1.74 0.57 6.66 6.03 -1.26 -4.71 114.94 119.93 1tw5 s ASN 336 Ca 0.61 0.90 0.36 0.00 -1.03 0.00 0.00 52.86 53.70 1tw5 s ASN 336 Cb -0.14 -1.36 1.63 0.00 -3.03 0.00 0.00 41.25 38.35 1tw5 s ASN 336 CO 0.53 -3.64 2.07 0.00 -2.03 0.00 0.00 177.10 174.03 1tw5 h ALA 337 N -2.25 1.00 0.00 3.54 0.00 -1.94 -0.01 119.26 119.60 1tw5 h ALA 337 Ca -0.50 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 1tw5 h ALA 337 Cb 1.32 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1tw5 h ALA 337 CO 0.46 0.00 -0.55 0.28 0.00 0.00 0.00 179.25 179.44 1tw5 h VAL 338 N 0.00 1.40 0.00 0.00 2.07 -1.96 -3.30 116.25 114.46 1tw5 h VAL 338 Ca 0.00 -2.26 -0.06 0.00 0.82 0.00 0.00 66.70 65.20 1tw5 h VAL 338 Cb 0.37 2.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1tw5 h VAL 338 CO 0.00 0.47 -0.26 0.16 0.02 0.00 0.00 177.57 177.96 1tw5 h ILE 339 N -1.00 0.66 -0.10 4.57 3.07 -1.92 -2.97 117.51 119.81 1tw5 h ILE 339 Ca -0.15 -1.21 0.00 0.00 1.55 0.00 0.00 64.86 65.04 1tw5 h ILE 339 Cb 1.13 1.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.47 1tw5 h ILE 339 CO -0.09 0.26 0.00 0.61 -1.05 0.00 0.00 178.15 177.88 1tw5 n GLY 340 N 0.13 -0.35 3.76 0.16 0.00 -0.02 -4.32 105.19 104.56 1tw5 n GLY 340 Ca -0.00 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1tw5 n GLY 340 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tw5 s LYS 341 N -1.81 4.25 0.03 1.61 1.02 -1.13 -1.91 119.74 121.80 1tw5 s LYS 341 Ca 0.07 2.36 -0.12 0.00 0.02 0.00 0.00 55.97 58.30 1tw5 s LYS 341 Cb 0.04 -3.06 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1tw5 s LYS 341 CO 0.04 -0.39 0.25 0.95 -0.92 0.00 0.00 175.35 175.29 1tw5 s THR 342 N -0.63 0.09 -0.07 2.17 -4.23 -0.49 -1.27 115.64 111.21 1tw5 s THR 342 Ca 0.55 -0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 60.31 1tw5 s THR 342 Cb -0.43 -0.83 -0.03 0.00 1.34 0.00 0.00 72.50 72.55 1tw5 s THR 342 CO 0.51 -0.40 0.03 -0.13 -0.54 0.00 0.00 174.62 174.09 1tw5 s ARG 343 N -2.25 3.03 -0.11 3.99 0.52 -0.45 -0.73 118.95 122.95 1tw5 s ARG 343 Ca -0.07 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 54.73 1tw5 s ARG 343 Cb -0.02 -2.84 -0.02 0.00 0.52 0.00 0.00 34.95 32.59 1tw5 s ARG 343 CO -0.02 0.70 -0.09 -1.58 0.02 0.00 0.00 175.30 174.33 1tw5 s HIS 344 N -0.95 2.88 -0.36 -0.53 5.65 -1.26 -0.89 115.29 119.83 1tw5 s HIS 344 Ca 0.15 -0.35 -0.29 0.00 0.25 0.00 0.00 55.06 54.83 1tw5 s HIS 344 Cb -0.11 -1.82 0.00 0.00 -1.18 0.00 0.00 32.58 29.47 1tw5 s HIS 344 CO 0.04 0.00 1.41 0.42 -0.65 0.00 0.00 174.74 175.97 1tw5 s ILE 345 N -0.03 3.94 0.04 0.89 1.01 0.00 -4.90 121.20 122.15 1tw5 s ILE 345 Ca -0.01 1.00 -0.34 0.00 0.00 0.00 0.00 60.65 61.30 