#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nye s THR 222 N 0.00 4.67 -0.15 3.17 -1.32 -1.26 -5.05 115.64 115.70 1nye s THR 222 Ca 0.00 1.73 -0.08 0.00 -1.21 0.00 0.00 61.69 62.13 1nye s THR 222 Cb 0.00 -4.16 -0.04 0.00 -1.51 0.00 0.00 72.50 66.78 1nye s THR 222 CO 0.00 0.36 0.13 -0.63 -2.21 0.00 0.00 174.62 172.27 1nye s ILE 223 N -0.06 5.46 -0.12 5.08 1.01 -1.26 -5.10 121.20 126.21 1nye s ILE 223 Ca 0.40 0.20 0.03 0.00 0.00 0.00 0.00 60.65 61.28 1nye s ILE 223 Cb -0.21 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.84 1nye s ILE 223 CO 0.25 0.55 -0.23 -1.00 0.00 0.00 0.00 174.94 174.51 1nye s HIS 224 N -0.47 2.62 -0.02 3.97 3.76 -1.26 -5.12 115.29 118.78 1nye s HIS 224 Ca 0.12 -1.17 0.03 0.00 -0.15 0.00 0.00 55.06 53.88 1nye s HIS 224 Cb -0.12 -1.76 -0.00 0.00 1.11 0.00 0.00 32.58 31.81 1nye s HIS 224 CO 0.02 -0.50 -0.09 0.15 -0.85 0.00 0.00 174.74 173.46 1nye s LYS 225 N 0.56 0.89 0.13 1.40 3.01 -1.26 -5.16 119.74 119.32 1nye s LYS 225 Ca -0.13 -0.32 0.11 0.00 -1.01 0.00 0.00 55.97 54.62 1nye s LYS 225 Cb -0.17 -0.85 -0.04 0.00 -1.01 0.00 0.00 37.83 35.77 1nye s LYS 225 CO 0.04 0.15 -0.26 0.15 0.51 0.00 0.00 175.35 175.94 1nye s LYS 226 N 0.04 1.45 0.18 1.68 1.02 -1.26 -5.09 119.74 117.76 1nye s LYS 226 Ca -0.01 -1.35 0.07 0.00 0.02 0.00 0.00 55.97 54.71 1nye s LYS 226 Cb -0.07 -1.92 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 1nye s LYS 226 CO 0.00 0.45 -0.15 0.20 -0.92 0.00 0.00 175.35 174.93 1nye s GLY 227 N -2.13 1.34 0.08 -3.33 0.00 -1.26 -1.93 107.32 100.09 1nye s GLY 227 Ca 0.15 -1.56 -0.03 0.00 0.00 0.00 0.00 44.72 43.28 1nye s GLY 227 CO 0.07 -1.64 0.06 1.62 0.00 0.00 0.00 173.10 173.21 1nye s GLN 228 N -3.33 0.77 -0.01 2.90 0.74 0.67 -4.96 119.66 116.44 1nye s GLN 228 Ca 0.19 -1.21 -0.24 0.00 0.05 0.00 0.00 55.36 54.15 1nye s GLN 228 Cb -0.02 0.26 0.05 0.00 1.10 0.00 0.00 33.01 34.40 1nye s GLN 228 CO 0.06 -0.20 0.52 0.00 -0.55 0.00 0.00 175.29 175.12 1nye s ALA 229 N -3.94 -1.34 0.09 1.58 0.00 -1.26 0.13 121.76 117.02 1nye s ALA 229 Ca 0.11 0.79 0.08 0.00 0.00 0.00 0.00 51.96 52.94 1nye s ALA 229 Cb 0.07 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1nye s ALA 229 CO -0.07 -0.39 -0.20 -1.58 0.00 0.00 0.00 175.76 173.52 1nye s HIS 230 N -1.69 1.71 -0.05 0.00 2.46 0.14 -4.96 115.29 112.90 1nye s HIS 230 Ca -0.10 -0.42 -0.11 0.00 0.47 0.00 0.00 55.06 54.90 1nye s HIS 230 Cb -0.02 -0.95 0.02 0.00 -0.13 0.00 0.00 32.58 31.51 1nye s HIS 230 CO 0.04 0.18 0.26 -0.46 -2.47 0.00 0.00 174.74 172.29 1nye s TRP 231 N -1.14 -0.19 -0.05 3.88 -0.11 -1.26 -1.33 118.94 118.73 1nye s TRP 231 Ca 0.05 0.39 -0.00 0.00 1.22 0.00 0.00 56.10 57.77 1nye s TRP 231 Cb -0.10 0.07 0.03 0.00 -1.50 0.00 0.00 33.47 31.97 1nye s TRP 231 CO 0.04 -0.27 -0.02 -1.21 -4.62 0.00 0.00 176.95 170.87 1nye s GLU 232 N -0.72 0.62 2.80 5.86 2.02 -0.65 -5.02 118.70 123.61 1nye s GLU 232 Ca -0.08 0.02 0.00 0.00 0.02 0.00 0.00 54.97 54.93 1nye s GLU 232 Cb -0.04 -0.81 0.00 0.00 0.10 0.00 0.00 34.13 33.37 1nye s GLU 232 CO 0.02 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 175.53 1nye n GLY 233 N 4.52 0.38 2.60 -1.39 0.00 -1.26 -3.10 105.19 106.94 1nye n GLY 233 Ca -0.18 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.60 1nye n GLY 233 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1nye n ASP 234 N -2.28 -4.47 -0.02 1.61 -0.08 -1.26 -4.62 116.55 105.42 1nye n ASP 234 Ca 0.00 0.28 -0.12 0.00 -1.51 0.00 0.00 54.79 53.44 1nye n ASP 234 Cb 0.00 -0.67 -0.08 0.00 2.34 0.00 0.00 41.12 42.72 1nye n ASP 234 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1nye h ILE 235 N -0.58 1.24 0.00 5.18 5.03 -1.94 -0.62 117.51 125.82 1nye h ILE 235 Ca -0.36 -0.75 0.00 0.00 -0.12 0.00 0.00 64.86 63.63 1nye h ILE 235 Cb 1.14 1.61 0.00 0.00 -3.03 0.00 0.00 36.82 36.54 1nye h ILE 235 CO 0.24 0.21 -1.84 1.17 -0.68 0.00 0.00 178.15 177.25 1nye n LYS 236 N -4.86 0.63 0.01 2.37 0.00 -1.26 -4.23 118.16 110.81 1nye n LYS 236 Ca -0.07 -0.15 0.11 0.00 0.00 0.00 0.00 58.31 58.20 1nye n LYS 236 Cb 0.18 -1.56 0.00 0.00 0.00 0.00 0.00 35.03 33.66 1nye n LYS 236 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1nye n ARG 237 N -2.28 0.19 -2.29 1.64 3.00 -1.25 -4.81 116.66 110.85 1nye n ARG 237 Ca -0.03 -0.02 -0.32 0.00 -0.00 0.00 0.00 57.85 57.48 1nye n ARG 237 Cb 0.56 -1.55 -0.02 0.00 0.00 0.00 0.00 32.46 31.45 1nye n ARG 237 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1nye s GLY 238 N -3.43 2.12 -0.01 5.14 0.00 -0.24 -4.84 107.32 106.06 1nye s GLY 238 Ca 0.05 0.28 0.03 0.00 0.00 0.00 0.00 44.72 45.08 1nye s GLY 238 CO 0.81 0.58 -0.06 0.54 0.00 0.00 0.00 173.10 174.97 1nye s LYS 239 N -4.01 2.61 0.05 2.90 -0.14 -1.18 -4.54 119.74 115.43 1nye s LYS 239 Ca 0.61 -0.68 -0.07 0.00 -1.36 0.00 0.00 55.97 54.47 1nye s LYS 239 Cb -0.12 -2.53 -0.00 0.00 -1.68 0.00 0.00 37.83 