#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ia6 h SER 208 N 0.00 0.77 -0.60 1.62 0.02 -2.02 -2.35 113.55 110.99 3ia6 h SER 208 Ca 0.00 -0.09 0.06 0.00 -0.84 0.00 0.00 61.79 60.91 3ia6 h SER 208 Cb 0.00 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.29 3ia6 h SER 208 CO 0.00 0.69 0.32 0.00 -1.14 0.00 0.00 176.83 176.70 3ia6 h ALA 209 N 1.43 0.80 -0.29 3.77 0.00 -2.05 0.31 119.26 123.23 3ia6 h ALA 209 Ca 0.20 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 3ia6 h ALA 209 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ia6 h ALA 209 CO -0.02 -0.02 -0.41 -0.44 0.00 0.00 0.00 179.25 178.36 3ia6 h ASP 210 N 0.59 0.74 -0.24 0.00 5.19 -1.92 -1.07 116.42 119.71 3ia6 h ASP 210 Ca 0.27 -0.34 -0.03 0.00 -0.62 0.00 0.00 57.03 56.31 3ia6 h ASP 210 Cb 0.18 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.48 3ia6 h ASP 210 CO -0.18 1.06 0.03 -0.07 -3.12 0.00 0.00 179.24 176.95 3ia6 h LEU 211 N 0.57 0.40 -1.36 1.55 3.38 -1.07 -0.38 115.31 118.39 3ia6 h LEU 211 Ca 0.05 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 3ia6 h LEU 211 Cb 0.95 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3ia6 h LEU 211 CO 0.09 0.58 -0.32 0.03 0.09 0.00 0.00 178.44 178.91 3ia6 h ARG 212 N 0.21 0.00 -0.18 1.13 3.08 -0.92 -0.58 114.38 117.11 3ia6 h ARG 212 Ca 0.07 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3ia6 h ARG 212 Cb 0.36 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 3ia6 h ARG 212 CO 0.01 0.32 -0.03 0.00 -1.07 0.00 0.00 179.97 179.20 3ia6 h ALA 213 N 1.68 0.25 -0.94 0.04 0.00 -0.97 -1.96 119.26 117.36 3ia6 h ALA 213 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3ia6 h ALA 213 Cb 0.56 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 3ia6 h ALA 213 CO 0.04 0.01 0.60 1.25 0.00 0.00 0.00 179.25 181.15 3ia6 h LEU 214 N 0.07 1.10 -0.20 0.00 5.85 -0.80 -1.83 115.31 119.50 3ia6 h LEU 214 Ca 0.05 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3ia6 h LEU 214 Cb 0.46 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3ia6 h LEU 214 CO 0.02 0.82 0.06 0.00 -0.34 0.00 0.00 178.44 179.00 3ia6 h ALA 215 N 1.33 0.26 -0.41 1.25 0.00 -1.04 -1.54 119.26 119.11 3ia6 h ALA 215 Ca 0.34 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 3ia6 h ALA 215 Cb -0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3ia6 h ALA 215 CO -0.07 -0.12 -0.14 -0.22 0.00 0.00 0.00 179.25 178.69 3ia6 h LYS 216 N 0.15 0.76 -0.21 0.00 3.64 -1.28 -1.51 116.57 118.12 3ia6 h LYS 216 Ca 0.06 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 3ia6 h LYS 216 Cb 0.22 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 3ia6 h LYS 216 CO -0.00 0.86 0.13 1.25 -2.27 0.00 0.00 179.45 179.42 3ia6 h HIS 217 N 0.68 0.26 -0.78 1.91 2.76 -1.23 -0.68 115.15 118.07 3ia6 h HIS 217 Ca 0.11 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.24 3ia6 h HIS 217 Cb 0.62 -0.09 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 3ia6 h HIS 217 CO 0.03 0.19 0.30 -0.07 -1.30 0.00 0.00 177.93 177.08 3ia6 h LEU 218 N 0.26 1.08 0.12 0.26 3.38 -1.12 -1.41 115.31 117.88 3ia6 h LEU 218 Ca 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3ia6 h LEU 218 Cb -0.01 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3ia6 h LEU 218 CO -0.02 0.97 -0.08 0.22 0.09 0.00 0.00 178.44 179.62 3ia6 h TYR 219 N 1.13 -0.21 -0.73 1.13 3.20 -1.09 0.15 116.97 120.55 3ia6 h TYR 219 Ca 0.26 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.21 3ia6 h TYR 219 Cb 0.23 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.51 3ia6 h TYR 219 CO 0.02 -0.13 0.39 -0.44 -1.64 0.00 0.00 178.16 176.36 3ia6 h ASP 220 N -0.20 0.53 -0.19 -2.11 3.32 -0.91 -0.68 116.42 116.18 3ia6 h ASP 220 Ca -0.01 0.05 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 3ia6 h ASP 220 Cb 0.18 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 3ia6 h ASP 220 CO -0.00 0.31 -0.37 0.28 -1.72 0.00 0.00 179.24 177.74 3ia6 h SER 221 N 0.67 0.76 -0.52 6.45 0.02 -1.03 -2.57 113.55 117.32 3ia6 h SER 221 Ca 0.35 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3ia6 h SER 221 Cb 0.33 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 3ia6 h SER 221 CO -0.25 1.05 0.34 0.22 -1.14 0.00 0.00 176.83 177.05 3ia6 h TYR 222 N 0.59 0.65 -0.82 3.45 5.03 -0.50 -0.82 116.97 124.56 3ia6 h TYR 222 Ca 0.05 0.01 0.05 0.00 2.58 0.00 0.00 58.73 61.43 3ia6 h TYR 222 Cb 0.91 -0.22 -0.05 0.00 1.55 0.00 0.00 36.73 38.91 3ia6 h TYR 222 CO 0.05 0.41 0.51 0.82 -1.32 0.00 0.00 178.16 178.63 3ia6 h ILE 223 N 0.70 1.08 0.00 1.81 1.08 -1.01 -1.54 117.51 119.63 3ia6 h ILE 223 Ca 0.19 -0.33 -0.10 0.00 -0.39 0.00 0.00 64.86 64.23 3ia6 h ILE 223 Cb -0.08 0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 33.69 3ia6 h ILE 223 CO -0.04 0.18 -0.45 0.50 -0.69 0.00 0.00 178.15 177.64 3ia6 h LYS 224 N 0.96 0.00 0.00 2.37 3.64 -1.09 -3.33 116.57 119.12 3ia6 h LYS 224 Ca 0.34 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.40 3ia6 h LYS 224 Cb 0.09 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.86 3ia6 h LYS 224 CO -0.14 0.45 -2.07 0.43 -2.27 0.00 0.00 179.45 175.85 3ia6 n SER 225 N -3.57 0.38 -4.18 4.20 7.64 -0.35 -4.85 113.62 112.90 3ia6 n SER 225 Ca -0.00 0.18 -0.35 0.00 1.01 0.00 0.00 58.87 59.71 3ia6 n SER 225 Cb 0.56 0.57 -0.14 0.00 -1.01 0.00 0.00 64.21 64.19 3ia6 n SER 225 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3ia6 s PHE 226 N -2.57 3.25 0.09 1.43 0.08 -0.61 -4.80 117.98 114.85 3ia6 s PHE 226 Ca -0.08 -1.84 -0.35 0.00 0.12 0.00 0.00 56.93 54.78 3ia6 s PHE 226 Cb 0.07 -2.10 -0.16 0.00 -0.57 0.00 0.00 43.02 40.25 3ia6 s PHE 226 CO 0.83 -0.80 1.56 -1.35 -0.10 0.00 0.00 175.22 175.37 3ia6 h PRO 227 N 8.00 -0.90 -4.70 0.24 0.11 -1.88 -3.37 132.00 129.49 3ia6 h PRO 227 Ca -0.22 0.06 -0.70 0.00 0.11 0.00 0.00 66.00 65.25 3ia6 h PRO 227 Cb 1.06 0.21 -0.20 0.00 0.11 0.00 0.00 31.00 32.18 3ia6 h PRO 227 CO 0.53 -0.60 0.17 -1.17 -0.21 0.00 0.00 178.00 176.72 3ia6 s LEU 228 N -10.15 5.39 0.76 2.35 2.96 -1.26 -5.03 118.68 113.70 3ia6 s LEU 228 Ca -0.18 -1.50 -0.11 0.00 -0.22 0.00 0.00 54.13 52.12 3ia6 s LEU 228 Cb 0.05 -2.31 0.05 0.00 0.50 0.00 0.00 46.19 44.49 3ia6 s LEU 228 CO 0.61 -1.11 1.13 0.42 -1.32 0.00 0.00 176.35 176.09 3ia6 s THR 229 N 2.64 2.57 0.14 3.68 -4.23 -1.26 -4.88 115.64 114.30 3ia6 s THR 229 Ca 0.13 0.15 -0.14 0.00 -1.18 0.00 0.00 61.69 60.65 3ia6 s THR 229 Cb -0.22 -3.17 0.02 0.00 1.34 0.00 0.00 72.50 70.46 3ia6 s THR 229 CO 0.05 -0.23 1.65 0.50 -0.54 0.00 0.00 174.62 176.05 3ia6 h LYS 230 N -0.87 0.75 -0.33 3.99 3.64 -1.95 -0.18 116.57 121.62 3ia6 h LYS 230 Ca -0.46 -0.18 0.07 0.00 -1.27 0.00 0.00 60.65 58.82 3ia6 h LYS 230 Cb 1.30 -0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.95 3ia6 h LYS 230 CO 0.65 0.74 -0.14 0.00 -2.27 0.00 0.00 179.45 178.42 3ia6 h ALA 231 N 0.98 0.13 -0.34 5.00 0.00 -1.94 0.35 119.26 123.44 3ia6 h ALA 231 Ca 0.15 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 3ia6 h ALA 231 Cb 0.32 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3ia6 h ALA 231 CO 0.00 -0.53 -0.15 0.87 0.00 0.00 0.00 179.25 179.44 3ia6 h LYS 232 N -0.09 0.61 -0.02 0.00 1.57 -1.91 -2.63 116.57 114.10 3ia6 h LYS 232 Ca 0.17 -0.20 -0.22 0.00 -1.87 0.00 0.00 60.65 58.53 3ia6 h LYS 232 Cb 0.34 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3ia6 h LYS 232 CO -0.39 0.74 -0.90 0.00 -0.57 0.00 0.00 179.45 178.33 3ia6 h ALA 233 N 1.28 0.40 -0.59 3.86 0.00 -0.42 -2.75 119.26 121.04 3ia6 h ALA 233 Ca 0.09 -0.68 -0.09 0.00 0.00 0.00 0.00 54.91 54.22 3ia6 h ALA 233 Cb 0.58 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3ia6 h ALA 233 CO 0.04 0.80 -0.00 0.00 0.00 0.00 0.00 179.25 180.08 3ia6 h ARG 234 N 0.26 1.03 -0.14 0.00 2.47 -0.27 -1.16 114.38 116.56 3ia6 h ARG 234 Ca -0.07 -0.32 0.01 0.00 -1.26 0.00 0.00 59.98 58.34 3ia6 h ARG 234 Cb 1.52 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.73 3ia6 h ARG 234 CO 0.16 1.01 0.05 0.00 0.56 0.00 0.00 179.97 181.75 3ia6 h ALA 235 N 1.04 0.15 -0.86 0.04 0.00 -1.49 -0.07 119.26 118.07 3ia6 h ALA 235 Ca 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3ia6 h ALA 235 Cb 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3ia6 h ALA 235 CO 0.03 -0.40 0.53 0.82 0.00 0.00 0.00 179.25 180.23 3ia6 h ILE 236 N 0.12 1.23 0.02 0.00 2.04 -1.38 -2.35 117.51 117.20 3ia6 h ILE 236 Ca 0.06 -0.50 -0.09 0.00 1.00 0.00 0.00 64.86 65.33 3ia6 h ILE 236 Cb 0.03 0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.14 3ia6 h ILE 236 CO -0.06 0.24 -0.36 -0.07 0.00 0.00 0.00 178.15 177.90 3ia6 h LEU 237 N 1.18 0.28 -5.79 1.44 3.38 -0.93 -3.45 115.31 111.42 3ia6 h LEU 237 Ca 0.31 -0.83 0.01 0.00 0.09 0.00 0.00 57.88 57.46 3ia6 h LEU 237 Cb -0.06 -0.09 -0.19 0.00 0.09 0.00 0.00 40.66 40.41 3ia6 h LEU 237 CO -0.06 1.08 -0.33 -0.89 0.09 0.00 0.00 178.44 178.33 3ia6 s THR 238 N -2.90 -0.75 0.15 0.22 2.01 -0.06 -5.10 115.64 109.20 3ia6 s THR 238 Ca -0.16 0.00 -0.24 0.00 0.31 0.00 0.00 61.69 61.60 3ia6 s THR 238 Cb 0.01 -0.11 0.06 0.00 0.01 0.00 0.00 72.50 72.48 3ia6 s THR 238 CO 0.76 0.00 0.74 -0.83 -0.69 0.00 0.00 174.62 174.60 3ia6 s GLY 239 