#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 -1.19 -0.87 4.31 0.02 -2.02 -2.27 113.55 111.54 3ia6 h SER 208 Ca 0.00 0.20 0.10 0.00 -0.84 0.00 0.00 61.79 61.26 3ia6 h SER 208 Cb 0.00 0.55 -0.08 0.00 0.14 0.00 0.00 62.40 63.01 3ia6 h SER 208 CO 0.00 -0.34 0.51 0.00 -1.14 0.00 0.00 176.83 175.86 3ia6 h ALA 209 N 0.67 1.26 -0.44 3.77 0.00 -2.05 -0.24 119.26 122.23 3ia6 h ALA 209 Ca 0.17 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 3ia6 h ALA 209 Cb 0.56 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3ia6 h ALA 209 CO -0.56 0.12 -0.21 -0.44 0.00 0.00 0.00 179.25 178.16 3ia6 h ASP 210 N 0.83 0.91 0.05 0.00 3.32 -1.86 -1.93 116.42 117.72 3ia6 h ASP 210 Ca 0.42 -0.33 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 3ia6 h ASP 210 Cb 0.41 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 3ia6 h ASP 210 CO -0.26 1.08 -0.50 -0.07 -1.72 0.00 0.00 179.24 177.77 3ia6 h LEU 211 N 0.77 0.56 -0.24 1.55 3.38 -0.89 -1.76 115.31 118.68 3ia6 h LEU 211 Ca 0.11 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 3ia6 h LEU 211 Cb 0.75 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3ia6 h LEU 211 CO 0.06 0.97 0.04 0.03 0.09 0.00 0.00 178.44 179.63 3ia6 h ARG 212 N 0.40 0.40 -0.71 1.13 3.08 -0.99 -1.46 114.38 116.24 3ia6 h ARG 212 Ca 0.02 -0.11 0.04 0.00 0.07 0.00 0.00 59.98 60.00 3ia6 h ARG 212 Cb 1.02 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.98 3ia6 h ARG 212 CO 0.09 0.53 0.47 0.00 -1.07 0.00 0.00 179.97 179.99 3ia6 h ALA 213 N 0.86 1.61 -0.44 0.04 0.00 -1.29 -1.20 119.26 118.83 3ia6 h ALA 213 Ca 0.07 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3ia6 h ALA 213 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3ia6 h ALA 213 CO 0.00 0.32 -0.06 1.25 0.00 0.00 0.00 179.25 180.76 3ia6 h LEU 214 N 0.84 0.81 -0.40 0.00 5.85 -1.11 -2.40 115.31 118.90 3ia6 h LEU 214 Ca 0.28 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.70 3ia6 h LEU 214 Cb 0.08 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 3ia6 h LEU 214 CO -0.08 0.96 0.17 0.00 -0.34 0.00 0.00 178.44 179.15 3ia6 h ALA 215 N 0.88 0.49 -0.25 1.25 0.00 -0.52 -1.76 119.26 119.35 3ia6 h ALA 215 Ca 0.12 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ia6 h ALA 215 Cb 0.58 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3ia6 h ALA 215 CO 0.03 -0.21 0.11 0.87 0.00 0.00 0.00 179.25 180.06 3ia6 h LYS 216 N 0.35 0.36 -0.80 0.00 1.57 -1.24 -0.92 116.57 115.91 3ia6 h LYS 216 Ca 0.18 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 58.94 3ia6 h LYS 216 Cb 0.12 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 3ia6 h LYS 216 CO -0.15 0.37 0.50 1.25 -0.57 0.00 0.00 179.45 180.85 3ia6 h HIS 217 N 0.26 0.94 -0.26 -1.35 2.76 -1.23 0.46 115.15 116.73 3ia6 h HIS 217 Ca 0.08 0.03 -0.19 0.00 -2.20 0.00 0.00 60.37 58.09 3ia6 h HIS 217 Cb 0.14 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 28.79 3ia6 h HIS 217 CO -0.02 0.53 -0.58 -0.07 -1.30 0.00 0.00 177.93 176.49 3ia6 h LEU 218 N 0.97 0.92 -0.23 0.26 3.38 -1.15 -1.96 115.31 117.50 3ia6 h LEU 218 Ca 0.32 -0.51 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3ia6 h LEU 218 Cb 0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3ia6 h LEU 218 CO -0.12 1.29 0.12 0.22 0.09 0.00 0.00 178.44 180.04 3ia6 h TYR 219 N 0.62 0.23 -0.56 1.13 3.20 -0.94 -0.87 116.97 119.78 3ia6 h TYR 219 Ca 0.01 0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.96 3ia6 h TYR 219 Cb 1.18 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 39.32 3ia6 h TYR 219 CO 0.07 0.13 0.23 0.22 -1.64 0.00 0.00 178.16 177.18 3ia6 h ASP 220 N 0.26 0.28 0.44 -2.11 3.58 -0.82 -0.93 116.42 117.11 3ia6 h ASP 220 Ca 0.09 0.06 -0.16 0.00 0.42 0.00 0.00 57.03 57.44 3ia6 h ASP 220 Cb 0.01 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 3ia6 h ASP 220 CO -0.05 0.18 -0.70 0.28 -2.88 0.00 0.00 179.24 176.07 3ia6 h SER 221 N 0.44 0.26 0.16 2.28 0.02 -1.20 -2.48 113.55 113.04 3ia6 h SER 221 Ca 0.27 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 3ia6 h SER 221 Cb 0.28 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 3ia6 h SER 221 CO -0.25 0.88 -0.09 0.22 -1.14 0.00 0.00 176.83 176.45 3ia6 h TYR 222 N 0.15 -0.24 -0.81 3.45 5.03 -0.76 0.12 116.97 123.91 3ia6 h TYR 222 Ca -0.02 -0.00 0.11 0.00 2.58 0.00 0.00 58.73 61.40 3ia6 h TYR 222 Cb 1.24 0.08 -0.08 0.00 1.55 0.00 0.00 36.73 39.53 3ia6 h TYR 222 CO 0.02 -0.15 0.44 0.82 -1.32 0.00 0.00 178.16 177.98 3ia6 h ILE 223 N -0.24 0.85 0.00 1.81 1.08 -1.07 -0.78 117.51 119.15 3ia6 h ILE 223 Ca -0.02 -0.24 -0.09 0.00 -0.39 0.00 0.00 64.86 64.12 3ia6 h ILE 223 Cb 0.20 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.01 3ia6 h ILE 223 CO 0.02 0.13 -0.44 0.11 -0.69 0.00 0.00 178.15 177.29 3ia6 h LYS 224 N 0.71 0.00 0.00 2.37 1.57 -1.16 -3.30 116.57 116.76 3ia6 h LYS 224 Ca 0.41 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.91 3ia6 h LYS 224 Cb 0.44 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 3ia6 h LYS 224 CO -0.28 0.44 -1.80 0.43 -0.57 0.00 0.00 179.45 177.66 3ia6 n SER 225 N -3.63 0.65 -4.05 0.86 7.64 0.00 -4.83 113.62 110.27 3ia6 n SER 225 Ca -0.01 0.30 -0.32 0.00 1.01 0.00 0.00 58.87 59.85 3ia6 n SER 225 Cb 0.53 0.29 -0.14 0.00 -1.01 0.00 0.00 64.21 63.87 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 -2.67 3.62 0.15 1.43 0.08 -0.37 -4.76 117.98 115.45 3ia6 s PHE 226 Ca -0.06 -2.72 0.24 0.00 0.12 0.00 0.00 56.93 54.51 3ia6 s PHE 226 Cb 0.08 -2.76 0.95 0.00 -0.57 0.00 0.00 43.02 40.72 3ia6 s PHE 226 CO 0.83 -0.93 1.84 -1.00 -0.10 0.00 0.00 175.22 175.85 3ia6 h PRO 227 N 7.73 0.00 -4.17 0.24 0.13 -1.87 -3.37 132.00 130.70 3ia6 h PRO 227 Ca -0.09 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.31 3ia6 h PRO 227 Cb 1.03 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.87 3ia6 h PRO 227 CO 0.54 0.22 -0.32 -1.17 -0.23 0.00 0.00 178.00 177.03 3ia6 s LEU 228 N -6.80 5.81 0.74 1.56 2.96 -1.26 -5.07 118.68 116.62 3ia6 s LEU 228 Ca 0.00 -2.07 -0.07 0.00 -0.22 0.00 0.00 54.13 51.78 3ia6 s LEU 228 Cb 0.10 -2.04 0.09 0.00 0.50 0.00 0.00 46.19 44.85 3ia6 s LEU 228 CO 0.63 -0.67 1.05 0.42 -1.32 0.00 0.00 176.35 176.46 3ia6 s THR 229 N 1.14 2.22 0.13 3.68 -4.23 -1.26 -4.91 115.64 112.41 3ia6 s THR 229 Ca 0.08 -0.28 -0.13 0.00 -1.18 0.00 0.00 61.69 60.17 3ia6 s THR 229 Cb -0.24 -2.94 -0.03 0.00 1.34 0.00 0.00 72.50 70.62 3ia6 s THR 229 CO -0.01 0.00 1.51 0.50 -0.54 0.00 0.00 174.62 176.08 3ia6 h LYS 230 N -0.72 0.79 -0.78 3.99 3.64 -1.95 -0.91 116.57 120.62 3ia6 h LYS 230 Ca -0.43 -0.33 0.12 0.00 -1.27 0.00 0.00 60.65 58.74 3ia6 h LYS 230 Cb 1.30 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 33.00 3ia6 h LYS 230 CO 0.55 0.95 0.39 0.00 -2.27 0.00 0.00 179.45 179.07 3ia6 h ALA 231 N 0.82 1.13 -0.13 5.00 0.00 -1.95 0.12 119.26 124.25 3ia6 h ALA 231 Ca 0.09 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3ia6 h ALA 231 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3ia6 h ALA 231 CO 0.05 -0.07 -0.23 -0.22 0.00 0.00 0.00 179.25 178.78 3ia6 h LYS 232 N 0.61 0.39 -0.63 0.00 3.64 -1.92 -2.47 116.57 116.19 3ia6 h LYS 232 Ca 0.41 -0.25 0.09 0.00 -1.27 0.00 0.00 60.65 59.63 3ia6 h LYS 232 Cb 0.51 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.29 3ia6 h LYS 232 CO -0.32 0.84 0.28 0.00 -2.27 0.00 0.00 179.45 177.98 3ia6 h ALA 233 N 0.55 0.84 -0.55 5.00 0.00 -0.72 -1.47 119.26 122.91 3ia6 h ALA 233 Ca 0.01 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3ia6 h ALA 233 Cb 0.81 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 3ia6 h ALA 233 CO 0.05 -0.12 0.08 0.00 0.00 0.00 0.00 179.25 179.26 3ia6 h ARG 234 N 0.50 0.92 -0.88 0.00 2.47 -1.03 -1.21 114.38 115.15 3ia6 h ARG 234 Ca 0.31 -0.25 0.06 0.00 -1.26 0.00 0.00 59.98 58.83 3ia6 h ARG 234 Cb 0.34 -0.11 -0.06 0.00 -1.65 0.00 0.00 29.97 28.49 3ia6 h ARG 234 CO -0.27 0.89 0.55 0.00 0.56 0.00 0.00 179.97 181.71 3ia6 h ALA 235 N 0.99 1.20 -0.29 0.04 0.00 -0.95 0.28 119.26 120.52 3ia6 h ALA 235 Ca 0.17 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 3ia6 h ALA 235 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ia6 h ALA 235 CO 0.01 0.33 -0.26 0.82 0.00 0.00 0.00 179.25 180.15 3ia6 h ILE 236 N 1.02 1.30 0.00 0.00 2.04 -1.08 -1.52 117.51 119.28 3ia6 h ILE 236 Ca 0.37 -1.42 -0.12 0.00 1.00 0.00 0.00 64.86 64.70 3ia6 h ILE 236 Cb 0.13 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 3ia6 h ILE 236 CO -0.16 0.45 -0.56 -0.07 0.00 0.00 0.00 178.15 177.81 3ia6 h LEU 237 N 0.44 0.00 -0.85 1.44 3.38 -0.79 -3.29 115.31 115.64 3ia6 h LEU 237 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3ia6 h LEU 237 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3ia6 h LEU 237 CO 0.07 0.56 -0.52 0.35 0.09 0.00 0.00 178.44 178.99 3ia6 n THR 238 N -3.75 0.00 -0.42 0.22 -2.24 0.05 -4.99 114.28 103.14 3ia6 n THR 238 Ca -0.01 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3ia6 n THR 238 Cb 0.59 1.21 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 