#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ix7 s ALA 138 N 0.00 3.28 -0.05 -2.53 0.00 -1.26 -4.88 121.76 116.31 3ix7 s ALA 138 Ca 0.00 -3.20 -0.30 0.00 0.00 0.00 0.00 51.96 48.46 3ix7 s ALA 138 Cb 0.00 -2.16 -0.05 0.00 0.00 0.00 0.00 23.12 20.91 3ix7 s ALA 138 CO 0.00 -1.99 1.48 -1.25 0.00 0.00 0.00 175.76 174.00 3ix7 s PRO 139 N -0.16 4.23 0.00 0.00 0.04 -1.26 -4.93 135.00 132.92 3ix7 s PRO 139 Ca 0.16 2.01 0.23 0.00 0.04 0.00 0.00 61.00 63.44 3ix7 s PRO 139 Cb -0.25 -3.77 0.51 0.00 0.04 0.00 0.00 34.50 31.03 3ix7 s PRO 139 CO -0.01 -0.71 1.46 0.54 0.04 0.00 0.00 177.00 178.31 3ix7 n ARG 140 N 6.31 2.60 -0.11 4.56 1.74 -1.24 -4.47 116.66 126.04 3ix7 n ARG 140 Ca 0.15 -2.45 0.03 0.00 -0.77 0.00 0.00 57.85 54.81 3ix7 n ARG 140 Cb 0.43 -1.54 0.08 0.00 -1.02 0.00 0.00 32.46 30.42 3ix7 n ARG 140 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ix7 n GLY 141 N 1.58 0.22 2.43 -0.13 0.00 -0.45 -4.80 105.19 104.05 3ix7 n GLY 141 Ca 0.21 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3ix7 n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ix7 n GLY 142 N 0.66 0.68 3.03 -0.02 0.00 -1.26 -4.44 105.19 103.84 3ix7 n GLY 142 Ca 0.06 -1.42 -0.13 0.00 0.00 0.00 0.00 46.02 44.53 3ix7 n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ix7 s LYS 143 N 0.00 0.19 -0.25 1.61 -0.14 -0.31 -1.34 119.74 119.49 3ix7 s LYS 143 Ca 0.00 0.47 -0.08 0.00 -1.36 0.00 0.00 55.97 55.01 3ix7 s LYS 143 Cb 0.00 -0.11 -0.03 0.00 -1.68 0.00 0.00 37.83 36.01 3ix7 s LYS 143 CO 0.00 -0.15 0.09 0.08 -0.76 0.00 0.00 175.35 174.61 3ix7 s VAL 144 N 1.13 4.50 -0.08 3.17 1.01 0.95 -0.44 120.40 130.64 3ix7 s VAL 144 Ca -0.08 -0.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.67 3ix7 s VAL 144 Cb -0.10 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 3ix7 s VAL 144 CO -0.07 0.33 0.29 -0.76 0.00 0.00 0.00 175.10 174.88 3ix7 s LEU 145 N 1.61 4.39 0.55 3.92 1.43 -0.23 -0.44 118.68 129.91 3ix7 s LEU 145 Ca 0.06 0.69 0.08 0.00 -1.03 0.00 0.00 54.13 53.93 3ix7 s LEU 145 Cb -0.15 -2.35 0.06 0.00 0.03 0.00 0.00 46.19 43.78 3ix7 s LEU 145 CO 0.05 0.30 0.65 1.51 0.23 0.00 0.00 176.35 179.09 3ix7 s ASP 146 N -0.71 5.00 0.14 2.29 -4.77 -0.99 -4.44 116.67 113.19 3ix7 s ASP 146 Ca 0.19 -0.93 -0.18 0.00 -3.30 0.00 0.00 52.55 48.33 3ix7 s ASP 146 Cb -0.14 0.22 -0.00 0.00 -1.09 0.00 0.00 42.92 41.91 3ix7 s ASP 146 CO 0.08 -1.20 1.77 0.74 0.70 0.00 0.00 175.17 177.26 3ix7 h THR 147 N 0.41 1.00 -0.65 2.11 2.02 -1.90 -3.16 112.91 112.74 3ix7 h THR 147 Ca -0.33 -0.11 0.10 0.00 0.77 0.00 0.00 66.41 66.84 3ix7 h THR 147 Cb 1.29 0.66 -0.08 0.00 -1.74 0.00 0.00 68.15 68.28 3ix7 h THR 147 CO 0.47 0.06 0.26 0.77 0.37 0.00 0.00 175.52 177.44 3ix7 h SER 148 N 0.31 0.28 0.70 4.18 4.64 -1.96 0.10 113.55 121.80 3ix7 h SER 148 Ca 0.12 0.08 -0.16 0.00 -0.47 0.00 0.00 61.79 61.36 3ix7 h SER 148 Cb 0.03 0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 3ix7 h SER 148 CO -0.08 0.15 -0.76 -0.37 -0.87 0.00 0.00 176.83 174.90 3ix7 h VAL 149 N 0.45 1.52 -0.43 0.95 -1.51 -1.84 -0.33 116.25 115.07 3ix7 h VAL 149 Ca 0.33 -2.55 -0.15 0.00 -1.23 0.00 0.00 66.70 63.11 3ix7 h VAL 149 Cb 0.42 2.38 -0.01 0.00 -2.13 0.00 0.00 31.29 31.95 3ix7 h VAL 149 CO -0.32 0.73 -0.31 -0.07 -1.23 0.00 0.00 177.57 176.38 3ix7 h LEU 150 N 0.03 1.01 -0.43 4.19 3.38 -1.39 -0.27 115.31 121.83 3ix7 h LEU 150 Ca -0.01 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 3ix7 h LEU 150 Cb 1.35 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 3ix7 h LEU 150 CO 0.10 1.23 0.05 0.58 0.09 0.00 0.00 178.44 180.50 3ix7 h VAL 151 N 0.81 1.25 -0.93 1.22 2.07 -0.67 -2.56 116.25 117.43 3ix7 h VAL 151 Ca 0.08 -0.93 0.12 0.00 0.82 0.00 0.00 66.70 66.80 3ix7 h VAL 151 Cb 0.90 1.01 -0.07 0.00 -1.52 0.00 0.00 31.29 31.61 3ix7 h VAL 151 CO 0.08 0.32 0.60 -0.78 0.02 0.00 0.00 177.57 177.81 3ix7 h ASP 152 N 0.58 0.79 0.00 0.57 1.82 -0.91 -3.43 116.42 115.84 3ix7 h ASP 152 Ca 0.13 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.81 3ix7 h ASP 152 Cb 0.41 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.30 3ix7 h ASP 152 CO 0.01 0.43 0.00 0.61 -1.61 0.00 0.00 179.24 178.68 3ix7 n GLY 153 N -1.39 2.64 0.26 -0.78 0.00 -0.13 -4.84 105.19 100.96 3ix7 n GLY 153 Ca 0.17 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.32 3ix7 n GLY 153 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3ix7 h ARG 154 N 0.00 0.00 -0.69 1.61 3.08 -1.89 -2.60 114.38 113.90 3ix7 h ARG 154 Ca 0.00 0.00 0.20 0.00 0.07 0.00 0.00 59.98 60.25 