N 2.03 -0.41 0.00 4.40 0.00 -0.88 -4.61 107.32 107.84 3ia6 s GLY 239 Ca 0.16 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.25 3ia6 s GLY 239 CO -0.12 0.12 0.00 0.28 0.00 0.00 0.00 173.10 173.38 3ia6 n LYS 240 N -0.38 0.00 -3.07 2.90 5.02 -1.26 -4.42 118.16 116.95 3ia6 n LYS 240 Ca -0.11 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.77 3ia6 n LYS 240 Cb 0.62 -0.98 -0.06 0.00 -0.02 0.00 0.00 35.03 34.59 3ia6 n LYS 240 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3ia6 s THR 241 N -1.45 4.88 -0.18 -0.18 2.01 -1.26 -4.90 115.64 114.56 3ia6 s THR 241 Ca 0.00 0.85 0.18 0.00 0.31 0.00 0.00 61.69 63.03 3ia6 s THR 241 Cb 0.00 -4.06 0.46 0.00 0.01 0.00 0.00 72.50 68.90 3ia6 s THR 241 CO 0.00 -0.23 1.17 0.41 -0.69 0.00 0.00 174.62 175.28 3ia6 n THR 242 N 5.50 1.34 -0.07 -0.82 -1.04 -1.26 -4.82 114.28 113.11 3ia6 n THR 242 Ca 0.00 -2.68 -0.08 0.00 -2.04 0.00 0.00 64.05 59.25 3ia6 n THR 242 Cb 0.49 0.41 -0.06 0.00 -1.82 0.00 0.00 70.33 69.34 3ia6 n THR 242 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 3ia6 h ASP 243 N 1.72 0.00 -2.72 8.00 3.32 -1.96 -3.48 116.42 121.30 3ia6 h ASP 243 Ca -0.04 -0.39 -0.52 0.00 0.02 0.00 0.00 57.03 56.11 3ia6 h ASP 243 Cb 1.46 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.87 3ia6 h ASP 243 CO 0.24 0.83 -0.67 -0.54 -1.72 0.00 0.00 179.24 177.38 3ia6 s LYS 244 N -1.98 1.62 -0.05 3.56 1.02 -1.26 -5.16 119.74 117.48 3ia6 s LYS 244 Ca -0.12 -1.83 -0.02 0.00 0.02 0.00 0.00 55.97 54.02 3ia6 s LYS 244 Cb 0.00 -1.26 0.04 0.00 -0.52 0.00 0.00 37.83 36.08 3ia6 s LYS 244 CO 0.33 0.05 0.09 0.45 -0.92 0.00 0.00 175.35 175.35 3ia6 s SER 245 N -3.48 0.86 0.47 2.83 0.15 -1.26 -5.04 113.70 108.21 3ia6 s SER 245 Ca 0.31 0.17 -0.25 0.00 0.70 0.00 0.00 55.95 56.87 3ia6 s SER 245 Cb 0.04 0.01 -0.08 0.00 -1.71 0.00 0.00 66.02 64.28 3ia6 s SER 245 CO 0.13 -0.23 1.42 -2.16 1.20 0.00 0.00 173.24 173.60 3ia6 s PRO 246 N 2.05 3.59 0.05 5.44 0.04 -1.26 -4.97 135.00 139.94 3ia6 s PRO 246 Ca 0.02 2.41 -0.30 0.00 0.04 0.00 0.00 61.00 63.17 3ia6 s PRO 246 Cb -0.12 -2.60 -0.05 0.00 0.04 0.00 0.00 34.50 31.77 3ia6 s PRO 246 CO -0.04 -0.89 1.19 0.12 0.04 0.00 0.00 177.00 177.42 3ia6 s PHE 247 N -1.21 3.42 -0.17 0.56 5.36 -0.18 -4.78 117.98 120.99 3ia6 s PHE 247 Ca 0.63 1.31 -0.18 0.00 -0.96 0.00 0.00 56.93 57.73 3ia6 s PHE 247 Cb -0.44 -3.41 -0.04 0.00 -0.34 0.00 0.00 43.02 38.80 3ia6 s PHE 247 CO 0.55 -1.23 0.48 0.08 -1.46 0.00 0.00 175.22 173.64 3ia6 s VAL 248 N 1.18 5.16 -0.31 3.12 1.01 -1.26 -0.56 120.40 128.74 3ia6 s VAL 248 Ca 0.58 0.91 -0.06 0.00 0.00 0.00 0.00 61.98 63.41 3ia6 s VAL 248 Cb -0.29 -3.81 0.03 0.00 0.00 0.00 0.00 36.38 32.31 3ia6 s VAL 248 CO 0.28 0.25 0.07 -0.63 0.00 0.00 0.00 175.10 175.08 3ia6 s ILE 249 N 1.16 3.68 0.00 2.22 1.01 0.13 -4.85 121.20 124.55 3ia6 s ILE 249 Ca 0.24 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.88 3ia6 s ILE 249 Cb -0.15 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.31 3ia6 s ILE 249 CO 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 174.94 174.98 3ia6 n TYR 250 N 4.80 0.00 -3.73 3.97 0.18 -1.26 -1.50 117.16 119.62 3ia6 n TYR 250 Ca -0.14 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.56 3ia6 n TYR 250 Cb 0.46 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.42 3ia6 n TYR 250 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 3ia6 n ASP 251 N -1.05 -1.43 -0.22 9.48 3.85 -1.26 -4.36 116.55 121.56 3ia6 n ASP 251 Ca 0.00 -2.29 -0.06 0.00 -0.71 0.00 0.00 54.79 51.73 3ia6 n ASP 251 Cb 0.00 2.47 0.04 0.00 -1.35 0.00 0.00 41.12 42.28 3ia6 n ASP 251 CO 0.00 0.00 0.00 0.24 -1.01 0.00 0.00 177.20 176.43 3ia6 h MET 252 N 0.00 0.86 -0.76 0.11 2.86 -1.98 -2.09 114.93 113.93 3ia6 h MET 252 Ca -0.23 -0.08 -0.05 0.00 -2.06 0.00 0.00 59.70 57.28 3ia6 h MET 252 Cb 0.91 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 3ia6 h MET 252 CO 0.30 0.62 0.29 -0.91 1.06 0.00 0.00 176.91 178.27 3ia6 h ASN 253 N 0.86 1.06 0.35 1.22 -0.26 -1.99 -2.32 115.58 114.50 3ia6 h ASN 253 Ca 0.23 -0.18 -0.11 0.00 -0.56 0.00 0.00 56.30 55.67 3ia6 h ASN 253 Cb -0.02 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 36.95 3ia6 h ASN 253 CO -0.04 0.95 -0.48 0.77 -1.06 0.00 0.00 177.43 177.57 3ia6 h SER 254 N 1.11 0.17 0.44 5.81 4.64 -1.86 -1.26 113.55 122.60 3ia6 h SER 254 Ca 0.25 -0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.47 3ia6 h SER 254 Cb 0.23 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3ia6 h SER 254 CO -0.02 0.63 -0.21 0.25 -0.87 0.00 0.00 176.83 176.61 3ia6 h LEU 255 N 0.13 -0.50 -0.66 5.97 5.85 -1.15 0.33 115.31 125.28 3ia6 h LEU 255 Ca 0.01 -0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.83 3ia6 h LEU 255 Cb 0.90 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.96 3ia6 h LEU 255 CO 0.07 -0.29 0.10 0.24 -0.34 0.00 0.00 178.44 178.22 3ia6 h MET 256 N -0.68 0.20 -0.96 1.25 2.86 -1.37 0.30 114.93 116.54 3ia6 h MET 256 Ca -0.06 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3ia6 h MET 256 Cb 0.50 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.06 3ia6 h MET 256 CO 0.10 0.13 0.62 1.98 1.06 0.00 0.00 176.91 180.81 3ia6 h MET 257 N 0.21 1.28 0.00 1.72 1.85 -1.05 -2.68 114.93 116.26 3ia6 h MET 257 Ca 0.36 -0.09 -0.07 0.00 -0.61 0.00 0.00 59.70 59.29 3ia6 h MET 257 Cb 0.58 -0.28 -0.01 0.00 0.43 0.00 0.00 31.60 32.32 3ia6 h MET 257 CO -0.49 0.86 -0.35 0.78 -0.40 0.00 0.00 176.91 177.31 3ia6 h GLY 258 N 1.31 0.00 2.00 1.39 0.00 0.17 -3.14 103.07 104.80 3ia6 h GLY 258 Ca 0.35 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.56 3ia6 h GLY 258 CO -0.07 0.00 -0.57 -2.09 0.00 0.00 0.00 176.54 173.81 3ia6 h GLU 259 N 0.00 0.00 0.09 4.80 4.81 -0.15 -2.90 114.58 121.23 3ia6 h GLU 259 Ca -0.00 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.04 3ia6 h GLU 259 Cb 1.05 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3ia6 h GLU 259 CO 0.04 0.57 -0.93 -0.44 -0.73 0.00 0.00 179.01 177.52 3ia6 h ASP 260 N 0.00 0.28 0.00 1.04 3.32 -1.50 -3.39 116.42 116.18 3ia6 h ASP 260 Ca -0.01 -0.87 0.00 0.00 0.02 0.00 0.00 57.03 56.18 3ia6 h ASP 260 Cb 1.05 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.50 3ia6 h ASP 260 CO 0.07 1.41 0.00 0.29 -1.72 0.00 0.00 179.24 179.30 3ia6 n LYS 261 N -4.19 0.00 -2.66 3.56 4.76 -1.19 -4.64 118.16 113.81 3ia6 n LYS 261 Ca -0.20 0.45 -0.42 0.00 -2.87 0.00 0.00 58.31 55.27 3ia6 n LYS 261 Cb 0.77 -1.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.72 3ia6 n LYS 261 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ia6 s ILE 262 N -1.87 4.63 -0.17 -0.18 1.01 -1.09 -5.04 121.20 118.48 3ia6 s ILE 262 Ca 0.00 1.94 -0.09 0.00 0.00 0.00 0.00 60.65 62.50 3ia6 s ILE 262 Cb 0.00 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 3ia6 s ILE 262 CO 0.00 0.18 0.12 -0.54 0.00 0.00 0.00 174.94 174.70 3ia6 s LYS 263 N 0.81 3.91 -0.43 2.79 1.02 -1.26 -4.08 119.74 122.50 3ia6 s LYS 263 Ca 0.52 -0.21 -0.25 0.00 0.02 0.00 0.00 55.97 56.06 3ia6 s LYS 263 Cb -0.23 -3.32 0.02 0.00 -0.52 0.00 0.00 37.83 33.78 3ia6 s LYS 263 CO 0.29 0.46 0.89 -0.06 -0.92 0.00 0.00 175.35 176.01 3ia6 s PHE 264 N -0.10 2.98 -0.11 3.18 0.08 -1.26 -5.14 117.98 117.61 3ia6 s PHE 264 Ca 0.10 0.46 -0.05 0.00 0.12 0.00 0.00 56.93 57.56 3ia6 s PHE 264 Cb -0.11 -3.81 -0.21 0.00 -0.57 0.00 0.00 43.02 38.32 3ia6 s PHE 264 CO 0.00 -0.99 3.05 0.36 -0.10 0.00 0.00 175.22 177.55 3ia6 n LYS 265 N 6.95 1.77 0.00 0.44 2.85 -1.26 -5.22 118.16 123.69 3ia6 n LYS 265 Ca 0.06 -0.92 0.00 0.00 -1.05 0.00 0.00 58.31 56.40 3ia6 n LYS 265 Cb 0.48 -1.97 0.00 0.00 -0.65 0.00 0.00 35.03 32.89 3ia6 n LYS 265 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3ia6 n LYS 275 N 2.69 0.00 -2.28 -1.58 5.02 -1.26 -5.14 118.16 115.61 3ia6 n LYS 275 Ca 0.38 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 56.31 3ia6 n LYS 275 Cb 0.72 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.72 3ia6 n LYS 275 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3ia6 s GLU 276 N -5.32 3.57 0.11 1.97 2.12 -1.26 -4.86 118.70 115.04 3ia6 s GLU 276 Ca 0.00 1.67 -0.21 0.00 0.36 0.00 0.00 54.97 56.79 3ia6 s GLU 276 Cb 0.00 -2.20 -0.08 0.00 0.26 0.00 0.00 34.13 32.11 3ia6 s GLU 276 CO 0.00 -0.68 1.72 0.28 -0.54 0.00 0.00 175.26 176.04 3ia6 h VAL 277 N 1.53 0.90 -0.15 3.70 2.07 -1.99 -0.91 116.25 121.39 3ia6 h VAL 277 Ca -0.50 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 3ia6 h VAL 277 Cb 1.25 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 3ia6 h VAL 277 CO 0.59 0.00 0.07 0.00 0.02 0.00 0.00 177.57 178.25 3ia6 h ALA 278 N 1.11 1.84 -0.01 1.67 0.00 -1.93 -1.65 119.26 120.28 3ia6 h ALA 278 Ca 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3ia6 h ALA 278 Cb 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ia6 h ALA 278 CO -0.11 0.14 -0.08 0.82 0.00 0.00 0.00 179.25 180.02 3ia6 h ILE 279 N 0.21 1.52 -0.86 0.00 2.04 -1.85 -2.80 117.51 115.77 3ia6 h ILE 279 Ca 0.05 -1.65 0.12 0.00 1.00 0.00 0.00 64.86 64.39 3ia6 h ILE 279 Cb 0.03 2.58 -0.08 0.00 -0.74 0.00 0.00 36.82 38.61 3ia6 h ILE 279 CO -0.01 0.44 0.48 0.03 0.00 0.00 0.00 178.15 