#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gwx h LYS 212 N 0.00 0.55 0.00 1.96 1.63 -1.99 -1.62 116.57 117.09 2gwx h LYS 212 Ca 0.00 -0.25 -0.05 0.00 -0.85 0.00 0.00 60.65 59.51 2gwx h LYS 212 Cb 0.00 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.61 2gwx h LYS 212 CO 0.00 0.81 -0.23 0.00 -3.45 0.00 0.00 179.45 176.58 2gwx h ALA 213 N 0.73 1.04 0.11 5.00 0.00 -2.04 -2.18 119.26 121.92 2gwx h ALA 213 Ca 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2gwx h ALA 213 Cb 0.65 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2gwx h ALA 213 CO 0.04 0.28 -0.05 0.35 0.00 0.00 0.00 179.25 179.87 2gwx h PHE 214 N 0.00 -0.13 -0.32 0.00 3.04 -1.95 -2.32 116.94 115.26 2gwx h PHE 214 Ca -0.00 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2gwx h PHE 214 Cb 0.72 0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.26 2gwx h PHE 214 CO 0.00 0.37 0.16 1.03 -2.02 0.00 0.00 178.31 177.85 2gwx h SER 215 N -0.79 0.39 -0.11 0.41 0.87 -1.25 -2.06 113.55 111.01 2gwx h SER 215 Ca -0.01 -0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.36 2gwx h SER 215 Cb 0.56 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2gwx h SER 215 CO 0.02 0.33 -0.49 0.50 -0.53 0.00 0.00 176.83 176.67 2gwx h LYS 216 N 0.44 0.68 -0.27 2.24 3.64 -1.44 -1.19 116.57 120.68 2gwx h LYS 216 Ca 0.12 -0.40 -0.11 0.00 -1.27 0.00 0.00 60.65 58.99 2gwx h LYS 216 Cb 0.03 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 2gwx h LYS 216 CO -0.02 1.01 -0.31 1.25 -2.27 0.00 0.00 179.45 179.12 2gwx h HIS 217 N 0.54 0.64 -0.00 1.91 2.76 -0.80 -2.24 115.15 117.95 2gwx h HIS 217 Ca 0.03 -0.16 -0.14 0.00 -2.20 0.00 0.00 60.37 57.90 2gwx h HIS 217 Cb 1.04 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.83 2gwx h HIS 217 CO 0.05 0.80 -0.66 0.82 -1.30 0.00 0.00 177.93 177.64 2gwx h ILE 218 N 0.48 1.47 -0.37 6.26 2.04 -1.24 -2.12 117.51 124.02 2gwx h ILE 218 Ca 0.06 -2.24 -0.09 0.00 1.00 0.00 0.00 64.86 63.59 2gwx h ILE 218 Cb 0.77 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 2gwx h ILE 218 CO 0.06 0.64 -0.12 0.22 0.00 0.00 0.00 178.15 178.96 2gwx h TYR 219 N 0.01 0.83 -0.45 1.37 3.20 -0.92 -1.89 116.97 119.13 2gwx h TYR 219 Ca -0.01 -0.19 -0.13 0.00 3.14 0.00 0.00 58.73 61.54 2gwx h TYR 219 Cb 1.17 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 2gwx h TYR 219 CO 0.00 0.89 -0.24 -0.91 -1.64 0.00 0.00 178.16 176.27 2gwx h ASN 220 N 0.53 0.99 -0.95 -2.11 4.21 -1.38 -0.85 115.58 116.02 2gwx h ASN 220 Ca 0.09 -0.41 0.03 0.00 1.21 0.00 0.00 56.30 57.22 2gwx h ASN 220 Cb 0.64 -0.27 -0.05 0.00 -1.12 0.00 0.00 38.32 37.51 2gwx h ASN 220 CO 0.04 1.18 0.63 0.00 -1.29 0.00 0.00 177.43 177.99 2gwx h ALA 221 N 0.84 1.37 -0.45 -0.83 0.00 -1.33 -0.96 119.26 117.90 2gwx h ALA 221 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2gwx h ALA 221 Cb 0.82 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2gwx h ALA 221 CO 0.07 0.54 -0.07 -0.92 0.00 0.00 0.00 179.25 178.87 2gwx h TYR 222 N 1.22 0.94 0.00 0.00 5.03 -0.99 -2.42 116.97 120.75 2gwx h TYR 222 Ca 0.37 -0.19 -0.08 0.00 2.58 0.00 0.00 58.73 61.41 2gwx h TYR 222 Cb -0.02 -0.24 -0.01 0.00 1.55 0.00 0.00 36.73 38.01 2gwx h TYR 222 CO -0.00 0.93 -0.37 -0.07 -1.32 0.00 0.00 178.16 177.33 2gwx h LEU 223 N 0.69 0.00 -1.54 2.82 3.38 -0.30 -2.55 115.31 117.80 2gwx h LEU 223 