3ia6 n THR 238 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ia6 n GLY 239 N 1.39 0.85 3.77 3.38 0.00 -1.14 -5.07 105.19 108.36 3ia6 n GLY 239 Ca 0.08 -0.40 -0.38 0.00 0.00 0.00 0.00 46.02 45.32 3ia6 n GLY 239 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ia6 s LYS 240 N -0.93 3.81 0.00 1.61 1.02 -0.59 -4.94 119.74 119.73 3ia6 s LYS 240 Ca 0.00 1.88 0.29 0.00 0.02 0.00 0.00 55.97 58.16 3ia6 s LYS 240 Cb 0.00 -2.51 1.23 0.00 -0.52 0.00 0.00 37.83 36.03 3ia6 s LYS 240 CO 0.00 -0.54 1.93 0.25 -0.92 0.00 0.00 175.35 176.07 3ia6 n THR 241 N -0.30 0.01 0.24 2.17 -2.24 -1.26 -2.38 114.28 110.52 3ia6 n THR 241 Ca 0.06 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.92 3ia6 n THR 241 Cb 0.47 -0.50 0.59 0.00 -2.10 0.00 0.00 70.33 68.78 3ia6 n THR 241 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3ia6 h THR 242 N 0.00 0.94 -3.38 4.28 1.35 -1.93 -3.45 112.91 110.72 3ia6 h THR 242 Ca 0.00 -0.57 -0.45 0.00 -0.55 0.00 0.00 66.41 64.84 3ia6 h THR 242 Cb 0.50 1.32 -0.14 0.00 -1.73 0.00 0.00 68.15 68.11 3ia6 h THR 242 CO 0.00 0.15 -0.57 -1.81 -0.25 0.00 0.00 175.52 173.05 3ia6 s ASP 243 N -6.71 1.96 0.16 5.36 1.01 -1.00 -5.11 116.67 112.33 3ia6 s ASP 243 Ca -0.04 -1.53 0.07 0.00 0.71 0.00 0.00 52.55 51.77 3ia6 s ASP 243 Cb 0.15 0.29 -0.04 0.00 1.01 0.00 0.00 42.92 44.33 3ia6 s ASP 243 CO 0.66 -0.82 0.00 -0.54 0.21 0.00 0.00 175.17 174.68 3ia6 s LYS 244 N -3.84 2.43 0.33 8.23 -0.14 -1.26 -4.75 119.74 120.75 3ia6 s LYS 244 Ca 0.33 -1.06 -0.26 0.00 -1.36 0.00 0.00 55.97 53.63 3ia6 s LYS 244 Cb 0.06 -2.39 -0.10 0.00 -1.68 0.00 0.00 37.83 33.72 3ia6 s LYS 244 CO 0.16 0.47 0.97 -1.54 -0.76 0.00 0.00 175.35 174.65 3ia6 s SER 245 N -2.84 7.23 0.48 2.83 1.04 -1.26 -4.79 113.70 116.40 3ia6 s SER 245 Ca 0.27 1.89 -0.14 0.00 0.48 0.00 0.00 55.95 58.46 3ia6 s SER 245 Cb -0.10 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.37 3ia6 s SER 245 CO 0.19 -0.15 0.90 -2.16 0.98 0.00 0.00 173.24 173.00 3ia6 s PRO 246 N -2.11 3.85 0.26 4.02 0.04 -1.26 -4.98 135.00 134.82 3ia6 s PRO 246 Ca 0.51 0.73 -0.30 0.00 0.04 0.00 0.00 61.00 61.99 3ia6 s PRO 246 Cb -0.20 -2.23 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 3ia6 s PRO 246 CO 0.25 -0.20 1.12 0.12 0.04 0.00 0.00 177.00 178.32 3ia6 s PHE 247 N -2.57 3.55 -0.21 0.56 2.19 -0.67 -4.82 117.98 116.00 3ia6 s PHE 247 Ca 0.55 1.65 -0.06 0.00 0.33 0.00 0.00 56.93 59.41 3ia6 s PHE 247 Cb -0.10 -3.31 -0.02 0.00 -1.31 0.00 0.00 43.02 38.27 3ia6 s PHE 247 CO 0.33 -0.66 0.01 0.08 1.83 0.00 0.00 175.22 176.82 3ia6 s VAL 248 N -0.95 4.02 -0.34 3.12 1.01 -1.26 -0.73 120.40 125.27 3ia6 s VAL 248 Ca 0.46 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 3ia6 s VAL 248 Cb -0.32 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.23 3ia6 s VAL 248 CO 0.40 0.41 0.20 -0.63 0.00 0.00 0.00 175.10 175.49 3ia6 s ILE 249 N 1.15 4.87 0.00 2.22 1.01 0.15 -4.85 121.20 125.75 3ia6 s ILE 249 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3ia6 s ILE 249 Cb -0.14 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.77 3ia6 s ILE 249 CO 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 174.94 174.91 3ia6 n TYR 250 N 5.04 0.00 -3.92 3.97 0.18 -1.26 -2.02 117.16 119.15 3ia6 n TYR 250 Ca -0.13 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.55 3ia6 n TYR 250 Cb 0.49 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.44 3ia6 n TYR 250 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 3ia6 s ASP 251 N -0.50 0.27 0.18 9.48 3.84 -1.26 -4.54 116.67 124.13 3ia6 s ASP 251 Ca 0.00 -1.20 -0.19 0.00 -0.00 0.00 0.00 52.55 51.16 3ia6 s ASP 251 Cb 0.00 0.76 0.11 0.00 -1.38 0.00 0.00 42.92 42.42 3ia6 s ASP 251 CO 0.00 -1.50 1.63 0.24 -0.00 0.00 0.00 175.17 175.54 3ia6 h MET 252 N 2.05 -0.12 -0.44 2.11 2.86 -1.99 -0.58 114.93 118.82 3ia6 h MET 252 Ca -0.29 0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.24 3ia6 h MET 252 Cb 1.25 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 3ia6 h MET 252 CO 0.38 -0.08 -0.15 -0.91 1.06 0.00 0.00 176.91 177.21 3ia6 h ASN 253 N -0.13 0.90 0.01 1.22 4.21 -1.98 0.10 115.58 119.91 3ia6 h ASN 253 Ca 0.21 -0.38 -0.05 0.00 1.21 0.00 0.00 56.30 57.28 3ia6 h ASN 253 Cb 0.45 -0.25 -0.01 0.00 -1.12 0.00 0.00 38.32 37.39 3ia6 h ASN 253 CO -0.52 1.08 -0.13 0.77 -1.29 0.00 0.00 177.43 177.33 3ia6 h SER 254 N 0.72 0.25 -0.56 5.81 4.64 -1.86 0.34 113.55 122.88 3ia6 h SER 254 Ca 0.11 -0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.31 3ia6 h SER 254 Cb 0.71 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.71 3ia6 h SER 254 CO 0.05 0.42 0.09 0.25 -0.87 0.00 0.00 176.83 176.78 3ia6 h LEU 255 N 0.25 0.89 -0.51 5.97 5.85 -0.65 0.31 115.31 127.43 3ia6 h LEU 255 Ca 0.05 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 3ia6 h LEU 255 Cb 0.40 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3ia6 h LEU 255 CO 0.02 0.92 0.18 0.24 -0.34 0.00 0.00 178.44 179.46 3ia6 h MET 256 N 0.82 0.77 -0.24 1.25 2.86 -0.22 -1.76 114.93 118.40 3ia6 h MET 256 Ca 0.17 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 3ia6 h MET 256 Cb 0.41 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3ia6 h MET 256 CO 0.01 0.70 -0.19 0.52 1.06 0.00 0.00 176.91 179.01 3ia6 h MET 257 N 0.68 0.44 0.00 1.72 2.86 -0.27 -3.12 114.93 117.24 3ia6 h MET 257 Ca 0.17 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.55 3ia6 h MET 257 Cb 0.24 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 3ia6 h MET 257 CO -0.01 0.61 -0.53 0.78 1.06 0.00 0.00 176.91 178.82 3ia6 h GLY 258 N 0.96 0.00 -5.38 8.32 0.00 -0.06 -3.38 103.07 103.54 3ia6 h GLY 258 Ca 0.07 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.83 3ia6 h GLY 258 CO 0.04 0.00 3.21 1.18 0.00 0.00 0.00 176.54 180.97 3ia6 n GLU 259 N -3.68 2.85 0.00 4.80 1.02 -0.69 -3.53 120.64 121.41 3ia6 n GLU 259 Ca -0.01 -1.94 0.00 0.00 -0.02 0.00 0.00 57.16 55.19 3ia6 n GLU 259 Cb 0.58 -2.73 0.00 0.00 -0.02 0.00 0.00 31.44 29.27 3ia6 n GLU 259 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3ia6 n ASP 260 N 4.37 3.49 -0.82 1.62 9.92 -1.26 -5.05 116.55 128.81 3ia6 n ASP 260 Ca 0.61 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.93 3ia6 n ASP 260 Cb 0.22 0.00 0.14 0.00 -0.64 0.00 0.00 41.12 40.84 3ia6 n ASP 260 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 3ia6 n LYS 261 N -2.52 1.04 -0.01 -1.24 5.02 -1.23 -5.27 118.16 113.96 3ia6 n LYS 261 Ca 0.00 -2.78 -0.00 0.00 -2.02 0.00 0.00 58.31 53.50 3ia6 n LYS 261 Cb 0.48 -1.09 -0.00 0.00 -0.02 0.00 0.00 35.03 34.40 3ia6 n LYS 261 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3ia6 n GLU 276 N -0.63 0.00 -0.06 1.97 2.13 -1.26 -5.01 120.64 117.78 3ia6 n GLU 276 Ca 0.14 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.85 3ia6 n GLU 276 Cb 0.82 -0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.47 3ia6 n GLU 276 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 3ia6 h VAL 277 N 0.01 1.26 -0.77 6.31 -1.51 -2.03 -1.41 116.25 118.11 3ia6 h VAL 277 Ca -0.00 -0.87 0.07 0.00 -1.23 0.00 0.00 66.70 64.67 3ia6 h VAL 277 Cb 0.01 1.46 -0.06 0.00 -2.13 0.00 0.00 31.29 30.56 3ia6 h VAL 277 CO 0.00 0.26 0.45 0.00 -1.23 0.00 0.00 177.57 177.05 3ia6 h ALA 278 N 0.78 1.06 0.22 5.19 0.00 -1.99 0.13 119.26 124.66 3ia6 h ALA 278 Ca 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3ia6 h ALA 278 Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3ia6 h ALA 278 CO 0.01 0.12 -0.11 0.82 0.00 0.00 0.00 179.25 180.10 3ia6 h ILE 279 N 0.79 0.81 -0.91 0.00 2.04 -1.97 -1.40 117.51 116.88 3ia6 h ILE 279 Ca 0.35 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 66.12 3ia6 h ILE 279 Cb 0.24 0.91 -0.07 0.00 -0.74 0.00 0.00 36.82 37.17 3ia6 h ILE 279 CO -0.20 0.04 0.56 0.03 0.00 0.00 0.00 178.15 178.58 3ia6 h ARG 280 N -0.38 0.98 -0.58 2.37 3.08 -0.46 0.16 114.38 119.55 3ia6 h ARG 280 Ca -0.03 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 3ia6 h ARG 280 Cb 0.29 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 3ia6 h ARG 280 CO 0.05 0.65 0.31 0.82 -1.07 0.00 0.00 179.97 180.73 3ia6 h ILE 281 N 1.00 1.19 -0.71 2.04 2.04 -0.74 -1.33 117.51 121.01 3ia6 h ILE 281 Ca 0.40 -0.49 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 3ia6 h ILE 281 Cb 0.22 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 3ia6 h ILE 281 CO -0.19 0.21 0.26 0.15 0.00 0.00 0.00 178.15 178.57 3ia6 h PHE 282 N 0.78 1.10 -0.14 1.37 3.57 0.16 -1.41 116.94 122.38 3ia6 h PHE 282 Ca 0.20 -0.09 -0.17 0.00 3.53 0.00 0.00 57.97 61.44 3ia6 h PHE 282 Cb 0.05 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.46 3ia6 h PHE 282 CO -0.01 0.85 -0.64 1.96 -2.23 0.00 0.00 178.31 178.24 3ia6 h GLN 283 N 1.04 0.50 -0.97 1.11 1.08 -0.70 -2.39 115.11 114.79 3ia6 h GLN 283 Ca 0.24 -0.36 0.03 0.00 -1.45 0.00 0.00 58.65 57.11 3ia6 h GLN 283 Cb 0.24 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.68 3ia6 h GLN 283 CO -0.01 0.98 0.64 0.78 -0.95 0.00 0.00 178.83 180.26 3ia6 h GLY 284 N 1.12 1.40 