179.10 3ia6 h ARG 280 N -0.56 0.73 -0.01 2.37 3.08 -0.86 -0.91 114.38 118.23 3ia6 h ARG 280 Ca -0.01 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 3ia6 h ARG 280 Cb 0.76 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 3ia6 h ARG 280 CO 0.02 0.48 0.00 0.82 -1.07 0.00 0.00 179.97 180.22 3ia6 h ILE 281 N 0.75 1.14 -0.54 2.04 2.04 -1.39 -1.44 117.51 120.12 3ia6 h ILE 281 Ca 0.44 -0.41 0.11 0.00 1.00 0.00 0.00 64.86 66.00 3ia6 h ILE 281 Cb 0.50 1.41 -0.10 0.00 -0.74 0.00 0.00 36.82 37.89 3ia6 h ILE 281 CO -0.30 0.11 -0.12 0.15 0.00 0.00 0.00 178.15 177.99 3ia6 h PHE 282 N -0.16 -0.26 -0.39 1.37 3.57 -1.14 -1.01 116.94 118.92 3ia6 h PHE 282 Ca 0.00 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 3ia6 h PHE 282 Cb 0.17 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 3ia6 h PHE 282 CO -0.02 -0.22 -0.06 1.96 -2.23 0.00 0.00 178.31 177.74 3ia6 h GLN 283 N 0.01 0.64 -0.49 1.11 4.20 -1.10 -2.10 115.11 117.39 3ia6 h GLN 283 Ca 0.26 -0.18 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3ia6 h GLN 283 Cb 0.40 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 3ia6 h GLN 283 CO -0.54 0.71 0.05 0.78 -0.67 0.00 0.00 178.83 179.15 3ia6 h GLY 284 N 0.94 0.84 1.40 3.46 0.00 -0.47 -1.43 103.07 107.82 3ia6 h GLY 284 Ca 0.12 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 3ia6 h GLY 284 CO 0.02 0.49 -0.08 0.00 0.00 0.00 0.00 176.54 176.98 3ia6 h GLN 286 N 0.66 0.75 -0.26 0.00 4.20 -0.93 0.08 115.11 119.61 3ia6 h GLN 286 Ca 0.12 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3ia6 h GLN 286 Cb 0.52 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 3ia6 h GLN 286 CO 0.03 0.68 0.17 0.35 -0.67 0.00 0.00 178.83 179.38 3ia6 h PHE 287 N 0.66 0.34 -0.47 2.96 3.04 -1.06 -1.47 116.94 120.95 3ia6 h PHE 287 Ca 0.16 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.04 3ia6 h PHE 287 Cb 0.22 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 3ia6 h PHE 287 CO 0.01 0.24 -0.01 0.00 -2.02 0.00 0.00 178.31 176.53 3ia6 h ARG 288 N 0.34 0.77 -0.21 1.11 2.47 -1.22 -2.19 114.38 115.45 3ia6 h ARG 288 Ca 0.10 -0.21 0.03 0.00 -1.26 0.00 0.00 59.98 58.64 3ia6 h ARG 288 Cb -0.01 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.19 3ia6 h ARG 288 CO -0.02 0.79 0.00 1.03 0.56 0.00 0.00 179.97 182.33 3ia6 h SER 289 N 0.72 -0.07 -0.88 7.04 0.87 -0.61 -0.11 113.55 120.51 3ia6 h SER 289 Ca 0.14 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.76 3ia6 h SER 289 Cb 0.45 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.44 3ia6 h SER 289 CO 0.02 -0.01 0.58 0.58 -0.53 0.00 0.00 176.83 177.48 3ia6 h VAL 290 N 0.07 1.20 -0.61 2.23 2.07 -1.04 -0.81 116.25 119.36 3ia6 h VAL 290 Ca 0.10 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 3ia6 h VAL 290 Cb 0.12 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 3ia6 h VAL 290 CO -0.16 0.21 0.02 -0.33 0.02 0.00 0.00 177.57 177.34 3ia6 h GLU 291 N 1.17 1.05 -0.65 1.57 5.08 -0.87 -3.16 114.58 118.77 3ia6 h GLU 291 Ca 0.33 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3ia6 h GLU 291 Cb -0.09 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 3ia6 h GLU 291 CO -0.08 1.02 0.17 0.00 -1.00 0.00 0.00 179.01 179.12 3ia6 h ALA 292 N 0.99 1.07 -0.54 3.43 0.00 -0.27 -2.70 119.26 121.25 3ia6 h ALA 292 Ca 0.17 -0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.94 3ia6 h ALA 292 Cb 0.53 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 3ia6 h ALA 292 CO 0.03 0.62 0.19 0.28 0.00 0.00 0.00 179.25 180.36 3ia6 h VAL 293 N 0.98 0.80 -0.21 0.00 2.07 -1.14 -0.79 116.25 117.95 3ia6 h VAL 293 Ca 0.21 -0.12 -0.11 0.00 0.82 0.00 0.00 66.70 67.50 3ia6 h VAL 293 Cb 0.33 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3ia6 h VAL 293 CO -0.00 0.07 -0.34 1.56 0.02 0.00 0.00 177.57 178.88 3ia6 h GLN 294 N 0.36 0.44 -0.24 1.57 1.08 -1.51 0.11 115.11 116.93 3ia6 h GLN 294 Ca 0.26 -0.20 -0.05 0.00 -1.45 0.00 0.00 58.65 57.22 3ia6 h GLN 294 Cb 0.31 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.72 3ia6 h GLN 294 CO -0.28 0.73 -0.06 0.93 -0.95 0.00 0.00 178.83 179.21 3ia6 h GLU 295 N 0.38 0.46 -0.55 1.46 5.08 -1.14 -1.38 114.58 118.89 3ia6 h GLU 295 Ca 0.04 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 3ia6 h GLU 295 Cb 0.78 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 3ia6 h GLU 295 CO 0.06 0.69 0.24 0.82 -1.00 0.00 0.00 179.01 179.82 3ia6 h ILE 296 N 0.19 1.21 -0.72 3.13 2.04 -1.02 -1.00 117.51 121.35 3ia6 h ILE 296 Ca 0.06 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.33 3ia6 h ILE 296 Cb 0.52 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 3ia6 h ILE 296 CO 0.02 0.25 0.44 0.74 0.00 0.00 0.00 178.15 179.60 3ia6 h THR 297 N 0.74 1.04 -0.33 -0.27 2.02 -0.74 0.16 112.91 115.54 3ia6 h THR 297 Ca 0.19 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 67.04 3ia6 h THR 297 Cb 0.17 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 3ia6 h THR 297 CO -0.02 0.15 0.03 -0.08 0.37 0.00 0.00 175.52 175.97 3ia6 h GLU 298 N 0.83 0.57 -0.52 6.66 4.81 -1.02 -2.88 114.58 123.02 3ia6 h GLU 298 Ca 0.31 -0.16 0.06 0.00 -0.13 0.00 0.00 59.36 59.43 3ia6 h GLU 298 Cb 0.10 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 3ia6 h GLU 298 CO -0.15 0.67 0.24 -0.92 -0.73 0.00 0.00 179.01 178.12 3ia6 h TYR 299 N 0.39 0.44 -0.84 0.92 3.20 -0.56 -2.89 116.97 117.61 3ia6 h TYR 299 Ca 0.10 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.10 3ia6 h TYR 299 Cb 0.39 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.46 3ia6 h TYR 299 CO 0.03 0.19 0.48 0.00 -1.64 0.00 0.00 178.16 177.22 3ia6 h ALA 300 N 1.30 1.23 -0.15 1.82 0.00 -0.49 -0.83 119.26 122.13 3ia6 h ALA 300 Ca 0.24 0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.23 3ia6 h ALA 300 Cb 0.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ia6 h ALA 300 CO -0.19 0.07 0.12 0.87 0.00 0.00 0.00 179.25 180.12 3ia6 h LYS 301 N 0.77 0.00 0.00 0.00 1.57 -1.33 -0.47 116.57 117.12 3ia6 h LYS 301 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 3ia6 h LYS 301 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3ia6 h LYS 301 CO -0.27 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.48 3ia6 n SER 302 N -4.33 0.35 -4.64 0.86 3.41 -0.32 -4.57 113.62 104.38 3ia6 n SER 302 Ca 0.01 0.54 -0.43 0.00 -0.26 0.00 0.00 58.87 58.73 3ia6 n SER 302 Cb 0.24 -0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 63.54 3ia6 n SER 302 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ia6 s ILE 303 N -3.05 4.00 0.02 -1.33 1.01 -0.19 -4.92 121.20 116.75 3ia6 s ILE 303 Ca 0.12 1.16 -0.38 0.00 0.00 0.00 0.00 60.65 61.55 3ia6 s ILE 303 Cb 0.15 -3.93 -0.18 0.00 0.01 0.00 0.00 42.46 38.52 3ia6 s ILE 303 CO 0.54 -0.30 1.31 -2.65 0.00 0.00 0.00 174.94 173.84 3ia6 n PRO 304 N 7.21 0.84 0.00 2.79 -0.02 -1.26 -0.57 135.00 143.99 3ia6 n PRO 304 Ca 0.16 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3ia6 n PRO 304 Cb 0.45 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3ia6 n PRO 304 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ia6 n GLY 305 N 2.44 3.11 0.16 -1.23 0.00 -1.26 -4.94 105.19 103.47 3ia6 n GLY 305 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.14 3ia6 n GLY 305 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3ia6 h PHE 306 N 0.00 0.36 0.00 1.61 3.57 -1.13 -2.43 116.94 118.93 3ia6 h PHE 306 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3ia6 h PHE 306 Cb 0.00 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.63 3ia6 h PHE 306 CO 0.00 0.20 -0.00 -0.39 -2.23 0.00 0.00 178.31 175.89 3ia6 h VAL 307 N 0.40 0.01 -0.00 1.41 -1.51 -1.80 -2.78 116.25 111.97 3ia6 h VAL 307 Ca 0.15 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 65.10 3ia6 h VAL 307 Cb 0.03 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 3ia6 h VAL 307 CO -0.09 0.00 -0.10 0.59 -1.23 0.00 0.00 177.57 176.74 3ia6 n ASN 308 N -3.09 0.30 -4.79 4.19 3.02 -0.92 -4.84 115.26 109.12 3ia6 n ASN 308 Ca 0.01 -0.30 -0.35 0.00 -0.03 0.00 0.00 54.58 53.91 3ia6 n ASN 308 Cb 0.31 -0.15 -0.02 0.00 -0.61 0.00 0.00 39.78 39.31 3ia6 n ASN 308 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ia6 s LEU 309 N -2.61 3.82 -0.09 3.41 1.43 -1.05 -4.97 118.68 118.62 3ia6 s LEU 309 Ca 0.25 2.06 -0.31 0.00 -1.03 0.00 0.00 54.13 55.10 3ia6 s LEU 309 Cb 0.20 -4.55 -0.15 0.00 0.03 0.00 0.00 46.19 41.72 3ia6 s LEU 309 CO 0.50 -0.97 0.89 -0.67 0.23 0.00 0.00 176.35 176.33 3ia6 n ASP 310 N -1.07 0.21 -0.35 2.29 2.03 -1.26 -4.75 116.55 113.65 3ia6 n ASP 310 Ca 0.10 0.87 0.02 0.00 0.52 0.00 0.00 54.79 56.31 3ia6 n ASP 310 Cb 0.52 -0.68 0.17 0.00 -0.72 0.00 0.00 41.12 40.40 3ia6 n ASP 310 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3ia6 h LEU 311 N 2.60 0.95 -1.00 -2.67 3.38 -1.93 -0.43 115.31 116.22 3ia6 h LEU 311 Ca -0.37 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 3ia6 h LEU 311 Cb 1.06 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 3ia6 h LEU 311 CO 0.54 0.60 0.18 0.78 0.09 0.00 0.00 178.44 180.64 3ia6 h ASN 312 N 1.08 0.84 -0.50 -0.43 2.35 -2.00 -2.77 115.58 114.15 3ia6 h ASN 312 Ca 0.42 -0.14 -0.09 0.00 -0.55 0.00 0.00 56.30 55.94 3ia6 h ASN 312 Cb 0.20 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3ia6 h ASN 312 CO -0.18 0.79 -0.02 0.44 -1.65 0.00 0.00 177.43 176.81 3ia6 h ASP 313 N 0.88 0.89 -0.43 5.81 3.32 -1.46 -0.98 116.42 124.44 3ia6 h ASP 313 Ca 0.20 -0.32 0.09 0.00 0.02 0.00 0.00 57.03 57.01 3ia6 h ASP 313 Cb 0.26 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 39.49 3ia6 h ASP 313 CO -0.01 0.99 -0.08 1.56 -1.72 0.00 0.00 179.24 179.99 3ia6 h GLN 314 N 0.76 0.03 -0.49 3.56 4.20 -1.14 0.67 115.11 122.70 3ia6 h GLN 314 Ca 0.14 -0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.76 3ia6 h GLN 314 Cb 0.55 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3ia6 h GLN 314 CO 0.03 0.02 -0.06 0.28 -0.67 0.00 0.00 178.83 178.43 3ia6 h VAL 315 N 0.03 1.26 -0.07 -0.54 2.07 -1.33 -1.95 116.25 115.71 3ia6 h VAL 315 Ca 0.21 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3ia6 h VAL 315 Cb 0.32 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3ia6 h VAL 315 CO -0.42 0.40 0.03 0.74 0.02 0.00 0.00 177.57 178.33 3ia6 h THR 316 N 0.78 1.16 -0.75 2.57 2.02 -0.63 -0.30 112.91 117.77 3ia6 h THR 316 Ca 0.14 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.84 3ia6 h THR 316 Cb 0.55 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.27 3ia6 h THR 316 CO 0.03 0.14 0.50 -0.07 0.37 0.00 0.00 175.52 176.49 3ia6 h LEU 317 N -0.06 0.86 -0.21 2.58 3.38 -0.78 -2.15 115.31 118.93 3ia6 h LEU 317 Ca 0.02 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3ia6 h LEU 317 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3ia6 h LEU 317 CO -0.00 0.62 -0.03 -0.07 0.09 0.00 0.00 178.44 179.05 3ia6 h LEU 318 N 1.02 0.39 -0.52 1.67 3.38 -1.31 -1.52 115.31 118.42 3ia6 h LEU 318 Ca 0.28 -0.35 0.09 0.00 0.09 0.00 0.00 57.88 57.99 3ia6 h LEU 318 Cb -0.12 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.46 3ia6 h LEU 318 CO -0.06 0.64 0.11 0.50 0.09 0.00 0.00 178.44 179.72 3ia6 h LYS 319 N 0.12 0.23 -0.00 1.13 3.64 -0.84 -1.84 116.57 119.02 3ia6 h LYS 319 Ca 0.05 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3ia6 h LYS 319 Cb 0.46 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3ia6 h LYS 319 CO 0.02 0.16 -0.45 0.66 -2.27 0.00 0.00 179.45 177.56 3ia6 n TYR 320 N -5.11 0.00 -0.06 1.91 4.02 -0.83 -4.31 117.16 112.78 3ia6 n TYR 320 Ca 0.06 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.94 3ia6 n TYR 320 Cb 0.26 -0.24 -0.15 0.00 -0.02 0.00 0.00 39.34 39.19 3ia6 n TYR 320 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ia6 n GLY 321 N 1.48 -0.89 0.38 2.72 0.00 -0.57 -4.64 105.19 103.67 3ia6 n GLY 321 Ca 0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 3ia6 n GLY 321 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3ia6 h VAL 322 N 0.00 1.26 -0.33 1.61 -1.51 -1.54 -2.58 116.25 113.16 3ia6 h VAL 322 Ca -0.29 -0.47 -0.17 0.00 -1.23 0.00 0.00 66.70 64.55 3ia6 h VAL 322 Cb 1.61 -0.22 -0.00 0.00 -2.13 0.00 0.00 31.29 30.54 3ia6 h VAL 322 CO 0.02 0.25 -0.46 0.45 -1.23 0.00 0.00 177.57 176.60 3ia6 h HIS 323 N 1.36 1.07 -0.83 5.19 3.86 -1.86 0.23 115.15 124.17 3ia6 h HIS 323 Ca 0.37 -0.34 0.06 0.00 -1.16 0.00 0.00 60.37 59.29 3ia6 h HIS 323 Cb -0.16 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.04 3ia6 h HIS 323 CO -0.00 1.16 0.52 0.93 0.86 0.00 0.00 177.93 181.40 3ia6 h GLU 324 N 0.69 0.92 -0.21 2.45 5.08 -1.77 -1.14 114.58 120.60 3ia6 h GLU 324 Ca 0.04 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 3ia6 h GLU 324 Cb 1.05 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3ia6 h GLU 324 CO 0.10 0.61 -0.45 0.82 -1.00 0.00 0.00 179.01 179.10 3ia6 h ILE 325 N 0.95 1.32 -0.50 3.13 2.04 -1.16 -2.00 117.51 121.29 3ia6 h ILE 325 Ca 0.36 -1.67 0.05 0.00 1.00 0.00 0.00 64.86 64.60 3ia6 h ILE 325 Cb 0.15 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.02 3ia6 h ILE 325 CO -0.16 0.52 0.24 0.40 0.00 0.00 0.00 178.15 179.15 3ia6 h ILE 326 N 0.38 0.94 -0.18 -0.67 2.04 -0.22 -0.18 117.51 119.62 3ia6 h ILE 326 Ca 0.00 -0.16 -0.13 0.00 1.00 0.00 0.00 64.86 65.57 3ia6 h ILE 326 Cb 1.06 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3ia6 h ILE 326 CO 0.10 0.09 -0.44 1.88 0.00 0.00 0.00 178.15 179.77 3ia6 h TYR 327 N 0.47 0.53 0.31 1.37 0.05 -1.23 -0.81 116.97 117.66 3ia6 h TYR 327 Ca 0.22 -0.16 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 3ia6 h TYR 327 Cb 0.15 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 3ia6 h TYR 327 CO -0.11 0.81 -0.21 1.15 -1.05 0.00 0.00 178.16 178.75 3ia6 h THR 328 N 0.36 0.56 0.00 -2.88 2.02 -0.86 -3.08 112.91 109.04 3ia6 h THR 328 Ca 0.03 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.11 3ia6 h THR 328 Cb 0.93 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 3ia6 h THR 328 CO 0.08 0.00 -0.46 0.24 0.37 0.00 0.00 175.52 175.75 3ia6 h MET 329 N -0.50 0.00 -0.59 6.66 2.86 -0.98 -2.69 114.93 119.69 3ia6 h MET 329 Ca -0.03 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.67 3ia6 h MET 329 Cb 0.43 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 3ia6 h MET 329 CO 0.02 0.46 0.39 1.25 1.06 0.00 0.00 176.91 180.08 3ia6 h LEU 330 N 0.00 0.49 -1.37 1.22 5.85 -1.12 -1.85 115.31 118.53 3ia6 h LEU 330 Ca -0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 3ia6 h LEU 330 Cb 1.05 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 3ia6 h LEU 330 CO 0.06 0.32 0.45 0.00 -0.34 0.00 0.00 178.44 178.93 3ia6 h ALA 331 N 1.68 1.61 -0.22 1.25 0.00 -1.39 0.54 119.26 122.74 3ia6 h ALA 331 Ca 0.25 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.19 3ia6 h ALA 331 Cb 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ia6 h ALA 331 CO -0.07 0.32 0.20 0.77 0.00 0.00 0.00 179.25 180.46 3ia6 h SER 332 N 0.82 0.00 -0.45 0.00 0.02 -1.45 -1.93 113.55 110.56 3ia6 h SER 332 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 3ia6 h SER 332 Cb 0.05 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3ia6 h SER 332 CO -0.07 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.80 3ia6 n LEU 333 N -4.04 3.41 -4.53 5.07 4.77 0.16 -4.58 117.00 117.26 3ia6 n LEU 333 Ca 0.02 -1.69 -0.27 0.00 -0.03 0.00 0.00 56.01 54.04 3ia6 n LEU 333 Cb 0.33 -0.30 -0.10 0.00 -2.33 0.00 0.00 43.42 41.03 3ia6 n LEU 333 CO 0.30 0.79 -0.45 -0.04 -1.33 0.00 0.00 177.39 176.66 3ia6 s MET 334 N -1.22 1.92 0.14 3.23 -1.94 -0.73 -0.98 119.30 119.72 3ia6 s MET 334 Ca 0.37 -1.28 0.01 0.00 -1.71 0.00 0.00 55.69 53.08 3ia6 s MET 334 Cb 0.21 -2.11 -0.00 0.00 2.01 0.00 0.00 34.83 34.94 3ia6 s MET 334 CO 0.28 0.44 0.04 0.27 -0.01 0.00 0.00 175.02 176.04 3ia6 n ASN 335 N 0.27 1.24 0.07 3.03 0.23 -0.70 -4.97 115.26 114.43 3ia6 n ASN 335 Ca -0.12 -1.71 0.08 0.00 -0.53 0.00 0.00 54.58 52.29 3ia6 n ASN 335 Cb 0.55 0.30 0.34 0.00 -2.08 0.00 0.00 39.78 38.90 3ia6 n ASN 335 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 3ia6 n LYS 336 N -0.32 0.08 0.00 -3.83 2.85 -1.26 -3.18 118.16 112.51 3ia6 n LYS 336 Ca -0.03 0.43 0.04 0.00 -1.05 0.00 0.00 58.31 57.71 3ia6 n LYS 336 Cb 0.20 -1.69 -0.02 0.00 -0.65 0.00 0.00 35.03 32.86 3ia6 n LYS 336 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3ia6 n ASP 337 N -1.86 0.71 0.00 -5.58 8.00 -1.26 -4.85 116.55 111.72 3ia6 n ASP 337 Ca 0.01 -0.86 0.00 0.00 0.71 0.00 0.00 54.79 54.66 3ia6 n ASP 337 Cb 0.12 0.73 0.00 0.00 -0.02 0.00 0.00 41.12 41.95 3ia6 n ASP 337 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ia6 n GLY 338 N 0.99 -1.86 3.04 0.44 0.00 -1.19 -0.90 105.19 105.70 3ia6 n GLY 338 Ca 0.02 -1.14 -0.23 0.00 0.00 0.00 0.00 46.02 44.67 3ia6 n GLY 338 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ia6 s VAL 339 N -2.20 1.08 0.16 1.61 0.11 -0.01 -1.73 120.40 119.42 3ia6 s VAL 339 Ca 0.00 -0.50 -0.30 0.00 -2.93 0.00 0.00 61.98 58.25 3ia6 s VAL 339 Cb 0.00 -0.96 -0.08 0.00 -1.53 0.00 0.00 36.38 33.81 3ia6 s VAL 339 CO 0.00 0.33 1.28 -0.76 -3.33 0.00 0.00 175.10 172.62 3ia6 s LEU 340 N 0.32 4.41 0.28 2.54 1.43 -0.16 -1.30 118.68 126.20 3ia6 s LEU 340 Ca -0.07 2.30 0.10 0.00 -1.03 0.00 0.00 54.13 55.42 3ia6 s LEU 340 Cb -0.12 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.45 3ia6 s LEU 340 CO 0.02 -0.50 -0.14 0.27 0.23 0.00 0.00 176.35 176.22 3ia6 s ILE 341 N 0.38 2.13 -1.07 -0.59 -4.36 -0.90 -4.79 121.20 112.00 3ia6 s ILE 341 Ca 0.57 -2.27 -0.18 0.00 -0.26 0.00 0.00 60.65 58.51 3ia6 s ILE 341 Cb -0.35 -2.35 0.00 0.00 1.25 0.00 0.00 42.46 41.02 3ia6 s ILE 341 CO 0.35 -0.38 0.74 -0.24 0.24 0.00 0.00 174.94 175.66 3ia6 n SER 342 N -0.60 -5.34 -1.03 4.36 2.88 -1.26 -1.57 113.62 111.06 3ia6 n SER 342 Ca -0.06 -0.96 -0.13 0.00 -1.33 0.00 0.00 58.87 56.39 3ia6 n SER 342 Cb 0.61 -3.06 -0.06 0.00 -0.75 0.00 0.00 64.21 60.96 3ia6 n SER 342 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3ia6 n GLU 343 N -3.86 -1.04 -0.94 -1.46 4.07 -1.26 -2.23 120.64 113.92 3ia6 n GLU 343 Ca -0.12 0.96 0.00 0.00 -0.06 0.00 0.00 57.16 57.94 3ia6 n GLU 343 Cb 0.59 -5.07 0.00 0.00 -0.06 0.00 0.00 31.44 26.90 3ia6 n GLU 343 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3ia6 n GLY 344 N -1.12 0.58 0.13 8.31 0.00 -0.61 -4.89 105.19 107.59 3ia6 n GLY 