1tw5 s ILE 345 Cb -0.14 -4.13 -0.13 0.00 0.01 0.00 0.00 42.46 38.07 1tw5 s ILE 345 CO 0.03 -0.63 1.73 0.54 0.00 0.00 0.00 174.94 176.61 1tw5 n ARG 346 N 7.84 2.17 -4.03 2.79 1.74 -1.26 -4.95 116.66 120.96 1tw5 n ARG 346 Ca 0.16 0.79 -0.10 0.00 -0.77 0.00 0.00 57.85 57.93 1tw5 n ARG 346 Cb 0.47 -2.60 -0.07 0.00 -1.02 0.00 0.00 32.46 29.25 1tw5 n ARG 346 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1tw5 s HIS 347 N 2.49 0.54 0.49 -1.55 -3.43 -1.26 -5.17 115.29 107.40 1tw5 s HIS 347 Ca 0.86 -0.87 0.07 0.00 -0.80 0.00 0.00 55.06 54.32 1tw5 s HIS 347 Cb -0.68 -0.05 0.04 0.00 -1.43 0.00 0.00 32.58 30.46 1tw5 s HIS 347 CO 0.45 -0.83 0.68 -1.54 -2.00 0.00 0.00 174.74 171.49 1tw5 s SER 348 N -3.03 5.39 0.69 7.38 1.04 -1.26 -5.08 113.70 118.84 1tw5 s SER 348 Ca 0.24 -0.48 -0.17 0.00 0.48 0.00 0.00 55.95 56.03 1tw5 s SER 348 Cb 0.02 -0.40 0.01 0.00 0.10 0.00 0.00 66.02 65.75 1tw5 s SER 348 CO 0.07 -1.02 1.27 -0.13 0.98 0.00 0.00 173.24 174.41 1tw5 s ARG 349 N -4.53 2.29 -0.12 4.02 3.00 -1.26 -5.02 118.95 117.34 1tw5 s ARG 349 Ca 0.58 1.99 -0.04 0.00 0.00 0.00 0.00 55.73 58.26 1tw5 s ARG 349 Cb -0.09 -1.82 -0.03 0.00 0.00 0.00 0.00 34.95 33.01 1tw5 s ARG 349 CO 0.36 -1.78 0.02 -0.51 0.00 0.00 0.00 175.30 173.39 1tw5 s ASP 350 N -1.59 5.32 0.61 0.23 1.11 -1.26 -5.08 116.67 116.00 1tw5 s ASP 350 Ca 0.80 0.11 -0.19 0.00 0.18 0.00 0.00 52.55 53.45 1tw5 s ASP 350 Cb -0.35 -1.67 -0.03 0.00 1.07 0.00 0.00 42.92 41.94 1tw5 s ASP 350 CO 0.43 0.30 1.23 -0.75 1.18 0.00 0.00 175.17 177.56 1tw5 s LYS 351 N -0.42 2.86 -0.15 8.23 2.36 -1.26 -2.59 119.74 128.77 1tw5 s LYS 351 Ca 0.08 1.88 0.00 0.00 -2.55 0.00 0.00 55.97 55.38 1tw5 s LYS 351 Cb -0.12 -1.91 0.00 0.00 -1.05 0.00 0.00 37.83 34.75 1tw5 s LYS 351 CO 0.02 -1.30 0.00 1.63 1.55 0.00 0.00 175.35 177.25 1tw5 n LYS 352 N -1.68 -0.51 -2.75 4.03 4.76 -1.26 -4.86 118.16 115.89 1tw5 n LYS 352 Ca 0.14 0.28 -0.04 0.00 -2.87 0.00 0.00 58.31 55.81 1tw5 n LYS 352 Cb 0.49 -3.77 0.04 0.00 -1.84 0.00 0.00 35.03 29.96 1tw5 n LYS 352 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1tw5 n ASN 353 N 0.07 1.52 -4.80 4.39 5.15 -1.07 -0.63 115.26 119.89 1tw5 n ASN 353 Ca -0.01 -2.35 -0.31 0.00 -0.60 0.00 0.00 54.58 51.30 1tw5 n ASN 353 Cb 0.15 -0.50 0.07 0.00 -0.53 0.00 0.00 39.78 38.96 1tw5 n ASN 353 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1tw5 s GLU 354 N -3.48 2.63 0.35 1.20 8.01 -1.26 -3.68 118.70 122.47 1tw5 s GLU 354 Ca 0.27 1.05 -0.28 0.00 0.01 0.00 0.00 54.97 56.02 1tw5 s GLU 354 Cb 0.39 -1.95 -0.12 0.00 -4.31 0.00 0.00 34.13 28.14 1tw5 s GLU 354 CO -0.00 -1.35 1.39 -2.30 0.01 0.00 0.00 175.26 173.01 1tw5 n PRO 355 