1.12 3.46 0.00 -0.80 -0.77 103.07 108.60 3ia6 h GLY 284 Ca -0.01 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 3ia6 h GLY 284 CO 0.12 0.43 0.06 0.00 0.00 0.00 0.00 176.54 177.14 3ia6 h GLN 286 N 0.98 -0.25 -0.84 0.00 4.20 -0.85 0.14 115.11 118.49 3ia6 h GLN 286 Ca 0.19 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.92 3ia6 h GLN 286 Cb 0.48 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 3ia6 h GLN 286 CO 0.02 -0.16 0.55 0.74 -0.67 0.00 0.00 178.83 179.31 3ia6 h PHE 287 N -0.28 1.06 -0.49 2.96 0.05 -1.20 -0.27 116.94 118.77 3ia6 h PHE 287 Ca -0.03 0.02 -0.09 0.00 3.82 0.00 0.00 57.97 61.70 3ia6 h PHE 287 Cb 0.22 -0.36 -0.02 0.00 2.00 0.00 0.00 35.95 37.79 3ia6 h PHE 287 CO -0.06 0.67 -0.04 -0.09 -0.18 0.00 0.00 178.31 178.61 3ia6 h ARG 288 N 1.14 0.84 -0.40 1.51 9.65 -1.22 0.05 114.38 125.95 3ia6 h ARG 288 Ca 0.31 -0.26 -0.11 0.00 -1.10 0.00 0.00 59.98 58.82 3ia6 h ARG 288 Cb -0.12 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.37 3ia6 h ARG 288 CO -0.06 0.87 -0.16 1.03 2.80 0.00 0.00 179.97 184.45 3ia6 h SER 289 N 0.77 0.84 -0.23 -3.80 0.87 -0.26 -0.07 113.55 111.68 3ia6 h SER 289 Ca 0.14 -0.39 -0.00 0.00 -1.23 0.00 0.00 61.79 60.31 3ia6 h SER 289 Cb 0.53 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3ia6 h SER 289 CO 0.03 1.04 0.13 0.58 -0.53 0.00 0.00 176.83 178.08 3ia6 h VAL 290 N 0.63 1.11 -0.91 2.23 2.07 -0.87 0.14 116.25 120.65 3ia6 h VAL 290 Ca 0.09 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 67.39 3ia6 h VAL 290 Cb 0.71 0.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3ia6 h VAL 290 CO 0.05 0.10 0.58 -0.08 0.02 0.00 0.00 177.57 178.25 3ia6 h GLU 291 N 0.27 1.06 -0.55 1.57 4.81 -0.91 -2.21 114.58 118.63 3ia6 h GLU 291 Ca 0.08 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 3ia6 h GLU 291 Cb 0.05 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 3ia6 h GLU 291 CO -0.01 0.70 0.02 0.00 -0.73 0.00 0.00 179.01 178.99 3ia6 h ALA 292 N 1.40 0.73 -0.57 2.92 0.00 -0.40 -2.43 119.26 120.91 3ia6 h ALA 292 Ca 0.38 -0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.06 3ia6 h ALA 292 Cb 0.09 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3ia6 h ALA 292 CO -0.15 0.54 0.30 0.28 0.00 0.00 0.00 179.25 180.22 3ia6 h VAL 293 N 0.83 0.96 -0.54 0.00 2.07 -0.32 -0.50 116.25 118.74 3ia6 h VAL 293 Ca 0.16 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.52 3ia6 h VAL 293 Cb 0.51 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 3ia6 h VAL 293 CO 0.02 0.10 0.31 1.56 0.02 0.00 0.00 177.57 179.59 3ia6 h GLN 294 N 0.56 0.59 -0.31 1.57 4.20 -1.19 0.62 115.11 121.16 3ia6 h GLN 294 Ca 0.25 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.86 3ia6 h GLN 294 Cb 0.16 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 3ia6 h GLN 294 CO -0.17 0.39 -0.07 0.93 -0.67 0.00 0.00 178.83 179.24 3ia6 h GLU 295 N 0.61 0.59 -0.59 1.46 5.08 -0.99 -1.64 114.58 119.11 3ia6 h GLU 295 Ca 0.23 -0.22 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3ia6 h GLU 295 Cb 0.07 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 3ia6 h GLU 295 CO -0.12 0.78 0.34 0.82 -1.00 0.00 0.00 179.01 179.82 3ia6 h ILE 296 N 0.36 1.02 -0.48 3.13 2.04 -0.93 -0.54 117.51 122.11 3ia6 h ILE 296 Ca 0.08 -0.23 0.03 0.00 1.00 0.00 0.00 64.86 65.75 3ia6 h ILE 296 Cb 0.56 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 3ia6 h ILE 296 CO 0.03 0.12 0.26 0.74 0.00 0.00 0.00 178.15 179.30 3ia6 h THR 297 N 0.66 1.00 -0.83 -0.27 2.02 -0.66 0.16 112.91 114.99 3ia6 h THR 297 Ca 0.25 -0.18 0.02 0.00 0.77 0.00 0.00 66.41 67.27 3ia6 h THR 297 Cb 0.08 0.44 -0.05 0.00 -1.74 0.00 0.00 68.15 66.88 3ia6 h THR 297 CO -0.13 0.09 0.54 -0.33 0.37 0.00 0.00 175.52 176.06 3ia6 h GLU 298 N 0.52 1.03 -0.29 6.66 5.08 -0.92 -2.90 114.58 123.75 3ia6 h GLU 298 Ca 0.20 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 3ia6 h GLU 298 Cb 0.08 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3ia6 h GLU 298 CO -0.12 0.68 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.64 3ia6 h TYR 299 N 1.06 0.57 -0.45 4.33 5.03 -0.43 -3.23 116.97 123.85 3ia6 h TYR 299 Ca 0.32 -0.10 0.09 0.00 2.58 0.00 0.00 58.73 61.62 3ia6 h TYR 299 Cb -0.04 -0.15 -0.09 0.00 1.55 0.00 0.00 36.73 38.01 3ia6 h TYR 299 CO -0.02 0.67 -0.12 0.00 -1.32 0.00 0.00 178.16 177.37 3ia6 h ALA 300 N 0.83 0.29 -0.28 1.82 0.00 -0.51 -0.88 119.26 120.54 3ia6 h ALA 300 Ca 0.08 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.25 3ia6 h ALA 300 Cb 0.44 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3ia6 h ALA 300 CO 0.02 -0.45 0.39 0.87 0.00 0.00 0.00 179.25 180.07 3ia6 h LYS 301 N -0.01 0.00 0.00 0.00 1.57 -1.54 0.32 116.57 116.92 3ia6 h LYS 301 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3ia6 h LYS 301 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3ia6 h LYS 301 CO -0.47 0.00 -0.00 0.66 -0.57 0.00 0.00 179.45 179.07 3ia6 h SER 302 N 0.00 0.00 -2.73 0.86 4.64 -1.24 -3.42 113.55 111.65 3ia6 h SER 302 Ca 0.13 -0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.89 3ia6 h SER 302 Cb 0.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 3ia6 h SER 302 CO -0.00 0.00 1.10 -0.63 -0.87 0.00 0.00 176.83 176.43 3ia6 s ILE 303 N -3.12 3.71 0.02 0.95 1.01 0.11 -4.90 121.20 118.99 3ia6 s ILE 303 Ca 0.10 0.83 -0.34 0.00 0.00 0.00 0.00 60.65 61.24 3ia6 s ILE 303 Cb 0.11 -3.66 -0.13 0.00 0.01 0.00 0.00 42.46 38.79 3ia6 s ILE 303 CO 0.61 -0.22 1.76 -2.65 0.00 0.00 0.00 174.94 174.44 3ia6 n PRO 304 N 7.44 2.18 0.00 2.79 -0.02 -1.26 -1.13 135.00 145.00 3ia6 n PRO 304 Ca 0.18 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 3ia6 n PRO 304 Cb 0.45 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 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 4.00 2.12 0.23 -1.23 0.00 -1.26 -4.96 105.19 104.09 3ia6 n GLY 305 Ca 0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 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 0.82 0.00 1.61 3.57 -1.43 -3.08 116.94 118.43 3ia6 h PHE 306 Ca 0.00 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.38 3ia6 h PHE 306 Cb 0.00 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.52 3ia6 h PHE 306 CO 0.00 0.77 0.00 -0.39 -2.23 0.00 0.00 178.31 176.46 3ia6 h VAL 307 N 0.63 0.00 -0.00 1.41 -1.51 -1.82 -2.91 116.25 112.05 3ia6 h VAL 307 Ca 0.14 -0.47 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 3ia6 h VAL 307 Cb 0.40 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 3ia6 h VAL 307 CO 0.01 0.00 -0.14 0.59 -1.23 0.00 0.00 177.57 176.80 3ia6 n ASN 308 N -2.44 0.62 -4.84 4.19 3.02 -1.17 -4.89 115.26 109.76 3ia6 n ASN 308 Ca 0.04 -0.68 -0.32 0.00 -0.03 0.00 0.00 54.58 53.59 3ia6 n ASN 308 Cb 0.37 -0.02 -0.02 0.00 -0.61 0.00 0.00 39.78 39.50 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 -2.46 3.57 0.08 3.41 1.43 -1.10 -4.97 118.68 118.64 3ia6 s LEU 309 Ca 0.28 1.61 -0.36 0.00 -1.03 0.00 0.00 54.13 54.64 3ia6 s LEU 309 Cb 0.20 -4.51 -0.19 0.00 0.03 0.00 0.00 46.19 41.72 3ia6 s LEU 309 CO 0.48 -0.73 0.90 -0.67 0.23 0.00 0.00 176.35 176.56 3ia6 n ASP 310 N -1.77 -0.31 -0.29 2.29 -0.08 -1.26 -4.76 116.55 110.37 3ia6 n ASP 310 Ca 0.07 1.15 -0.02 0.00 -1.51 0.00 0.00 54.79 54.47 3ia6 n ASP 310 Cb 0.54 -0.95 0.09 0.00 2.34 0.00 0.00 41.12 43.14 3ia6 n ASP 310 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3ia6 h LEU 311 N 2.39 0.86 -1.19 -2.67 5.85 -1.93 -1.79 115.31 116.84 3ia6 h LEU 311 Ca -0.43 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 3ia6 h LEU 311 Cb 1.43 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 3ia6 h LEU 311 CO 0.63 0.60 0.42 0.78 -0.34 0.00 0.00 178.44 180.53 3ia6 h ASN 312 N 1.02 0.86 0.30 1.25 2.35 -2.00 -1.23 115.58 118.13 3ia6 h ASN 312 Ca 0.32 -0.05 -0.15 0.00 -0.55 0.00 0.00 56.30 55.87 3ia6 h ASN 312 Cb -0.01 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 3ia6 h ASN 312 CO -0.10 0.68 -0.59 0.44 -1.65 0.00 0.00 177.43 176.20 3ia6 h ASP 313 N 0.99 0.33 0.09 5.81 5.19 -1.78 -1.22 116.42 125.83 3ia6 h ASP 313 Ca 0.26 -0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 3ia6 h ASP 313 Cb -0.02 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 3ia6 h ASP 313 CO -0.05 0.84 -0.08 1.56 -3.12 0.00 0.00 179.24 178.40 3ia6 h GLN 314 N 0.22 -0.17 -0.34 3.56 4.20 -0.54 0.85 115.11 122.89 3ia6 h GLN 314 Ca -0.00 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.75 3ia6 h GLN 314 Cb 1.09 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.88 3ia6 h GLN 314 CO 0.09 -0.12 0.16 0.28 -0.67 0.00 0.00 178.83 178.58 3ia6 h VAL 315 N -0.18 0.97 -0.46 -0.54 2.07 -1.20 -1.88 116.25 115.02 3ia6 h VAL 315 Ca -0.00 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.43 3ia6 h VAL 315 Cb 0.17 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 3ia6 h VAL 315 CO -0.01 0.06 0.25 0.74 0.02 0.00 0.00 177.57 178.63 3ia6 h THR 316 N 0.34 1.01 -0.73 2.57 2.02 -1.06 0.90 112.91 117.96 3ia6 h THR 316 Ca 0.15 -0.17 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 