3ix7 h ARG 154 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3ix7 h ARG 154 CO 0.00 0.12 0.51 -0.24 -1.07 0.00 0.00 179.97 179.29 3ix7 h VAL 155 N 0.00 0.62 -0.14 2.04 3.04 -1.88 -1.57 116.25 118.37 3ix7 h VAL 155 Ca -0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.65 3ix7 h VAL 155 Cb 0.43 0.64 -0.00 0.00 -2.01 0.00 0.00 31.29 30.36 3ix7 h VAL 155 CO 0.02 0.00 -0.06 0.00 -1.01 0.00 0.00 177.57 176.52 3ix7 h ALA 156 N 1.63 0.19 -0.37 3.17 0.00 -1.79 -1.36 119.26 120.74 3ix7 h ALA 156 Ca 0.33 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 3ix7 h ALA 156 Cb 1.34 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 3ix7 h ALA 156 CO -0.00 -0.03 -0.11 0.93 0.00 0.00 0.00 179.25 180.04 3ix7 h GLU 157 N -0.05 0.64 -0.15 0.00 3.07 -1.53 -2.43 114.58 114.12 3ix7 h GLU 157 Ca 0.03 -0.19 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 3ix7 h GLU 157 Cb 0.52 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 3ix7 h GLU 157 CO 0.02 0.73 0.07 0.28 -1.40 0.00 0.00 179.01 178.72 3ix7 h VAL 158 N 0.59 1.13 -0.47 3.13 2.07 -1.22 -1.91 116.25 119.56 3ix7 h VAL 158 Ca 0.11 -0.36 0.09 0.00 0.82 0.00 0.00 66.70 67.35 3ix7 h VAL 158 Cb 0.53 1.09 -0.08 0.00 -1.52 0.00 0.00 31.29 31.31 3ix7 h VAL 158 CO 0.03 0.12 -0.00 0.00 0.02 0.00 0.00 177.57 177.73 3ix7 h ALA 159 N 0.94 0.43 0.00 1.67 0.00 -1.18 -2.32 119.26 118.80 3ix7 h ALA 159 Ca 0.05 0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 3ix7 h ALA 159 Cb 0.12 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3ix7 h ALA 159 CO -0.01 -0.39 -0.23 0.00 0.00 0.00 0.00 179.25 178.63 3ix7 h ALA 160 N 1.42 1.40 -0.01 0.00 0.00 -1.17 -0.33 119.26 120.57 3ix7 h ALA 160 Ca 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3ix7 h ALA 160 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3ix7 h ALA 160 CO -0.39 0.29 -0.21 1.55 0.00 0.00 0.00 179.25 180.49 3ix7 n VAL 161 N -3.95 0.00 0.00 0.00 3.14 -0.74 -4.93 118.33 111.85 3ix7 n VAL 161 Ca -0.02 -0.12 0.00 0.00 -2.96 0.00 0.00 64.34 61.24 3ix7 n VAL 161 Cb 0.31 0.30 0.00 0.00 -1.06 0.00 0.00 33.84 33.39 3ix7 n VAL 161 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3ix7 n GLY 162 N 1.32 0.89 1.67 7.55 0.00 -0.13 -4.99 105.19 111.48 3ix7 n GLY 162 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 3ix7 n GLY 162 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ix7 n PHE 163 N -1.72 1.99 -3.38 1.61 3.01 -0.91 -4.65 117.46 113.41 3ix7 n PHE 163 Ca 0.00 -1.24 -0.26 0.00 1.01 0.00 0.00 57.45 56.96 3ix7 n PHE 163 Cb 0.00 -0.60 -0.10 0.00 -0.01 0.00 0.00 39.48 38.77 3ix7 n PHE 163 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 3ix7 s LEU 164 N -3.02 1.09 0.22 4.37 2.96 -1.26 -4.80 118.68 118.24 3ix7 s LEU 164 Ca 0.51 -2.70 -0.30 0.00 -0.22 0.00 0.00 54.13 51.42 3ix7 s LEU 164 Cb 0.42 -0.28 -0.08 0.00 0.50 0.00 0.00 46.19 46.75 3ix7 s LEU 164 CO 0.10 -0.21 1.13 -1.61 -1.32 0.00 0.00 176.35 174.44 3ix7 s GLU 165 N 0.44 4.58 0.20 1.98 2.02 -1.26 -4.79 118.70 121.87 3ix7 s GLU 165 Ca 0.28 1.79 -0.01 0.00 0.02 0.00 0.00 54.97 57.05 3ix7 s GLU 165 Cb -0.05 -3.23 0.04 0.00 0.10 0.00 0.00 34.13 31.00 3ix7 s GLU 165 CO -0.13 0.08 0.28 0.41 0.02 0.00 0.00 175.26 175.93 3ix7 n GLY 166 N 1.74 0.17 3.76 -1.39 0.00 -1.26 -4.40 105.19 103.81 3ix7 n GLY 166 Ca 0.02 -1.89 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 3ix7 n GLY 166 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ix7 s PRO 167 N -3.27 3.06 -0.17 1.61 0.04 -1.26 -4.11 135.00 130.90 3ix7 s PRO 167 Ca 0.18 1.83 -0.09 0.00 0.04 0.00 0.00 61.00 62.95 3ix7 s PRO 167 Cb -0.01 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 3ix7 s PRO 167 CO 0.12 -1.13 0.14 -0.51 0.04 0.00 0.00 177.00 175.65 3ix7 s LEU 168 N -3.96 4.27 -0.07 -3.56 1.43 -1.01 -1.16 118.68 114.62 3ix7 s LEU 168 Ca 0.76 0.31 0.04 0.00 -1.03 0.00 0.00 54.13 54.22 3ix7 s LEU 168 Cb -0.30 -2.09 -0.00 0.00 0.03 0.00 0.00 46.19 43.83 3ix7 s LEU 168 CO 0.33 0.25 -0.21 0.26 0.23 0.00 0.00 176.35 177.21 3ix7 s TRP 169 N -0.08 2.16 -0.10 0.29 0.52 0.42 -1.30 118.94 120.85 3ix7 s TRP 169 Ca 0.10 -0.75 0.03 0.00 0.02 0.00 0.00 56.10 55.50 3ix7 s TRP 169 Cb -0.11 -1.45 0.01 0.00 -1.15 0.00 0.00 33.47 30.76 3ix7 s TRP 169 CO 0.00 -0.28 -0.19 0.08 0.02 0.00 0.00 176.95 176.57 3ix7 s VAL 170 N 0.17 1.72 0.61 4.03 1.01 -0.93 -1.06 120.40 125.95 3ix7 s VAL 170 Ca -0.10 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 60.87 3ix7 s VAL 170 Cb -0.15 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 