N -3.31 2.38 -2.91 0.39 -0.02 -1.26 -1.02 135.00 129.25 1tw5 n PRO 355 Ca 0.08 0.83 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 1tw5 n PRO 355 Cb 0.53 -2.49 -0.05 0.00 -0.02 0.00 0.00 33.50 31.48 1tw5 n PRO 355 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1tw5 s ASN 356 N -0.20 6.38 0.39 2.55 2.47 -0.15 -4.73 114.94 121.65 1tw5 s ASN 356 Ca 0.55 -0.24 0.06 0.00 0.42 0.00 0.00 52.86 53.65 1tw5 s ASN 356 Cb -0.53 -2.41 0.78 0.00 -1.45 0.00 0.00 41.25 37.65 1tw5 s ASN 356 CO 0.62 -1.05 2.03 1.55 -3.72 0.00 0.00 177.10 176.54 1tw5 h PRO 357 N 9.12 0.65 -0.10 0.43 0.13 -1.91 -1.82 132.00 138.50 1tw5 h PRO 357 Ca -0.25 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1tw5 h PRO 357 Cb 1.08 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1tw5 h PRO 357 CO 1.02 0.43 0.00 0.00 -0.23 0.00 0.00 178.00 179.22 1tw5 n GLN 358 N -4.46 1.21 -0.11 0.86 10.64 -1.26 -4.10 117.38 120.16 1tw5 n GLN 358 Ca 0.05 -0.33 -0.04 0.00 -1.83 0.00 0.00 57.00 54.86 1tw5 n GLN 358 Cb 0.08 -1.08 0.17 0.00 -0.86 0.00 0.00 30.24 28.55 1tw5 n GLN 358 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.06 175.30 1tw5 h ARG 359 N 0.53 0.79 -0.57 2.61 0.11 -1.66 -1.26 114.38 114.92 1tw5 h ARG 359 Ca 0.00 -0.21 -0.10 0.00 0.10 0.00 0.00 59.98 59.78 1tw5 h ARG 359 Cb 0.13 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.10 1tw5 h ARG 359 CO 0.00 0.79 -0.02 0.74 0.10 0.00 0.00 179.97 181.58 1tw5 h PHE 360 N 0.74 1.11 -0.01 4.08 -1.00 -1.81 -2.09 116.94 117.96 1tw5 h PHE 360 Ca 0.15 -0.20 -0.11 0.00 2.81 0.00 0.00 57.97 60.61 1tw5 h PHE 360 Cb 0.44 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.70 1tw5 h PHE 360 CO 0.02 1.00 -0.51 0.22 -1.61 0.00 0.00 178.31 177.44 1tw5 h ASP 361 N 0.90 0.03 -0.03 2.17 1.82 -1.76 -2.99 116.42 116.55 1tw5 h ASP 361 Ca 0.16 -0.01 -0.21 0.00 -0.39 0.00 0.00 57.03 56.58 1tw5 h ASP 361 Cb 0.58 -0.01 0.01 0.00 0.68 0.00 0.00 39.33 40.59 1tw5 h ASP 361 CO 0.03 0.54 -0.78 0.03 -1.61 0.00 0.00 179.24 177.45 1tw5 h ARG 362 N 0.02 0.59 0.00 0.28 3.08 -0.90 -3.20 114.38 114.26 1tw5 h ARG 362 Ca -0.00 -0.59 0.00 0.00 0.07 0.00 0.00 59.98 59.46 1tw5 h ARG 362 Cb 0.91 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.12 1tw5 h ARG 362 CO 0.07 1.20 0.00 -0.84 -1.07 0.00 0.00 179.97 179.33 1tw5 h ILE 363 N 0.20 0.00 -0.00 2.04 3.07 -1.39 -1.08 117.51 120.35 1tw5 h ILE 363 Ca -0.09 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.01 1tw5 h ILE 363 Cb 1.45 1.15 0.00 0.00 -0.27 0.00 0.00 36.82 39.16 1tw5 h ILE 363 CO 0.16 0.00 -0.29 0.00 -1.05 0.00 0.00 178.15 176.97 1tw5 n ALA 364 N -1.92 3.06 -1.01 0.16 0.00 -1.13 -3.93 120.51 115.74 