33.49 1nye s LYS 239 CO 0.32 0.62 0.14 0.20 -0.76 0.00 0.00 175.35 175.87 1nye s GLY 240 N -1.32 0.12 0.05 -3.33 0.00 -0.50 -1.64 107.32 100.70 1nye s GLY 240 Ca 0.16 -0.47 0.03 0.00 0.00 0.00 0.00 44.72 44.44 1nye s GLY 240 CO 0.07 -0.63 -0.10 -0.51 0.00 0.00 0.00 173.10 171.93 1nye s THR 241 N -2.79 0.72 -0.04 0.90 -4.23 -0.44 -0.06 115.64 109.70 1nye s THR 241 Ca -0.03 -1.19 0.06 0.00 -1.18 0.00 0.00 61.69 59.34 1nye s THR 241 Cb -0.00 -0.80 -0.01 0.00 1.34 0.00 0.00 72.50 73.02 1nye s THR 241 CO -0.05 -0.36 -0.22 0.68 -0.54 0.00 0.00 174.62 174.13 1nye s VAL 242 N -1.47 1.77 0.17 2.29 -7.23 -0.26 0.24 120.40 115.91 1nye s VAL 242 Ca -0.06 -0.93 0.06 0.00 -1.81 0.00 0.00 61.98 59.23 1nye s VAL 242 Cb -0.09 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 35.32 1nye s VAL 242 CO 0.01 0.50 -0.11 -0.44 -0.31 0.00 0.00 175.10 174.74 1nye s SER 243 N -0.29 2.08 0.09 4.85 0.01 0.12 -2.50 113.70 118.07 1nye s SER 243 Ca 0.02 -1.03 0.08 0.00 1.31 0.00 0.00 55.95 56.34 1nye s SER 243 Cb -0.11 -0.06 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 1nye s SER 243 CO 0.01 -0.28 -0.21 0.28 0.41 0.00 0.00 173.24 173.45 1nye s THR 244 N -3.20 1.69 0.34 1.44 -1.32 -0.30 -0.24 115.64 114.05 1nye s THR 244 Ca 0.19 -1.49 0.14 0.00 -1.21 0.00 0.00 61.69 59.32 1nye s THR 244 Cb 0.02 -1.53 0.10 0.00 -1.51 0.00 0.00 72.50 69.57 1nye s THR 244 CO 0.03 -0.03 1.81 1.05 -2.21 0.00 0.00 174.62 175.27 1nye h GLU 245 N 4.19 0.00 0.00 7.08 4.11 -1.72 -2.53 114.58 125.71 1nye h GLU 245 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1nye h GLU 245 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1nye h GLU 245 CO 0.40 0.38 0.00 -1.13 0.07 0.00 0.00 179.01 178.74 1nye n SER 246 N -3.96 0.75 0.00 3.06 3.41 -1.26 -4.89 113.62 110.73 1nye n SER 246 Ca -0.02 0.64 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 1nye n SER 246 Cb 0.43 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 1nye n SER 246 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1nye n GLY 247 N 0.50 3.34 0.62 5.00 0.00 -0.95 -4.90 105.19 108.80 1nye n GLY 247 Ca 0.03 0.00 0.48 0.00 0.00 0.00 0.00 46.02 46.53 1nye n GLY 247 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1nye h VAL 248 N 0.00 0.02 -3.34 1.61 2.07 -1.90 -2.74 116.25 111.97 1nye h VAL 248 Ca 0.00 -0.00 -0.62 0.00 0.82 0.00 0.00 66.70 66.89 1nye h VAL 248 Cb 0.00 0.02 -0.40 0.00 -1.52 0.00 0.00 31.29 29.38 1nye h VAL 248 CO 0.00 0.00 -0.72 -0.76 0.02 0.00 0.00 177.57 176.11 1nye s LEU 249 N -8.49 3.54 0.00 2.57 1.43 -1.26 -5.00 118.68 111.47 1nye s LEU 249 Ca -0.06 -2.26 0.00 0.00 -1.03 0.00 0.00 54.13 50.78 1nye s LEU 249 Cb 0.28 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 45.21 1nye s LEU 249 CO 0.87 -0.34 0.38 -3.20 0.23 0.00 0.00 176.35 174.29 1nye n ASN 250 N 4.07 0.00 -3.03 2.29 2.85 -1.04 -1.15 115.26 119.25 1nye n ASN 250 Ca 0.03 0.39 -0.15 0.00 -0.11 0.00 0.00 54.58 54.75 1nye n ASN 250 Cb 0.39 -0.03 0.01 0.00 1.24 0.00 0.00 39.78 41.38 1nye n ASN 250 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1nye n GLN 251 N -0.59 1.00 -1.87 1.20 6.02 -1.26 -4.13 117.38 117.74 1nye n GLN 251 Ca 0.00 -2.97 -0.42 0.00 -0.01 0.00 0.00 57.00 53.60 1nye n GLN 251 Cb 0.00 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 29.76 1nye n GLN 251 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1nye s GLN 252 N -1.72 4.18 0.61 -1.09 -1.52 -1.04 -4.66 119.66 114.43 1nye s GLN 252 Ca 0.34 2.45 -0.16 0.00 -1.95 0.00 0.00 55.36 56.05 1nye s GLN 252 Cb 0.34 -3.09 -0.03 0.00 -0.22 0.00 0.00 33.01 30.02 1nye s GLN 252 CO -0.07 -0.59 1.08 -1.25 -0.25 0.00 0.00 175.29 174.22 1nye s PRO 253 N 0.22 3.17 -0.12 2.91 0.04 -1.26 -1.11 135.00 138.85 1nye s PRO 253 Ca 0.66 1.30 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 1nye s PRO 253 Cb -0.45 -2.01 0.12 0.00 0.04 0.00 0.00 34.50 32.20 1nye s PRO 253 CO 0.40 -0.94 1.01 1.52 0.04 0.00 0.00 177.00 179.03 1nye s TYR 254 N -2.34 -0.31 0.01 0.56 1.13 0.92 -4.39 117.35 112.92 1nye s TYR 254 Ca 0.66 0.41 -0.01 0.00 -1.41 0.00 0.00 57.07 56.71 1nye s TYR 254 Cb -0.18 0.49 0.00 0.00 -1.10 0.00 0.00 41.96 41.17 1nye s TYR 254 CO 0.37 -0.37 0.04 0.41 -2.51 0.00 0.00 175.55 173.49 1nye n GLY 255 N 0.32 1.34 0.34 5.49 0.00 -1.26 -1.41 105.19 110.01 1nye n GLY 255 Ca -0.08 -0.94 0.15 0.00 0.00 0.00 0.00 46.02 45.15 1nye n GLY 255 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1nye h PHE 256 N 1.03 0.11 -0.14 1.61 3.04 -1.80 -2.63 116.94 118.17 1nye h PHE 256 Ca -0.01 0.00 -0.19 0.00 3.98 0.00 0.00 57.97 61.76 1nye h PHE 256 Cb 0.04 -0.04 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 1nye h PHE 256 CO 0.00 0.05 -0.68 -2.95 -2.02 0.00 0.00 178.31 172.71 1nye h ASN 257 N 0.11 0.65 0.94 0.41 -0.00 -1.92 -1.11 115.58 114.66 1nye h ASN 257 Ca 0.19 -0.40 0.00 0.00 -0.00 0.00 0.00 