3ix7 s VAL 170 CO 0.05 0.49 1.30 -2.84 0.00 0.00 0.00 175.10 174.10 3ix7 s PRO 171 N 0.57 2.81 0.22 2.72 0.02 -1.26 -0.61 135.00 139.46 3ix7 s PRO 171 Ca -0.15 2.09 -0.08 0.00 0.02 0.00 0.00 61.00 62.88 3ix7 s PRO 171 Cb -0.17 -1.99 0.34 0.00 0.02 0.00 0.00 34.50 32.70 3ix7 s PRO 171 CO 0.05 -1.41 1.73 1.12 -0.33 0.00 0.00 177.00 178.16 3ix7 h HIS 172 N 0.90 0.38 0.00 6.54 2.07 -0.08 -2.66 115.15 122.30 3ix7 h HIS 172 Ca -0.51 0.03 -0.03 0.00 -2.85 0.00 0.00 60.37 57.02 3ix7 h HIS 172 Cb 1.32 -0.07 -0.00 0.00 2.57 0.00 0.00 27.41 31.23 3ix7 h HIS 172 CO 0.44 0.05 -0.13 0.27 -3.07 0.00 0.00 177.93 175.49 3ix7 h PHE 173 N 0.38 0.00 -0.33 6.12 -5.15 -1.92 0.26 116.94 116.30 3ix7 h PHE 173 Ca 0.34 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 58.08 3ix7 h PHE 173 Cb 0.48 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.64 3ix7 h PHE 173 CO -0.19 0.13 0.08 0.28 -2.00 0.00 0.00 178.31 176.61 3ix7 h VAL 174 N 0.00 1.22 -0.32 0.88 2.07 -1.85 0.24 116.25 118.48 3ix7 h VAL 174 Ca -0.00 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 3ix7 h VAL 174 Cb 0.25 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3ix7 h VAL 174 CO 0.02 0.25 0.04 0.25 0.02 0.00 0.00 177.57 178.15 3ix7 h LEU 175 N 0.37 0.52 -1.55 2.57 5.85 -1.26 -0.07 115.31 121.75 3ix7 h LEU 175 Ca 0.10 -0.27 0.19 0.00 0.84 0.00 0.00 57.88 58.74 3ix7 h LEU 175 Cb 0.29 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.12 3ix7 h LEU 175 CO 0.00 0.66 0.57 0.50 -0.34 0.00 0.00 178.44 179.83 3ix7 h LYS 176 N 0.37 0.38 -0.02 1.25 3.64 -0.30 -1.02 116.57 120.87 3ix7 h LYS 176 Ca 0.10 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.36 3ix7 h LYS 176 Cb 0.37 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.11 3ix7 h LYS 176 CO 0.01 0.25 -0.36 1.49 -2.27 0.00 0.00 179.45 178.57 3ix7 h GLU 177 N 0.39 0.28 -0.30 1.90 4.81 0.48 -2.35 114.58 119.79 3ix7 h GLU 177 Ca 0.44 -0.28 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 3ix7 h GLU 177 Cb 1.10 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 3ix7 h GLU 177 CO -0.15 0.96 0.13 -0.07 -0.73 0.00 0.00 179.01 179.15 3ix7 h LEU 178 N -0.29 0.37 0.00 1.64 3.38 -0.17 -1.13 115.31 119.11 3ix7 h LEU 178 Ca -0.04 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 3ix7 h LEU 178 Cb 1.07 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3ix7 h LEU 178 CO 0.07 0.33 -0.66 1.56 0.09 0.00 0.00 178.44 179.84 3ix7 h GLN 179 N 0.42 0.00 -0.18 1.13 1.08 -1.29 -0.17 115.11 116.10 3ix7 h GLN 179 Ca 0.11 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.24 3ix7 h GLN 179 Cb 0.07 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 3ix7 h GLN 179 CO -0.01 0.54 -0.20 1.25 -0.95 0.00 0.00 178.83 179.46 3ix7 h HIS 180 N 0.00 0.33 -0.12 2.96 2.76 -0.84 -0.19 115.15 120.06 3ix7 h HIS 180 Ca -0.02 -0.05 -0.13 0.00 -2.20 0.00 0.00 60.37 57.97 3ix7 h HIS 180 Cb 1.46 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 30.33 3ix7 h HIS 180 CO 0.00 0.50 -0.43 0.74 -1.30 0.00 0.00 177.93 177.44 3ix7 h PHE 181 N 0.28 0.66 -0.28 5.26 0.04 -1.23 -3.28 116.94 118.40 3ix7 h PHE 181 Ca 0.05 -0.28 -0.02 0.00 2.80 0.00 0.00 57.97 60.53 3ix7 h PHE 181 Cb 0.52 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.55 3ix7 h PHE 181 CO 0.01 1.03 0.10 0.00 -0.60 0.00 0.00 178.31 178.86 3ix7 h ALA 182 N 0.50 1.65 0.00 2.45 0.00 -0.77 -1.96 119.26 121.12 3ix7 h ALA 182 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ix7 h ALA 182 Cb 1.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3ix7 h ALA 182 CO 0.09 0.28 0.00 -0.25 0.00 0.00 0.00 179.25 179.37 3ix7 n ASP 183 N -4.41 0.25 -4.78 0.00 8.00 -0.10 -4.72 116.55 110.79 3ix7 n ASP 183 Ca 0.01 -1.69 -0.39 0.00 0.71 0.00 0.00 54.79 53.43 3ix7 n ASP 183 Cb 0.14 -0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.05 3ix7 n ASP 183 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3ix7 s SER 184 N -0.85 7.32 0.35 -2.24 0.15 -0.74 -4.95 113.70 112.74 3ix7 s SER 184 Ca 0.00 1.57 0.27 0.00 0.70 0.00 0.00 55.95 58.48 3ix7 s SER 184 Cb 0.00 -2.47 0.95 0.00 -1.71 0.00 0.00 66.02 62.78 3ix7 s SER 184 CO 0.00 0.22 1.78 1.56 1.20 0.00 0.00 173.24 178.00 3ix7 h GLN 185 N 4.39 0.00 -6.20 5.44 1.08 -1.90 -3.41 115.11 114.52 3ix7 h GLN 185 Ca -0.47 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.15 3ix7 h GLN 185 Cb 1.21 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 28.57 3ix7 h GLN 185 CO 0.66 0.00 0.80 0.34 -0.95 0.00 0.00 178.83 179.67 3ix7 s ASP 186 N -4.98 6.96 0.39 1.46 -1.08 -1.26 -4.94 116.67 113.21 3ix7 s ASP 186 Ca 0.05 1.12 0.09 0.00 -0.52 0.00 0.00 52.55 53.29 3ix7 s ASP 186 Cb 0.09 -2.53 0.78 0.00 -1.46 0.00 0.00 42.92 39.80 3ix7 s ASP 186 CO 0.52 -0.80 1.93 -0.65 0.52 0.00 0.00 175.17 176.69 3ix7 h PRO 187 N 7.90 0.29 0.14 4.34 0.11 -1.98 -0.33 132.00 142.46 3ix7 h PRO 187 Ca -0.20 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 3ix7 h PRO 187 Cb 1.06 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3ix7 h PRO 187 CO 1.01 0.39 -0.07 1.25 -0.21 0.00 0.00 178.00 180.37 3ix7 h LEU 188 N 0.28 -0.15 -0.67 2.35 6.46 -1.96 0.33 115.31 121.95 3ix7 h LEU 188 Ca 0.06 -0.16 -0.13 0.00 -0.12 0.00 0.00 57.88 57.52 3ix7 h LEU 188 Cb 0.33 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 3ix7 h LEU 188 CO 0.02 0.07 -0.41 0.03 -0.62 0.00 0.00 178.44 177.53 3ix7 h ARG 189 N -0.38 0.56 -0.28 1.25 3.08 -1.81 -2.93 114.38 113.87 3ix7 h ARG 189 Ca -0.02 -0.29 0.01 0.00 0.07 0.00 0.00 59.98 59.76 3ix7 h ARG 189 Cb 0.31 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 3ix7 h ARG 189 CO 0.03 0.87 0.16 -0.09 -1.07 0.00 0.00 179.97 179.88 3ix7 h ARG 190 N 0.46 0.32 0.00 0.04 2.43 -0.97 -1.96 114.38 114.71 3ix7 h ARG 190 Ca 0.04 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3ix7 h ARG 190 Cb 0.91 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 3ix7 h ARG 190 CO 0.08 0.21 0.00 0.00 -1.51 0.00 0.00 179.97 178.75 3ix7 n ALA 191 N -2.20 2.30 -0.05 2.80 0.00 0.11 -1.08 120.51 122.38 3ix7 n ALA 191 Ca -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 53.44 53.28 3ix7 n ALA 191 Cb 0.05 -1.42 -0.12 0.00 0.00 0.00 0.00 19.45 17.95 3ix7 n ALA 191 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3ix7 n LYS 192 N -1.30 1.22 -0.08 0.00 2.85 -1.12 -2.96 118.16 116.78 3ix7 n LYS 192 Ca 0.12 -0.05 -0.12 0.00 -1.05 0.00 0.00 58.31 57.21 3ix7 n LYS 192 Cb 0.22 -1.39 -0.05 0.00 -0.65 0.00 0.00 35.03 33.16 3ix7 n LYS 192 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 3ix7 h GLY 193 N 2.98 0.48 0.41 2.58 0.00 -1.16 -1.85 103.07 106.51 3ix7 h GLY 193 Ca -0.29 -0.42 0.12 0.00 0.00 0.00 0.00 47.33 46.75 3ix7 h GLY 193 CO 0.02 0.38 0.53 -0.09 0.00 0.00 0.00 176.54 177.38 3ix7 h ARG 194 N 0.16 0.81 -0.23 4.80 2.43 -1.28 -2.69 114.38 118.37 3ix7 h ARG 194 Ca 0.05 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 3ix7 h ARG 194 Cb 0.56 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3ix7 h ARG 194 CO 0.03 0.53 -0.29 -0.09 -1.51 0.00 0.00 179.97 178.64 3ix7 h ARG 195 N 0.83 0.61 -0.76 0.20 9.65 -1.41 -2.64 114.38 120.86 3ix7 h ARG 195 Ca 0.46 -0.35 0.12 0.00 -1.10 0.00 0.00 59.98 59.11 3ix7 h ARG 195 Cb 0.51 0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 29.03 3ix7 h ARG 195 CO -0.29 0.95 0.36 0.78 2.80 0.00 0.00 179.97 184.58 3ix7 h GLY 196 N 0.31 1.17 0.98 2.80 0.00 -1.03 -2.36 103.07 104.93 3ix7 h GLY 196 Ca 0.03 -0.21 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 3ix7 h GLY 196 CO 0.07 0.00 -0.00 1.41 0.00 0.00 0.00 176.54 178.02 3ix7 h LEU 197 N 0.57 0.78 -0.78 3.11 3.38 -1.38 -2.27 115.31 118.72 3ix7 h LEU 197 Ca 0.39 -0.31 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3ix7 h LEU 197 Cb 0.50 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3ix7 h LEU 197 CO -0.32 0.90 0.52 -0.08 0.09 0.00 0.00 178.44 179.54 3ix7 h GLU 198 N 0.64 1.04 -0.64 1.13 4.81 -1.19 -1.01 114.58 119.36 3ix7 h GLU 198 Ca 0.13 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.36 3ix7 h GLU 198 Cb 0.50 -0.23 -0.06 0.00 0.63 0.00 0.00 28.75 29.59 3ix7 h GLU 198 CO 0.02 0.69 0.33 1.15 -0.73 0.00 0.00 179.01 180.48 3ix7 h THR 199 N 1.06 0.93 0.36 0.32 2.02 -1.08 -0.67 112.91 115.86 3ix7 h THR 199 Ca 0.29 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 3ix7 h THR 199 Cb -0.12 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 66.53 3ix7 h THR 199 CO -0.06 0.11 -0.41 -0.07 0.37 0.00 0.00 175.52 175.46 3ix7 h LEU 200 N 0.61 -1.13 -0.97 2.58 3.38 -0.97 -1.00 115.31 117.81 3ix7 h LEU 200 Ca 0.29 0.10 0.21 0.00 0.09 0.00 0.00 57.88 58.58 3ix7 h LEU 200 Cb 0.22 0.39 -0.12 0.00 0.09 0.00 0.00 40.66 41.24 3ix7 h LEU 200 CO -0.20 -0.55 0.55 -0.33 0.09 0.00 0.00 178.44 178.00 3ix7 h GLU 201 N -0.80 0.60 0.00 1.13 4.39 -0.75 -1.19 114.58 117.96 3ix7 h GLU 201 Ca -0.03 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.49 3ix7 h GLU 201 Cb 0.73 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 3ix7 h GLU 201 CO -0.10 0.39 -0.69 0.00 -1.16 0.00 0.00 179.01 177.46 3ix7 h ARG 202 N 0.61 