344 Ca -0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.01 3ia6 n GLY 344 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3ia6 h GLN 345 N 1.38 0.00 -5.04 1.61 1.08 -1.29 -3.40 115.11 109.46 3ia6 h GLN 345 Ca 0.00 0.00 -0.43 0.00 -1.45 0.00 0.00 58.65 56.77 3ia6 h GLN 345 Cb 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 27.29 3ia6 h GLN 345 CO 0.00 0.00 -0.59 0.20 -0.95 0.00 0.00 178.83 177.49 3ia6 s GLY 346 N -3.60 2.01 -0.22 3.46 0.00 -0.93 -1.01 107.32 107.03 3ia6 s GLY 346 Ca 0.07 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 42.90 3ia6 s GLY 346 CO 0.49 -1.71 0.33 -0.12 0.00 0.00 0.00 173.10 172.09 3ia6 s PHE 347 N -3.49 -0.65 -0.19 1.90 5.36 0.28 -2.12 117.98 119.07 3ia6 s PHE 347 Ca 0.35 0.71 -0.09 0.00 -0.96 0.00 0.00 56.93 56.94 3ia6 s PHE 347 Cb 0.07 -0.07 -0.05 0.00 -0.34 0.00 0.00 43.02 42.63 3ia6 s PHE 347 CO 0.15 -0.66 0.10 1.41 -1.46 0.00 0.00 175.22 174.76 3ia6 s MET 348 N 2.48 4.10 0.48 10.12 -2.45 -0.42 0.20 119.30 133.82 3ia6 s MET 348 Ca 0.10 -0.27 -0.19 0.00 -1.25 0.00 0.00 55.69 54.08 3ia6 s MET 348 Cb -0.15 -3.34 -0.09 0.00 1.25 0.00 0.00 34.83 32.50 3ia6 s MET 348 CO -0.14 0.29 0.99 0.95 1.05 0.00 0.00 175.02 178.16 3ia6 s THR 349 N 0.35 4.24 0.26 10.11 -4.23 -0.56 -0.83 115.64 125.00 3ia6 s THR 349 Ca 0.06 1.26 -0.05 0.00 -1.18 0.00 0.00 61.69 61.79 3ia6 s THR 349 Cb -0.12 -3.58 0.24 0.00 1.34 0.00 0.00 72.50 70.39 3ia6 s THR 349 CO -0.01 -0.43 1.92 -0.09 -0.54 0.00 0.00 174.62 175.46 3ia6 h ARG 350 N 1.38 1.20 -0.32 3.99 2.43 -1.35 -2.53 114.38 119.18 3ia6 h ARG 350 Ca -0.48 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 58.55 3ia6 h ARG 350 Cb 1.19 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 3ia6 h ARG 350 CO 0.60 0.83 0.05 1.49 -1.51 0.00 0.00 179.97 181.43 3ia6 h GLU 351 N 1.22 0.53 -0.62 0.20 4.22 -1.93 -0.19 114.58 118.01 3ia6 h GLU 351 Ca 0.32 -0.14 -0.02 0.00 0.08 0.00 0.00 59.36 59.60 3ia6 h GLU 351 Cb -0.07 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 3ia6 h GLU 351 CO -0.06 0.62 0.30 0.35 -2.18 0.00 0.00 179.01 178.04 3ia6 h PHE 352 N 0.36 0.89 -0.77 0.92 3.57 -1.74 -2.32 116.94 117.85 3ia6 h PHE 352 Ca 0.10 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3ia6 h PHE 352 Cb 0.35 -0.28 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 3ia6 h PHE 352 CO 0.02 0.67 0.37 -0.07 -2.23 0.00 0.00 178.31 177.07 3ia6 h LEU 353 N 0.86 1.02 -1.91 0.59 3.38 -1.31 -2.72 115.31 115.21 3ia6 h LEU 353 Ca 0.21 -0.14 0.14 0.00 0.09 0.00 0.00 57.88 58.19 3ia6 h LEU 353 Cb 0.11 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3ia6 h LEU 353 CO -0.03 0.87 0.38 0.11 0.09 0.00 0.00 178.44 179.86 3ia6 h LYS 354 N 1.09 0.09 -0.64 1.13 1.57 -0.57 -3.11 116.57 116.13 3ia6 h LYS 354 Ca 0.27 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3ia6 h LYS 354 Cb 0.13 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3ia6 h LYS 354 CO -0.03 0.06 0.00 -1.13 -0.57 0.00 0.00 179.45 177.78 3ia6 n SER 355 N -4.41 3.57 0.01 0.86 3.41 -0.92 -4.69 113.62 111.45 3ia6 n SER 355 Ca 0.10 -2.00 -0.11 0.00 -0.26 0.00 0.00 58.87 56.60 3ia6 n SER 355 Cb 0.55 -0.43 -0.05 0.00 -0.26 0.00 0.00 64.21 64.02 3ia6 n SER 355 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ia6 h LEU 356 N 3.96 0.04 0.00 1.04 3.38 -1.60 -3.49 115.31 118.64 3ia6 h LEU 356 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3ia6 h LEU 356 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3ia6 h LEU 356 CO 0.00 0.04 0.00 -2.11 0.09 0.00 0.00 178.44 176.46 3ia6 n ARG 357 N -5.06 0.00 0.11 1.13 1.85 -1.26 -4.80 116.66 108.62 3ia6 n ARG 357 Ca -0.05 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.58 3ia6 n ARG 357 Cb 0.04 0.00 -0.13 0.00 -1.05 0.00 0.00 32.46 31.32 3ia6 n ARG 357 CO 0.00 0.00 0.00 1.57 -0.01 0.00 0.00 177.63 179.19 3ia6 h LYS 358 N 0.00 0.57 0.00 2.89 5.09 -1.98 -3.25 116.57 119.89 3ia6 h LYS 358 Ca 0.00 -0.81 -0.38 0.00 0.09 0.00 0.00 60.65 59.56 3ia6 h LYS 358 Cb 0.00 0.28 -0.07 0.00 0.10 0.00 0.00 32.23 32.54 3ia6 h LYS 358 CO 0.00 1.37 -2.40 -0.35 -2.09 0.00 0.00 179.45 175.98 3ia6 n PRO 359 N -3.75 0.67 0.06 0.07 -0.04 -1.26 -4.68 135.00 126.07 3ia6 n PRO 359 Ca -0.14 0.08 0.13 0.00 -0.04 0.00 0.00 63.50 63.53 3ia6 n PRO 359 Cb 1.01 -1.53 0.44 0.00 -0.04 0.00 0.00 33.50 33.38 3ia6 n PRO 359 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3ia6 n PHE 360 N -3.00 0.54 1.74 0.54 3.72 -1.26 -3.72 117.46 116.02 3ia6 n PHE 360 Ca -0.38 0.16 0.11 0.00 -0.05 0.00 0.00 57.45 57.29 3ia6 n PHE 360 Cb 1.08 -0.73 0.58 0.00 -0.94 0.00 0.00 39.48 39.46 3ia6 n PHE 360 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ia6 n GLY 361 N 1.38 -0.55 0.00 1.37 0.00 -1.23 -3.98 105.19 102.18 3ia6 n GLY 361 Ca 0.06 -0.25 0.04 0.00 0.00 0.00 0.00 46.02 45.87 3ia6 n GLY 361 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ia6 n ASP 362 N -0.43 1.56 0.15 1.61 8.00 -1.24 -4.43 116.55 121.77 3ia6 n ASP 362 Ca 0.17 -0.39 0.02 0.00 0.71 0.00 0.00 54.79 55.30 3ia6 n ASP 362 Cb 0.17 1.14 0.18 0.00 -0.02 0.00 0.00 41.12 42.59 3ia6 n ASP 362 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 3ia6 h PHE 363 N 0.00 0.00 0.00 1.24 -5.15 -1.79 -3.31 116.94 107.93 3ia6 h PHE 363 Ca 0.00 0.00 -0.26 0.00 -0.20 0.00 0.00 57.97 57.51 3ia6 h PHE 363 Cb 0.24 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.36 3ia6 h PHE 363 CO 0.00 0.52 -1.77 -1.33 -2.00 0.00 0.00 178.31 173.73 3ia6 n MET 364 N -3.46 0.64 -0.18 6.09 2.81 -1.26 -4.44 117.12 117.32 3ia6 n MET 364 Ca 0.00 0.20 -0.01 0.00 -1.81 0.00 0.00 57.70 56.08 3ia6 n MET 364 Cb 0.64 -1.74 0.08 0.00 -0.71 0.00 0.00 33.22 31.49 3ia6 n MET 364 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 3ia6 h GLU 365 N 0.00 0.30 -0.11 0.03 4.57 -1.84 -1.09 114.58 116.44 3ia6 h GLU 365 Ca -0.29 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.84 3ia6 h GLU 365 Cb 1.90 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 30.42 3ia6 h GLU 365 CO 0.06 0.20 -0.06 -1.35 -1.18 0.00 0.00 179.01 176.67 3ia6 h PRO 366 N 0.31 0.17 -0.40 0.92 0.11 -1.78 -1.02 132.00 130.31 3ia6 h PRO 366 Ca 0.27 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 66.25 3ia6 h PRO 366 Cb 0.35 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3ia6 h PRO 366 CO -0.32 0.25 -0.17 0.87 -0.21 0.00 0.00 178.00 178.42 3ia6 h LYS 367 N 0.16 0.82 -0.65 1.05 1.79 -1.46 -1.78 116.57 116.49 3ia6 h LYS 367 Ca 0.04 -0.35 0.00 0.00 -2.18 0.00 0.00 60.65 58.16 3ia6 h LYS 367 Cb 0.23 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 3ia6 h LYS 367 CO 0.01 0.98 0.41 0.74 -1.08 0.00 0.00 179.45 180.51 3ia6 h PHE 368 N 0.63 0.84 -0.14 -1.35 0.04 -0.83 -0.59 116.94 115.53 3ia6 h PHE 368 Ca 0.09 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.87 3ia6 h PHE 368 Cb 0.72 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 3ia6 h PHE 368 CO 0.06 0.55 0.08 0.93 -0.60 0.00 0.00 178.31 179.33 3ia6 h GLU 369 N 0.88 0.19 -0.58 1.51 5.08 -1.07 -0.94 114.58 119.65 3ia6 h GLU 369 Ca 0.24 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.61 3ia6 h GLU 369 Cb -0.06 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 3ia6 h GLU 369 CO -0.05 0.17 0.35 0.35 -1.00 0.00 0.00 179.01 178.83 3ia6 h PHE 370 N 0.16 0.65 -0.29 4.33 3.57 -1.23 -3.09 116.94 121.03 3ia6 h PHE 370 Ca 0.05 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 3ia6 h PHE 370 Cb 0.03 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3ia6 h PHE 370 CO -0.05 0.37 0.16 0.00 -2.23 0.00 0.00 178.31 176.56 3ia6 h ALA 371 N 1.26 0.38 -0.47 2.41 0.00 -0.73 0.44 119.26 122.55 3ia6 h ALA 371 Ca 0.23 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.16 3ia6 h ALA 371 Cb 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 3ia6 h ALA 371 CO -0.10 -0.09 -0.03 0.28 0.00 0.00 0.00 179.25 179.30 3ia6 h VAL 372 N 0.36 0.61 -0.04 0.00 2.07 -1.16 0.67 116.25 118.75 3ia6 h VAL 372 Ca 0.10 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 3ia6 h VAL 372 Cb 0.06 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 3ia6 h VAL 372 CO -0.02 0.01 -0.03 0.11 0.02 0.00 0.00 177.57 177.67 3ia6 h LYS 373 N 0.08 0.10 -0.71 1.57 1.57 -1.41 -3.02 116.57 114.76 3ia6 h LYS 373 Ca 0.23 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 59.00 3ia6 h LYS 373 Cb 0.35 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 3ia6 h LYS 373 CO -0.41 0.52 0.44 0.35 -0.57 0.00 0.00 179.45 179.78 3ia6 h PHE 374 N -0.32 0.83 0.00 -1.35 3.57 0.28 -2.11 116.94 117.83 3ia6 h PHE 374 Ca 0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3ia6 h PHE 374 Cb 0.49 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 3ia6 h PHE 374 CO 0.08 0.47 -0.05 -0.91 -2.23 0.00 0.00 178.31 175.67 3ia6 h ASN 375 N 0.86 0.00 0.23 0.41 -0.26 0.30 -2.22 115.58 114.91 3ia6 h ASN 375 Ca 0.29 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 56.01 3ia6 h ASN 375 Cb 0.03 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.29 3ia6 h ASN 375 CO -0.11 0.05 -0.06 0.00 -1.06 0.00 0.00 177.43 176.25 3ia6 h ALA 376 N 1.95 1.32 0.00 -0.83 0.00 -1.24 0.07 119.26 120.53 3ia6 h ALA 