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2gwx h LEU 223 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2gwx h LEU 223 CO 0.04 0.37 -0.01 2.29 0.09 0.00 0.00 178.44 181.22 2gwx n LYS 224 N -4.05 2.05 -0.01 1.13 2.85 -0.45 -4.28 118.16 115.41 2gwx n LYS 224 Ca -0.02 -1.54 0.03 0.00 -1.05 0.00 0.00 58.31 55.73 2gwx n LYS 224 Cb 0.41 -1.47 -0.07 0.00 -0.65 0.00 0.00 35.03 33.26 2gwx n LYS 224 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2gwx n ASN 225 N 0.87 3.06 -4.28 -5.58 4.13 -0.92 -4.94 115.26 107.60 2gwx n ASN 225 Ca 0.16 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 56.05 2gwx n ASN 225 Cb 0.50 1.27 -0.13 0.00 -1.54 0.00 0.00 39.78 39.88 2gwx n ASN 225 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2gwx s PHE 226 N -2.52 3.18 0.10 3.10 0.08 -0.97 -4.79 117.98 116.15 2gwx s PHE 226 Ca -0.03 -1.28 -0.27 0.00 0.12 0.00 0.00 56.93 55.47 2gwx s PHE 226 Cb 0.05 -2.22 -0.11 0.00 -0.57 0.00 0.00 43.02 40.18 2gwx s PHE 226 CO 0.35 -0.67 1.66 -2.95 -0.10 0.00 0.00 175.22 173.51 2gwx h ASN 227 N 8.17 -0.58 -3.65 1.36 -1.07 -1.89 -3.40 115.58 114.52 2gwx h ASN 227 Ca -0.28 0.06 -0.66 0.00 0.07 0.00 0.00 56.30 55.49 2gwx h ASN 227 Cb 1.10 0.21 -0.16 0.00 -2.07 0.00 0.00 38.32 37.40 2gwx h ASN 227 CO 0.59 -0.31 -0.21 -0.32 0.07 0.00 0.00 177.43 177.25 2gwx s MET 228 N -6.09 3.60 0.28 4.14 0.00 -1.26 -5.07 119.30 114.90 2gwx s MET 228 Ca -0.15 -0.32 0.06 0.00 0.00 0.00 0.00 55.69 55.28 2gwx s MET 228 Cb 0.07 -3.80 -0.02 0.00 0.00 0.00 0.00 34.83 31.08 2gwx s MET 228 CO 0.65 -0.55 0.36 0.95 0.00 0.00 0.00 175.02 176.43 2gwx s THR 229 N 2.14 4.58 0.26 10.11 -4.23 -1.26 -4.98 115.64 122.24 2gwx s THR 229 Ca 0.14 -1.10 -0.04 0.00 -1.18 0.00 0.00 61.69 59.52 2gwx s THR 229 Cb -0.16 -3.58 0.15 0.00 1.34 0.00 0.00 72.50 70.26 2gwx s THR 229 CO 0.12 -0.26 1.81 0.50 -0.54 0.00 0.00 174.62 176.24 2gwx h LYS 230 N 1.14 0.96 -3.74 3.99 3.64 -1.96 -0.90 116.57 119.70 2gwx h LYS 230 Ca -0.49 -0.19 -0.76 0.00 -1.27 0.00 0.00 60.65 57.94 2gwx h LYS 230 Cb 1.24 -0.15 -0.18 0.00 -0.41 0.00 0.00 32.23 32.73 2gwx h LYS 230 CO 0.58 0.83 1.60 1.63 -2.27 0.00 0.00 179.45 181.82 2gwx n LYS 231 N -4.27 3.68 0.00 1.90 4.76 -1.26 -1.19 118.16 121.77 2gwx n LYS 231 Ca 0.05 -3.80 0.00 0.00 -2.87 0.00 0.00 58.31 51.69 2gwx n LYS 231 Cb 0.22 -2.88 0.00 0.00 -1.84 0.00 0.00 35.03 30.53 2gwx n LYS 231 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2gwx n LYS 232 N 3.89 0.00 0.00 1.97 4.81 -1.19 -4.86 118.16 122.78 2gwx n LYS 232 Ca 0.36 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.78 2gwx n LYS 232 Cb 0.38 0.00 0.25 0.00 0.02 0.00 0.00 35.03 35.67 2gwx n LYS 232 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gwx h ALA 233 N 0.00 1.24 0.00 3.14 0.00 -0.85 0.90 119.26 123.69 2gwx h ALA 233 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2gwx h ALA 233 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2gwx h ALA 233 CO 0.00 0.50 0.00 0.00 0.00 0.00 0.00 179.25 179.75 2gwx h ARG 234 N 0.48 0.00 0.00 0.00 2.47 -1.36 -2.71 114.38 113.26 2gwx h ARG 234 Ca 0.09 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.73 2gwx h ARG 234 Cb 0.48 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.79 2gwx h ARG 234 CO 0.03 0.00 -0.63 0.77 0.56 0.00 0.00 179.97 180.70 2gwx h SER 235 N 0.00 0.00 -2.20 