56.30 56.09 1nye h ASN 257 Cb 0.60 -0.19 0.00 0.00 -0.00 0.00 0.00 38.32 38.73 1nye h ASN 257 CO -0.02 1.15 -0.16 0.35 -0.00 0.00 0.00 177.43 178.75 1nye n THR 258 N -3.90 0.11 -0.11 6.14 -2.24 -1.01 -2.11 114.28 111.16 1nye n THR 258 Ca -0.05 -0.06 -0.16 0.00 -2.27 0.00 0.00 64.05 61.51 1nye n THR 258 Cb 0.68 -0.31 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1nye n THR 258 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1nye n ARG 259 N -1.65 0.54 -0.01 -0.78 3.00 -1.08 -4.70 116.66 111.98 1nye n ARG 259 Ca 0.06 0.30 0.10 0.00 -0.00 0.00 0.00 57.85 58.31 1nye n ARG 259 Cb 0.36 -1.51 -0.15 0.00 0.00 0.00 0.00 32.46 31.16 1nye n ARG 259 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1nye n PHE 260 N -4.41 0.00 0.00 -0.14 3.72 -0.42 -4.87 117.46 111.34 1nye n PHE 260 Ca -0.28 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 1nye n PHE 260 Cb 0.62 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 1nye n PHE 260 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1nye n GLU 261 N -2.13 0.00 0.00 -1.08 4.71 -1.00 -5.05 120.64 116.09 1nye n GLU 261 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.12 1nye n GLU 261 Cb 0.51 -0.03 0.00 0.00 -1.01 0.00 0.00 31.44 30.91 1nye n GLU 261 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nye n GLY 262 N 2.94 0.17 3.61 0.62 0.00 -0.90 -5.03 105.19 106.60 1nye n GLY 262 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 1nye n GLY 262 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nye n GLU 263 N 0.00 1.46 -1.75 1.61 1.02 -1.17 -4.87 120.64 116.94 1nye n GLU 263 Ca 0.00 0.52 -0.40 0.00 -0.02 0.00 0.00 57.16 57.26 1nye n GLU 263 Cb 0.00 -2.06 0.02 0.00 -0.02 0.00 0.00 31.44 29.39 1nye n GLU 263 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1nye n LYS 264 N 1.76 2.07 0.00 3.49 4.81 -1.26 -4.36 118.16 124.67 1nye n LYS 264 Ca 0.13 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1nye n LYS 264 Cb 0.27 -2.58 0.00 0.00 0.02 0.00 0.00 35.03 32.74 1nye n LYS 264 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nye n GLY 265 N 0.66 3.06 3.72 3.14 0.00 -1.26 -4.91 105.19 109.60 1nye n GLY 265 Ca 0.07 -1.53 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 1nye n GLY 265 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nye s THR 266 N -2.00 2.47 0.02 2.61 -4.23 -1.26 -4.94 115.64 108.32 1nye s THR 266 Ca 0.00 0.15 -0.29 0.00 -1.18 0.00 0.00 61.69 60.38 1nye s THR 266 Cb 0.00 -2.69 0.10 0.00 1.34 0.00 0.00 72.50 71.25 1nye s THR 266 CO 0.00 -0.20 1.07 0.54 -0.54 0.00 0.00 174.62 175.49 1nye s ASN 267 N -3.53 -0.18 0.19 3.99 4.22 -1.26 -4.63 114.94 113.74 1nye s ASN 267 Ca 0.64 -0.19 -0.12 0.00 -2.14 0.00 0.00 52.86 51.05 1nye s ASN 267 Cb -0.17 0.33 0.17 0.00 1.28 0.00 0.00 41.25 42.86 1nye s ASN 267 CO 0.57 -0.58 1.79 -0.65 -2.04 0.00 0.00 177.10 176.18 1nye h PRO 268 N 2.00 0.53 -0.49 3.55 0.11 -1.97 -2.95 132.00 132.79 1nye h PRO 268 Ca -0.23 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.94 1nye h PRO 268 Cb 1.22 -0.12 -0.09 0.00 0.11 0.00 0.00 31.00 32.12 1nye h PRO 268 CO 0.27 0.35 -0.06 0.93 -0.21 0.00 0.00 178.00 179.29 1nye h GLU 269 N 0.55 0.06 -0.52 1.05 3.07 -1.97 -0.52 114.58 116.30 1nye h GLU 269 Ca 0.25 -0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.07 1nye h GLU 269 Cb 0.16 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1nye h GLU 269 CO -0.17 0.04 0.17 1.49 -1.40 0.00 0.00 179.01 179.14 1nye h GLU 270 N 0.06 0.80 -0.55 2.33 4.81 -1.91 -0.43 114.58 119.69 1nye h GLU 270 Ca 0.24 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1nye h GLU 270 Cb 0.37 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1nye h GLU 270 CO -0.45 0.73 0.19 -0.07 -0.73 0.00 0.00 179.01 178.68 1nye h LEU 271 N 0.70 0.78 -0.45 1.64 4.07 -1.24 0.53 115.31 121.35 1nye h LEU 271 Ca 0.17 -0.19 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1nye h LEU 271 Cb 0.26 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.77 1nye h LEU 271 CO -0.01 0.76 0.26 0.40 -1.08 0.00 0.00 178.44 178.77 1nye h ILE 272 N 0.75 1.15 -0.39 1.22 2.04 -0.98 0.11 117.51 121.41 1nye h ILE 272 Ca 0.18 -0.36 0.04 0.00 1.00 0.00 0.00 64.86 65.72 1nye h ILE 272 Cb 0.25 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 1nye h ILE 272 CO -0.01 0.15 0.16 1.23 0.00 0.00 0.00 178.15 179.69 1nye h GLY 273 N 0.59 0.52 0.87 5.37 0.00 -0.66 0.23 103.07 109.99 1nye h GLY 273 Ca 0.16 -0.11 0.03 0.00 0.00 0.00 0.00 47.33 47.41 1nye h GLY 273 CO -0.03 0.06 0.42 0.00 0.00 0.00 0.00 176.54 176.99 1nye h ALA 274 N 1.23 0.87 -0.68 3.60 0.00 -0.38 -0.71 119.26 123.19 1nye h ALA 274 Ca 0.17 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1nye h ALA 274 Cb 0.12 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1nye h ALA 274 CO -0.15 0.18 0.44 0.00 0.00 0.00 0.00 179.25 179.72 1nye h ALA 