3ia6 h THR 316 Cb 0.07 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 66.90 3ia6 h THR 316 CO -0.11 0.09 0.25 -0.07 0.37 0.00 0.00 175.52 176.05 3ia6 h LEU 317 N 0.51 1.04 -0.19 2.58 3.38 -0.68 -2.66 115.31 119.29 3ia6 h LEU 317 Ca 0.19 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 3ia6 h LEU 317 Cb 0.06 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 3ia6 h LEU 317 CO -0.11 0.96 -0.14 -0.07 0.09 0.00 0.00 178.44 179.16 3ia6 h LEU 318 N 1.08 0.45 -0.79 1.67 3.38 -0.96 -1.23 115.31 118.92 3ia6 h LEU 318 Ca 0.24 -0.45 0.19 0.00 0.09 0.00 0.00 57.88 57.95 3ia6 h LEU 318 Cb 0.27 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 40.77 3ia6 h LEU 318 CO -0.01 0.80 0.16 0.50 0.09 0.00 0.00 178.44 179.99 3ia6 h LYS 319 N 0.10 0.21 0.00 1.13 3.64 -0.69 -1.95 116.57 119.02 3ia6 h LYS 319 Ca 0.04 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3ia6 h LYS 319 Cb 0.66 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3ia6 h LYS 319 CO 0.04 0.14 -1.42 0.66 -2.27 0.00 0.00 179.45 176.60 3ia6 n TYR 320 N -5.21 0.23 0.02 1.91 4.01 -1.02 -4.43 117.16 112.68 3ia6 n TYR 320 Ca 0.16 0.07 -0.14 0.00 -0.16 0.00 0.00 57.90 57.83 3ia6 n TYR 320 Cb 0.53 -0.49 -0.14 0.00 -0.31 0.00 0.00 39.34 38.94 3ia6 n TYR 320 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3ia6 h GLY 321 N 4.30 0.17 0.67 2.72 0.00 -0.90 -3.41 103.07 106.61 3ia6 h GLY 321 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 47.33 46.93 3ia6 h GLY 321 CO 0.00 0.38 -0.03 -0.39 0.00 0.00 0.00 176.54 176.50 3ia6 h VAL 322 N 0.04 0.84 -0.64 4.60 -1.51 -1.57 -1.94 116.25 116.06 3ia6 h VAL 322 Ca -0.28 -0.01 -0.05 0.00 -1.23 0.00 0.00 66.70 65.13 3ia6 h VAL 322 Cb 2.00 0.82 -0.03 0.00 -2.13 0.00 0.00 31.29 31.95 3ia6 h VAL 322 CO 0.12 0.00 0.19 0.45 -1.23 0.00 0.00 177.57 177.10 3ia6 h HIS 323 N 0.02 1.02 -0.51 5.19 3.86 -1.85 0.20 115.15 123.07 3ia6 h HIS 323 Ca 0.08 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 3ia6 h HIS 323 Cb 0.12 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 3ia6 h HIS 323 CO -0.19 0.82 0.23 0.93 0.86 0.00 0.00 177.93 180.58 3ia6 h GLU 324 N 0.95 0.72 -0.23 2.45 5.08 -1.70 -1.51 114.58 120.35 3ia6 h GLU 324 Ca 0.21 -0.09 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 3ia6 h GLU 324 Cb 0.29 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3ia6 h GLU 324 CO -0.01 0.58 -0.57 0.82 -1.00 0.00 0.00 179.01 178.83 3ia6 h ILE 325 N 0.72 1.29 -0.42 3.13 2.04 -0.74 -2.63 117.51 120.91 3ia6 h ILE 325 Ca 0.18 -1.77 -0.00 0.00 1.00 0.00 0.00 64.86 64.26 3ia6 h ILE 325 Cb 0.11 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 3ia6 h ILE 325 CO -0.02 0.57 0.24 0.40 0.00 0.00 0.00 178.15 179.34 3ia6 h ILE 326 N 0.53 1.14 -0.00 -0.67 2.04 -0.08 -0.54 117.51 119.93 3ia6 h ILE 326 Ca -0.01 -0.33 -0.13 0.00 1.00 0.00 0.00 64.86 65.39 3ia6 h ILE 326 Cb 1.19 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 3ia6 h ILE 326 CO 0.12 0.14 -0.61 1.88 0.00 0.00 0.00 178.15 179.68 3ia6 h TYR 327 N 0.55 0.01 -0.02 1.37 0.05 -1.38 0.91 116.97 118.45 3ia6 h TYR 327 Ca 0.15 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.92 3ia6 h TYR 327 Cb 0.02 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 3ia6 h TYR 327 CO -0.03 0.62 0.00 1.15 -1.05 0.00 0.00 178.16 178.85 3ia6 h THR 328 N 0.00 1.18 0.00 -2.88 2.02 -1.13 -3.09 112.91 109.02 3ia6 h THR 328 Ca -0.01 -0.54 -0.11 0.00 0.77 0.00 0.00 66.41 66.52 3ia6 h THR 328 Cb 1.09 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 69.00 3ia6 h THR 328 CO 0.08 0.14 -0.54 0.24 0.37 0.00 0.00 175.52 175.82 3ia6 h MET 329 N -0.19 0.00 -0.07 6.66 2.86 -1.03 -3.06 114.93 120.10 3ia6 h MET 329 Ca 0.01 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.61 3ia6 h MET 329 Cb 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3ia6 h MET 329 CO 0.00 0.54 -0.13 1.25 1.06 0.00 0.00 176.91 179.63 3ia6 h LEU 330 N 0.00 0.09 -1.38 1.22 5.85 -0.84 -2.23 115.31 118.03 3ia6 h LEU 330 Ca -0.01 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.70 3ia6 h LEU 330 Cb 1.31 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.29 3ia6 h LEU 330 CO 0.07 0.24 0.41 0.00 -0.34 0.00 0.00 178.44 178.82 3ia6 h ALA 331 N 1.77 1.55 -0.36 1.25 0.00 -1.44 -1.89 119.26 120.14 3ia6 h ALA 331 Ca 0.02 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 54.99 3ia6 h ALA 331 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3ia6 h ALA 331 CO 0.02 0.42 0.29 0.77 0.00 0.00 0.00 179.25 180.75 3ia6 h SER 332 N 0.85 0.00 -0.66 0.00 0.02 -1.52 -0.91 113.55 111.33 3ia6 h SER 332 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3ia6 h SER 332 Cb -0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.45 3ia6 h SER 332 CO -0.05 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.82 3ia6 n LEU 333 N -4.18 4.03 -4.42 5.07 4.77 -0.72 -4.58 117.00 116.98 3ia6 n LEU 333 Ca 0.06 -2.12 -0.30 0.00 -0.03 0.00 0.00 56.01 53.61 3ia6 n LEU 333 Cb 0.47 -0.48 -0.13 0.00 -2.33 0.00 0.00 43.42 40.95 3ia6 n LEU 333 CO 0.33 0.92 -0.53 -0.04 -1.33 0.00 0.00 177.39 176.74 3ia6 s MET 334 N -1.23 1.87 0.25 3.23 -1.94 -0.35 -0.95 119.30 120.19 3ia6 s MET 334 Ca 0.46 -1.09 0.01 0.00 -1.71 0.00 0.00 55.69 53.37 3ia6 s MET 334 Cb 0.26 -2.08 -0.00 0.00 2.01 0.00 0.00 34.83 35.02 3ia6 s MET 334 CO 0.29 0.51 0.05 0.27 -0.01 0.00 0.00 175.02 176.13 3ia6 n ASN 335 N 1.45 1.81 0.27 3.03 0.23 -0.59 -4.97 115.26 116.49 3ia6 n ASN 335 Ca -0.17 -2.23 0.16 0.00 -0.53 0.00 0.00 54.58 51.82 3ia6 n ASN 335 Cb 0.52 0.42 0.90 0.00 -2.08 0.00 0.00 39.78 39.54 3ia6 n ASN 335 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 3ia6 h LYS 336 N 0.00 0.00 0.00 -3.83 2.10 -1.97 -2.87 116.57 110.00 3ia6 h LYS 336 Ca -0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.45 3ia6 h LYS 336 Cb 0.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 3ia6 h LYS 336 CO 0.33 0.00 -1.22 -0.25 -2.00 0.00 0.00 179.45 176.30 3ia6 n ASP 337 N -3.78 0.77 0.00 7.07 8.00 -1.26 -4.86 116.55 122.49 3ia6 n ASP 337 Ca -0.01 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.71 3ia6 n ASP 337 Cb 0.17 1.23 0.00 0.00 -0.02 0.00 0.00 41.12 42.49 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 1.45 -0.82 2.84 0.44 0.00 -1.08 -0.93 105.19 107.08 3ia6 n GLY 338 Ca 0.02 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 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 -3.00 0.00 0.36 1.61 0.11 -0.09 -1.54 120.40 117.86 3ia6 s VAL 339 Ca 0.00 0.07 -0.27 0.00 -2.93 0.00 0.00 61.98 58.85 3ia6 s VAL 339 Cb 0.00 -0.06 -0.09 0.00 -1.53 0.00 0.00 36.38 34.70 3ia6 s VAL 339 CO 0.00 0.04 1.24 -0.76 -3.33 0.00 0.00 175.10 172.29 3ia6 s LEU 340 N 0.40 4.32 0.16 2.54 1.43 -0.13 -0.66 118.68 126.75 3ia6 s LEU 340 Ca -0.03 2.52 0.02 0.00 -1.03 0.00 0.00 54.13 55.61 3ia6 s LEU 340 Cb -0.05 -3.82 -0.05 0.00 0.03 0.00 0.00 46.19 42.31 3ia6 s LEU 340 CO -0.01 -0.60 -0.02 0.27 0.23 0.00 0.00 176.35 176.22 3ia6 s ILE 341 N -1.25 0.75 -1.12 -0.59 -4.36 -0.27 -4.85 121.20 109.50 3ia6 s ILE 341 Ca 0.53 -1.99 -0.17 0.00 -0.26 0.00 0.00 60.65 58.76 3ia6 s ILE 341 Cb -0.36 -2.04 -0.02 0.00 1.25 0.00 0.00 42.46 41.29 3ia6 s ILE 341 CO 0.46 -0.56 0.82 -0.24 0.24 0.00 0.00 174.94 175.67 3ia6 n SER 342 N -0.22 -5.49 -3.75 4.36 2.88 -1.26 -1.74 113.62 108.40 3ia6 n SER 342 Ca -0.08 -0.94 -0.29 0.00 -1.33 0.00 0.00 58.87 56.24 3ia6 n SER 342 Cb 0.63 -3.84 -0.00 0.00 -0.75 0.00 0.00 64.21 60.24 3ia6 n SER 342 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 3ia6 n GLU 343 N -3.96 -3.86 -0.91 -1.46 0.28 -1.26 -2.00 120.64 107.47 3ia6 n GLU 343 Ca -0.09 0.48 0.00 0.00 -0.16 0.00 0.00 57.16 57.39 3ia6 n GLU 343 Cb 0.60 -5.25 0.00 0.00 1.43 0.00 0.00 31.44 28.23 3ia6 n GLU 343 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3ia6 n GLY 344 N -1.37 0.92 0.21 -1.84 0.00 -0.71 -4.90 105.19 97.51 3ia6 n GLY 344 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 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 3.02 0.00 -5.27 1.61 4.20 -1.21 -3.40 115.11 114.07 3ia6 h GLN 345 Ca 0.00 0.00 -0.42 0.00 0.06 0.00 0.00 58.65 58.29 3ia6 h GLN 345 Cb 0.00 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.64 3ia6 h GLN 345 CO 0.00 0.28 -0.68 0.20 -0.67 0.00 0.00 178.83 177.97 3ia6 s GLY 346 N -4.31 1.58 -0.10 3.46 0.00 -0.94 -1.67 107.32 105.34 3ia6 s GLY 346 Ca 0.00 -1.77 -0.03 0.00 0.00 0.00 0.00 44.72 42.92 3ia6 s GLY 346 CO 0.66 -1.72 0.11 -0.12 0.00 0.00 0.00 173.10 172.02 3ia6 s PHE 347 N -3.23 0.00 -0.21 1.90 2.19 0.09 -1.12 117.98 117.61 3ia6 s PHE 347 Ca 0.27 0.20 -0.07 0.00 0.33 0.00 0.00 56.93 57.66 3ia6 s PHE 347 Cb 0.04 -0.47 -0.04 0.00 -1.31 0.00 0.00 43.02 41.25 3ia6 s PHE 347 CO 0.09 -0.32 0.07 1.41 1.83 0.00 0.00 175.22 178.29 3ia6 s MET 348 N 2.21 3.82 0.35 10.12 -2.45 0.17 -0.68 119.30 132.84 3ia6 s MET 348 Ca 0.04 -0.41 -0.26 0.00 -1.25 0.00 0.00 55.69 53.80 3ia6 s MET 348 Cb -0.13 -3.27 -0.09 0.00 1.25 0.00 0.00 34.83 32.59 3ia6 s