7.04 0.02 -1.12 -3.35 113.55 113.94 2gwx h SER 235 Ca 0.00 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.37 2gwx h SER 235 Cb 0.67 0.00 -0.42 0.00 0.14 0.00 0.00 62.40 62.80 2gwx h SER 235 CO 0.00 0.34 -0.71 2.30 -1.14 0.00 0.00 176.83 177.63 2gwx n ILE 236 N -3.07 2.20 0.00 3.27 -5.35 -0.56 -4.73 119.36 111.12 2gwx n ILE 236 Ca 0.00 -5.23 0.00 0.00 -0.27 0.00 0.00 62.75 57.25 2gwx n ILE 236 Cb 0.69 -1.63 0.00 0.00 -1.74 0.00 0.00 39.64 36.96 2gwx n ILE 236 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2gwx n LEU 237 N 0.37 0.00 0.00 7.28 0.00 -1.16 -4.88 117.00 118.61 2gwx n LEU 237 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.30 2gwx n LEU 237 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.85 2gwx n LEU 237 CO 0.34 0.00 0.00 0.41 0.00 0.00 0.00 177.39 178.14 2gwx n THR 238 N 0.00 0.00 0.00 1.96 -1.04 -1.26 -4.41 114.28 109.53 2gwx n THR 238 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2gwx n THR 238 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2gwx n THR 238 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2gwx n GLY 239 N 0.00 0.01 0.00 3.41 0.00 -1.26 -5.13 105.19 102.23 2gwx n GLY 239 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2gwx n GLY 239 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2gwx n LYS 240 N -0.23 0.00 -3.37 1.61 3.00 -1.26 -4.99 118.16 112.91 2gwx n LYS 240 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.14 2gwx n LYS 240 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 35.03 35.11 2gwx n LYS 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2gwx n ALA 241 N -3.00 -1.69 0.19 3.14 0.00 -1.26 -4.78 120.51 113.11 2gwx n ALA 241 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2gwx n ALA 241 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.39 2gwx n ALA 241 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2gwx n SER 242 N -2.89 0.86 -0.12 0.00 7.64 -1.26 -4.30 113.62 113.55 2gwx n SER 242 Ca -0.19 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.04 2gwx n SER 242 Cb 0.63 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 2gwx n SER 242 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2gwx n HIS 243 N 1.05 0.00 0.16 1.43 -0.00 -1.26 -3.82 115.22 112.77 2gwx n HIS 243 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2gwx n HIS 243 Cb 0.13 -0.01 0.00 0.00 -0.00 0.00 0.00 29.99 30.11 2gwx n HIS 243 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 2gwx n THR 244 N -0.30 0.00 -2.65 1.59 -1.04 -1.26 -5.09 114.28 105.53 2gwx n THR 244 Ca 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 61.97 2gwx n THR 244 Cb 0.02 -0.12 -0.03 0.00 -1.82 0.00 0.00 70.33 68.37 2gwx n THR 244 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gwx n ALA 245 N -3.19 -3.58 -1.85 2.41 0.00 -1.25 -4.93 120.51 108.10 2gwx n ALA 245 Ca 0.00 1.83 -0.41 0.00 0.00 0.00 0.00 53.44 54.86 2gwx n ALA 245 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 19.45 15.81 2gwx n ALA 245 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gwx s PRO 246 N -0.94 4.57 -0.04 0.00 0.04 -1.26 -4.99 135.00 132.37 2gwx s PRO 246 Ca -0.20 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.41 2gwx s PRO 246 Cb 0.01 -3.19 -0.05 0.00 0.04 0.00 0.00 34.50 31.31 2gwx s PRO 246 CO 0.77 0.08 1.46 0.12 0.04 0.00 0.00 177.00 