275 N 1.29 0.87 0.44 0.00 0.00 0.20 -1.44 119.26 120.61 1nye h ALA 275 Ca 0.27 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1nye h ALA 275 Cb 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1nye h ALA 275 CO -0.11 0.26 -0.21 1.25 0.00 0.00 0.00 179.25 180.44 1nye h HIS 276 N 0.89 -0.55 -0.92 0.00 6.17 0.28 -1.13 115.15 119.91 1nye h HIS 276 Ca 0.26 -0.01 0.13 0.00 0.71 0.00 0.00 60.37 61.45 1nye h HIS 276 Cb -0.07 0.18 -0.09 0.00 2.52 0.00 0.00 27.41 29.95 1nye h HIS 276 CO -0.03 -0.23 0.54 0.00 0.71 0.00 0.00 177.93 178.91 1nye h ALA 277 N -0.42 1.38 -0.42 5.26 0.00 -1.15 0.42 119.26 124.33 1nye h ALA 277 Ca -0.06 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1nye h ALA 277 Cb 0.56 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1nye h ALA 277 CO 0.10 0.08 0.15 0.00 0.00 0.00 0.00 179.25 179.57 1nye h ALA 278 N 1.53 0.55 -0.20 0.00 0.00 -1.17 -1.71 119.26 118.27 1nye h ALA 278 Ca 0.47 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 1nye h ALA 278 Cb 0.55 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1nye h ALA 278 CO -0.30 0.18 -0.40 0.00 0.00 0.00 0.00 179.25 178.73 1nye h PHE 280 N 0.31 0.73 -0.24 0.00 3.04 -0.94 -0.84 116.94 119.00 1nye h PHE 280 Ca 0.01 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1nye h PHE 280 Cb 1.00 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 1nye h PHE 280 CO 0.09 0.52 0.16 0.77 -2.02 0.00 0.00 178.31 177.83 1nye h SER 281 N 0.73 0.28 -0.27 0.41 0.02 -1.36 0.19 113.55 113.55 1nye h SER 281 Ca 0.19 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1nye h SER 281 Cb 0.01 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1nye h SER 281 CO -0.03 0.21 0.13 -0.03 -1.14 0.00 0.00 176.83 175.97 1nye h MET 282 N 0.33 0.28 -0.90 3.45 1.85 -1.24 -2.37 114.93 116.32 1nye h MET 282 Ca 0.09 -0.02 0.02 0.00 -0.61 0.00 0.00 59.70 59.18 1nye h MET 282 Cb -0.03 -0.06 -0.05 0.00 0.43 0.00 0.00 31.60 31.89 1nye h MET 282 CO -0.02 0.18 0.59 0.00 -0.40 0.00 0.00 176.91 177.27 1nye h ALA 283 N 1.14 1.15 -0.43 0.39 0.00 -0.62 -0.84 119.26 120.04 1nye h ALA 283 Ca 0.11 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1nye h ALA 283 Cb 0.03 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1nye h ALA 283 CO -0.08 0.52 0.26 1.25 0.00 0.00 0.00 179.25 181.20 1nye h LEU 284 N 1.20 0.41 0.03 0.00 5.85 -0.22 0.98 115.31 123.57 1nye h LEU 284 Ca 0.34 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.08 1nye h LEU 284 Cb -0.10 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1nye h LEU 284 CO -0.08 0.30 -0.18 -1.28 -0.34 0.00 0.00 178.44 176.85 1nye h SER 285 N 0.52 -0.53 -0.18 1.25 0.87 -0.92 -0.69 113.55 113.87 1nye h SER 285 Ca 0.17 0.07 0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1nye h SER 285 Cb 0.01 0.21 -0.07 0.00 -0.44 0.00 0.00 62.40 62.12 1nye h SER 285 CO -0.08 -0.25 -0.38 0.25 -0.53 0.00 0.00 176.83 175.83 1nye h LEU 286 N -0.31 -1.21 -1.34 2.23 7.12 -0.32 0.19 115.31 121.67 1nye h LEU 286 Ca 0.05 0.17 0.01 0.00 0.13 0.00 0.00 57.88 58.24 1nye h LEU 286 Cb 0.37 0.51 -0.03 0.00 -0.53 0.00 0.00 40.66 40.97 1nye h LEU 286 CO -0.15 -0.39 0.45 0.24 -0.13 0.00 0.00 178.44 178.46 1nye h MET 287 N -0.43 0.88 -0.04 1.25 2.86 -0.55 -1.95 114.93 116.94 1nye h MET 287 Ca 0.10 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1nye h MET 287 Cb 0.59 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1nye h MET 287 CO -0.41 0.58 0.00 -0.07 1.06 0.00 0.00 176.91 178.07 1nye h LEU 288 N 0.91 0.07 -0.86 1.22 3.38 -0.38 -2.89 115.31 116.75 1nye h LEU 288 Ca 0.25 -0.30 0.19 0.00 0.09 0.00 0.00 57.88 58.11 1nye h LEU 288 Cb -0.08 -0.02 -0.11 0.00 0.09 0.00 0.00 40.66 40.54 1nye h LEU 288 CO -0.06 0.36 0.38 1.23 0.09 0.00 0.00 178.44 180.44 1nye h GLY 289 N -0.22 1.43 2.00 0.83 0.00 -0.11 0.75 103.07 107.75 1nye h GLY 289 Ca 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1nye h GLY 289 CO 0.00 -0.19 -0.02 0.83 0.00 0.00 0.00 176.54 177.16 1nye h GLU 290 N 0.45 0.00 -0.02 4.80 5.08 -1.23 -1.25 114.58 122.42 1nye h GLU 290 Ca 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.87 1nye h GLU 290 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1nye h GLU 290 CO -0.47 0.02 -0.12 0.00 -1.00 0.00 0.00 179.01 177.43 1nye n ALA 291 N -2.11 2.79 -1.44 3.43 0.00 0.25 -4.96 120.51 118.47 1nye n ALA 291 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1nye n ALA 291 Cb 0.21 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1nye n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nye n GLY 292 N 1.29 0.91 3.17 0.00 0.00 -0.47 -5.08 105.19 105.02 1nye n GLY 292 Ca 0.15 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 1nye n GLY 292 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nye s PHE 293 N -2.15 0.99 -0.25 1.61 0.08 -1.00 -5.01 117.98 112.25 1nye s PHE 293 Ca 0.00 -0.75 -0.02 0.00 0.12 0.00 0.00 56.93 56.28 1nye s PHE 293 Cb 0.00 -0.55 0.08 0.00 -0.57 0.00 0.00 43.02 41.98 1nye s PHE 293 CO 0.00 -0.05 0.05 0.99 -0.10 0.00 0.00 175.22 176.11 1nye s THR 294 N -2.92 0.77 0.14 0.64 2.01 -1.26 -2.75 115.64 112.27 1nye s THR 294 Ca 0.08 -0.97 -0.35 0.00 0.31 0.00 0.00 61.69 60.76 1nye s THR 294 Cb 0.00 -1.37 -0.15 0.00 0.01 0.00 0.00 72.50 70.99 1nye s THR 294 CO -0.02 -0.39 1.41 -0.81 -0.69 0.00 0.00 174.62 174.12 1nye n PRO 295 N 4.93 1.58 0.04 4.92 -0.04 -1.26 -4.69 135.00 140.47 1nye n PRO 295 Ca -0.07 0.57 -0.10 0.00 -0.04 0.00 0.00 63.50 63.86 1nye n PRO 295 Cb 0.45 -2.24 -0.13 0.00 -0.04 0.00 0.00 33.50 31.54 1nye n PRO 295 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1nye h THR 296 N 3.32 1.32 -2.31 0.52 1.35 -1.70 -3.47 112.91 111.94 1nye h THR 296 Ca -0.46 -3.05 -0.07 0.00 -0.55 0.00 0.00 66.41 62.28 1nye h THR 296 Cb 1.30 2.71 -0.22 0.00 -1.73 0.00 0.00 68.15 70.21 1nye h THR 296 CO 0.80 0.80 -0.01 -0.55 -0.25 0.00 0.00 175.52 176.31 1nye s SER 297 N -6.62 -0.60 -0.06 5.36 0.15 -1.20 -5.03 113.70 105.69 1nye s SER 297 Ca -0.03 1.10 -0.02 0.00 0.70 0.00 0.00 55.95 57.70 1nye s SER 297 Cb 0.09 1.11 0.03 0.00 -1.71 0.00 0.00 66.02 65.54 1nye s SER 297 CO 0.83 -0.26 0.05 -0.63 1.20 0.00 0.00 173.24 174.44 1nye s ILE 298 N 0.10 -0.01 -0.16 6.45 1.01 -1.26 -1.34 121.20 125.99 1nye s ILE 298 Ca -0.02 0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.92 1nye s ILE 298 Cb -0.04 -0.28 0.04 0.00 0.01 0.00 0.00 42.46 42.19 1nye s ILE 298 CO 0.02 0.14 -0.06 -1.81 0.00 0.00 0.00 174.94 173.23 1nye s ASP 299 N 2.13 2.78 0.03 3.58 1.01 -0.08 -4.98 116.67 121.13 1nye s ASP 299 Ca 0.05 -0.63 0.03 0.00 0.71 0.00 0.00 52.55 52.71 1nye s ASP 299 Cb -0.13 -0.92 -0.02 0.00 1.01 0.00 0.00 42.92 42.87 1nye s ASP 299 CO -0.04 -0.18 -0.10 0.42 0.21 0.00 0.00 175.17 175.48 1nye s THR 300 N 1.63 0.77 -0.02 -1.27 -4.23 -1.26 0.12 115.64 111.38 1nye s THR 300 Ca 0.01 -0.87 0.05 0.00 -1.18 0.00 0.00 61.69 59.71 1nye s THR 300 Cb -0.15 -0.73 -0.03 0.00 1.34 0.00 0.00 72.50 72.93 1nye s THR 300 CO -0.08 -0.10 -0.18 -0.89 -0.54 0.00 0.00 174.62 172.83 1nye s THR 301 N -0.88 2.75 -0.25 3.99 2.01 0.37 -4.92 115.64 118.71 1nye s THR 301 Ca -0.02 -0.93 0.02 0.00 0.31 0.00 0.00 61.69 61.08 1nye s THR 301 Cb -0.07 -2.07 0.06 0.00 0.01 0.00 0.00 72.50 70.43 1nye s THR 301 CO 0.01 0.53 -0.10 0.00 -0.69 0.00 0.00 174.62 174.37 1nye s ALA 302 N -0.75 2.41 -0.38 7.40 0.00 -1.26 -0.05 121.76 129.14 1nye s ALA 302 Ca 0.12 -1.66 -0.15 0.00 0.00 0.00 0.00 51.96 50.27 1nye s ALA 302 Cb -0.10 -1.55 0.01 0.00 0.00 0.00 0.00 23.12 21.47 1nye s ALA 302 CO 0.01 -1.20 0.31 0.34 0.00 0.00 0.00 175.76 175.23 1nye s ASP 303 N 1.18 6.12 -0.16 0.00 3.68 -0.23 -4.73 116.67 122.52 1nye s ASP 303 Ca -0.08 -0.64 -0.15 0.00 2.13 0.00 0.00 52.55 53.81 1nye s ASP 303 Cb -0.20 -2.17 -0.04 0.00 -1.45 0.00 0.00 42.92 39.06 1nye s ASP 303 CO -0.05 -0.39 0.34 -0.69 0.13 0.00 0.00 175.17 174.51 1nye s VAL 304 N 1.81 5.27 -0.19 1.11 1.01 -1.26 -0.88 120.40 127.27 1nye s VAL 304 Ca 0.07 0.65 -0.09 0.00 0.00 0.00 0.00 61.98 62.61 1nye s VAL 304 Cb -0.18 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 1nye s VAL 304 CO 0.11 0.36 0.10 -0.44 0.00 0.00 0.00 175.10 175.23 1nye s SER 305 N 0.59 5.97 -0.58 3.32 0.01 -0.11 -4.98 113.70 117.91 1nye s SER 305 Ca 0.19 0.18 0.03 0.00 1.31 0.00 0.00 55.95 57.66 1nye s SER 305 Cb -0.14 -2.03 0.14 0.00 0.21 0.00 0.00 66.02 64.21 1nye s SER 305 CO 0.06 0.19 0.35 -0.22 0.41 0.00 0.00 173.24 174.03 1nye s LEU 306 N 0.27 4.56 0.22 2.44 1.98 -1.26 -2.52 118.68 124.37 1nye s LEU 306 Ca 0.06 -3.22 -0.17 0.00 -2.89 0.00 0.00 54.13 47.91 1nye s LEU 306 Cb -0.12 -1.67 -0.08 0.00 0.66 0.00 0.00 46.19 44.99 1nye s LEU 306 CO -0.01 -0.21 0.68 -1.81 -1.89 0.00 0.00 176.35 173.11 1nye s ASP 307 N -0.47 6.94 -0.03 3.68 -0.00 -0.52 -4.83 116.67 121.45 1nye s ASP 307 Ca 0.19 1.30 -0.30 0.00 -0.00 0.00 0.00 52.55 53.74 1nye s ASP 307 Cb -0.20 -2.37 -0.04 0.00 -0.00 0.00 0.00 42.92 40.30 1nye s ASP 307 CO -0.04 0.00 1.29 -1.59 -0.00 0.00 0.00 175.17 174.83 1nye s LYS 308 N -2.17 4.32 -0.06 8.23 0.00 -1.26 -1.53 119.74 127.26 1nye s LYS 308 Ca 0.44 1.81 -0.03 0.00 0.00 0.00 0.00 55.97 58.19 1nye s LYS 308 Cb -0.15 -3.56 0.04 0.00 0.00 0.00 0.00 37.83 34.16 1nye s LYS 308 CO 0.20 -0.50 0.08 0.08 0.00 0.00 0.00 175.35 175.21 1nye s VAL 309 N 2.26 -0.13 0.00 1.79 1.01 0.36 -4.93 120.40 120.76 1nye s VAL 309 Ca 0.60 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.92 1nye s VAL 309 Cb -0.28 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 35.88 1nye s VAL 309 CO 0.24 0.12 0.00 0.47 0.00 0.00 0.00 175.10 175.93 1nye n ASP 310 N 5.30 0.00 -0.91 3.32 10.43 -1.26 -2.10 116.55 131.33 1nye n ASP 310 Ca -0.04 0.00 -0.01 0.00 2.57 0.00 0.00 54.79 57.32 1nye n ASP 