376 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ia6 h ALA 376 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3ia6 h ALA 376 CO 0.01 0.08 0.00 -0.07 0.00 0.00 0.00 179.25 179.26 3ia6 h LEU 377 N 0.00 0.00 -0.81 0.00 3.38 -1.49 -3.47 115.31 112.93 3ia6 h LEU 377 Ca -0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3ia6 h LEU 377 Cb 0.19 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3ia6 h LEU 377 CO 0.01 0.00 -0.74 -0.62 0.09 0.00 0.00 178.44 177.18 3ia6 n GLU 378 N -2.51 -5.31 -1.72 1.13 1.02 0.01 -4.95 120.64 108.30 3ia6 n GLU 378 Ca 0.01 0.59 -0.33 0.00 -0.02 0.00 0.00 57.16 57.41 3ia6 n GLU 378 Cb 0.21 -5.47 0.05 0.00 -0.02 0.00 0.00 31.44 26.21 3ia6 n GLU 378 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3ia6 s LEU 379 N -7.22 3.36 0.00 -4.62 1.43 -1.26 -5.07 118.68 105.29 3ia6 s LEU 379 Ca 0.65 1.97 0.02 0.00 -1.03 0.00 0.00 54.13 55.74 3ia6 s LEU 379 Cb -0.32 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.36 3ia6 s LEU 379 CO 0.80 -1.65 0.14 -0.90 0.23 0.00 0.00 176.35 174.97 3ia6 n ASP 380 N -2.50 2.54 -0.18 2.29 5.68 -1.26 -4.98 116.55 118.13 3ia6 n ASP 380 Ca 0.10 -2.35 -0.04 0.00 -0.50 0.00 0.00 54.79 52.00 3ia6 n ASP 380 Cb 0.52 0.10 0.06 0.00 -1.14 0.00 0.00 41.12 40.66 3ia6 n ASP 380 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3ia6 h ASP 381 N 0.62 0.45 -0.41 -1.12 3.45 -1.97 0.68 116.42 118.11 3ia6 h ASP 381 Ca -0.25 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.20 3ia6 h ASP 381 Cb 0.84 -0.07 -0.02 0.00 -0.56 0.00 0.00 39.33 39.52 3ia6 h ASP 381 CO 0.41 0.31 0.15 0.77 -1.57 0.00 0.00 179.24 179.31 3ia6 h SER 382 N 0.58 0.62 0.02 6.45 4.64 -1.97 0.67 113.55 124.56 3ia6 h SER 382 Ca 0.24 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3ia6 h SER 382 Cb 0.11 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3ia6 h SER 382 CO -0.15 0.59 -0.01 0.44 -0.87 0.00 0.00 176.83 176.84 3ia6 h ASP 383 N 0.67 -0.02 -0.49 4.97 3.32 -1.81 -3.32 116.42 119.74 3ia6 h ASP 383 Ca 0.16 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.87 3ia6 h ASP 383 Cb 0.19 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 3ia6 h ASP 383 CO -0.01 0.27 0.12 -0.07 -1.72 0.00 0.00 179.24 177.83 3ia6 h LEU 384 N -0.31 0.79 -0.45 1.55 3.38 -0.41 -2.38 115.31 117.49 3ia6 h LEU 384 Ca -0.00 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.91 3ia6 h LEU 384 Cb 0.30 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 40.75 3ia6 h LEU 384 CO 0.00 0.78 -0.19 0.00 0.09 0.00 0.00 178.44 179.13 3ia6 h ALA 385 N 1.32 0.16 -0.45 1.53 0.00 -0.98 0.14 119.26 120.98 3ia6 h ALA 385 Ca 0.18 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.12 3ia6 h ALA 385 Cb 0.31 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3ia6 h ALA 385 CO 0.00 -0.53 -0.20 0.82 0.00 0.00 0.00 179.25 179.34 3ia6 h ILE 386 N -0.09 1.27 -0.43 0.00 2.04 -1.62 -2.96 117.51 115.72 3ia6 h ILE 386 Ca 0.21 -1.35 0.01 0.00 1.00 0.00 0.00 64.86 64.73 3ia6 h ILE 386 Cb 0.43 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 3ia6 h ILE 386 CO -0.51 0.46 0.28 0.15 0.00 0.00 0.00 178.15 178.53 3ia6 h PHE 387 N 0.76 0.52 -0.07 1.37 3.57 -0.83 -1.20 116.94 121.06 3ia6 h PHE 387 Ca 0.10 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.53 3ia6 h PHE 387 Cb 0.77 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3ia6 h PHE 387 CO 0.05 0.32 -0.34 -0.84 -2.23 0.00 0.00 178.31 175.27 3ia6 h ILE 388 N 0.56 1.27 -0.61 1.41 3.07 -0.76 -1.77 117.51 120.68 3ia6 h ILE 388 Ca 0.16 -1.29 -0.03 0.00 1.55 0.00 0.00 64.86 65.25 3ia6 h ILE 388 Cb -0.04 1.60 -0.03 0.00 -0.27 0.00 0.00 36.82 38.08 3ia6 h ILE 388 CO -0.05 0.38 0.27 0.00 -1.05 0.00 0.00 178.15 177.71 3ia6 h ALA 389 N 1.53 0.79 -0.58 0.16 0.00 -1.26 -1.36 119.26 118.54 3ia6 h ALA 389 Ca 0.02 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3ia6 h ALA 389 Cb 0.67 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3ia6 h ALA 389 CO 0.05 0.38 0.34 0.28 0.00 0.00 0.00 179.25 180.30 3ia6 h VAL 390 N 0.85 1.04 -0.99 0.00 2.07 -0.65 -2.24 116.25 116.32 3ia6 h VAL 390 Ca 0.21 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.53 3ia6 h VAL 390 Cb 0.16 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.19 3ia6 h VAL 390 CO -0.02 0.12 0.65 0.40 0.02 0.00 0.00 177.57 178.74 3ia6 h ILE 391 N 0.67 1.20 -0.27 4.57 2.04 -0.95 -3.03 117.51 121.74 3ia6 h ILE 391 Ca 0.24 -0.44 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 3ia6 h ILE 391 Cb 0.05 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 35.92 3ia6 h ILE 391 CO -0.11 0.23 -0.04 0.40 0.00 0.00 0.00 178.15 178.63 3ia6 h ILE 392 N 1.28 1.27 -0.88 -0.67 2.04 -0.69 -3.27 117.51 116.59 3ia6 h ILE 392 Ca 0.39 -1.03 -0.55 0.00 1.00 0.00 0.00 64.86 64.66 3ia6 h ILE 392 Cb -0.04 1.41 -0.13 0.00 -0.74 0.00 0.00 36.82 37.32 3ia6 h ILE 392 CO -0.11 0.32 1.23 0.18 0.00 0.00 0.00 178.15 179.78 3ia6 n LEU 393 N -4.56 7.02 -4.68 1.44 4.32 -0.95 -4.77 117.00 114.82 3ia6 n LEU 393 Ca -0.03 -4.25 -0.40 0.00 -0.02 0.00 0.00 56.01 51.31 3ia6 n LEU 393 Cb 0.29 -1.32 -0.06 0.00 -1.62 0.00 0.00 43.42 40.71 3ia6 n LEU 393 CO 0.39 1.87 0.35 -0.44 -1.22 0.00 0.00 177.39 178.34 3ia6 s SER 394 N 0.70 6.74 0.00 -1.43 0.01 -1.24 -4.51 113.70 113.98 3ia6 s SER 394 Ca 0.59 0.90 0.30 0.00 1.31 0.00 0.00 55.95 59.05 3ia6 s SER 394 Cb 0.29 -2.35 1.51 0.00 0.21 0.00 0.00 66.02 65.68 3ia6 s SER 394 CO -0.14 -0.20 2.02 0.61 0.41 0.00 0.00 173.24 175.93 3ia6 n GLY 395 N 3.58 -0.88 1.01 3.44 0.00 -1.26 -3.52 105.19 107.57 3ia6 n GLY 395 Ca -0.02 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.86 3ia6 n GLY 395 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3ia6 n ASP 396 N -0.86 2.99 -4.77 1.61 5.75 -1.26 -4.94 116.55 115.07 3ia6 n ASP 396 Ca 0.19 -1.94 -0.41 0.00 -0.01 0.00 0.00 54.79 52.62 3ia6 n ASP 396 Cb 0.22 -0.27 -0.01 0.00 -1.03 0.00 0.00 41.12 40.02 3ia6 n ASP 396 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3ia6 s ARG 397 N -1.45 4.20 0.49 0.11 1.81 -1.23 -4.95 118.95 117.93 3ia6 s ARG 397 Ca 0.38 2.39 -0.22 0.00 -1.72 0.00 0.00 55.73 56.56 3ia6 s ARG 397 Cb 0.21 -2.99 -0.07 0.00 -0.45 0.00 0.00 34.95 31.65 3ia6 s ARG 397 CO 0.29 -0.39 1.15 -1.25 -0.68 0.00 0.00 175.30 174.42 3ia6 s PRO 398 N -1.98 3.63 0.00 3.54 0.04 -1.26 -3.58 135.00 135.39 3ia6 s PRO 398 Ca 0.51 1.71 0.00 0.00 0.04 0.00 0.00 61.00 63.26 3ia6 s PRO 398 Cb -0.43 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 31.84 3ia6 s PRO 398 CO 0.58 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.39 3ia6 n GLY 399 N 0.33 0.84 3.76 0.56 0.00 -1.26 -5.00 105.19 104.41 3ia6 n GLY 399 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 3ia6 n GLY 399 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ia6 s LEU 400 N 0.00 3.93 -0.26 0.99 1.43 -1.24 -4.96 118.68 118.58 3ia6 s LEU 400 Ca 0.00 2.63 -0.00 0.00 -1.03 0.00 0.00 54.13 55.73 3ia6 s LEU 400 Cb 0.00 -4.23 -0.16 0.00 0.03 0.00 0.00 46.19 41.83 3ia6 s LEU 400 CO 0.00 -1.33 -0.24 0.18 0.23 0.00 0.00 176.35 175.19 3ia6 n LEU 401 N -0.78 2.83 -3.70 1.79 4.77 -1.26 -4.81 117.00 115.84 3ia6 n LEU 401 Ca 0.09 -0.07 -0.28 0.00 -0.03 0.00 0.00 56.01 55.72 3ia6 n LEU 401 Cb 0.46 -0.88 -0.11 0.00 -2.33 0.00 0.00 43.42 40.55 3ia6 n LEU 401 CO 0.52 0.88 -0.16 0.21 -1.33 0.00 0.00 177.39 177.51 3ia6 s ASN 402 N -6.62 3.51 0.46 -1.43 2.47 -1.26 -4.96 114.94 107.11 3ia6 s ASN 402 Ca -0.35 -3.43 0.18 0.00 0.42 0.00 0.00 52.86 49.68 3ia6 s ASN 402 Cb 0.10 -1.15 1.10 0.00 -1.45 0.00 0.00 41.25 39.84 3ia6 s ASN 402 CO 0.57 -0.14 2.00 0.58 -3.72 0.00 0.00 177.10 176.39 3ia6 h VAL 403 N 4.59 0.99 0.45 -5.21 2.07 -1.92 -3.34 116.25 113.88 3ia6 h VAL 403 Ca 0.17 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 3ia6 h VAL 403 Cb 0.83 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 3ia6 h VAL 403 CO 0.57 0.18 -0.50 0.50 0.02 0.00 0.00 177.57 178.35 3ia6 h LYS 404 N 0.00 -0.92 0.00 1.57 3.64 -1.97 -2.01 116.57 116.87 3ia6 h LYS 404 Ca -0.00 0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3ia6 h LYS 404 Cb 0.36 0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 3ia6 h LYS 404 CO 0.02 -0.61 -0.11 -1.00 -2.27 0.00 0.00 179.45 175.48 3ia6 h PRO 405 N -0.96 0.00 0.40 1.90 0.13 -2.00 -0.07 132.00 131.41 3ia6 h PRO 405 Ca -0.05 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.06 3ia6 h PRO 405 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3ia6 h PRO 405 CO -0.09 0.11 -0.19 0.82 -0.23 0.00 0.00 178.00 178.41 3ia6 h ILE 406 N 0.00 0.58 -0.73 -3.56 2.04 -1.65 -1.86 117.51 112.32 3ia6 h ILE 406 Ca -0.00 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.50 3ia6 h ILE 406 Cb 0.38 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 3ia6 h ILE 406 CO 0.01 0.07 0.48 -0.33 0.00 0.00 0.00 178.15 178.39 3ia6 h GLU 407 N -0.77 0.88 -0.71 2.37 5.08 -1.01 -0.33 114.58 120.08 3ia6 h GLU 407 Ca -0.05 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3ia6 h GLU 407 Cb 0.53 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.54 3ia6 h GLU 407 CO 0.09 0.58 0.45 -0.44 -1.00 0.00 0.00 179.01 178.69 3ia6 