179.47 2gwx s PHE 247 N -0.82 2.59 -0.40 0.56 5.36 -0.59 -4.68 117.98 120.01 2gwx s PHE 247 Ca 0.47 0.66 -0.25 0.00 -0.96 0.00 0.00 56.93 56.85 2gwx s PHE 247 Cb -0.33 -3.72 0.02 0.00 -0.34 0.00 0.00 43.02 38.65 2gwx s PHE 247 CO 0.41 -2.76 0.88 0.08 -1.46 0.00 0.00 175.22 172.37 2gwx s VAL 248 N 3.07 4.60 -0.29 3.12 1.01 -1.26 -0.40 120.40 130.25 2gwx s VAL 248 Ca 0.65 0.95 -0.15 0.00 0.00 0.00 0.00 61.98 63.43 2gwx s VAL 248 Cb -0.30 -4.33 -0.03 0.00 0.00 0.00 0.00 36.38 31.72 2gwx s VAL 248 CO 0.25 -0.60 0.39 -0.63 0.00 0.00 0.00 175.10 174.52 2gwx s ILE 249 N 3.44 5.15 0.00 2.22 1.01 -0.63 -4.89 121.20 127.50 2gwx s ILE 249 Ca 0.36 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.46 2gwx s ILE 249 Cb -0.12 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.60 2gwx s ILE 249 CO 0.20 0.07 0.05 0.00 0.00 0.00 0.00 174.94 175.26 2gwx n HIS 250 N 5.39 0.00 -3.20 3.97 1.44 -1.26 -1.42 115.22 120.14 2gwx n HIS 250 Ca -0.08 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.62 2gwx n HIS 250 Cb 0.50 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.61 2gwx n HIS 250 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 2gwx n ASP 251 N -0.04 -0.10 -0.12 4.39 5.68 -1.26 -4.45 116.55 120.65 2gwx n ASP 251 Ca 0.00 -1.08 -0.11 0.00 -0.50 0.00 0.00 54.79 53.10 2gwx n ASP 251 Cb 0.16 0.17 -0.02 0.00 -1.14 0.00 0.00 41.12 40.28 2gwx n ASP 251 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 2gwx h ILE 252 N 1.05 1.27 0.13 2.12 2.04 -1.99 -2.82 117.51 119.31 2gwx h ILE 252 Ca -0.02 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 2gwx h ILE 252 Cb 0.06 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2gwx h ILE 252 CO 0.02 0.36 -0.06 -0.08 0.00 0.00 0.00 178.15 178.38 2gwx h GLU 253 N 0.47 -0.17 -0.89 2.37 4.81 -1.99 0.22 114.58 119.42 2gwx h GLU 253 Ca 0.10 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2gwx h GLU 253 Cb 0.53 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.90 2gwx h GLU 253 CO 0.03 -0.01 0.58 1.79 -0.73 0.00 0.00 179.01 180.66 2gwx h THR 254 N -0.29 1.16 -0.60 0.32 1.35 -1.91 0.04 112.91 112.98 2gwx h THR 254 Ca -0.02 -0.39 -0.03 0.00 -0.55 0.00 0.00 66.41 65.43 2gwx h THR 254 Cb 0.23 -0.07 -0.03 0.00 -1.73 0.00 0.00 68.15 66.56 2gwx h THR 254 CO 0.03 0.21 0.27 0.25 -0.25 0.00 0.00 175.52 176.02 2gwx h LEU 255 N 1.13 0.80 -0.89 3.87 5.85 -1.28 0.39 115.31 125.18 2gwx h LEU 255 Ca 0.35 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 2gwx h LEU 255 Cb -0.03 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.76 2gwx h LEU 255 CO -0.11 0.72 0.44 -0.25 -0.34 0.00 0.00 178.44 178.90 2gwx h TRP 256 N 0.82 1.23 0.00 1.25 7.01 -0.14 0.36 115.95 126.48 2gwx h TRP 256 Ca 0.20 -0.05 0.00 0.00 2.11 0.00 0.00 58.89 61.15 2gwx h TRP 256 Cb 0.15 -0.38 0.00 0.00 -2.10 0.00 0.00 29.16 26.83 2gwx h TRP 256 CO 0.00 0.87 -0.07 0.00 -2.79 0.00 0.00 178.44 176.45 2gwx n GLN 257 N -4.31 0.08 0.11 2.65 10.64 -0.08 -2.63 117.38 123.84 2gwx n GLN 257 Ca 0.09 0.06 -0.24 0.00 -1.83 0.00 0.00 57.00 55.08 2gwx n GLN 257 Cb 0.13 -1.58 -0.15 0.00 -0.86 0.00 0.00 30.24 27.77 2gwx n GLN 257 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2gwx h ALA 258 N 2.87 -0.06 0.00 2.61 0.00 0.11 1.27 119.26 126.06 2gwx h ALA 258 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 53.99 2gwx