310 Cb 0.50 0.00 0.01 0.00 1.84 0.00 0.00 41.12 43.47 1nye n ASP 310 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1nye n ALA 311 N 8.98 2.65 -3.00 2.24 0.00 -1.26 -4.88 120.51 125.24 1nye n ALA 311 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1nye n ALA 311 Cb 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1nye n ALA 311 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nye n GLY 312 N 0.28 1.32 3.51 0.00 0.00 -0.89 -5.17 105.19 104.24 1nye n GLY 312 Ca 0.03 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 1nye n GLY 312 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1nye s PHE 313 N -1.44 2.52 -0.03 1.61 0.08 -1.26 0.14 117.98 119.59 1nye s PHE 313 Ca 0.00 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.67 1nye s PHE 313 Cb 0.00 -1.24 0.02 0.00 -0.57 0.00 0.00 43.02 41.22 1nye s PHE 313 CO 0.00 0.50 0.24 0.00 -0.10 0.00 0.00 175.22 175.85 1nye s ALA 314 N -1.64 -0.59 -0.77 5.36 0.00 -0.59 -4.84 121.76 118.69 1nye s ALA 314 Ca 0.23 0.28 -0.22 0.00 0.00 0.00 0.00 51.96 52.25 1nye s ALA 314 Cb -0.09 -0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.06 1nye s ALA 314 CO 0.13 -0.20 1.09 0.42 0.00 0.00 0.00 175.76 177.19 1nye s ILE 315 N -0.95 4.31 -0.06 0.00 1.01 -1.26 -1.44 121.20 122.82 1nye s ILE 315 Ca -0.10 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 59.83 1nye s ILE 315 Cb -0.05 -4.77 -0.30 0.00 0.01 0.00 0.00 42.46 37.35 1nye s ILE 315 CO 0.02 -1.56 0.62 0.71 0.00 0.00 0.00 174.94 174.73 1nye h THR 316 N 6.03 0.90 -4.00 2.92 1.35 -1.85 -3.42 112.91 114.84 1nye h THR 316 Ca -0.13 -2.48 -0.14 0.00 -0.55 0.00 0.00 66.41 63.11 1nye h THR 316 Cb 1.05 2.73 -0.18 0.00 -1.73 0.00 0.00 68.15 70.02 1nye h THR 316 CO 1.20 0.85 -0.62 -0.75 -0.25 0.00 0.00 175.52 175.95 1nye s LYS 317 N -2.57 0.52 -0.10 4.72 2.20 -1.26 -0.07 119.74 123.19 1nye s LYS 317 Ca -0.17 -0.87 -0.02 0.00 -0.36 0.00 0.00 55.97 54.54 1nye s LYS 317 Cb 0.05 0.19 0.04 0.00 -1.51 0.00 0.00 37.83 36.61 1nye s LYS 317 CO 0.84 -0.11 0.04 0.42 -0.36 0.00 0.00 175.35 176.18 1nye s ILE 318 N -2.76 0.19 -0.31 5.43 1.01 0.17 -0.93 121.20 123.99 1nye s ILE 318 Ca -0.04 0.04 -0.17 0.00 0.00 0.00 0.00 60.65 60.48 1nye s ILE 318 Cb -0.00 -0.52 -0.02 0.00 0.01 0.00 0.00 42.46 41.93 1nye s ILE 318 CO -0.06 0.06 0.48 0.00 0.00 0.00 0.00 174.94 175.43 1nye s ALA 319 N 2.04 3.53 -0.23 9.38 0.00 -0.05 -2.16 121.76 134.26 1nye s ALA 319 Ca 0.03 -0.87 -0.16 0.00 0.00 0.00 0.00 51.96 50.96 1nye s ALA 319 Cb -0.14 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 1nye s ALA 319 CO -0.06 -0.98 0.42 -0.51 0.00 0.00 0.00 175.76 174.64 1nye s LEU 320 N 2.29 4.11 -0.15 0.00 1.43 -0.17 -1.07 118.68 125.12 1nye s LEU 320 Ca 0.18 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1nye s LEU 320 Cb -0.16 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.54 1nye s LEU 320 CO 0.11 -0.15 -0.19 -0.75 0.23 0.00 0.00 176.35 175.60 1nye s LYS 321 N 1.69 3.08 -0.01 1.70 2.20 0.93 -0.54 119.74 128.79 1nye s LYS 321 Ca 0.19 -0.82 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 1nye s LYS 321 Cb -0.15 -2.53 0.01 0.00 -1.51 0.00 0.00 37.83 33.65 1nye s LYS 321 CO 0.09 -0.05 -0.01 0.45 -0.36 0.00 0.00 175.35 175.47 1nye s SER 322 N 0.93 0.17 -0.28 1.43 0.15 0.15 0.14 113.70 116.38 1nye s SER 322 Ca -0.04 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.58 1nye s SER 322 Cb -0.15 -0.05 0.04 0.00 -1.71 0.00 0.00 66.02 64.15 1nye s SER 322 CO -0.04 -0.02 -0.02 -1.61 1.20 0.00 0.00 173.24 172.76 1nye s GLU 323 N 0.26 2.64 -0.08 5.44 2.02 0.32 -1.93 118.70 127.38 1nye s GLU 323 Ca -0.02 -1.12 0.05 0.00 0.02 0.00 0.00 54.97 53.90 1nye s GLU 323 Cb -0.04 -3.12 -0.01 0.00 0.10 0.00 0.00 34.13 31.07 1nye s GLU 323 CO -0.01 -0.52 -0.23 0.08 0.02 0.00 0.00 175.26 174.60 1nye s VAL 324 N 1.30 2.20 -0.21 2.63 1.01 -0.58 -0.90 120.40 125.84 1nye s VAL 324 Ca -0.03 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 60.92 1nye s VAL 324 Cb -0.18 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.37 1nye s VAL 324 CO -0.02 0.56 -0.07 0.00 0.00 0.00 0.00 175.10 175.58 1nye s ALA 325 N -0.01 2.75 -0.10 5.51 0.00 -0.45 -1.21 121.76 128.25 1nye s ALA 325 Ca -0.08 -1.16 -0.03 0.00 0.00 0.00 0.00 51.96 50.69 1nye s ALA 325 Cb -0.15 -1.62 0.05 0.00 0.00 0.00 0.00 23.12 21.40 1nye s ALA 325 CO 0.05 -0.39 0.13 0.08 0.00 0.00 0.00 175.76 175.63 1nye s VAL 326 N 1.40 -0.20 0.00 0.00 1.01 -1.21 -1.59 120.40 119.81 1nye s VAL 326 Ca 0.05 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1nye s VAL 326 Cb -0.14 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.90 1nye s VAL 326 CO -0.04 0.06 0.00 -2.65 0.00 0.00 0.00 175.10 172.46 1nye n PRO 327 N 5.31 0.00 -3.82 2.72 -0.02 -1.26 -4.04 135.00 133.89 1nye n PRO 327 Ca -0.05 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.13 1nye n