h ASP 408 N 0.90 0.74 -0.13 1.42 3.32 -0.95 -1.21 116.42 120.51 3ia6 h ASP 408 Ca 0.29 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.18 3ia6 h ASP 408 Cb 0.04 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.43 3ia6 h ASP 408 CO -0.08 0.52 -0.51 0.40 -1.72 0.00 0.00 179.24 177.84 3ia6 h ILE 409 N 0.88 1.34 -0.82 0.35 2.04 -0.61 -2.91 117.51 117.79 3ia6 h ILE 409 Ca 0.28 -1.80 -0.02 0.00 1.00 0.00 0.00 64.86 64.33 3ia6 h ILE 409 Cb 0.01 2.09 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 3ia6 h ILE 409 CO -0.10 0.55 0.43 -0.61 0.00 0.00 0.00 178.15 178.42 3ia6 h GLN 410 N 0.22 1.15 -0.68 2.37 4.15 -0.99 0.97 115.11 122.30 3ia6 h GLN 410 Ca -0.03 -0.15 0.04 0.00 0.77 0.00 0.00 58.65 59.29 3ia6 h GLN 410 Cb 1.15 -0.22 -0.05 0.00 0.21 0.00 0.00 27.48 28.57 3ia6 h GLN 410 CO 0.11 0.86 0.40 -0.44 -1.93 0.00 0.00 178.83 177.83 3ia6 h ASP 411 N 1.14 0.64 -0.37 -0.69 3.32 -1.27 0.52 116.42 119.71 3ia6 h ASP 411 Ca 0.29 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.25 3ia6 h ASP 411 Cb 0.06 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3ia6 h ASP 411 CO -0.04 0.43 -0.13 -1.13 -1.72 0.00 0.00 179.24 176.64 3ia6 h ASN 412 N 0.77 0.82 -0.49 6.45 -1.24 -1.19 -1.66 115.58 119.05 3ia6 h ASN 412 Ca 0.29 -0.26 -0.12 0.00 0.71 0.00 0.00 56.30 56.91 3ia6 h ASN 412 Cb 0.10 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 38.91 3ia6 h ASN 412 CO -0.14 0.97 -0.17 -0.07 -1.29 0.00 0.00 177.43 176.72 3ia6 h LEU 413 N 0.74 1.01 -0.53 0.34 3.38 -0.29 -2.43 115.31 117.53 3ia6 h LEU 413 Ca 0.12 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 3ia6 h LEU 413 Cb 0.64 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3ia6 h LEU 413 CO 0.04 1.16 0.30 -0.07 0.09 0.00 0.00 178.44 179.96 3ia6 h LEU 414 N 0.87 0.65 -0.95 1.67 3.38 0.15 0.45 115.31 121.53 3ia6 h LEU 414 Ca 0.12 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3ia6 h LEU 414 Cb 0.75 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 3ia6 h LEU 414 CO 0.06 0.54 0.62 1.56 0.09 0.00 0.00 178.44 181.32 3ia6 h GLN 415 N 0.71 1.20 -0.26 1.13 4.20 -1.28 -1.38 115.11 119.43 3ia6 h GLN 415 Ca 0.19 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.69 3ia6 h GLN 415 Cb 0.03 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 3ia6 h GLN 415 CO -0.03 0.79 -0.40 0.00 -0.67 0.00 0.00 178.83 178.52 3ia6 h ALA 416 N 1.37 0.81 -0.43 3.87 0.00 -0.91 -2.53 119.26 121.44 3ia6 h ALA 416 Ca 0.37 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 3ia6 h ALA 416 Cb -0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ia6 h ALA 416 CO -0.10 0.65 -0.12 1.25 0.00 0.00 0.00 179.25 180.93 3ia6 h LEU 417 N 0.51 0.86 -0.13 0.00 5.85 -0.58 -1.68 115.31 120.14 3ia6 h LEU 417 Ca 0.04 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 3ia6 h LEU 417 Cb 0.92 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 3ia6 h LEU 417 CO 0.08 1.03 0.06 -0.08 -0.34 0.00 0.00 178.44 179.19 3ia6 h GLU 418 N 0.67 0.18 -0.60 1.25 4.81 -1.19 -0.86 114.58 118.84 3ia6 h GLU 418 Ca 0.11 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 3ia6 h GLU 418 Cb 0.66 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.99 3ia6 h GLU 418 CO 0.05 0.23 0.10 1.25 -0.73 0.00 0.00 179.01 179.91 3ia6 h LEU 419 N 0.09 0.95 -0.10 1.64 5.85 -1.48 -1.79 115.31 120.46 3ia6 h LEU 419 Ca 0.04 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.54 3ia6 h LEU 419 Cb 0.11 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 3ia6 h LEU 419 CO -0.01 0.96 -0.16 -0.61 -0.34 0.00 0.00 178.44 178.29 3ia6 h GLN 420 N 0.89 -0.20 -0.56 1.25 5.75 -1.10 -0.66 115.11 120.48 3ia6 h GLN 420 Ca 0.18 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.65 3ia6 h GLN 420 Cb 0.42 0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.99 3ia6 h GLN 420 CO 0.01 -0.13 0.18 -0.07 -2.65 0.00 0.00 178.83 176.17 3ia6 h LEU 421 N -0.21 0.77 -0.72 -2.39 3.38 -1.09 0.14 115.31 115.19 3ia6 h LEU 421 Ca 0.08 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 3ia6 h LEU 421 Cb 0.33 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3ia6 h LEU 421 CO -0.22 0.72 -0.40 0.11 0.09 0.00 0.00 178.44 178.75 3ia6 h LYS 422 N 0.81 0.52 0.16 1.13 1.57 -1.01 -0.37 116.57 119.38 3ia6 h LYS 422 Ca 0.19 -0.26 -0.31 0.00 -1.87 0.00 0.00 60.65 58.39 3ia6 h LYS 422 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.55 3ia6 h LYS 422 CO -0.01 0.83 -1.51 -0.07 -0.57 0.00 0.00 179.45 178.12 3ia6 h LEU 423 N 0.43 0.52 0.00 2.94 3.38 -0.91 -3.22 115.31 118.45 3ia6 h LEU 423 Ca 0.04 -0.66 -0.05 0.00 0.09 0.00 0.00 57.88 57.29 3ia6 h LEU 423 Cb 0.88 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 3ia6 h LEU 423 CO 0.08 1.54 -0.81 -1.13 0.09 0.00 0.00 178.44 178.21 3ia6 h ASN 424 N 0.09 0.00 -2.05 -0.43 -1.24 -0.75 -3.37 115.58 107.84 3ia6 h ASN 424 Ca -0.24 0.00 -0.51 0.00 0.71 0.00 0.00 56.30 56.25 3ia6 h ASN 424 Cb 2.05 0.00 -0.40 0.00 0.73 0.00 0.00 38.32 40.70 3ia6 h ASN 424 CO 0.19 0.21 -1.08 1.41 -1.29 0.00 0.00 177.43 176.87 3ia6 n HIS 425 N -2.90 0.79 0.29 0.67 8.25 -0.15 -4.97 115.22 117.20 3ia6 n HIS 425 Ca -0.01 -3.82 0.14 0.00 -0.26 0.00 0.00 57.72 53.77 3ia6 n HIS 425 Cb 0.64 -0.42 0.87 0.00 1.12 0.00 0.00 29.99 32.20 3ia6 n HIS 425 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3ia6 h PRO 426 N 3.19 0.00 -0.02 -0.41 0.13 -1.72 -1.80 132.00 131.37 3ia6 h PRO 426 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3ia6 h PRO 426 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3ia6 h PRO 426 CO 0.55 0.00 -0.02 0.39 -0.23 0.00 0.00 178.00 178.69 3ia6 n GLU 427 N -3.96 2.03 -3.09 0.86 1.02 -1.26 -4.76 120.64 111.47 3ia6 n GLU 427 Ca -0.03 -1.53 -0.45 0.00 -0.02 0.00 0.00 57.16 55.13 3ia6 n GLU 427 Cb 0.08 -1.47 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 3ia6 n GLU 427 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3ia6 s SER 428 N -2.03 6.31 0.08 1.62 0.15 -0.68 -5.03 113.70 114.12 3ia6 s SER 428 Ca 0.31 -1.63 -0.31 0.00 0.70 0.00 0.00 55.95 55.02 3ia6 s SER 428 Cb 0.20 -2.31 -0.07 0.00 -1.71 0.00 0.00 66.02 62.13 3ia6 s SER 428 CO 0.33 -1.07 1.37 -0.55 1.20 0.00 0.00 173.24 174.51 3ia6 s SER 429 N 3.48 6.87 -1.68 5.45 0.15 -1.26 -3.32 113.70 123.38 3ia6 s SER 429 Ca 0.16 2.23 0.00 0.00 0.70 0.00 0.00 55.95 59.03 3ia6 s SER 429 Cb -0.19 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 3ia6 s SER 429 CO 0.03 -0.64 0.00 1.67 1.20 0.00 0.00 173.24 175.49 3ia6 n GLN 430 N 4.33 -1.32 -0.28 5.44 -0.06 -1.26 -4.89 117.38 119.34 3ia6 n GLN 430 Ca 0.12 0.98 0.05 0.00 -2.00 0.00 0.00 57.00 56.15 3ia6 n GLN 430 Cb 0.43 -5.35 0.19 0.00 -4.06 0.00 0.00 30.24 21.45 3ia6 n GLN 430 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 3ia6 h LEU 431 N 0.00 0.51 0.08 1.69 5.85 -1.95 -2.39 115.31 119.10 3ia6 h LEU 431 Ca -0.39 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.43 3ia6 h LEU 431 Cb 1.23 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.21 3ia6 h LEU 431 CO 0.51 0.24 -0.38 0.15 -0.34 0.00 0.00 178.44 178.62 3ia6 h PHE 432 N 0.63 -1.06 -0.55 1.25 3.57 -1.90 0.10 116.94 118.97 3ia6 h PHE 432 Ca 0.42 0.03 0.11 0.00 3.53 0.00 0.00 57.97 62.06 3ia6 h PHE 432 Cb 0.54 0.46 -0.09 0.00 2.79 0.00 0.00 35.95 39.65 3ia6 h PHE 432 CO -0.10 -0.48 0.04 0.00 -2.23 0.00 0.00 178.31 175.54 3ia6 h ALA 433 N -0.01 0.57 -0.42 2.41 0.00 -1.91 -1.20 119.26 118.70 3ia6 h ALA 433 Ca 0.04 0.15 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 3ia6 h ALA 433 Cb 0.63 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3ia6 h ALA 433 CO -0.25 -0.36 -0.13 0.87 0.00 0.00 0.00 179.25 179.37 3ia6 h LYS 434 N 0.16 0.76 -0.14 0.00 1.57 -0.90 -1.40 116.57 116.62 3ia6 h LYS 434 Ca 0.28 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3ia6 h LYS 434 Cb 0.43 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 3ia6 h LYS 434 CO -0.43 0.86 0.08 1.25 -0.57 0.00 0.00 179.45 180.63 3ia6 h LEU 435 N 0.69 0.17 -1.35 2.94 5.85 -0.48 -2.87 115.31 120.26 3ia6 h LEU 435 Ca 0.11 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.82 3ia6 h LEU 435 Cb 0.61 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 3ia6 h LEU 435 CO 0.04 0.19 0.49 -0.07 -0.34 0.00 0.00 178.44 178.74 3ia6 h LEU 436 N 0.14 0.70 -1.50 2.25 3.38 -0.89 -1.10 115.31 118.29 3ia6 h LEU 436 Ca 0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3ia6 h LEU 436 Cb 0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3ia6 h LEU 436 CO -0.01 0.46 -0.25 1.56 0.09 0.00 0.00 178.44 180.29 3ia6 h GLN 437 N 0.80 0.00 0.00 1.13 4.20 -1.14 -2.38 115.11 117.72 3ia6 h GLN 437 Ca 0.31 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.01 3ia6 h GLN 437 Cb 0.21 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.99 3ia6 h GLN 437 CO -0.10 0.25 -0.07 0.87 -0.67 0.00 0.00 178.83 179.11 3ia6 h LYS 438 N 0.00 0.00 -0.08 1.46 1.79 -0.98 -2.65 116.57 116.11 3ia6 h LYS 438 Ca -0.00 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 3ia6 h LYS 438 Cb 0.46 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.11 3ia6 h LYS 438 CO 0.03 0.07 0.08 0.52 -1.08 0.00 0.00 179.45 