h ALA 258 Cb 0.57 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2gwx h ALA 258 CO 0.00 0.74 0.00 0.39 0.00 0.00 0.00 179.25 180.38 2gwx n GLU 259 N -3.75 0.09 0.03 0.00 -0.58 0.11 -2.70 120.64 113.85 2gwx n GLU 259 Ca -0.19 0.21 -0.01 0.00 -0.42 0.00 0.00 57.16 56.75 2gwx n GLU 259 Cb 1.06 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 30.43 2gwx n GLU 259 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2gwx n LYS 260 N -1.25 0.02 -0.14 3.49 5.02 -1.12 -4.37 118.16 119.81 2gwx n LYS 260 Ca 0.03 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2gwx n LYS 260 Cb 0.04 -0.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 2gwx n LYS 260 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2gwx n GLY 261 N 3.32 1.79 0.00 0.72 0.00 0.44 -1.97 105.19 109.49 2gwx n GLY 261 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2gwx n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gwx n LEU 262 N 0.96 0.00 -2.78 0.99 4.77 -1.10 -4.91 117.00 114.93 2gwx n LEU 262 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 2gwx n LEU 262 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2gwx n LEU 262 CO 0.00 0.00 -0.47 0.52 -1.33 0.00 0.00 177.39 176.11 2gwx n VAL 263 N -0.03-11.08 0.00 4.08 0.31 -0.83 -5.09 118.33 105.69 2gwx n VAL 263 Ca 0.00 1.68 0.00 0.00 -0.01 0.00 0.00 64.34 66.01 2gwx n VAL 263 Cb 0.00 -6.58 0.00 0.00 -0.91 0.00 0.00 33.84 26.35 2gwx n VAL 263 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2gwx n TRP 264 N 0.71 0.00 0.00 3.52 8.01 -1.26 -5.08 117.44 123.34 2gwx n TRP 264 Ca 0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.20 2gwx n TRP 264 Cb 0.07 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.37 2gwx n TRP 264 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2gwx n LYS 265 N 0.00 0.00 -2.97 -0.99 5.02 -1.26 -5.07 118.16 112.89 2gwx n LYS 265 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2gwx n LYS 265 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2gwx n LYS 265 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2gwx n GLN 266 N 0.00 -0.30 -1.26 1.97 3.00 -1.26 -4.66 117.38 114.87 2gwx n GLN 266 Ca 0.00 0.73 -0.46 0.00 -0.01 0.00 0.00 57.00 57.26 2gwx n GLN 266 Cb 0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 30.24 29.31 2gwx n GLN 266 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 2gwx n LEU 267 N 1.31 -0.52 0.00 1.08 -0.00 -1.26 -4.46 117.00 113.15 2gwx n LEU 267 Ca 0.00 0.99 0.00 0.00 -0.00 0.00 0.00 56.01 57.00 2gwx n LEU 267 Cb 0.43 -0.81 0.00 0.00 -0.00 0.00 0.00 43.42 43.04 2gwx n LEU 267 CO 0.00 -2.09 0.00 0.55 -0.00 0.00 0.00 177.39 175.85 2gwx n VAL 268 N 0.68 0.00 -3.92 1.47 3.14 -1.26 -4.66 118.33 113.78 2gwx n VAL 268 Ca 0.16 0.00 -0.21 0.00 -2.96 0.00 0.00 64.34 61.33 2gwx n VAL 268 Cb 0.14 0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.90 2gwx n VAL 268 CO 0.00 0.00 0.00 0.21 -6.46 0.00 0.00 176.83 170.58 2gwx s ASN 269 N -4.00 6.31 0.00 6.55 2.47 -1.26 -5.00 114.94 120.01 2gwx s ASN 269 Ca 0.00 0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.37 2gwx s ASN 269 Cb 0.00 -1.86 0.00 0.00 -1.45 0.00 0.00 41.25 37.94 2gwx s ASN 269 CO 0.00 -0.09 0.00 0.61 -3.72 0.00 0.00 177.10 173.90 2gwx n GLY 270 N -1.44 -2.41 1.43 1.21 0.00 -1.26 -4.77 105.19 97.95 2gwx n GLY 270 Ca -0.09 -1.25 -0.02 