0.00 -0.42 2.33 3.08 -0.91 -3.16 114.38 115.92 3ix7 h ARG 202 Ca 0.59 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.51 3ix7 h ARG 202 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 3ix7 h ARG 202 CO -0.44 0.69 -0.23 -0.07 -1.07 0.00 0.00 179.97 178.84 3ix7 h LEU 203 N 0.00 0.94 0.00 3.04 3.38 -0.04 -2.87 115.31 119.76 3ix7 h LEU 203 Ca -0.01 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.55 3ix7 h LEU 203 Cb 1.30 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3ix7 h LEU 203 CO 0.09 1.15 0.00 0.54 0.09 0.00 0.00 178.44 180.31 3ix7 n ARG 204 N -4.17 0.08 -0.10 1.13 1.74 -0.65 -1.57 116.66 113.11 3ix7 n ARG 204 Ca -0.01 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.93 3ix7 n ARG 204 Cb 0.46 -1.21 -0.05 0.00 -1.02 0.00 0.00 32.46 30.64 3ix7 n ARG 204 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3ix7 n GLU 205 N -0.71 0.54 0.18 5.56 4.71 -1.09 -4.66 120.64 125.17 3ix7 n GLU 205 Ca 0.01 0.24 0.08 0.00 -0.01 0.00 0.00 57.16 57.47 3ix7 n GLU 205 Cb 0.00 -1.46 0.59 0.00 -1.01 0.00 0.00 31.44 29.57 3ix7 n GLU 205 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ix7 h ALA 206 N -0.99 1.95 -2.67 0.62 0.00 -1.34 -3.45 119.26 113.38 3ix7 h ALA 206 Ca -0.16 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 3ix7 h ALA 206 Cb 1.12 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.73 3ix7 h ALA 206 CO -0.10 0.03 0.06 0.00 0.00 0.00 0.00 179.25 179.24 3ix7 s ALA 207 N -5.18 -1.32 0.05 0.00 0.00 -0.80 -4.95 121.76 109.56 3ix7 s ALA 207 Ca -0.06 0.45 -0.32 0.00 0.00 0.00 0.00 51.96 52.03 3ix7 s ALA 207 Cb 0.17 0.57 -0.11 0.00 0.00 0.00 0.00 23.12 23.75 3ix7 s ALA 207 CO 0.69 -0.60 1.85 -2.30 0.00 0.00 0.00 175.76 175.40 3ix7 n PRO 208 N 0.09 2.56 -5.18 0.00 -0.02 -1.26 -4.17 135.00 127.01 3ix7 n PRO 208 Ca -0.17 0.93 -0.30 0.00 -2.02 0.00 0.00 63.50 61.94 3ix7 n PRO 208 Cb 0.62 -2.81 -0.16 0.00 -0.02 0.00 0.00 33.50 31.13 3ix7 n PRO 208 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3ix7 s LEU 209 N 3.28 2.04 -0.01 2.45 0.20 -1.26 -2.39 118.68 122.99 3ix7 s LEU 209 Ca 0.86 -0.46 0.01 0.00 0.69 0.00 0.00 54.13 55.23 3ix7 s LEU 209 Cb -0.56 -1.27 0.01 0.00 -0.43 0.00 0.00 46.19 43.94 3ix7 s LEU 209 CO 0.43 0.25 -0.02 -0.70 -0.29 0.00 0.00 176.35 176.02 3ix7 s GLU 210 N -0.25 0.20 0.00 1.98 2.12 -0.42 -5.00 118.70 117.32 3ix7 s GLU 210 Ca 0.00 -0.04 -0.28 0.00 0.36 0.00 0.00 54.97 55.02 3ix7 s GLU 210 Cb -0.12 -0.24 -0.04 0.00 0.26 0.00 0.00 34.13 33.99 3ix7 s GLU 210 CO 0.02 0.00 0.89 0.08 -0.54 0.00 0.00 175.26 175.71 3ix7 s VAL 211 N 0.21 4.85 -0.42 3.70 1.01 -1.26 -2.19 120.40 126.30 3ix7 s VAL 211 Ca -0.02 1.86 -0.22 0.00 0.00 0.00 0.00 61.98 63.60 3ix7 s VAL 211 Cb -0.04 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 32.13 3ix7 s VAL 211 CO -0.01 0.22 0.73 -0.76 0.00 0.00 0.00 175.10 175.29 3ix7 s LEU 212 N 0.72 4.29 0.16 3.92 1.43 0.22 -4.89 118.68 124.53 3ix7 s LEU 212 Ca 0.46 -0.06 0.12 0.00 -1.03 0.00 0.00 54.13 53.62 3ix7 s LEU 212 Cb -0.20 -2.90 -0.10 0.00 0.03 0.00 0.00 46.19 43.02 3ix7 s LEU 212 CO 0.25 -0.82 1.24 -0.33 0.23 0.00 0.00 176.35 176.92 3ix7 h GLU 213 N 8.82 0.00 -5.13 1.70 3.07 -1.95 0.61 114.58 121.71 3ix7 h GLU 213 Ca -0.25 0.00 -0.68 0.00 -0.50 0.00 0.00 59.36 57.93 3ix7 h GLU 213 Cb 1.09 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 28.83 3ix7 h GLU 213 CO 0.92 0.69 0.87 0.95 -1.40 0.00 0.00 179.01 181.04 3ix7 s THR 214 N -2.82 4.65 -0.21 1.13 -4.23 -1.26 -4.85 115.64 108.05 3ix7 s THR 214 Ca 0.01 -1.46 -0.01 0.00 -1.18 0.00 0.00 61.69 59.05 3ix7 s THR 214 Cb 0.09 -4.80 0.06 0.00 1.34 0.00 0.00 72.50 69.19 3ix7 s THR 214 CO 0.79 -1.54 -0.01 0.42 -0.54 0.00 0.00 174.62 173.74 3ix7 s THR 215 N 2.92 1.04 -0.21 3.99 -4.23 -1.26 -5.03 115.64 112.86 3ix7 s THR 215 Ca 0.33 -0.88 -0.01 0.00 -1.18 0.00 0.00 61.69 59.95 3ix7 s THR 215 Cb -0.05 -1.41 -0.13 0.00 1.34 0.00 0.00 72.50 72.25 3ix7 s THR 215 CO -0.09 -0.14 -0.20 -0.81 -0.54 0.00 0.00 174.62 172.84 3ix7 n PRO 216 N 4.86 0.51 -3.29 3.99 -0.04 -1.26 -5.01 135.00 134.75 3ix7 n PRO 216 Ca -0.11 0.13 -0.38 0.00 -0.04 0.00 0.00 63.50 63.11 3ix7 n PRO 216 Cb 0.46 -1.39 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 3ix7 n PRO 216 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3ix7 s LYS 217 N -2.41 4.25 0.00 0.54 3.01 -1.26 -4.97 119.74 118.90 3ix7 s LYS 217 Ca -0.28 0.58 0.00 0.00 -1.01 0.00 0.00 55.97 55.26 3ix7 s LYS 217 Cb 0.08 -3.35 0.00 0.00 -1.01 0.00 0.00 37.83 33.55 3ix7 s LYS 217 CO 0.46 