PRO 327 Cb 0.50 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.83 1nye n PRO 327 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1nye s GLY 328 N 0.00 1.54 -0.01 -1.23 0.00 -1.26 -4.89 107.32 101.47 1nye s GLY 328 Ca 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 44.72 42.49 1nye s GLY 328 CO 0.00 1.38 -0.01 -0.42 0.00 0.00 0.00 173.10 174.05 1nye s ILE 329 N 0.98 0.14 0.05 0.90 1.01 -1.26 -5.07 121.20 117.95 1nye s ILE 329 Ca 0.13 0.01 -0.28 0.00 0.00 0.00 0.00 60.65 60.51 1nye s ILE 329 Cb -0.20 -0.18 -0.05 0.00 0.01 0.00 0.00 42.46 42.04 1nye s ILE 329 CO -0.13 0.08 0.87 1.51 0.00 0.00 0.00 174.94 177.28 1nye s ASP 330 N 0.45 7.32 0.14 3.58 -4.77 -1.26 -4.93 116.67 117.19 1nye s ASP 330 Ca -0.04 1.58 -0.17 0.00 -3.30 0.00 0.00 52.55 50.62 1nye s ASP 330 Cb -0.07 -2.53 0.05 0.00 -1.09 0.00 0.00 42.92 39.29 1nye s ASP 330 CO -0.01 -0.09 1.10 0.00 0.70 0.00 0.00 175.17 176.87 1nye n ALA 331 N 3.14 -0.28 -0.29 2.11 0.00 -1.26 -1.83 120.51 122.10 1nye n ALA 331 Ca 0.01 0.65 -0.09 0.00 0.00 0.00 0.00 53.44 54.01 1nye n ALA 331 Cb 0.50 -0.20 -0.08 0.00 0.00 0.00 0.00 19.45 19.67 1nye n ALA 331 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nye h SER 332 N 0.00 -1.62 -0.54 0.00 0.87 -2.00 0.17 113.55 110.43 1nye h SER 332 Ca 0.18 0.24 -0.07 0.00 -1.23 0.00 0.00 61.79 60.91 1nye h SER 332 Cb 0.35 0.71 -0.03 0.00 -0.44 0.00 0.00 62.40 63.00 1nye h SER 332 CO -0.68 -0.20 0.10 0.71 -0.53 0.00 0.00 176.83 176.23 1nye h THR 333 N -0.05 1.25 -0.39 2.23 1.35 -1.77 -2.62 112.91 112.91 1nye h THR 333 Ca 0.11 -0.94 -0.02 0.00 -0.55 0.00 0.00 66.41 65.02 1nye h THR 333 Cb 0.34 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 67.42 1nye h THR 333 CO -0.68 0.35 0.18 0.15 -0.25 0.00 0.00 175.52 175.27 1nye h PHE 334 N 0.89 0.56 -0.83 4.73 3.04 -0.82 -1.93 116.94 122.58 1nye h PHE 334 Ca 0.18 -0.03 0.12 0.00 3.98 0.00 0.00 57.97 62.22 1nye h PHE 334 Cb 0.38 -0.17 -0.08 0.00 2.56 0.00 0.00 35.95 38.63 1nye h PHE 334 CO 0.02 0.48 0.45 0.22 -2.02 0.00 0.00 178.31 177.46 1nye h ASP 335 N 0.48 0.59 -0.08 0.41 3.58 -0.53 0.18 116.42 121.05 1nye h ASP 335 Ca 0.13 0.07 0.02 0.00 0.42 0.00 0.00 57.03 57.67 1nye h ASP 335 Cb 0.13 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.13 1nye h ASP 335 CO -0.02 0.30 -0.04 1.23 -2.88 0.00 0.00 179.24 177.83 1nye h GLY 336 N 0.70 0.04 0.65 -0.78 0.00 -1.03 -2.26 103.07 100.39 1nye h GLY 336 Ca 0.43 0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.82 1nye h GLY 336 CO -0.31 -0.05 -0.23 -2.22 0.00 0.00 0.00 176.54 173.74 1nye h ILE 337 N -0.03 0.50 -1.01 2.60 1.08 -0.30 -1.60 117.51 118.75 1nye h ILE 337 Ca 0.05 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.58 1nye h ILE 337 Cb 0.10 0.50 -0.07 0.00 -3.07 0.00 0.00 36.82 34.28 1nye h ILE 337 CO -0.10 0.00 0.65 0.16 -0.69 0.00 0.00 178.15 178.17 1nye h ILE 338 N -0.45 1.10 -0.30 -0.67 -0.00 -1.05 0.40 117.51 116.53 1nye h ILE 338 Ca 0.02 -0.41 0.04 0.00 -0.00 0.00 0.00 64.86 64.51 1nye h ILE 338 Cb 0.45 -0.20 -0.04 0.00 -0.00 0.00 0.00 36.82 37.03 1nye h ILE 338 CO -0.10 0.22 0.08 1.56 -0.00 0.00 0.00 178.15 179.91 1nye h GLN 339 N 1.19 0.20 -0.15 0.16 1.08 -0.96 0.57 115.11 117.20 1nye h GLN 339 Ca 0.43 -0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.67 1nye h GLN 339 Cb 0.15 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.48 1nye h GLN 339 CO -0.17 0.13 -0.23 0.87 -0.95 0.00 0.00 178.83 178.48 1nye h LYS 340 N 0.20 -0.27 -0.69 1.46 1.79 -0.17 -0.16 116.57 118.72 1nye h LYS 340 Ca 0.14 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 1nye h LYS 340 Cb 0.13 0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.81 1nye h LYS 340 CO -0.16 -0.18 0.41 0.00 -1.08 0.00 0.00 179.45 178.43 1nye h ALA 341 N 0.69 0.88 -0.47 3.86 0.00 -0.38 -0.17 119.26 123.68 1nye h ALA 341 Ca 0.11 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1nye h ALA 341 Cb 0.44 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1nye h ALA 341 CO -0.31 0.36 0.30 -0.22 0.00 0.00 0.00 179.25 179.38 1nye h LYS 342 N 0.94 0.59 0.00 0.00 3.11 0.97 -2.02 116.57 120.16 1nye h LYS 342 Ca 0.25 -0.04 -0.18 0.00 -2.81 0.00 0.00 60.65 57.87 1nye h LYS 342 Cb -0.02 -0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 31.05 1nye h LYS 342 CO -0.05 0.39 -1.23 0.00 -2.81 0.00 0.00 179.45 175.76 1nye h ALA 343 N 1.19 0.64 0.00 5.00 0.00 -0.94 -3.39 119.26 121.75 1nye h ALA 343 Ca 0.18 -0.89 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1nye h ALA 343 Cb -0.04 0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1nye h ALA 343 CO -0.05 1.02 -1.17 0.41 0.00 0.00 0.00 179.25 179.46 1nye n GLY 344 N 1.38 -1.04 3.77 0.00 0.00 -0.08 -4.41 105.19 104.81 1nye n GLY 344 Ca -0.07 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 1nye n GLY 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nye