0.00 0.00 0.00 0.00 46.02 44.66 2gwx n GLY 270 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gwx n LEU 271 N 0.00 -2.30 0.00 0.99 7.99 -1.26 -4.98 117.00 117.44 2gwx n LEU 271 Ca 0.00 -0.07 0.00 0.00 -0.01 0.00 0.00 56.01 55.93 2gwx n LEU 271 Cb 0.00 -0.80 0.00 0.00 -0.11 0.00 0.00 43.42 42.51 2gwx n LEU 271 CO 0.00 0.03 0.00 -0.81 -1.51 0.00 0.00 177.39 175.10 2gwx n PRO 272 N -1.48 3.65 -0.02 3.23 -0.04 -1.15 -4.82 135.00 134.37 2gwx n PRO 272 Ca -0.02 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.26 2gwx n PRO 272 Cb 0.52 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.90 2gwx n PRO 272 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2gwx h PRO 273 N 0.00 0.74 -0.04 0.54 0.11 -2.02 -3.14 132.00 128.19 2gwx h PRO 273 Ca 0.00 -0.63 0.00 0.00 0.11 0.00 0.00 66.00 65.48 2gwx h PRO 273 Cb 0.00 0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.25 2gwx h PRO 273 CO 0.00 1.24 0.00 0.66 -0.21 0.00 0.00 178.00 179.69 2gwx n TYR 274 N -3.97 0.05 -4.17 0.65 4.02 -1.26 -4.84 117.16 107.64 2gwx n TYR 274 Ca -0.08 -0.03 -0.10 0.00 -0.01 0.00 0.00 57.90 57.68 2gwx n TYR 274 Cb 0.74 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.96 2gwx n TYR 274 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 176.86 174.26 2gwx s LYS 275 N -1.95 1.01 0.30 -0.72 -2.85 -1.19 -5.05 119.74 109.29 2gwx s LYS 275 Ca 0.30 -1.50 -0.01 0.00 -1.00 0.00 0.00 55.97 53.76 2gwx s LYS 275 Cb 0.14 0.25 -0.02 0.00 -2.06 0.00 0.00 37.83 36.14 2gwx s LYS 275 CO 0.23 -0.30 0.34 -1.83 0.10 0.00 0.00 175.35 173.90 2gwx s GLU 276 N -4.08 1.66 0.07 1.78 -1.05 -1.26 -2.95 118.70 112.87 2gwx s GLU 276 Ca 0.29 -1.74 -0.23 0.00 -0.15 0.00 0.00 54.97 53.13 2gwx s GLU 276 Cb 0.07 0.37 -0.14 0.00 -0.44 0.00 0.00 34.13 33.99 2gwx s GLU 276 CO 0.05 -0.64 1.61 0.97 0.95 0.00 0.00 175.26 178.19 2gwx h ILE 277 N 2.25 1.13 -0.93 1.83 6.09 -1.94 -1.50 117.51 124.43 2gwx h ILE 277 Ca -0.29 -0.39 0.07 0.00 -1.37 0.00 0.00 64.86 62.88 2gwx h ILE 277 Cb 1.24 1.29 -0.07 0.00 0.47 0.00 0.00 36.82 39.76 2gwx h ILE 277 CO 0.41 0.11 0.59 0.28 -3.07 0.00 0.00 178.15 176.47 2gwx h SER 278 N -0.06 0.93 0.21 2.19 0.02 -1.97 -1.57 113.55 113.30 2gwx h SER 278 Ca 0.02 0.02 -0.22 0.00 -0.84 0.00 0.00 61.79 60.77 2gwx h SER 278 Cb 0.16 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2gwx h SER 278 CO -0.00 0.59 -0.86 0.58 -1.14 0.00 0.00 176.83 175.99 2gwx h VAL 279 N 1.06 1.36 -0.20 2.27 2.07 -1.95 -2.52 116.25 118.34 2gwx h VAL 279 Ca 0.41 -2.26 -0.07 0.00 0.82 0.00 0.00 66.70 65.60 2gwx h VAL 279 Cb 0.20 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 2gwx h VAL 279 CO -0.18 0.68 -0.18 -0.74 0.02 0.00 0.00 177.57 177.17 2gwx h HIS 280 N 0.30 0.36 -0.24 1.57 6.17 -0.88 -1.11 115.15 121.33 2gwx h HIS 280 Ca -0.06 -0.06 -0.11 0.00 0.71 0.00 0.00 60.37 60.85 2gwx h HIS 280 Cb 1.48 -0.10 -0.00 0.00 2.52 0.00 0.00 27.41 31.31 2gwx h HIS 280 CO 0.06 0.50 -0.27 0.28 0.71 0.00 0.00 177.93 179.21 2gwx h VAL 281 N 0.31 1.32 -0.99 5.26 2.07 -1.26 -2.32 116.25 120.64 2gwx h VAL 281 Ca 0.06 -1.46 0.06 0.00 0.82 0.00 0.00 66.70 66.18 2gwx h VAL 281 Cb 0.50 1.