1tw5 n ALA 364 Ca 0.01 -0.27 0.08 0.00 0.00 0.00 0.00 53.44 53.27 1tw5 n ALA 364 Cb 0.24 -1.25 0.12 0.00 0.00 0.00 0.00 19.45 18.56 1tw5 n ALA 364 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1tw5 n HIS 365 N -1.39 0.00 -0.25 0.00 8.25 -0.43 -4.79 115.22 116.61 1tw5 n HIS 365 Ca 0.07 -0.89 0.12 0.00 -0.26 0.00 0.00 57.72 56.76 1tw5 n HIS 365 Cb 0.33 -0.13 0.39 0.00 1.12 0.00 0.00 29.99 31.70 1tw5 n HIS 365 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1tw5 h THR 366 N 0.38 0.84 -0.82 1.59 2.02 -1.63 -1.13 112.91 114.16 1tw5 h THR 366 Ca 0.00 -0.23 0.06 0.00 0.77 0.00 0.00 66.41 67.01 1tw5 h THR 366 Cb 0.97 0.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.44 1tw5 h THR 366 CO 0.00 0.12 0.50 0.50 0.37 0.00 0.00 175.52 177.01 1tw5 h LYS 367 N 0.66 0.89 0.00 6.66 3.64 -1.90 -1.02 116.57 125.50 1tw5 h LYS 367 Ca 0.43 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.72 1tw5 h LYS 367 Cb 0.72 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1tw5 h LYS 367 CO -0.19 0.59 -0.30 0.93 -2.27 0.00 0.00 179.45 178.20 1tw5 h GLU 368 N 0.91 0.00 0.00 1.90 3.07 -1.60 -3.37 114.58 115.49 1tw5 h GLU 368 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 1tw5 h GLU 368 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 1tw5 h GLU 368 CO -0.17 0.15 -1.11 0.25 -1.40 0.00 0.00 179.01 176.73 1tw5 n THR 369 N -3.08 0.00 0.25 1.13 -2.24 -0.97 -4.60 114.28 104.77 1tw5 n THR 369 Ca 0.02 -0.22 0.13 0.00 -2.27 0.00 0.00 64.05 61.72 1tw5 n THR 369 Cb 0.60 0.68 0.62 0.00 -2.10 0.00 0.00 70.33 70.13 1tw5 n THR 369 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tw5 h MET 370 N 0.00 0.00 -0.27 -0.78 -0.00 -1.36 0.57 114.93 113.08 1tw5 h MET 370 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 59.70 59.54 1tw5 h MET 370 Cb 0.51 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.10 1tw5 h MET 370 CO 0.00 0.12 -0.47 -0.07 -0.00 0.00 0.00 176.91 176.50 1tw5 h LEU 371 N 0.00 0.78 0.00 -0.10 3.38 -1.83 -3.34 115.31 114.20 1tw5 h LEU 371 Ca -0.00 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1tw5 h LEU 371 Cb 0.56 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1tw5 h LEU 371 CO 0.02 1.12 -1.82 -1.20 0.09 0.00 0.00 178.44 176.65 1tw5 n SER 372 N -4.01 0.17 -4.29 -0.43 7.64 -1.11 -4.86 113.62 106.73 1tw5 n SER 372 Ca -0.03 -0.13 -0.38 0.00 1.01 0.00 0.00 58.87 59.34 1tw5 n SER 372 Cb 0.57 1.80 -0.12 0.00 -1.01 0.00 0.00 64.21 65.44 1tw5 n SER 372 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1tw5 s ASP 373 N -4.32 5.37 0.00 6.43 2.15 0.17 -4.43 116.67 122.05 1tw5 s ASP 373 Ca -0.05 -1.11 0.00 0.00 0.43 0.00 0.00 52.55 51.82 1tw5 s ASP 