n PRO 346 N 0.98 -0.08 0.01 0.00 -0.02 -1.26 -0.94 135.00 133.70 1nye n PRO 346 Ca 0.03 1.43 -0.06 0.00 -2.02 0.00 0.00 63.50 62.88 1nye n PRO 346 Cb 0.39 -2.23 0.14 0.00 -0.02 0.00 0.00 33.50 31.78 1nye n PRO 346 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1nye h VAL 347 N 0.00 1.30 -0.33 -1.45 2.07 -1.93 -2.50 116.25 113.41 1nye h VAL 347 Ca 0.53 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.51 1nye h VAL 347 Cb 1.01 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 1nye h VAL 347 CO -0.91 0.48 0.19 0.28 0.02 0.00 0.00 177.57 177.63 1nye h SER 348 N 0.41 0.40 -0.57 0.57 0.02 -1.33 -2.75 113.55 110.29 1nye h SER 348 Ca 0.04 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1nye h SER 348 Cb 0.87 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.28 1nye h SER 348 CO 0.07 0.35 0.37 1.56 -1.14 0.00 0.00 176.83 178.05 1nye h GLN 349 N 0.42 0.77 0.00 3.45 1.08 -1.26 -2.76 115.11 116.80 1nye h GLN 349 Ca 0.12 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1nye h GLN 349 Cb 0.03 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 1nye h GLN 349 CO -0.02 0.52 -0.38 0.28 -0.95 0.00 0.00 178.83 178.28 1nye n VAL 350 N -4.44 0.27 -3.07 -0.54 0.31 -0.96 -4.82 118.33 105.09 1nye n VAL 350 Ca 0.06 -0.18 -0.39 0.00 -0.01 0.00 0.00 64.34 63.81 1nye n VAL 350 Cb 0.05 -0.20 -0.05 0.00 -0.91 0.00 0.00 33.84 32.74 1nye n VAL 350 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1nye s LEU 351 N -3.84 4.33 0.00 7.52 1.43 -1.04 -4.94 118.68 122.13 1nye s LEU 351 Ca 0.09 1.17 0.18 0.00 -1.03 0.00 0.00 54.13 54.55 1nye s LEU 351 Cb 0.15 -3.05 0.52 0.00 0.03 0.00 0.00 46.19 43.84 1nye s LEU 351 CO 0.66 -0.09 1.43 2.29 0.23 0.00 0.00 176.35 180.88 1nye n LYS 352 N 3.66 2.36 -2.19 1.70 2.85 -1.26 -4.93 118.16 120.34 1nye n LYS 352 Ca -0.02 -2.10 -0.27 0.00 -1.05 0.00 0.00 58.31 54.86 1nye n LYS 352 Cb 0.51 -1.46 0.05 0.00 -0.65 0.00 0.00 35.03 33.49 1nye n LYS 352 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1nye s ALA 353 N -1.23 3.12 -0.12 0.58 0.00 -1.26 -5.02 121.76 117.82 1nye s ALA 353 Ca 0.39 -0.70 -0.29 0.00 0.00 0.00 0.00 51.96 51.36 1nye s ALA 353 Cb 0.21 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 1nye s ALA 353 CO 0.27 -1.10 1.05 -2.00 0.00 0.00 0.00 175.76 173.98 1nye s GLU 354 N -5.20 4.37 -0.22 0.00 2.12 0.90 -4.88 118.70 115.80 1nye s GLU 354 Ca 0.57 1.43 -0.01 0.00 0.36 0.00 0.00 54.97 57.33 1nye s GLU 354 Cb -0.11 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.73 1nye s GLU 354 CO 0.47 -0.41 -0.11 0.42 -0.54 0.00 0.00 175.26 175.09 1nye s ILE 355 N 2.32 2.68 0.31 -3.70 1.01 -1.26 0.43 121.20 122.99 1nye s ILE 355 Ca 0.49 -0.90 0.07 0.00 0.00 0.00 0.00 60.65 60.31 1nye s ILE 355 Cb -0.19 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 39.99 1nye s ILE 355 CO 0.16 0.36 0.25 0.42 0.00 0.00 0.00 174.94 176.13 1nye s THR 356 N 1.34 3.79 -0.07 2.92 -4.23 -0.92 -4.98 115.64 113.49 1nye s THR 356 Ca 0.03 -1.40 0.02 0.00 -1.18 0.00 0.00 61.69 59.15 1nye s THR 356 Cb -0.15 -3.24 0.02 0.00 1.34 0.00 0.00 72.50 70.47 1nye s THR 356 CO -0.07 -0.23 -0.10 -0.22 -0.54 0.00 0.00 174.62 173.46 1nye s LEU 357 N -3.94 1.52 -0.06 4.79 0.20 -1.26 -1.00 118.68 118.93 1nye s LEU 357 Ca 0.38 -0.26 0.02 0.00 0.69 0.00 0.00 54.13 54.96 1nye s LEU 357 Cb -0.06 -0.74 0.01 0.00 -0.43 0.00 0.00 46.19 44.97 1nye s LEU 357 CO 0.26 -0.00 -0.12 -1.81 -0.29 0.00 0.00 176.35 174.39 1nye s ASP 358 N 0.83 1.70 -0.10 3.68 1.11 0.30 -4.99 116.67 119.20 1nye s ASP 358 Ca -0.12 -0.28 -0.24 0.00 0.18 0.00 0.00 52.55 52.09 1nye s ASP 358 Cb -0.15 -0.79 0.06 0.00 1.07 0.00 0.00 42.92 43.10 1nye s ASP 358 CO 0.02 0.03 0.58 -0.72 1.18 0.00 0.00 175.17 176.25 1nye s TYR 359 N 0.69 -0.56 -0.06 4.23 1.13 -1.25 0.30 117.35 121.82 1nye s TYR 359 Ca -0.14 1.12 0.03 0.00 -1.41 0.00 0.00 57.07 56.67 1nye s TYR 359 Cb -0.16 0.28 -0.02 0.00 -1.10 0.00 0.00 41.96 40.96 1nye s TYR 359 CO 0.03 -0.47 -0.15 -0.65 -2.51 0.00 0.00 175.55 171.81 1nye s GLN 360 N -0.70 2.64 -0.30 -3.49 -0.21 -0.81 -4.99 119.66 111.79 1nye s GLN 360 Ca -0.08 -0.72 0.03 0.00 0.02 0.00 0.00 55.36 54.61 1nye s GLN 360 Cb -0.03 -2.39 0.08 0.00 1.00 0.00 0.00 33.01 31.68 1nye s GLN 360 CO 0.06 0.53 0.01 -1.17 -2.12 0.00 0.00 175.29 172.59 1nye s LEU 361 N -0.50 3.78 -0.13 2.90 1.98 -1.26 -1.53 118.68 123.93 1nye s LEU 361 Ca 0.06 -1.76 -0.29 0.00 -2.89 0.00 0.00 54.13 49.25 1nye s LEU 361 Cb -0.12 -1.43 -0.04 0.00 0.66 0.00 0.00 46.19 45.26 1nye s LEU 361 CO 0.02 -0.32 1.58 -0.54 -1.89 0.00 0.00 176.35 175.19 1nye s LYS 362 N 1.12 4.07 0.00 1.98 1.02 -0.35 -4.99 119.74 122.59 1nye s LYS 362 Ca 0.04 1.94 0.00 0.00 0.02 0.00 0.00 55.97 57.96 1nye s LYS 362 Cb -0.19 -3.96 0.00 0.00 -0.52 0.00 0.00 37.83 33.16 1nye s LYS 362 CO -0.09 -0.97 0.00 0.43 -0.92 0.00 0.00 175.35 173.80