0.36 0.00 0.41 0.51 0.00 0.00 175.35 177.09 3ix7 n GLY 218 N 2.59 2.48 0.27 -3.33 0.00 -1.26 -4.31 105.19 101.63 3ix7 n GLY 218 Ca -0.08 -1.74 -0.25 0.00 0.00 0.00 0.00 46.02 43.95 3ix7 n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ix7 n GLU 219 N 1.28 0.49 -1.82 1.61 4.71 -1.26 -4.77 120.64 120.88 3ix7 n GLU 219 Ca 0.00 0.21 -0.31 0.00 -0.01 0.00 0.00 57.16 57.06 3ix7 n GLU 219 Cb 0.00 -1.33 0.03 0.00 -1.01 0.00 0.00 31.44 29.13 3ix7 n GLU 219 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 3ix7 s SER 220 N -7.04 5.79 0.15 1.62 1.04 -1.26 -4.96 113.70 109.03 3ix7 s SER 220 Ca -0.32 1.34 -0.17 0.00 0.48 0.00 0.00 55.95 57.28 3ix7 s SER 220 Cb 0.12 -2.27 0.02 0.00 0.10 0.00 0.00 66.02 63.99 3ix7 s SER 220 CO 0.41 -1.15 1.76 0.58 0.98 0.00 0.00 173.24 175.82 3ix7 h VAL 221 N -0.52 0.94 -0.78 5.02 2.07 -2.00 -2.46 116.25 118.51 3ix7 h VAL 221 Ca -0.44 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 66.99 3ix7 h VAL 221 Cb 1.22 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 3ix7 h VAL 221 CO 0.62 0.05 0.50 0.44 0.02 0.00 0.00 177.57 179.20 3ix7 h ASP 222 N 0.27 0.92 -0.34 0.57 3.32 -2.00 -2.20 116.42 116.96 3ix7 h ASP 222 Ca 0.14 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 3ix7 h ASP 222 Cb 0.09 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3ix7 h ASP 222 CO -0.13 0.68 0.01 -0.08 -1.72 0.00 0.00 179.24 178.00 3ix7 h GLU 223 N 1.06 0.69 -0.24 3.56 4.81 -1.92 -2.65 114.58 119.90 3ix7 h GLU 223 Ca 0.28 -0.17 -0.20 0.00 -0.13 0.00 0.00 59.36 59.15 3ix7 h GLU 223 Cb -0.09 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.20 3ix7 h GLU 223 CO -0.06 0.70 -0.63 0.87 -0.73 0.00 0.00 179.01 179.17 3ix7 h LYS 224 N 0.66 0.84 -0.81 1.92 1.57 -1.04 -3.01 116.57 116.69 3ix7 h LYS 224 Ca 0.13 -0.58 0.03 0.00 -1.87 0.00 0.00 60.65 58.36 3ix7 h LYS 224 Cb 0.40 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.75 3ix7 h LYS 224 CO 0.01 1.21 0.52 -0.07 -0.57 0.00 0.00 179.45 180.56 3ix7 h LEU 225 N 0.62 0.88 0.27 2.94 3.38 -1.28 -1.91 115.31 120.20 3ix7 h LEU 225 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3ix7 h LEU 225 Cb 1.24 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.79 3ix7 h LEU 225 CO 0.13 0.61 -0.13 -0.07 0.09 0.00 0.00 178.44 179.08 3ix7 h LEU 226 N 1.03 -0.30 -1.09 1.67 3.38 -1.42 -0.28 115.31 118.30 3ix7 h LEU 226 Ca 0.32 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 3ix7 h LEU 226 Cb -0.02 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3ix7 h LEU 226 CO -0.10 -0.06 -0.18 -0.26 0.09 0.00 0.00 178.44 177.93 3ix7 h PHE 227 N -0.55 0.47 -0.37 1.13 0.04 -1.55 -1.79 116.94 114.34 3ix7 h PHE 227 Ca -0.04 -0.08 0.07 0.00 2.80 0.00 0.00 57.97 60.72 3ix7 h PHE 227 Cb 0.40 -0.12 -0.07 0.00 2.20 0.00 0.00 35.95 38.36 3ix7 h PHE 227 CO -0.01 0.59 -0.06 1.25 -0.60 0.00 0.00 178.31 179.49 3ix7 h LEU 228 N 0.40 -0.27 -0.83 1.54 5.85 -1.21 0.84 115.31 121.63 3ix7 h LEU 228 Ca 0.07 0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 3ix7 h LEU 228 Cb 0.54 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3ix7 h LEU 228 CO 0.04 -0.09 -0.03 0.00 -0.34 0.00 0.00 178.44 178.02 3ix7 h ALA 229 N 1.35 1.02 -0.47 1.25 0.00 -0.24 -2.51 119.26 119.65 3ix7 h ALA 229 Ca 0.18 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 3ix7 h ALA 229 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3ix7 h ALA 229 CO -0.35 0.60 -0.19 0.00 0.00 0.00 0.00 179.25 179.31 3ix7 h ARG 230 N 0.79 0.97 -0.53 0.00 3.08 -1.11 -0.36 114.38 117.22 3ix7 h ARG 230 Ca 0.15 -0.41 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 3ix7 h ARG 230 Cb 0.51 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 3ix7 h ARG 230 CO 0.03 1.08 0.28 -0.44 -1.07 0.00 0.00 179.97 179.84 3ix7 h ASP 231 N 0.82 0.66 0.16 7.04 5.19 -0.67 -2.85 116.42 126.77 3ix7 h ASP 231 Ca 0.11 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3ix7 h ASP 231 Cb 0.76 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.11 3ix7 h ASP 231 CO 0.06 0.57 -0.19 0.18 -3.12 0.00 0.00 179.24 176.74 3ix7 n LEU 232 N -4.62 1.20 -3.86 1.55 4.77 -0.96 -4.95 117.00 110.13 3ix7 n LEU 232 Ca 0.03 -0.35 -0.26 0.00 -0.03 0.00 0.00 56.01 55.40 3ix7 n LEU 232 Cb 0.09 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3ix7 n LEU 232 CO 0.37 0.22 -0.17 -0.62 -1.33 0.00 0.00 177.39 175.85 3ix7 n GLU 233 N -0.39 -3.10 -4.39 3.23 -0.58 -0.76 -4.40 120.64 110.26 3ix7 n GLU 233 Ca 0.14 0.45 -0.24 0.00 -0.42 0.00 0.00 57.16 57.09 3ix7 n GLU 233 Cb 0.36 -4.53 -0.11 0.00 -0.57 0.00 0.00 31.44 26.59 3ix7 n GLU 233 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3ix7 s ALA 234 N -3.81 2.33 0.32 0.62 0.00 -0.22 -1.34 121.76 119.67 3ix7 s ALA 234 Ca 0.10 -1.62 -0.14 0.00 0.00 0.00 0.00 51.96 50.29 3ix7 s ALA 234 Cb -0.04 -0.24 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 3ix7 s ALA 234 CO 0.87 0.30 0.73 0.00 0.00 0.00 0.00 175.76 177.66 3ix7 s ALA 235 N -2.05 3.33 0.45 0.00 0.00 -0.45 -4.52 121.76 118.52 3ix7 s ALA 235 Ca 0.20 0.01 -0.22 0.00 0.00 0.00 0.00 51.96 51.96 3ix7 s ALA 235 Cb -0.06 -2.75 -0.09 0.00 0.00 0.00 0.00 23.12 20.22 3ix7 s ALA 235 CO 0.09 0.32 1.02 -0.51 0.00 0.00 0.00 175.76 176.69 3ix7 s LEU 236 N -3.03 3.96 -0.18 0.00 1.43 -0.78 -0.03 118.68 120.05 3ix7 s LEU 236 Ca 0.54 1.92 -0.00 0.00 -1.03 0.00 0.00 54.13 55.56 3ix7 s LEU 236 Cb -0.10 -4.43 0.05 0.00 0.03 0.00 0.00 46.19 41.73 3ix7 s LEU 236 CO 0.18 -0.61 -0.05 -0.69 0.23 0.00 0.00 176.35 175.41 3ix7 s VAL 237 N -1.90 1.19 -0.13 -1.59 1.01 0.41 0.73 120.40 120.12 3ix7 s VAL 237 Ca 0.63 -0.75 -0.28 0.00 0.00 0.00 0.00 61.98 61.58 3ix7 s VAL 237 Cb -0.17 -1.39 0.07 0.00 0.00 0.00 0.00 36.38 34.89 3ix7 s VAL 237 CO 0.21 0.08 0.69 0.28 0.00 0.00 0.00 175.10 176.36 3ix7 s THR 238 N 1.59 0.00 -2.00 3.92 -1.32 0.24 -2.35 115.64 115.72 3ix7 s THR 238 Ca -0.01 -0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.72 3ix7 s THR 238 Cb -0.16 -0.99 0.22 0.00 -1.51 0.00 0.00 72.50 70.05 3ix7 s THR 238 CO -0.08 -0.00 1.43 0.59 -2.21 0.00 0.00 174.62 174.35 3ix7 n ASN 239 N 1.59 1.49 -4.62 8.08 3.02 -1.26 -3.94 115.26 119.63 3ix7 n ASN 239 Ca -0.17 -1.21 -0.43 0.00 -0.03 0.00 0.00 54.58 52.74 3ix7 n ASN 239 Cb 0.56 0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.92 3ix7 n ASN 239 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ix7 s ASP 240 N -2.41 6.35 0.24 6.41 -1.08 -1.26 -4.92 116.67 120.00 3ix7 s ASP 240 Ca 0.24 1.38 -0.05 0.00 -0.52 0.00 0.00 52.55 53.60 3ix7 s ASP 240 Cb 0.19 -2.53 0.41 0.00 -1.46 0.00 0.00 42.92 39.53 3ix7 s ASP 240 CO 0.50 -1.32 1.73 0.45 0.52 0.00 0.00 175.17 177.05 3ix7 h HIS 241 N 10.79 0.49 -0.46 -5.34 3.86 -2.00 -0.27 115.15 122.22 3ix7 h HIS 241 Ca -0.31 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 58.81 3ix7 h HIS 241 Cb 1.14 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.49 3ix7 h HIS 241 CO 0.92 0.07 -0.19 0.00 0.86 0.00 0.00 177.93 179.60 3ix7 h ALA 242 N 1.52 0.64 -0.46 2.45 0.00 -2.00 -2.51 119.26 118.90 3ix7 h ALA 242 Ca 0.39 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3ix7 h ALA 242 Cb 0.56 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3ix7 h ALA 242 CO -0.38 0.61 0.10 1.25 0.00 0.00 0.00 179.25 180.83 3ix7 h LEU 243 N 0.78 0.70 -1.04 0.00 5.85 -1.86 -2.69 115.31 117.06 3ix7 h LEU 243 Ca 0.11 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.68 3ix7 h LEU 243 Cb 0.76 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.53 3ix7 h LEU 243 CO 0.06 0.76 0.63 -0.07 -0.34 0.00 0.00 178.44 179.48 3ix7 h LEU 244 N 0.61 0.96 -1.36 2.25 3.38 -1.01 -1.10 115.31 119.04 3ix7 h LEU 244 Ca 0.14 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3ix7 h LEU 244 Cb 0.34 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3ix7 h LEU 244 CO 0.00 0.57 0.00 1.67 0.09 0.00 0.00 178.44 180.77 3ix7 n GLN 245 N -4.55 0.24 0.00 1.13 7.27 -0.95 -2.00 117.38 118.52 3ix7 n GLN 245 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.24 3ix7 n GLN 245 Cb 0.27 -1.21 0.00 0.00 2.41 0.00 0.00 30.24 31.71 3ix7 n GLN 245 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3ix7 n ALA 247 N 0.56 0.00 -0.21 1.69 0.00 -0.42 -2.07 120.51 120.07 3ix7 n ALA 247 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 3ix7 n ALA 247 Cb 0.08 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.59 3ix7 n ALA 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ix7 h ARG 248 N 0.00 0.66 -0.27 0.00 3.08 -1.61 0.31 114.38 116.54 3ix7 h ARG 248 Ca 0.00 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3ix7 h ARG 248 Cb 0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3ix7 h ARG 248 CO 0.00 0.44 0.05 0.82 -1.07 0.00 0.00 179.97 180.21 3ix7 h ILE 249 N 0.68 1.23 0.00 2.04 2.04 -1.71 -2.48 117.51 119.30 3ix7 h ILE 249 Ca 0.25 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.35 3ix7 h ILE 249 Cb 0.07 1.20 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 3ix7 h ILE 249 CO -0.13 0.25 0.00 1.88 0.00 0.00 0.00 178.15 180.15 3ix7 h TYR 250 N 0.27 0.00 -3.52 1.37 