373 Cb 0.14 -1.89 0.00 0.00 -0.30 0.00 0.00 42.92 40.87 1tw5 s ASP 373 CO 0.90 -0.33 0.00 0.61 -0.17 0.00 0.00 175.17 176.18 1tw5 n GLY 374 N 4.84 -0.54 0.35 2.66 0.00 -1.26 -4.41 105.19 106.84 1tw5 n GLY 374 Ca -0.12 -0.45 0.12 0.00 0.00 0.00 0.00 46.02 45.56 1tw5 n GLY 374 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1tw5 h LEU 375 N 0.00 0.37 -0.18 0.99 5.85 -1.31 -0.30 115.31 120.74 1tw5 h LEU 375 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1tw5 h LEU 375 Cb 0.00 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1tw5 h LEU 375 CO 0.00 0.23 -0.08 -0.46 -0.34 0.00 0.00 178.44 177.79 1tw5 n ASN 376 N -4.47 0.35 0.00 1.25 6.94 -1.26 -3.19 115.26 114.88 1tw5 n ASN 376 Ca 0.10 -0.52 0.00 0.00 -0.02 0.00 0.00 54.58 54.14 1tw5 n ASN 376 Cb 0.37 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.68 1tw5 n ASN 376 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1tw5 n SER 377 N -1.01 1.47 -4.67 0.53 3.41 -0.55 -5.04 113.62 107.75 1tw5 n SER 377 Ca 0.15 -1.64 -0.42 0.00 -0.26 0.00 0.00 58.87 56.70 1tw5 n SER 377 Cb 0.26 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 1tw5 n SER 377 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1tw5 s LEU 378 N -0.64 4.34 -0.03 1.04 2.96 -0.23 -4.85 118.68 121.27 1tw5 s LEU 378 Ca 0.00 2.32 0.01 0.00 -0.22 0.00 0.00 54.13 56.24 1tw5 s LEU 378 Cb 0.00 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.17 1tw5 s LEU 378 CO 0.00 -0.92 -0.03 0.42 -1.32 0.00 0.00 176.35 174.50 1tw5 s THR 379 N 3.73 0.35 0.35 3.68 -4.23 -1.26 -5.06 115.64 113.19 1tw5 s THR 379 Ca 0.74 -0.07 -0.17 0.00 -1.18 0.00 0.00 61.69 61.02 1tw5 s THR 379 Cb -0.35 -0.38 0.04 0.00 1.34 0.00 0.00 72.50 73.15 1tw5 s THR 379 CO 0.31 0.16 0.76 -0.72 -0.54 0.00 0.00 174.62 174.59 1tw5 s TYR 380 N 0.65 0.04 -0.12 3.99 -0.85 -1.26 -4.76 117.35 115.04 1tw5 s TYR 380 Ca -0.07 -0.64 -0.02 0.00 -0.52 0.00 0.00 57.07 55.81 1tw5 s TYR 380 Cb -0.11 0.78 0.04 0.00 0.38 0.00 0.00 41.96 43.05 1tw5 s TYR 380 CO -0.01 -1.45 0.03 1.41 -1.52 0.00 0.00 175.55 174.01 1tw5 s MET 381 N -2.85 0.49 -0.00 -3.49 1.75 0.33 -4.98 119.30 110.55 1tw5 s MET 381 Ca 0.14 -0.05 -0.30 0.00 -1.25 0.00 0.00 55.69 54.23 1tw5 s MET 381 Cb -0.05 -1.39 -0.05 0.00 2.84 0.00 0.00 34.83 36.18 1tw5 s MET 381 CO 0.10 -0.46 1.38 0.08 -0.65 0.00 0.00 175.02 175.48 1tw5 s VAL 382 N 1.98 3.75 -0.13 10.11 1.01 -1.26 -0.00 120.40 135.86 1tw5 s VAL 382 Ca 0.03 1.14 0.18 0.00 0.00 0.00 0.00 61.98 63.33 1tw5 s VAL 382 Cb -0.14 -3.73 -0.22 0.00 0.00 0.00 0.00 36.38 32.29 1tw5 s VAL 382 CO -0.06 0.00 0.50 0.18 0.00 0.00 0.00 175.10 175.72 1tw5 n LEU 383 N 5.32 0.38 -3.60 3.92 4.77 