MET 348 CO -0.06 0.05 1.10 0.95 1.05 0.00 0.00 175.02 178.11 3ia6 s THR 349 N 0.98 3.48 0.22 10.11 -4.23 -0.86 -0.91 115.64 124.42 3ia6 s THR 349 Ca 0.04 1.30 -0.08 0.00 -1.18 0.00 0.00 61.69 61.77 3ia6 s THR 349 Cb -0.14 -3.75 0.18 0.00 1.34 0.00 0.00 72.50 70.13 3ia6 s THR 349 CO 0.03 0.17 1.73 -0.09 -0.54 0.00 0.00 174.62 175.91 3ia6 h ARG 350 N 3.05 0.38 -0.64 3.99 2.43 -1.37 -2.62 114.38 119.60 3ia6 h ARG 350 Ca -0.48 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 3ia6 h ARG 350 Cb 1.22 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 3ia6 h ARG 350 CO 0.64 0.25 0.34 0.93 -1.51 0.00 0.00 179.97 180.62 3ia6 h GLU 351 N 0.39 0.90 -0.64 0.20 5.08 -1.93 -2.54 114.58 116.05 3ia6 h GLU 351 Ca 0.35 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 3ia6 h GLU 351 Cb 0.49 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 3ia6 h GLU 351 CO -0.37 0.70 0.34 0.35 -1.00 0.00 0.00 179.01 179.03 3ia6 h PHE 352 N 0.87 0.86 -0.30 4.33 3.57 -1.71 -2.69 116.94 121.87 3ia6 h PHE 352 Ca 0.22 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 3ia6 h PHE 352 Cb 0.07 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 3ia6 h PHE 352 CO -0.00 0.60 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.38 3ia6 h LEU 353 N 0.88 0.58 -1.30 0.59 3.38 -1.15 -2.80 115.31 115.50 3ia6 h LEU 353 Ca 0.23 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3ia6 h LEU 353 Cb 0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3ia6 h LEU 353 CO -0.04 0.81 -0.34 0.11 0.09 0.00 0.00 178.44 179.07 3ia6 h LYS 354 N 0.51 0.00 0.00 1.13 1.57 -1.14 -3.22 116.57 115.43 3ia6 h LYS 354 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3ia6 h LYS 354 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 3ia6 h LYS 354 CO 0.05 0.34 0.00 -1.13 -0.57 0.00 0.00 179.45 178.13 3ia6 n SER 355 N -3.91 0.00 -4.76 0.86 3.41 -1.06 -4.62 113.62 103.54 3ia6 n SER 355 Ca -0.02 -0.60 -0.33 0.00 -0.26 0.00 0.00 58.87 57.67 3ia6 n SER 355 Cb 0.40 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.29 3ia6 n SER 355 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ia6 s LEU 356 N -2.25 3.29 0.23 1.04 1.43 -1.21 -4.94 118.68 116.27 3ia6 s LEU 356 Ca 0.38 2.00 -0.28 0.00 -1.03 0.00 0.00 54.13 55.19 3ia6 s LEU 356 Cb 0.20 -4.55 -0.16 0.00 0.03 0.00 0.00 46.19 41.72 3ia6 s LEU 356 CO 0.39 -1.81 0.72 -1.14 0.23 0.00 0.00 176.35 174.73 3ia6 n ARG 357 N -2.73 0.50 -0.23 1.70 0.63 -1.26 -3.69 116.66 111.58 3ia6 n ARG 357 Ca 0.10 0.18 0.10 0.00 -0.92 0.00 0.00 57.85 57.31 3ia6 n ARG 357 Cb 0.52 -1.32 0.19 0.00 0.45 0.00 0.00 32.46 32.30 3ia6 n ARG 357 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3ia6 n LYS 358 N 0.93 -0.05 -0.02 -0.14 5.02 -1.26 0.37 118.16 123.00 3ia6 n LYS 358 Ca 0.15 0.98 0.11 0.00 -2.02 0.00 0.00 58.31 57.53 3ia6 n LYS 358 Cb 0.27 -1.56 0.59 0.00 -0.02 0.00 0.00 35.03 34.31 3ia6 n LYS 358 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3ia6 n PRO 359 N -4.86 1.21 0.00 1.97 -0.04 -1.26 -4.00 135.00 128.01 3ia6 n PRO 359 Ca 0.16 -0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 3ia6 n PRO 359 Cb 0.51 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 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 -0.52 0.00 0.72 0.54 3.72 0.16 -4.67 117.46 117.41 3ia6 n PHE 360 Ca 0.17 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.63 3ia6 n PHE 360 Cb 0.15 0.00 0.17 0.00 -0.94 0.00 0.00 39.48 38.86 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 1.11 0.91 0.06 1.37 0.00 -1.06 -4.23 105.19 103.34 3ia6 n GLY 361 Ca 0.00 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.52 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 0.61 2.59 0.22 1.61 8.00 -1.26 -4.28 116.55 124.03 3ia6 n ASP 362 Ca 0.13 -0.04 0.08 0.00 0.71 0.00 0.00 54.79 55.67 3ia6 n ASP 362 Cb 0.35 0.26 0.49 0.00 -0.02 0.00 0.00 41.12 42.21 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 -0.00 -1.88 -3.17 116.94 113.14 3ia6 h PHE 363 Ca -0.31 0.00 -0.25 0.00 -0.00 0.00 0.00 57.97 57.42 3ia6 h PHE 363 Cb 1.59 0.00 -0.04 0.00 -0.00 0.00 0.00 35.95 37.50 3ia6 h PHE 363 CO 0.01 0.26 -1.31 0.52 -0.00 0.00 0.00 178.31 177.79 3ia6 h MET 364 N 0.00 0.00 -0.32 6.09 2.86 -1.86 -3.40 114.93 118.31 3ia6 h MET 364 Ca -0.00 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.68 3ia6 h MET 364 Cb 0.62 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 3ia6 h MET 364 CO 0.03 0.79 0.04 1.49 1.06 0.00 0.00 176.91 180.32 3ia6 h GLU 365 N 0.00 0.14 0.00 1.72 4.57 -1.85 -1.90 114.58 117.26 3ia6 h GLU 365 Ca -0.13 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.02 3ia6 h GLU 365 Cb 1.88 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 30.43 3ia6 h GLU 365 CO 0.11 0.09 -0.12 -1.00 -1.18 0.00 0.00 179.01 176.91 3ia6 h PRO 366 N 0.14 0.00 -0.49 0.92 0.13 -1.77 -0.90 132.00 130.02 3ia6 h PRO 366 Ca 0.15 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.19 3ia6 h PRO 366 Cb 0.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.29 3ia6 h PRO 366 CO -0.22 0.12 -0.05 0.87 -0.23 0.00 0.00 178.00 178.50 3ia6 h LYS 367 N 0.00 0.91 -0.14 0.86 6.56 -1.59 -1.06 116.57 122.11 3ia6 h LYS 367 Ca -0.00 -0.31 -0.00 0.00 -1.06 0.00 0.00 60.65 59.27 3ia6 h LYS 367 Cb 0.37 -0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 31.95 3ia6 h LYS 367 CO 0.02 0.96 0.08 0.74 -2.06 0.00 0.00 179.45 179.18 3ia6 h PHE 368 N 0.76 0.20 -0.62 -1.35 0.04 -0.81 0.40 116.94 115.57 3ia6 h PHE 368 Ca 0.13 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 3ia6 h PHE 368 Cb 0.58 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.64 3ia6 h PHE 368 CO 0.04 0.21 0.34 0.93 -0.60 0.00 0.00 178.31 179.24 3ia6 h GLU 369 N 0.12 0.85 -0.13 1.51 5.08 -1.15 0.16 114.58 121.02 3ia6 h GLU 369 Ca 0.05 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3ia6 h GLU 369 Cb 0.08 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3ia6 h GLU 369 CO -0.01 0.62 0.02 0.35 -1.00 0.00 0.00 179.01 178.99 3ia6 h PHE 370 N 0.86 0.24 -0.79 4.33 3.57 -1.04 -3.22 116.94 120.90 3ia6 h PHE 370 Ca 0.22 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.74 3ia6 h PHE 370 Cb 0.02 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 38.64 3ia6 h PHE 370 CO 0.01 0.42 0.48 0.00 -2.23 0.00 0.00 178.31 176.98 3ia6 h ALA 371 N 0.79 1.06 -0.97 2.41 0.00 0.20 0.37 119.26 123.11 3ia6 h ALA 371 Ca 0.04 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3ia6 h ALA 371 Cb 0.31 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 3ia6 h ALA 371 CO 0.00 0.22 0.64 0.28 0.00 0.00 0.00 179.25 180.40 3ia6 h VAL 372 N 0.89 1.22 0.18 0.00 2.07 -1.08 0.20 116.25 119.73 3ia6 h VAL 372 Ca 0.34 -0.44 -0.28 0.00 0.82 0.00 0.00 66.70 67.14 3ia6 h VAL 372 Cb 0.14 -0.18 0.03 0.00 -1.52 0.00 0.00 31.29 29.76 3ia6 h VAL 372 CO -0.16 0.23 -1.21 0.11 0.02 0.00 0.00 177.57 176.56 3ia6 h LYS 373 N 1.28 0.49 -0.61 1.57 1.57 -1.41 -3.24 116.57 116.23 3ia6 h LYS 373 Ca 0.37 -0.78 -0.05 0.00 -1.87 0.00 0.00 60.65 58.32 3ia6 h LYS 373 Cb -0.09 0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3ia6 h LYS 373 CO -0.10 1.36 0.18 0.35 -0.57 0.00 0.00 179.45 180.68 3ia6 h PHE 374 N 0.03 0.99 0.00 -1.35 3.57 -0.10 -2.82 116.94 117.25 3ia6 h PHE 374 Ca -0.20 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.17 3ia6 h PHE 374 Cb 1.93 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 40.39 3ia6 h PHE 374 CO 0.15 0.82 -0.09 -0.91 -2.23 0.00 0.00 178.31 176.05 3ia6 h ASN 375 N 0.87 0.00 0.17 0.41 -0.26 -0.74 -2.35 115.58 113.68 3ia6 h ASN 375 Ca 0.20 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.93 3ia6 h ASN 375 Cb 0.30 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.56 3ia6 h ASN 375 CO -0.00 0.09 -0.02 0.00 -1.06 0.00 0.00 177.43 176.44 3ia6 h ALA 376 N 1.91 1.15 0.00 -0.83 0.00 -1.52 -1.44 119.26 118.54 3ia6 h ALA 376 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ia6 h ALA 376 Cb 0.24 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3ia6 h ALA 376 CO 0.01 0.02 -0.02 -0.07 0.00 0.00 0.00 179.25 179.19 3ia6 h LEU 377 N 0.00 0.00 -1.14 0.00 3.38 -1.55 -3.47 115.31 112.53 3ia6 h LEU 377 Ca -0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 3ia6 h LEU 377 Cb 0.11 0.00 0.12 0.00 0.09 0.00 0.00 40.66 40.98 3ia6 h LEU 377 CO 0.00 0.02 -0.72 -0.62 0.09 0.00 0.00 178.44 177.21 3ia6 n GLU 378 N -3.12 -7.11 -2.53 1.13 1.02 -0.54 -4.98 120.64 104.50 3ia6 n GLU 378 Ca 0.00 0.79 -0.35 0.00 -0.02 0.00 0.00 57.16 57.58 3ia6 n GLU 378 Cb 0.29 -5.78 -0.04 0.00 -0.02 0.00 0.00 31.44 25.90 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 -7.02 3.95 0.54 -4.62 1.43 -1.26 -5.07 118.68 106.62 3ia6 s LEU 379 Ca 0.41 1.98 0.06 0.00 -1.03 0.00 0.00 54.13 55.55 3ia6 s LEU 379 Cb -0.18 -4.43 0.04 0.00 0.03 0.00 0.00 46.19 41.65 3ia6 s LEU 379 CO 0.75 -0.69 0.45 1.51 0.23 0.00 0.00 176.35 178.60 3ia6 s ASP 380 N -1.82 4.70 0.27 2.29 1.47 -1.26 -4.97 116.67 117.35 3ia6 s ASP 380 Ca 0.64 -1.18 -0.01 0.00 1.18 0.00 