0.05 -1.81 -3.47 116.97 109.86 3ix7 h TYR 250 Ca 0.08 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.63 3ix7 h TYR 250 Cb 0.32 0.00 0.07 0.00 1.01 0.00 0.00 36.73 38.13 3ix7 h TYR 250 CO 0.02 0.00 -0.38 0.41 -1.05 0.00 0.00 178.16 177.16 3ix7 n GLY 251 N -0.36 0.06 3.66 3.88 0.00 0.86 -5.04 105.19 108.25 3ix7 n GLY 251 Ca -0.00 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 3ix7 n GLY 251 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ix7 s VAL 252 N -3.11 5.31 0.27 1.61 1.01 0.05 -5.03 120.40 120.51 3ix7 s VAL 252 Ca 0.29 0.32 -0.31 0.00 0.00 0.00 0.00 61.98 62.28 3ix7 s VAL 252 Cb -0.13 -3.56 -0.12 0.00 0.00 0.00 0.00 36.38 32.57 3ix7 s VAL 252 CO 0.36 0.32 1.59 1.17 0.00 0.00 0.00 175.10 178.54 3ix7 n LYS 253 N 4.38 2.60 -3.78 2.72 3.00 -1.26 -4.40 118.16 121.41 3ix7 n LYS 253 Ca -0.13 0.93 -0.15 0.00 -0.00 0.00 0.00 58.31 58.96 3ix7 n LYS 253 Cb 0.52 -2.70 -0.16 0.00 0.00 0.00 0.00 35.03 32.69 3ix7 n LYS 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3ix7 s ALA 254 N 0.23 0.08 -0.17 3.14 0.00 -1.26 -1.86 121.76 121.91 3ix7 s ALA 254 Ca 0.67 0.29 -0.07 0.00 0.00 0.00 0.00 51.96 52.85 3ix7 s ALA 254 Cb -0.53 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 3ix7 s ALA 254 CO 0.45 -0.10 0.07 -0.51 0.00 0.00 0.00 175.76 175.67 3ix7 s LEU 255 N 1.02 3.88 -0.22 0.00 1.43 0.22 -4.93 118.68 120.09 3ix7 s LEU 255 Ca -0.09 0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.11 3ix7 s LEU 255 Cb -0.12 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 3ix7 s LEU 255 CO -0.03 0.21 -0.04 -0.55 0.23 0.00 0.00 176.35 176.17 3ix7 s SER 256 N 0.16 4.33 0.13 2.29 0.15 -1.25 -0.59 113.70 118.92 3ix7 s SER 256 Ca 0.05 -0.38 -0.17 0.00 0.70 0.00 0.00 55.95 56.15 3ix7 s SER 256 Cb -0.12 -1.74 -0.03 0.00 -1.71 0.00 0.00 66.02 62.42 3ix7 s SER 256 CO 0.00 -0.01 1.73 0.40 1.20 0.00 0.00 173.24 176.56 3ix7 h ILE 257 N 5.68 1.14 -0.66 6.45 1.08 -1.97 -0.61 117.51 128.62 3ix7 h ILE 257 Ca -0.41 -0.37 0.06 0.00 -0.39 0.00 0.00 64.86 63.75 3ix7 h ILE 257 Cb 1.16 0.79 -0.06 0.00 -3.07 0.00 0.00 36.82 35.64 3ix7 h ILE 257 CO 0.60 0.14 0.36 1.56 -0.69 0.00 0.00 178.15 180.13 3ix7 h GLN 258 N 0.41 0.65 -0.63 2.37 1.08 -1.94 0.23 115.11 117.27 3ix7 h GLN 258 Ca 0.11 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.20 3ix7 h GLN 258 Cb 0.07 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 3ix7 h GLN 258 CO -0.02 0.43 0.07 0.00 -0.95 0.00 0.00 178.83 178.36 3ix7 h ALA 259 N 1.35 0.95 -0.03 3.87 0.00 -1.90 0.23 119.26 123.73 3ix7 h ALA 259 Ca 0.30 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3ix7 h ALA 259 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3ix7 h ALA 259 CO -0.19 0.65 -0.09 1.25 0.00 0.00 0.00 179.25 180.87 3ix7 h LEU 260 N 0.97 -0.28 -0.44 0.00 5.85 -0.69 -2.39 115.31 118.34 3ix7 h LEU 260 Ca 0.19 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.00 3ix7 h LEU 260 Cb 0.46 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 3ix7 h LEU 260 CO 0.02 -0.14 0.20 0.00 -0.34 0.00 0.00 178.44 178.18 3ix7 h ALA 261 N 0.85 0.54 -0.91 1.25 0.00 0.31 -2.31 119.26 118.99 3ix7 h ALA 261 Ca 0.05 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.05 3ix7 h ALA 261 Cb 0.21 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3ix7 h ALA 261 CO -0.12 -0.17 0.57 0.37 0.00 0.00 0.00 179.25 179.91 3ix7 h GLN 262 N 0.40 1.01 0.00 0.00 5.75 -0.48 -2.06 115.11 119.74 3ix7 h GLN 262 Ca 0.19 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 3ix7 h GLN 262 Cb 0.13 -0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.45 3ix7 h GLN 262 CO -0.15 0.67 -0.13 0.00 -2.65 0.00 0.00 178.83 176.56 3ix7 h ALA 263 N 1.42 1.50 -0.40 3.38 0.00 -0.88 -2.91 119.26 121.36 3ix7 h ALA 263 Ca 0.40 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3ix7 h ALA 263 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3ix7 h ALA 263 CO -0.18 0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.52 3ix7 n LEU 264 N -3.97 3.14 -4.75 0.00 4.32 -0.81 -5.01 117.00 109.92 3ix7 n LEU 264 Ca -0.02 -1.79 -0.38 0.00 -0.02 0.00 0.00 56.01 53.79 3ix7 n LEU 264 Cb 0.22 -0.27 0.04 0.00 -1.62 0.00 0.00 43.42 41.80 3ix7 n LEU 264 CO 0.33 0.75 0.96 -0.13 -1.22 0.00 0.00 177.39 178.08 3ix7 s ARG 265 N -1.07 3.12 0.00 3.23 3.00 -1.00 -5.08 118.95 121.15 3ix7 s ARG 265 Ca 0.31 2.17 0.30 0.00 0.00 0.00 0.00 55.73 58.50 3ix7 s ARG 265 Cb 0.17 -2.21 1.37 0.00 0.00 0.00 0.00 34.95 34.28 3ix7 s ARG 265 CO 0.22 -1.19 1.93 -2.30 0.00 0.00 0.00 175.30 173.96