0.11 -4.92 117.00 122.98 1tw5 n LEU 383 Ca 0.13 0.17 -0.08 0.00 -0.03 0.00 0.00 56.01 56.19 1tw5 n LEU 383 Cb 0.44 0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.67 1tw5 n LEU 383 CO 0.58 0.22 0.86 -0.70 -1.33 0.00 0.00 177.39 177.02 1tw5 s GLU 384 N -2.93 0.46 -0.17 3.23 2.12 -1.02 -5.00 118.70 115.38 1tw5 s GLU 384 Ca -0.06 0.17 0.00 0.00 0.36 0.00 0.00 54.97 55.44 1tw5 s GLU 384 Cb 0.09 0.22 0.04 0.00 0.26 0.00 0.00 34.13 34.73 1tw5 s GLU 384 CO 0.84 -0.13 -0.10 0.08 -0.54 0.00 0.00 175.26 175.41 1tw5 s VAL 385 N -0.87 1.45 -0.14 3.70 1.01 -1.26 -1.00 120.40 123.28 1tw5 s VAL 385 Ca 0.01 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.22 1tw5 s VAL 385 Cb -0.01 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.86 1tw5 s VAL 385 CO -0.02 0.23 -0.18 -1.10 0.00 0.00 0.00 175.10 174.03 1tw5 s GLN 386 N 1.50 3.15 -0.26 2.72 -0.21 -0.21 -5.00 119.66 121.34 1tw5 s GLN 386 Ca 0.01 -0.79 -0.18 0.00 0.02 0.00 0.00 55.36 54.42 1tw5 s GLN 386 Cb -0.15 -2.53 -0.03 0.00 1.00 0.00 0.00 33.01 31.30 1tw5 s GLN 386 CO -0.09 0.04 0.50 1.03 -2.12 0.00 0.00 175.29 174.66 1tw5 s ARG 387 N 0.72 4.07 0.22 2.91 1.81 -1.26 -0.85 118.95 126.57 1tw5 s ARG 387 Ca -0.08 0.30 0.07 0.00 -1.72 0.00 0.00 55.73 54.31 1tw5 s ARG 387 Cb -0.16 -3.65 -0.04 0.00 -0.45 0.00 0.00 34.95 30.66 1tw5 s ARG 387 CO 0.01 -0.33 0.07 0.71 -0.68 0.00 0.00 175.30 175.08 1tw5 s TYR 388 N 2.24 2.92 0.21 -0.53 1.51 -0.24 -4.76 117.35 118.70 1tw5 s TYR 388 Ca 0.21 -0.14 -0.09 0.00 -1.01 0.00 0.00 57.07 56.04 1tw5 s TYR 388 Cb -0.16 -1.35 0.29 0.00 -0.11 0.00 0.00 41.96 40.63 1tw5 s TYR 388 CO 0.09 0.55 1.76 -1.00 -1.11 0.00 0.00 175.55 175.83 1tw5 h PRO 389 N 2.13 0.45 0.00 -1.71 0.13 -1.93 0.33 132.00 131.40 1tw5 h PRO 389 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1tw5 h PRO 389 Cb 1.22 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1tw5 h PRO 389 CO 0.60 0.30 -0.34 1.28 -0.23 0.00 0.00 178.00 179.61 1tw5 n LEU 390 N -4.95 0.37 -3.54 1.56 4.77 -1.26 -0.42 117.00 113.52 1tw5 n LEU 390 Ca 0.09 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1tw5 n LEU 390 Cb 0.27 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 1tw5 n LEU 390 CO 0.23 0.06 0.70 -0.72 -1.33 0.00 0.00 177.39 176.34 1tw5 s TYR 391 N -3.02 -0.40 -0.14 -1.77 -0.85 -1.06 -3.70 117.35 106.41 1tw5 s TYR 391 Ca 0.12 0.55 -0.18 0.00 -0.52 0.00 0.00 57.07 57.04 1tw5 s TYR 391 Cb 0.17 0.47 -0.04 0.00 0.38 0.00 0.00 41.96 42.95 1tw5 s TYR 391 CO 0.65 -0.44 0.48 0.99 -1.52 0.00 0.00 175.55 175.70 1tw5 s THR 392 N -1.80 5.18 -0.24 -3.49 2.01 -0.55 -1.08 115.64 115.66 1tw5 s THR 392 Ca -0.01 0.94 -0.05 0.00 0.31 0.00 