0.00 52.55 53.18 3ia6 s ASP 380 Cb -0.19 0.36 0.49 0.00 -0.34 0.00 0.00 42.92 43.24 3ia6 s ASP 380 CO 0.23 -1.12 1.82 0.44 0.68 0.00 0.00 175.17 177.22 3ia6 h ASP 381 N 0.69 0.81 -0.01 2.11 3.32 -1.97 -1.30 116.42 120.06 3ia6 h ASP 381 Ca -0.36 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.66 3ia6 h ASP 381 Cb 1.30 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 3ia6 h ASP 381 CO 0.55 0.44 -0.20 0.77 -1.72 0.00 0.00 179.24 179.08 3ia6 h SER 382 N 0.90 0.37 0.06 6.45 4.64 -1.96 0.79 113.55 124.80 3ia6 h SER 382 Ca 0.45 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3ia6 h SER 382 Cb 0.44 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3ia6 h SER 382 CO -0.26 0.58 -0.03 0.44 -0.87 0.00 0.00 176.83 176.69 3ia6 h ASP 383 N 0.34 -0.07 -0.22 4.97 3.32 -1.72 -3.31 116.42 119.73 3ia6 h ASP 383 Ca 0.06 -0.23 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 3ia6 h ASP 383 Cb 0.54 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 3ia6 h ASP 383 CO 0.04 0.19 0.03 -0.07 -1.72 0.00 0.00 179.24 177.70 3ia6 h LEU 384 N -0.33 0.44 -0.40 1.55 3.38 -0.65 -2.66 115.31 116.63 3ia6 h LEU 384 Ca -0.01 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 57.95 3ia6 h LEU 384 Cb 0.29 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 3ia6 h LEU 384 CO 0.01 0.49 0.08 0.00 0.09 0.00 0.00 178.44 179.11 3ia6 h ALA 385 N 1.58 0.43 -0.30 1.53 0.00 -0.95 -1.30 119.26 120.25 3ia6 h ALA 385 Ca 0.11 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 3ia6 h ALA 385 Cb 0.26 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3ia6 h ALA 385 CO 0.00 -0.32 -0.39 0.82 0.00 0.00 0.00 179.25 179.37 3ia6 h ILE 386 N 0.22 1.29 -0.64 0.00 2.04 -1.61 -2.83 117.51 115.98 3ia6 h ILE 386 Ca 0.19 -1.57 -0.01 0.00 1.00 0.00 0.00 64.86 64.47 3ia6 h ILE 386 Cb 0.23 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 3ia6 h ILE 386 CO -0.25 0.51 0.36 0.15 0.00 0.00 0.00 178.15 178.93 3ia6 h PHE 387 N 0.55 0.86 -0.35 1.37 3.57 -1.25 -0.24 116.94 121.45 3ia6 h PHE 387 Ca 0.04 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 3ia6 h PHE 387 Cb 0.98 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 3ia6 h PHE 387 CO 0.07 0.61 -0.16 0.82 -2.23 0.00 0.00 178.31 177.41 3ia6 h ILE 388 N 0.87 1.26 -0.34 1.41 2.04 -1.29 -1.42 117.51 120.03 3ia6 h ILE 388 Ca 0.23 -1.19 0.01 0.00 1.00 0.00 0.00 64.86 64.90 3ia6 h ILE 388 Cb 0.02 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3ia6 h ILE 388 CO -0.04 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.72 3ia6 h ALA 389 N 1.24 0.43 -0.54 1.87 0.00 -1.15 -2.23 119.26 118.88 3ia6 h ALA 389 Ca 0.09 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3ia6 h ALA 389 Cb 0.61 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 3ia6 h ALA 389 CO 0.04 -0.13 0.18 0.28 0.00 0.00 0.00 179.25 179.62 3ia6 h VAL 390 N 0.44 0.78 -0.58 0.00 2.07 -0.58 -2.57 116.25 115.80 3ia6 h VAL 390 Ca 0.13 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.55 3ia6 h VAL 390 Cb -0.03 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 3ia6 h VAL 390 CO -0.04 0.06 0.37 0.40 0.02 0.00 0.00 177.57 178.38 3ia6 h ILE 391 N 0.34 1.10 -0.65 4.57 2.04 -1.03 -2.91 117.51 120.97 3ia6 h ILE 391 Ca 0.27 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 3ia6 h ILE 391 Cb 0.33 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 3ia6 h ILE 391 CO -0.29 0.13 0.37 0.40 0.00 0.00 0.00 178.15 178.77 3ia6 h ILE 392 N 0.73 1.20 -1.44 -0.67 1.08 -1.07 -3.26 117.51 114.08 3ia6 h ILE 392 Ca 0.23 -0.46 -0.68 0.00 -0.39 0.00 0.00 64.86 63.55 3ia6 h ILE 392 Cb -0.02 0.33 -0.19 0.00 -3.07 0.00 0.00 36.82 33.88 3ia6 h ILE 392 CO -0.08 0.21 1.38 0.18 -0.69 0.00 0.00 178.15 179.15 3ia6 n LEU 393 N -4.56 7.39 -4.55 1.44 4.32 -1.00 -4.81 117.00 115.22 3ia6 n LEU 393 Ca 0.05 -4.73 -0.42 0.00 -0.02 0.00 0.00 56.01 50.89 3ia6 n LEU 393 Cb 0.07 -1.25 -0.07 0.00 -1.62 0.00 0.00 43.42 40.55 3ia6 n LEU 393 CO 0.37 1.92 0.33 -0.44 -1.22 0.00 0.00 177.39 178.35 3ia6 s SER 394 N -0.13 6.35 0.00 -1.43 0.01 -1.23 -4.44 113.70 112.83 3ia6 s SER 394 Ca 0.53 -0.08 0.15 0.00 1.31 0.00 0.00 55.95 57.85 3ia6 s SER 394 Cb 0.28 -2.30 0.78 0.00 0.21 0.00 0.00 66.02 64.98 3ia6 s SER 394 CO -0.18 -0.61 1.36 0.61 0.41 0.00 0.00 173.24 174.83 3ia6 n GLY 395 N 4.83 -0.66 1.30 3.44 0.00 -1.26 -3.25 105.19 109.58 3ia6 n GLY 395 Ca -0.03 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.19 3.91 -4.77 1.61 5.75 -1.26 -4.87 116.55 115.74 3ia6 n ASP 396 Ca 0.08 -2.03 -0.40 0.00 -0.01 0.00 0.00 54.79 52.43 3ia6 n ASP 396 Cb 0.09 -0.47 -0.02 0.00 -1.03 0.00 0.00 41.12 39.69 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 -1.06 4.28 0.17 0.11 1.81 -1.20 -4.94 118.95 118.12 3ia6 s ARG 397 Ca 0.47 2.04 -0.34 0.00 -1.72 0.00 0.00 55.73 56.18 3ia6 s ARG 397 Cb 0.25 -2.95 -0.14 0.00 -0.45 0.00 0.00 34.95 31.66 3ia6 s ARG 397 CO 0.31 -0.19 1.58 -2.30 -0.68 0.00 0.00 175.30 174.02 3ia6 n PRO 398 N 0.60 2.19 -0.98 3.54 -0.02 -1.26 -3.18 135.00 135.89 3ia6 n PRO 398 Ca 0.01 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3ia6 n PRO 398 Cb 0.44 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 3ia6 n PRO 398 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ia6 n GLY 399 N 3.39 0.40 3.74 -1.23 0.00 -1.26 -5.02 105.19 105.20 3ia6 n GLY 399 Ca 0.17 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 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 4.44 -0.05 0.99 1.43 -1.19 -4.95 118.68 119.34 3ia6 s LEU 400 Ca 0.00 2.28 -0.12 0.00 -1.03 0.00 0.00 54.13 55.27 3ia6 s LEU 400 Cb 0.00 -3.61 -0.31 0.00 0.03 0.00 0.00 46.19 42.31 3ia6 s LEU 400 CO 0.00 -0.41 0.66 -0.07 0.23 0.00 0.00 176.35 176.76 3ia6 h LEU 401 N 5.20 0.60 -6.82 1.79 3.38 -1.94 -3.42 115.31 114.10 3ia6 h LEU 401 Ca -0.45 -0.93 -0.61 0.00 0.09 0.00 0.00 57.88 55.98 3ia6 h LEU 401 Cb 1.21 -0.20 -0.40 0.00 0.09 0.00 0.00 40.66 41.37 3ia6 h LEU 401 CO 0.75 1.78 -0.77 0.20 0.09 0.00 0.00 178.44 180.49 3ia6 s ASN 402 N -7.28 3.29 0.26 -0.43 -0.87 -1.26 -5.00 114.94 103.65 3ia6 s ASN 402 Ca -0.16 -3.01 -0.05 0.00 -1.57 0.00 0.00 52.86 48.07 3ia6 s ASN 402 Cb 0.05 -0.98 0.30 0.00 -0.02 0.00 0.00 41.25 40.60 3ia6 s ASN 402 CO 0.85 -0.20 1.93 0.58 -2.57 0.00 0.00 177.10 177.69 3ia6 h VAL 403 N 4.87 1.25 -0.36 1.60 2.07 -1.89 -3.32 116.25 120.47 3ia6 h VAL 403 Ca 0.10 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 3ia6 h VAL 403 Cb 0.88 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 3ia6 h VAL 403 CO 0.50 0.24 0.09 0.50 0.02 0.00 0.00 177.57 178.92 3ia6 h LYS 404 N 1.29 0.57 -0.32 1.57 1.63 -1.95 -1.18 116.57 118.19 3ia6 h LYS 404 Ca 0.35 -0.14 -0.05 0.00 -0.85 0.00 0.00 60.65 59.97 3ia6 h LYS 404 Cb -0.13 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.40 3ia6 h LYS 404 CO -0.07 0.62 0.01 -1.00 -3.45 0.00 0.00 179.45 175.55 3ia6 h PRO 405 N 0.43 0.49 0.03 1.90 0.13 -2.01 -1.47 132.00 131.50 3ia6 h PRO 405 Ca 0.11 -0.10 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 3ia6 h PRO 405 Cb 0.30 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.36 3ia6 h PRO 405 CO 0.00 0.52 -0.01 0.82 -0.23 0.00 0.00 178.00 179.09 3ia6 h ILE 406 N 0.47 1.01 -0.04 -3.56 2.04 -1.61 -2.70 117.51 113.13 3ia6 h ILE 406 Ca 0.10 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.75 3ia6 h ILE 406 Cb 0.30 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3ia6 h ILE 406 CO 0.01 0.03 -0.37 -0.33 0.00 0.00 0.00 178.15 177.49 3ia6 h GLU 407 N -0.10 0.09 -0.60 2.37 5.08 -1.09 -1.07 114.58 119.26 3ia6 h GLU 407 Ca -0.00 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 3ia6 h GLU 407 Cb 0.09 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 3ia6 h GLU 407 CO 0.01 0.45 0.11 -0.44 -1.00 0.00 0.00 179.01 178.13 3ia6 h ASP 408 N 0.07 0.91 -0.09 1.42 3.32 -1.23 -1.21 116.42 119.62 3ia6 h ASP 408 Ca 0.01 -0.20 -0.03 0.00 0.02 0.00 0.00 57.03 56.83 3ia6 h ASP 408 Cb 0.69 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 3ia6 h ASP 408 CO 0.05 0.91 -0.06 0.40 -1.72 0.00 0.00 179.24 178.82 3ia6 h ILE 409 N 0.91 1.34 -0.85 0.35 2.04 -1.09 -3.03 117.51 117.18 3ia6 h ILE 409 Ca 0.19 -1.14 0.04 0.00 1.00 0.00 0.00 64.86 64.95 3ia6 h ILE 409 Cb 0.38 1.