179.07 3ia6 h MET 439 N 0.00 0.00 -0.25 3.15 2.86 -1.47 -0.18 114.93 119.03 3ia6 h MET 439 Ca -0.00 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 3ia6 h MET 439 Cb 0.20 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 3ia6 h MET 439 CO 0.01 0.00 -0.27 1.79 1.06 0.00 0.00 176.91 179.50 3ia6 h THR 440 N 0.00 1.31 -0.77 2.22 1.35 -1.66 -2.10 112.91 113.27 3ia6 h THR 440 Ca 0.04 -1.45 0.03 0.00 -0.55 0.00 0.00 66.41 64.48 3ia6 h THR 440 Cb 0.20 1.67 -0.04 0.00 -1.73 0.00 0.00 68.15 68.24 3ia6 h THR 440 CO -0.00 0.46 0.49 0.44 -0.25 0.00 0.00 175.52 176.66 3ia6 h ASP 441 N 0.34 0.82 -0.07 5.36 3.32 -1.21 -2.00 116.42 122.99 3ia6 h ASP 441 Ca 0.04 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3ia6 h ASP 441 Cb 0.84 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 3ia6 h ASP 441 CO 0.07 0.58 0.04 -0.07 -1.72 0.00 0.00 179.24 178.13 3ia6 h LEU 442 N 0.97 0.09 -1.03 1.55 3.38 -1.13 -1.73 115.31 117.42 3ia6 h LEU 442 Ca 0.30 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 3ia6 h LEU 442 Cb -0.02 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3ia6 h LEU 442 CO -0.10 0.14 -0.05 0.03 0.09 0.00 0.00 178.44 178.55 3ia6 h ARG 443 N 0.03 0.65 -0.54 1.13 3.08 -1.27 -0.16 114.38 117.30 3ia6 h ARG 443 Ca 0.03 -0.17 -0.11 0.00 0.07 0.00 0.00 59.98 59.79 3ia6 h ARG 443 Cb 0.07 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3ia6 h ARG 443 CO -0.00 0.70 -0.10 0.37 -1.07 0.00 0.00 179.97 179.87 3ia6 h GLN 444 N 0.60 1.01 -0.29 0.04 4.15 -1.32 -1.99 115.11 117.32 3ia6 h GLN 444 Ca 0.12 -0.37 -0.17 0.00 0.77 0.00 0.00 58.65 59.00 3ia6 h GLN 444 Cb 0.45 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 3ia6 h GLN 444 CO 0.02 1.05 -0.49 0.82 -1.93 0.00 0.00 178.83 178.30 3ia6 h ILE 445 N 0.90 1.28 -0.25 2.39 2.04 -0.78 -2.03 117.51 121.08 3ia6 h ILE 445 Ca 0.14 -1.69 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 3ia6 h ILE 445 Cb 0.66 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3ia6 h ILE 445 CO 0.05 0.55 0.13 0.58 0.00 0.00 0.00 178.15 179.45 3ia6 h VAL 446 N 0.63 1.13 -0.54 1.67 2.07 -0.99 -1.90 116.25 118.32 3ia6 h VAL 446 Ca 0.03 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 3ia6 h VAL 446 Cb 1.08 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 3ia6 h VAL 446 CO 0.11 0.13 0.33 0.74 0.02 0.00 0.00 177.57 178.89 3ia6 h THR 447 N 0.28 1.16 0.00 2.57 2.02 -1.27 -2.05 112.91 115.62 3ia6 h THR 447 Ca 0.09 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 3ia6 h THR 447 Cb 0.08 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.91 3ia6 h THR 447 CO -0.01 0.16 -0.11 1.05 0.37 0.00 0.00 175.52 176.98 3ia6 h GLU 448 N 0.72 0.00 -0.05 6.66 4.11 -1.33 -2.62 114.58 122.08 3ia6 h GLU 448 Ca 0.19 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.60 3ia6 h GLU 448 Cb -0.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 3ia6 h GLU 448 CO -0.04 0.11 -0.04 1.25 0.07 0.00 0.00 179.01 180.36 3ia6 h HIS 449 N 0.00 0.14 -0.55 2.06 2.76 -0.86 -0.41 115.15 118.28 3ia6 h HIS 449 Ca -0.00 -0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3ia6 h HIS 449 Cb 0.88 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.78 3ia6 h HIS 449 CO 0.00 0.56 0.36 -0.39 -1.30 0.00 0.00 177.93 177.15 3ia6 h VAL 450 N -0.32 1.15 -0.36 5.26 -1.51 -1.33 -0.01 116.25 119.12 3ia6 h VAL 450 Ca 0.01 -0.28 -0.07 0.00 -1.23 0.00 0.00 66.70 65.12 3ia6 h VAL 450 Cb 0.53 0.34 -0.02 0.00 -2.13 0.00 0.00 31.29 30.01 3ia6 h VAL 450 CO 0.01 0.14 -0.08 -0.61 -1.23 0.00 0.00 177.57 175.81 3ia6 h GLN 451 N 0.75 0.61 0.00 5.19 4.15 -1.39 -1.57 115.11 122.86 3ia6 h GLN 451 Ca 0.20 -0.17 -0.14 0.00 0.77 0.00 0.00 58.65 59.31 3ia6 h GLN 451 Cb -0.07 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 3ia6 h GLN 451 CO -0.04 0.69 -0.67 1.25 -1.93 0.00 0.00 178.83 178.12 3ia6 h LEU 452 N 0.57 0.00 -0.40 -2.39 6.46 0.52 -3.18 115.31 116.88 3ia6 h LEU 452 Ca 0.11 0.00 -0.18 0.00 -0.12 0.00 0.00 57.88 57.69 3ia6 h LEU 452 Cb 0.47 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 3ia6 h LEU 452 CO 0.03 0.67 -0.79 -0.07 -0.62 0.00 0.00 178.44 177.65 3ia6 h LEU 453 N 0.00 0.21 -0.96 2.25 4.07 -0.70 -2.48 115.31 117.70 3ia6 h LEU 453 Ca -0.01 -0.16 -0.09 0.00 0.08 0.00 0.00 57.88 57.71 3ia6 h LEU 453 Cb 1.23 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.89 3ia6 h LEU 453 CO 0.09 0.92 -0.17 0.06 -1.08 0.00 0.00 178.44 178.25 3ia6 h GLN 454 N 0.10 0.56 -0.26 1.13 3.07 -1.30 0.35 115.11 118.76 3ia6 h GLN 454 Ca -0.03 -0.19 -0.15 0.00 0.09 0.00 0.00 58.65 58.37 3ia6 h GLN 454 Cb 1.39 -0.05 -0.00 0.00 0.08 0.00 0.00 27.48 28.90 3ia6 h GLN 454 CO 0.12 0.71 -0.44 0.28 0.09 0.00 0.00 178.83 179.58 3ia6 h VAL 455 N 0.50 1.30 -0.71 1.86 2.07 -1.54 -3.18 116.25 116.54 3ia6 h VAL 455 Ca 0.08 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.97 3ia6 h VAL 455 Cb 0.59 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 3ia6 h VAL 455 CO 0.04 0.52 0.45 0.40 0.02 0.00 0.00 177.57 179.01 3ia6 h ILE 456 N 0.49 1.19 -0.37 4.57 2.04 -1.21 -1.76 117.51 122.46 3ia6 h ILE 456 Ca 0.02 -0.38 0.11 0.00 1.00 0.00 0.00 64.86 65.60 3ia6 h ILE 456 Cb 1.04 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 3ia6 h ILE 456 CO 0.10 0.19 0.55 0.50 0.00 0.00 0.00 178.15 179.49 3ia6 h LYS 457 N 0.97 0.00 -1.08 2.37 3.64 -0.91 0.20 116.57 121.75 3ia6 h LYS 457 Ca 0.26 0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 58.97 3ia6 h LYS 457 Cb -0.08 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 31.43 3ia6 h LYS 457 CO -0.05 0.00 0.63 1.63 -2.27 0.00 0.00 179.45 179.39 3ia6 n LYS 458 N -3.39 2.84 0.16 1.90 5.02 -0.66 -3.88 118.16 120.15 3ia6 n LYS 458 Ca 0.07 -3.46 0.00 0.00 -2.02 0.00 0.00 58.31 52.90 3ia6 n LYS 458 Cb 0.70 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 3ia6 n LYS 458 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3ia6 n THR 459 N -0.84 0.00 -1.91 -0.18 -1.04 0.57 -4.90 114.28 105.97 3ia6 n THR 459 Ca 0.59 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 62.18 3ia6 n THR 459 Cb 0.66 -0.21 0.00 0.00 -1.82 0.00 0.00 70.33 68.96 3ia6 n THR 459 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 3ia6 n GLU 460 N -3.26 3.07 -1.09 -2.82 0.00 -0.46 -5.14 120.64 110.94 3ia6 n GLU 460 Ca 0.00 -2.87 -0.16 0.00 0.00 0.00 0.00 57.16 54.13 3ia6 n GLU 460 Cb 0.00 -3.19 -0.15 0.00 0.00 0.00 0.00 31.44 28.10 3ia6 n GLU 460 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3ia6 n THR 461 N 4.64 3.16 0.00 6.31 -2.24 -1.25 -4.67 114.28 120.23 3ia6 n THR 461 Ca 0.49 -1.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.49 3ia6 n THR 461 Cb 0.38 -2.00 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 3ia6 n THR 461 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3ia6 n HIS 466 N 2.40 0.00 0.26 4.78 -0.00 -1.26 -5.11 115.22 116.29 3ia6 n HIS 466 Ca 0.47 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 58.29 3ia6 n HIS 466 Cb 0.82 0.00 0.71 0.00 -0.00 0.00 0.00 29.99 31.52 3ia6 n HIS 466 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3ia6 h PRO 467 N 0.00 0.00 0.00 1.57 0.11 -2.06 0.81 132.00 132.43 3ia6 h PRO 467 Ca 0.00 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.94 3ia6 h PRO 467 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 3ia6 h PRO 467 CO 0.00 0.08 -0.83 1.25 -0.21 0.00 0.00 178.00 178.29 3ia6 h LEU 468 N 0.00 0.00 -0.34 2.35 5.85 -2.06 -3.05 115.31 118.06 3ia6 h LEU 468 Ca -0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 3ia6 h LEU 468 Cb 0.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3ia6 h LEU 468 CO 0.01 0.80 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.58 3ia6 h LEU 469 N 0.00 0.81 -1.33 2.25 3.38 -1.80 -2.78 115.31 115.84 3ia6 h LEU 469 Ca -0.02 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3ia6 h LEU 469 Cb 1.62 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3ia6 h LEU 469 CO 0.10 1.08 0.00 1.56 0.09 0.00 0.00 178.44 181.28 3ia6 h GLN 470 N 0.55 0.00 0.02 1.13 4.20 -0.92 -1.72 115.11 118.37 3ia6 h GLN 470 Ca 0.06 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.59 3ia6 h GLN 470 Cb 0.82 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.62 3ia6 h GLN 470 CO 0.07 0.00 -0.72 0.93 -0.67 0.00 0.00 178.83 178.43 3ia6 h GLU 471 N 0.00 0.45 -0.37 1.46 4.39 -1.41 -3.08 114.58 116.02 3ia6 h GLU 471 Ca 0.00 -0.51 -0.03 0.00 0.34 0.00 0.00 59.36 59.15 3ia6 h GLU 471 Cb 0.34 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 3ia6 h GLU 471 CO 0.00 1.17 0.08 0.82 -1.16 0.00 0.00 179.01 179.92 3ia6 h ILE 472 N -0.05 1.17 -0.66 3.13 2.04 -1.13 -3.11 117.51 118.90 3ia6 h ILE 472 Ca -0.10 -0.62 -0.30 0.00 1.00 0.00 0.00 64.86 64.84 3ia6 h ILE 472 Cb 1.44 0.80 -0.18 0.00 -0.74 0.00 0.00 36.82 38.15 3ia6 h ILE 472 CO 0.14 0.23 0.27 -1.22 0.00 0.00 0.00 178.15 177.56 3ia6 n TYR 473 N -4.33 2.07 1.21 1.37 4.01 -0.71 -5.06 117.16 115.72 3ia6 n TYR 473 Ca 0.02 -1.56 0.10 0.00 -0.16 0.00 0.00 57.90 56.29 3ia6 n TYR 473 Cb 0.19 -0.69 0.58 0.00 -0.31 0.00 0.00 39.34 39.11 3ia6 n TYR 473 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76