0.00 61.69 62.88 1tw5 s THR 392 Cb -0.01 -3.81 -0.00 0.00 0.01 0.00 0.00 72.50 68.69 1tw5 s THR 392 CO -0.01 0.30 -0.01 -0.75 -0.69 0.00 0.00 174.62 173.46 1tw5 s LYS 393 N 0.84 3.26 -0.33 4.92 2.20 -0.03 -1.04 119.74 129.57 1tw5 s LYS 393 Ca 0.25 -0.71 -0.06 0.00 -0.36 0.00 0.00 55.97 55.09 1tw5 s LYS 393 Cb -0.15 -3.12 0.04 0.00 -1.51 0.00 0.00 37.83 33.08 1tw5 s LYS 393 CO 0.10 -0.28 0.09 0.42 -0.36 0.00 0.00 175.35 175.32 1tw5 s ILE 394 N 1.48 3.73 -0.18 5.43 1.01 -0.45 -1.05 121.20 131.17 1tw5 s ILE 394 Ca 0.04 -1.10 -0.20 0.00 0.00 0.00 0.00 60.65 59.39 1tw5 s ILE 394 Cb -0.15 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.20 1tw5 s ILE 394 CO -0.01 -0.14 0.59 -0.89 0.00 0.00 0.00 174.94 174.48 1tw5 s THR 395 N 1.40 5.07 0.05 2.92 2.01 -0.17 -1.09 115.64 125.82 1tw5 s THR 395 Ca -0.01 1.11 0.03 0.00 0.31 0.00 0.00 61.69 63.13 1tw5 s THR 395 Cb -0.19 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 1tw5 s THR 395 CO 0.02 0.17 -0.10 0.68 -0.69 0.00 0.00 174.62 174.70 1tw5 s VAL 396 N 1.59 0.73 -0.43 3.82 -7.23 0.36 0.08 120.40 119.33 1tw5 s VAL 396 Ca 0.28 -1.13 -0.14 0.00 -1.81 0.00 0.00 61.98 59.17 1tw5 s VAL 396 Cb -0.16 -0.76 0.05 0.00 0.56 0.00 0.00 36.38 36.07 1tw5 s VAL 396 CO 0.11 -0.31 0.33 -0.62 -0.31 0.00 0.00 175.10 174.29 1tw5 s ASP 397 N -1.59 6.02 -0.19 4.85 -1.08 0.99 -0.95 116.67 124.72 1tw5 s ASP 397 Ca -0.07 -1.18 0.16 0.00 -0.52 0.00 0.00 52.55 50.93 1tw5 s ASP 397 Cb -0.10 -2.13 0.72 0.00 -1.46 0.00 0.00 42.92 39.95 1tw5 s ASP 397 CO 0.01 -0.54 1.64 2.30 0.52 0.00 0.00 175.17 179.10 1tw5 n ILE 398 N 5.13 2.39 -3.91 4.11 -5.35 -1.26 -0.51 119.36 119.95 1tw5 n ILE 398 Ca -0.12 -1.45 0.00 0.00 -0.27 0.00 0.00 62.75 60.91 1tw5 n ILE 398 Cb 0.45 -0.15 -0.00 0.00 -1.74 0.00 0.00 39.64 38.20 1tw5 n ILE 398 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tw5 n GLY 399 N 0.49 -2.07 3.33 3.28 0.00 -1.26 -4.93 105.19 104.03 1tw5 n GLY 399 Ca 0.25 -1.42 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 1tw5 n GLY 399 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tw5 s THR 400 N -0.03 1.48 0.90 2.61 -4.23 -1.26 -4.96 115.64 110.14 1tw5 s THR 400 Ca 0.00 -2.13 -0.12 0.00 -1.18 0.00 0.00 61.69 58.25 1tw5 s THR 400 Cb 0.00 -2.11 0.13 0.00 1.34 0.00 0.00 72.50 71.86 1tw5 s THR 400 CO 0.00 -0.54 1.15 -2.16 -0.54 0.00 0.00 174.62 172.53 1tw5 s PRO 401 N -3.72 1.25 0.00 3.99 0.04 -1.26 -5.15 135.00 130.16 1tw5 s PRO 401 Ca 0.23 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.50 1tw5 s PRO 401 Cb 0.02 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1tw5 s PRO 401 CO 0.06 -2.11 0.00 0.43 0.04 0.00 0.00 177.00 175.43