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 3ia6 h ILE 409 CO 0.01 0.32 0.56 -0.61 0.00 0.00 0.00 178.15 178.42 3ia6 h GLN 410 N -0.20 1.00 -0.51 2.37 4.15 -1.14 -0.31 115.11 120.47 3ia6 h GLN 410 Ca 0.02 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.43 3ia6 h GLN 410 Cb 0.54 -0.23 -0.05 0.00 0.21 0.00 0.00 27.48 27.95 3ia6 h GLN 410 CO 0.02 0.66 0.24 -0.44 -1.93 0.00 0.00 178.83 177.38 3ia6 h ASP 411 N 1.03 0.32 -0.32 -0.69 5.19 -1.25 0.51 116.42 121.20 3ia6 h ASP 411 Ca 0.34 0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.70 3ia6 h ASP 411 Cb 0.07 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 3ia6 h ASP 411 CO -0.11 0.22 -0.13 -1.13 -3.12 0.00 0.00 179.24 174.97 3ia6 h ASN 412 N 0.46 0.76 -0.44 6.45 -1.24 -1.20 -1.90 115.58 118.47 3ia6 h ASN 412 Ca 0.23 -0.23 -0.03 0.00 0.71 0.00 0.00 56.30 56.98 3ia6 h ASN 412 Cb 0.18 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 3ia6 h ASN 412 CO -0.19 0.91 0.17 -0.07 -1.29 0.00 0.00 177.43 176.95 3ia6 h LEU 413 N 0.69 0.61 -0.58 0.34 3.38 -0.53 -2.27 115.31 116.95 3ia6 h LEU 413 Ca 0.11 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3ia6 h LEU 413 Cb 0.61 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 3ia6 h LEU 413 CO 0.04 0.62 0.15 -0.07 0.09 0.00 0.00 178.44 179.27 3ia6 h LEU 414 N 0.56 0.87 -0.97 1.67 3.38 0.15 0.15 115.31 121.12 3ia6 h LEU 414 Ca 0.14 -0.23 0.07 0.00 0.09 0.00 0.00 57.88 57.95 3ia6 h LEU 414 Cb 0.21 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.66 3ia6 h LEU 414 CO -0.01 0.87 0.62 1.56 0.09 0.00 0.00 178.44 181.57 3ia6 h GLN 415 N 0.82 1.10 -0.25 1.13 4.20 -1.37 -0.48 115.11 120.27 3ia6 h GLN 415 Ca 0.18 -0.07 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 3ia6 h GLN 415 Cb 0.33 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 3ia6 h GLN 415 CO 0.00 0.73 -0.42 0.00 -0.67 0.00 0.00 178.83 178.47 3ia6 h ALA 416 N 1.45 0.38 -0.02 3.87 0.00 -0.73 -2.23 119.26 121.97 3ia6 h ALA 416 Ca 0.42 -0.46 0.03 0.00 0.00 0.00 0.00 54.91 54.90 3ia6 h ALA 416 Cb 0.17 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3ia6 h ALA 416 CO -0.18 0.50 -0.15 1.25 0.00 0.00 0.00 179.25 180.67 3ia6 h LEU 417 N 0.44 -0.45 -0.19 0.00 5.85 -0.57 -1.31 115.31 119.09 3ia6 h LEU 417 Ca 0.02 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3ia6 h LEU 417 Cb 1.02 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 3ia6 h LEU 417 CO 0.10 -0.21 -0.26 -0.08 -0.34 0.00 0.00 178.44 177.64 3ia6 h GLU 418 N -0.24 -0.29 -0.72 1.25 4.81 -1.03 0.11 114.58 118.47 3ia6 h GLU 418 Ca 0.06 0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 3ia6 h GLU 418 Cb 0.32 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 3ia6 h GLU 418 CO -0.16 -0.19 0.31 1.25 -0.73 0.00 0.00 179.01 179.48 3ia6 h LEU 419 N -0.30 0.97 -0.22 1.64 5.85 -1.38 -2.42 115.31 119.46 3ia6 h LEU 419 Ca 0.12 -0.16 0.01 0.00 0.84 0.00 0.00 57.88 58.69 3ia6 h LEU 419 Cb 0.48 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 3ia6 h LEU 419 CO -0.36 0.86 0.10 -0.61 -0.34 0.00 0.00 178.44 178.09 3ia6 h GLN 420 N 1.01 0.21 -0.72 1.25 5.75 -0.48 -1.49 115.11 120.66 3ia6 h GLN 420 Ca 0.24 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.71 3ia6 h GLN 420 Cb 0.18 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.65 3ia6 h GLN 420 CO -0.02 0.14 0.38 -0.07 -2.65 0.00 0.00 178.83 176.61 3ia6 h LEU 421 N 0.22 0.91 -0.94 -2.39 3.38 -0.68 0.13 115.31 115.95 3ia6 h LEU 421 Ca 0.09 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 3ia6 h LEU 421 Cb 0.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3ia6 h LEU 421 CO -0.07 0.76 -0.28 0.11 0.09 0.00 0.00 178.44 179.05 3ia6 h LYS 422 N 0.99 0.00 0.18 1.13 1.57 -1.27 0.42 116.57 119.59 3ia6 h LYS 422 Ca 0.25 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.68 3ia6 h LYS 422 Cb 0.06 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.38 3ia6 h LYS 422 CO -0.04 0.28 -1.78 -0.07 -0.57 0.00 0.00 179.45 177.27 3ia6 h LEU 423 N 0.00 0.59 0.03 2.94 3.38 -0.94 -3.25 115.31 118.06 3ia6 h LEU 423 Ca -0.00 -0.94 -0.24 0.00 0.09 0.00 0.00 57.88 56.79 3ia6 h LEU 423 Cb 0.85 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 3ia6 h LEU 423 CO 0.04 1.80 -1.17 -1.13 0.09 0.00 0.00 178.44 178.07 3ia6 h ASN 424 N 0.09 0.11 -2.16 -0.43 -1.24 -0.70 -3.38 115.58 107.87 3ia6 h ASN 424 Ca -0.36 -0.13 -0.57 0.00 0.71 0.00 0.00 56.30 55.95 3ia6 h ASN 424 Cb 2.08 -0.04 -0.41 0.00 0.73 0.00 0.00 38.32 40.68 3ia6 h ASN 424 CO 0.16 1.11 -0.78 1.41 -1.29 0.00 0.00 177.43 178.04 3ia6 n HIS 425 N -3.36 2.62 0.27 0.67 8.25 0.15 -4.95 115.22 118.87 3ia6 n HIS 425 Ca -0.05 -3.96 0.13 0.00 -0.26 0.00 0.00 57.72 53.58 3ia6 n HIS 425 Cb 0.98 -0.48 0.77 0.00 1.12 0.00 0.00 29.99 32.38 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 3.59 0.00 -0.08 -0.41 0.13 -1.73 -1.50 132.00 131.99 3ia6 h PRO 426 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3ia6 h PRO 426 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 3ia6 h PRO 426 CO 0.72 0.07 0.00 -0.85 -0.23 0.00 0.00 178.00 177.71 3ia6 n GLU 427 N -3.84 1.74 -3.50 0.86 -0.00 -1.26 -4.77 120.64 109.86 3ia6 n GLU 427 Ca -0.02 -1.09 -0.42 0.00 -0.00 0.00 0.00 57.16 55.62 3ia6 n GLU 427 Cb 0.17 -1.45 -0.05 0.00 -0.00 0.00 0.00 31.44 30.11 3ia6 n GLU 427 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3ia6 s SER 428 N -1.82 6.14 0.14 -1.84 0.15 -0.57 -5.04 113.70 110.85 3ia6 s SER 428 Ca 0.35 -2.85 -0.31 0.00 0.70 0.00 0.00 55.95 53.85 3ia6 s SER 428 Cb 0.20 -2.05 -0.10 0.00 -1.71 0.00 0.00 66.02 62.35 3ia6 s SER 428 CO 0.31 -0.46 1.63 -0.55 1.20 0.00 0.00 173.24 175.37 3ia6 s SER 429 N 1.42 6.56 -1.46 5.45 0.15 -1.26 -2.81 113.70 121.75 3ia6 s SER 429 Ca 0.18 2.61 0.00 0.00 0.70 0.00 0.00 55.95 59.45 3ia6 s SER 429 Cb -0.14 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 3ia6 s SER 429 CO -0.07 -0.87 0.00 0.00 1.20 0.00 0.00 173.24 173.50 3ia6 n GLN 430 N 4.63 -1.91 -0.34 5.44 1.13 -1.26 -4.87 117.38 120.19 3ia6 n GLN 430 Ca 0.15 0.82 0.06 0.00 -1.94 0.00 0.00 57.00 56.10 3ia6 n GLN 430 Cb 0.39 -5.44 0.25 0.00 0.11 0.00 0.00 30.24 25.55 3ia6 n GLN 430 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 3ia6 h LEU 431 N 0.00 0.91 0.07 1.08 5.85 -1.91 -0.72 115.31 120.58 3ia6 h LEU 431 Ca -0.39 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.38 3ia6 h LEU 431 Cb 1.28 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 3ia6 h LEU 431 CO 0.47 0.52 -0.21 0.15 -0.34 0.00 0.00 178.44 179.03 3ia6 h PHE 432 N 1.00 -0.57 -0.46 1.25 3.57 -1.89 0.26 116.94 120.10 3ia6 h PHE 432 Ca 0.46 0.01 0.05 0.00 3.53 0.00 0.00 57.97 62.02 3ia6 h PHE 432 Cb 0.40 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 3ia6 h PHE 432 CO -0.00 -0.31 0.20 0.00 -2.23 0.00 0.00 178.31 175.97 3ia6 h ALA 433 N 0.45 0.56 -0.54 2.41 0.00 -1.83 -2.00 119.26 118.32 3ia6 h ALA 433 Ca 0.04 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3ia6 h ALA 433 Cb 0.42 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3ia6 h ALA 433 CO -0.15 -0.17 0.04 0.87 0.00 0.00 0.00 179.25 179.84 3ia6 h LYS 434 N 0.40 0.89 -0.31 0.00 1.57 -0.78 -2.04 116.57 116.30 3ia6 h LYS 434 Ca 0.20 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3ia6 h LYS 434 Cb 0.15 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3ia6 h LYS 434 CO -0.17 0.86 0.13 1.25 -0.57 0.00 0.00 179.45 180.95 3ia6 h LEU 435 N 0.83 0.42 -0.92 2.94 5.85 -0.27 -3.04 115.31 121.11 3ia6 h LEU 435 Ca 0.16 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 3ia6 h LEU 435 Cb 0.44 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 3ia6 h LEU 435 CO 0.02 0.45 0.35 -0.07 -0.34 0.00 0.00 178.44 178.85 3ia6 h LEU 436 N 0.36 1.03 -2.74 2.25 3.38 -1.14 -1.67 115.31 116.78 3ia6 h LEU 436 Ca 0.10 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3ia6 h LEU 436 Cb 0.16 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 3ia6 h LEU 436 CO -0.01 0.89 0.01 1.56 0.09 0.00 0.00 178.44 180.98 3ia6 h GLN 437 N 1.12 0.00 0.00 1.13 4.20 -1.32 -1.69 115.11 118.55 3ia6 h GLN 437 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 3ia6 h GLN 437 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 3ia6 h GLN 437 CO -0.03 0.00 0.00 0.87 -0.67 0.00 0.00 178.83 179.00 3ia6 h LYS 438 N 0.00 0.00 0.00 1.46 1.79 -1.19 -2.74 116.57 115.90 3ia6 h LYS 438 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 3ia6 h LYS 438 Cb 0.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 3ia6 h LYS 438 CO -0.00 0.00 -0.13 0.52 -1.08 0.00 0.00 179.45 178.76 3ia6 h MET 439 N 0.00 0.00 -0.46 3.15 2.86 -1.40 -1.64 114.93 117.44 3ia6 h MET 439 Ca 0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3ia6 h MET 439 Cb 0.50 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 3ia6 h MET 439 CO 0.00 0.13 0.08 1.15 1.06 0.00 0.00 176.91 179.33 3ia6 h THR 440 N 0.00 1.25 -0.52 2.22 2.02 -1.67 -2.44 112.91 113.77 3ia6 h THR 440 Ca -0.00 -0.90 -0.01 0.00 0.77 0.00 0.00 66.41 66.27 3ia6 h THR 440 Cb 0.36 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 3ia6 h THR 440 CO 0.02 0.32 0.29 0.44 0.37 0.00 0.00 175.52 176.95 3ia6 h ASP 441 N 0.63 0.65 -0.08 4.18 5.19 -1.46 -2.90 116.42 122.63 3ia6 h ASP 441 Ca 0.14 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 3ia6 h ASP 441 Cb 0.38 -0.16 -0.00 0.00 0.18 0.00 0.00 39.33 39.72 3ia6 h ASP 441 CO 0.01 0.55 0.05 -0.07 -3.12 0.00 0.00 179.24 176.66 3ia6 h LEU 442 N 0.69 0.09 -1.13 1.55 3.38 -1.32 -1.99 115.31 116.60 3ia6 h LEU 442 Ca 0.18 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 3ia6 h LEU 442 Cb 0.05 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 3ia6 h LEU 442 CO -0.03 0.09 0.43 -0.09 0.09 0.00 0.00 178.44 178.92 3ia6 h ARG 443 N 0.09 1.03 -0.44 1.13 2.43 -1.41 -1.53 114.38 115.69 3ia6 h ARG 443 Ca 0.03 -0.10 -0.10 0.00 -0.81 0.00 0.00 59.98 59.00 3ia6 h ARG 443 Cb 0.01 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 3ia6 h ARG 443 CO -0.01 0.74 -0.13 1.96 -1.51 0.00 0.00 179.97 181.03 3ia6 h GLN 444 N 1.04 0.80 -0.67 0.20 1.08 -1.35 -2.52 115.11 113.69 3ia6 h GLN 444 Ca 0.27 -0.28 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 3ia6 h GLN 444 Cb 0.00 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 3ia6 h GLN 444 CO -0.05 0.89 0.37 0.82 -0.95 0.00 0.00 178.83 179.92 3ia6 h ILE 445 N 0.72 1.21 -0.13 2.54 2.04 -0.56 -0.30 117.51 123.03 3ia6 h ILE 445 Ca 0.12 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3ia6 h ILE 445 Cb 0.62 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3ia6 h ILE 445 CO 0.04 0.23 0.08 0.58 0.00 0.00 0.00 178.15 179.08 3ia6 h VAL 446 N 0.92 1.03 0.20 1.67 2.07 -1.19 -1.08 116.25 119.87 3ia6 h VAL 446 Ca 0.24 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 3ia6 h VAL 446 Cb 0.03 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3ia6 h VAL 446 CO -0.04 0.03 -0.12 0.74 0.02 0.00 0.00 177.57 178.21 3ia6 h THR 447 N 0.17 0.75 -0.53 2.57 2.02 -1.24 -1.03 112.91 115.61 3ia6 h THR 447 Ca 0.05 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.33 3ia6 h THR 447 Cb -0.02 0.75 -0.10 0.00 -1.74 0.00 0.00 68.15 67.04 3ia6 h THR 447 CO -0.01 0.00 -0.14 -0.33 0.37 0.00 0.00 175.52 175.41 3ia6 h GLU 448 N -0.31 -0.00 -0.66 6.66 5.08 -1.02 -2.58 114.58 121.75 3ia6 h GLU 448 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3ia6 h GLU 448 Cb 0.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 3ia6 h GLU 448 CO 0.02 -0.00 0.35 1.25 -1.00 0.00 0.00 179.01 179.63 3ia6 h HIS 449 N -0.00 0.91 -0.12 4.33 2.76 -0.61 -2.15 115.15 120.27 3ia6 h HIS 449 Ca 0.26 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.40 3ia6 h HIS 449 Cb 0.39 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 3ia6 h HIS 449 CO -0.45 0.66 0.08 0.28 -1.30 0.00 0.00 177.93 177.20 3ia6 h VAL 450 N 0.90 1.06 -0.99 5.26 2.07 -0.95 -0.40 116.25 123.20 3ia6 h VAL 450 Ca 0.23 -0.14 0.15 0.00 0.82 0.00 0.00 66.70 67.76 3ia6 h VAL 450 Cb 0.06 0.92 -0.09 0.00 -1.52 0.00 0.00 31.29 30.66 3ia6 h VAL 450 CO -0.04 0.05 0.60 1.56 0.02 0.00 0.00 177.57 179.77 3ia6 h GLN 451 N 0.14 0.85 -0.29 1.57 4.20 -1.24 -1.58 115.11 118.76 3ia6 h GLN 451 Ca 0.04 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.56 3ia6 h GLN 451 Cb 0.02 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 3ia6 h GLN 451 CO -0.01 0.56 -0.40 1.25 -0.67 0.00 0.00 178.83 179.57 3ia6 h LEU 452 N 0.87 0.72 -0.93 1.46 5.85 -0.74 -2.98 115.31 119.57 3ia6 h LEU 452 Ca 0.52 -0.32 -0.09 0.00 0.84 0.00 0.00 57.88 58.83 3ia6 h LEU 452 Cb 0.65 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 3ia6 h LEU 452 CO -0.32 1.04 -0.16 -0.07 -0.34 0.00 0.00 178.44 178.59 3ia6 h LEU 453 N 0.56 0.60 -0.99 2.25 3.38 -0.27 -2.83 115.31 118.01 3ia6 h LEU 453 Ca 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3ia6 h LEU 453 Cb 0.93 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 3ia6 h LEU 453 CO 0.08 0.78 0.49 1.56 0.09 0.00 0.00 178.44 181.44 3ia6 h GLN 454 N 0.54 1.20 -0.26 1.13 4.20 -1.23 -1.02 115.11 119.68 3ia6 h GLN 454 Ca 0.09 -0.13 0.03 0.00 0.06 0.00 0.00 58.65 58.71 3ia6 h GLN 454 Cb 0.59 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 3ia6 h GLN 454 CO 0.04 0.86 0.06 0.28 -0.67 0.00 0.00 178.83 179.40 3ia6 h VAL 455 N 1.21 0.89 -0.47 -0.54 2.07 -1.36 -2.82 116.25 115.23 3ia6 h VAL 455 Ca 0.31 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.68 3ia6 h VAL 455 Cb -0.00 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 3ia6 h VAL 455 CO -0.05 0.03 -0.09 0.40 0.02 0.00 0.00 177.57 177.87 3ia6 h ILE 456 N 0.16 1.26 -0.86 4.57 2.04 -1.20 -2.02 117.51 121.45 3ia6 h ILE 456 Ca 0.12 -1.18 0.08 0.00 1.00 0.00 0.00 64.86 64.88 3ia6 h ILE 456 Cb 0.11 0.99 -0.07 0.00 -0.74 0.00 0.00 36.82 37.12 3ia6 h ILE 456 CO -0.15 0.41 0.52 0.50 0.00 0.00 0.00 178.15 179.43 3ia6 h LYS 457 N 0.77 0.89 0.01 2.37 3.64 -1.12 0.69 116.57 123.81 3ia6 h LYS 457 Ca 0.13 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.26 3ia6 h LYS 457 Cb 0.60 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 3ia6 h LYS 457 CO 0.04 0.59 -0.92 0.87 -2.27 0.00 0.00 179.45 177.75 3ia6 h LYS 458 N 0.91 0.03 0.08 1.90 1.57 -1.20 -3.34 116.57 116.52 3ia6 h LYS 458 Ca 0.40 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 59.02 3ia6 h LYS 458 Cb 0.27 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.60 3ia6 h LYS 458 CO -0.21 0.93 -0.54 1.15 -0.57 0.00 0.00 179.45 180.21 3ia6 h THR 459 N 0.01 1.58 -3.48 -0.16 2.02 -1.15 -3.40 112.91 108.34 3ia6 h THR 459 Ca -0.02 -2.45 -0.76 0.00 0.77 0.00 0.00 66.41 63.95 3ia6 h THR 459 Cb 1.62 3.23 -0.31 0.00 -1.74 0.00 0.00 68.15 70.95 3ia6 h THR 459 CO 0.12 0.66 0.22 -1.61 0.37 0.00 0.00 175.52 175.29 3ia6 s GLU 460 N -2.35 3.82 0.00 6.66 0.41 0.21 -4.85 118.70 122.61 3ia6 s GLU 460 Ca -0.16 -3.22 0.25 0.00 -0.41 0.00 0.00 54.97 51.43 3ia6 s GLU 460 Cb -0.00 -4.31 1.32 0.00 -1.78 0.00 0.00 34.13 29.36 3ia6 s GLU 460 CO 0.77 -1.25 1.85 0.25 -0.49 0.00 0.00 175.26 176.38 3ia6 n THR 461 N 2.60 0.16 0.93 3.63 -2.24 -1.25 -2.02 114.28 116.09 3ia6 n THR 461 Ca 0.22 0.04 0.10 0.00 -2.27 0.00 0.00 64.05 62.14 3ia6 n THR 461 Cb 0.39 -0.63 0.29 0.00 -2.10 0.00 0.00 70.33 68.28 3ia6 n THR 461 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3ia6 n ASP 462 N -1.22 2.09 -4.45 3.42 5.75 -1.26 -4.96 116.55 115.92 3ia6 n ASP 462 Ca 0.14 -1.84 -0.23 0.00 -0.01 0.00 0.00 54.79 52.85 3ia6 n ASP 462 Cb 0.17 -0.18 -0.10 0.00 -1.03 0.00 0.00 41.12 39.98 3ia6 n ASP 462 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3ia6 s MET 463 N -1.64 1.62 -0.07 0.11 1.75 -0.85 -5.13 119.30 115.08 3ia6 s MET 463 Ca 0.32 -1.75 -0.03 0.00 -1.25 0.00 0.00 55.69 52.98 3ia6 s MET 463 Cb 0.17 -1.63 0.04 0.00 2.84 0.00 0.00 34.83 36.25 3ia6 s MET 463 CO 0.25 0.29 0.15 -1.54 -0.65 0.00 0.00 175.02 173.51 3ia6 s SER 464 N -3.48 0.37 0.46 1.11 1.04 -1.26 -5.02 113.70 106.92 3ia6 s SER 464 Ca 0.29 0.30 -0.23 0.00 0.48 0.00 0.00 55.95 56.79 3ia6 s SER 464 Cb -0.04 0.21 -0.08 0.00 0.10 0.00 0.00 66.02 66.22 3ia6 s SER 464 CO 0.14 -0.20 1.13 -0.22 0.98 0.00 0.00 173.24 175.07 3ia6 s LEU 465 N 1.77 4.00 0.32 2.42 2.96 -1.26 -4.99 118.68 123.90 3ia6 s LEU 465 Ca -0.03 2.22 -0.29 0.00 -0.22 0.00 0.00 54.13 55.81 3ia6 s LEU 465 Cb -0.12 -4.28 -0.11 0.00 0.50 0.00 0.00 46.19 42.18 3ia6 s LEU 465 CO -0.06 -0.85 1.51 -2.28 -1.32 0.00 0.00 176.35 173.35 3ia6 s HIS 466 N -1.61 2.75 0.25 5.38 5.65 -1.26 -4.74 115.29 121.70 3ia6 s HIS 466 Ca 0.63 1.00 -0.06 0.00 0.25 0.00 0.00 55.06 56.89 3ia6 s HIS 466 Cb -0.26 -3.99 0.47 0.00 -1.18 0.00 0.00 32.58 27.62 3ia6 s HIS 466 CO 0.32 -3.12 1.65 -1.35 -0.65 0.00 0.00 174.74 171.58 3ia6 h PRO 467 N 4.07 0.14 -0.86 2.88 0.11 -1.98 0.17 132.00 136.53 3ia6 h PRO 467 Ca -0.48 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.71 3ia6 h PRO 467 Cb 1.23 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 3ia6 h PRO 467 CO 0.72 0.09 0.51 1.25 -0.21 0.00 0.00 178.00 180.37 3ia6 h LEU 468 N 0.15 0.75 -0.25 2.35 5.85 -2.00 0.24 115.31 122.40 3ia6 h LEU 468 Ca 0.43 0.04 -0.21 0.00 0.84 0.00 0.00 57.88 58.98 3ia6 h LEU 468 Cb 0.76 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.69 3ia6 h LEU 468 CO -0.63 0.44 -0.84 -0.07 -0.34 0.00 0.00 178.44 176.99 3ia6 h LEU 469 N 0.87 0.58 -0.25 2.25 3.38 -1.17 -2.50 115.31 118.45 3ia6 h LEU 469 Ca 0.41 -0.42 0.03 0.00 0.09 0.00 0.00 57.88 57.99 3ia6 h LEU 469 Cb 0.34 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3ia6 h LEU 469 CO -0.23 1.20 0.06 1.56 0.09 0.00 0.00 178.44 181.11 3ia6 h GLN 470 N 0.29 0.16 -0.55 1.13 4.20 -0.26 -1.37 115.11 118.71 3ia6 h GLN 470 Ca -0.06 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.66 3ia6 h GLN 470 Cb 1.46 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 29.17 3ia6 h GLN 470 CO 0.15 0.11 0.33 1.49 -0.67 0.00 0.00 178.83 180.24 3ia6 h GLU 471 N 0.16 0.64 -0.18 1.46 4.57 -0.93 -2.91 114.58 117.40 3ia6 h GLU 471 Ca 0.12 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 3ia6 h GLU 471 Cb 0.11 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 3ia6 h GLU 471 CO -0.14 0.43 0.12 0.82 -1.18 0.00 0.00 179.01 179.05 3ia6 h ILE 472 N 0.66 1.05 -3.38 2.32 2.04 -1.23 -3.42 117.51 115.56 3ia6 h ILE 472 Ca 0.22 -0.10 -0.53 0.00 1.00 0.00 0.00 64.86 65.45 3ia6 h ILE 472 Cb 0.01 0.79 0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3ia6 h ILE 472 CO -0.09 0.05 0.54 -0.31 0.00 0.00 0.00 178.15 178.34 3ia6 s TYR 473 N -6.15 3.47 0.00 1.37 2.02 -0.54 -4.92 117.35 112.60 3ia6 s TYR 473 Ca -0.13 1.41 0.00 0.00 -0.37 0.00 0.00 57.07 57.98 3ia6 s TYR 473 Cb 0.08 -3.39 0.00 0.00 -0.40 0.00 0.00 41.96 38.25 3ia6 s TYR 473 CO 0.69 -1.11 0.00 1.63 -1.57 0.00 0.00 175.55 175.19