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 2gwx h VAL 281 CO 0.03 0.45 0.64 0.15 0.02 0.00 0.00 177.57 178.87 2gwx h PHE 282 N 0.31 1.19 -0.56 1.57 3.57 -1.01 -1.18 116.94 120.83 2gwx h PHE 282 Ca 0.03 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 2gwx h PHE 282 Cb 0.84 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2gwx h PHE 282 CO 0.08 0.63 0.03 1.88 -2.23 0.00 0.00 178.31 178.70 2gwx h TYR 283 N 1.17 1.01 0.00 0.41 0.05 -1.02 -1.87 116.97 116.72 2gwx h TYR 283 Ca 0.42 -0.15 -0.05 0.00 0.05 0.00 0.00 58.73 59.00 2gwx h TYR 283 Cb 0.14 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.59 2gwx h TYR 283 CO -0.00 0.89 -0.25 0.00 -1.05 0.00 0.00 178.16 177.74 2gwx h ARG 284 N 0.88 0.00 -0.07 4.88 2.47 -0.70 -1.75 114.38 120.09 2gwx h ARG 284 Ca 0.17 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.87 2gwx h ARG 284 Cb 0.47 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 2gwx h ARG 284 CO 0.02 0.25 -0.04 0.00 0.56 0.00 0.00 179.97 180.76 2gwx h GLN 286 N -0.25 0.00 0.12 0.00 3.07 -1.31 0.57 115.11 117.31 2gwx h GLN 286 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.75 2gwx h GLN 286 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.06 2gwx h GLN 286 CO 0.01 0.34 -0.06 0.00 0.09 0.00 0.00 178.83 179.21 2gwx h THR 288 N -0.23 0.72 -0.96 0.00 2.02 -1.20 -2.07 112.91 111.18 2gwx h THR 288 Ca -0.02 -0.12 0.16 0.00 0.77 0.00 0.00 66.41 67.20 2gwx h THR 288 Cb 0.18 0.78 -0.10 0.00 -1.74 0.00 0.00 68.15 67.28 2gwx h THR 288 CO 0.03 0.03 0.57 0.74 0.37 0.00 0.00 175.52 177.26 2gwx h THR 289 N -0.47 0.78 -0.16 3.16 2.02 -0.80 -0.15 112.91 117.30 2gwx h THR 289 Ca -0.04 -0.28 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 2gwx h THR 289 Cb 0.35 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2gwx h THR 289 CO 0.07 0.15 -0.47 0.58 0.37 0.00 0.00 175.52 176.22 2gwx h VAL 290 N 0.81 1.32 -0.40 3.16 2.07 -0.73 -1.77 116.25 120.71 2gwx h VAL 290 Ca 0.52 -1.67 -0.15 0.00 0.82 0.00 0.00 66.70 66.22 2gwx h VAL 290 Cb 0.70 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2gwx h VAL 290 CO -0.34 0.51 -0.33 -0.08 0.02 0.00 0.00 177.57 177.35 2gwx h GLU 291 N 0.32 0.93 -0.16 1.57 4.57 -0.44 -2.63 114.58 118.75 2gwx h GLU 291 Ca 0.02 -0.47 -0.08 0.00 -1.18 0.00 0.00 59.36 57.65 2gwx h GLU 291 Cb 0.95 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.53 2gwx h GLU 291 CO 0.08 1.12 -0.27 1.15 -1.18 0.00 0.00 179.01 179.91 2gwx h THR 292 N 0.76 1.25 -0.65 0.32 2.02 -0.98 -1.76 112.91 113.88 2gwx h THR 292 Ca 0.07 -1.20 -0.03 0.00 0.77 0.00 0.00 66.41 66.01 2gwx h THR 292 Cb 0.92 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 2gwx h THR 292 CO 0.09 0.37 0.26 0.58 0.37 0.00 0.00 175.52 177.19 2gwx h VAL 293 N 0.27 1.22 0.08 3.16 2.07 -1.15 0.11 116.25 122.02 2gwx h VAL 293 Ca 0.04 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2gwx h VAL 293 Cb 0.62 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2gwx h VAL 293 CO 0.04 0.28 -0.06 -0.09 0.02 0.00 0.00 177.57 177.77 2gwx h ARG 294 N 0.93 -0.14 -0.51 1.57 1.12 -0.96 -0.31 114.38 116.08 2gwx h ARG 294 Ca 0.22 0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 59.08 2gwx h ARG 294 Cb 0.17 0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.14 2gwx h ARG 294 CO -0.02 -0.09 0.26 0.93 -3.11 0.00 0.00 179.97 177.94 2gwx h GLU 295 N -0.14 0.72 -0.94 0.20 5.08 -0.98 -2.42 114.58 116.11 2gwx h GLU 295 Ca -0.00 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2gwx h GLU 295 Cb 0.13 -0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 2gwx h GLU 295 CO -0.01 0.58 0.62 -0.07 -1.00 0.00 0.00 179.01 179.13 2gwx h LEU 296 N 0.68 1.05 0.01 1.33 3.38 -0.53 0.58 115.31 121.82 2gwx h LEU 296 Ca 0.18 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 2gwx h LEU 296 Cb 0.08 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2gwx h LEU 296 CO -0.03 0.74 -0.01 0.74 0.09 0.00 0.00 178.44 179.98 2gwx h THR 297 N 1.23 0.99 -0.81 0.22 2.02 -0.63 0.10 112.91 116.03 2gwx h THR 297 Ca 0.36 -0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.49 2gwx h THR 297 Cb -0.08 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 2gwx h THR 297 CO -0.09 0.00 0.34 -0.33 0.37 0.00 0.00 175.52 175.81 2gwx h GLU 298 N -0.02 1.21 -0.31 6.66 4.39 -1.04 -1.80 114.58 123.66 2gwx h GLU 298 Ca -0.00 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 2gwx h GLU 298 Cb 0.01 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 2gwx h GLU 298 CO 0.00 0.97 0.18 0.35 -1.16 0.00 0.00 179.01 179.35 2gwx h PHE 299 N 1.18 0.42 -0.48 4.33 3.57 -0.62 -2.84 116.94 122.49 2gwx h PHE 299 Ca 0.27 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.78 2gwx h PHE 299 Cb 0.20 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 2gwx h PHE 299 CO 0.02 0.33 0.30 0.00 -2.23 0.00 0.00 178.31 176.73 2gwx h ALA 300 N 1.06 0.62 0.00 2.41 0.00 -0.49 -1.11 119.26 121.74 2gwx h ALA 300 Ca 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2gwx h ALA 300 Cb 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2gwx h ALA 300 CO -0.02 0.02 0.00 0.87 0.00 0.00 0.00 179.25 180.12 2gwx h LYS 301 N 0.61 0.00 0.00 0.00 1.57 -1.11 0.15 116.57 117.79 2gwx h LYS 301 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2gwx h LYS 301 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 2gwx h LYS 301 CO -0.07 0.00 -0.79 0.43 -0.57 0.00 0.00 179.45 178.46 2gwx n SER 302 N -2.50 0.64 -4.68 0.86 7.64 -0.44 -4.56 113.62 110.58 2gwx n SER 302 Ca -0.02 -0.09 -0.42 0.00 1.01 0.00 0.00 58.87 59.35 2gwx n SER 302 Cb 0.06 0.46 -0.03 0.00 -1.01 0.00 0.00 64.21 63.69 2gwx n SER 302 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2gwx s ILE 303 N -3.15 4.03 0.00 0.44 1.01 0.51 -4.94 121.20 119.10 2gwx s ILE 303 Ca 0.06 1.35 0.00 0.00 0.00 0.00 0.00 60.65 62.06 2gwx s ILE 303 Cb 0.14 -3.87 0.00 0.00 0.01 0.00 0.00 42.46 38.74 2gwx s ILE 303 CO 0.75 -0.04 0.00 -2.65 0.00 0.00 0.00 174.94 173.01 2gwx n PRO 304 N 5.70 0.00 0.00 2.79 -0.02 -1.26 -1.38 135.00 140.83 2gwx n PRO 304 Ca 0.13 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.76 2gwx n PRO 304 Cb 0.45 0.00 0.75 0.00 -0.02 0.00 0.00 33.50 34.68 2gwx n PRO 304 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2gwx n SER 305 N -0.10 0.12 0.18 2.55 3.41 -1.26 -4.21 113.62 114.30 2gwx n SER 305 Ca 0.00 -0.39 -0.14 0.00 -0.26 0.00 0.00 58.87 58.08 2gwx n SER 305 Cb 0.00 -0.19 -0.07 0.00 -0.26 0.00 0.00 64.21 63.69 2gwx n SER 305 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2gwx h PHE 306 N 0.15 -0.50 -0.09 7.33 3.57 -1.49 -2.76 116.94 123.15 2gwx h PHE 306 Ca 0.00 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.52 2gwx h PHE 306 Cb 0.26 0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.18 2gwx h PHE 306 CO 0.00 -0.29 0.10 0.77 -2.23 0.00 0.00 178.31 176.65 2gwx h SER 307 N -0.46 0.00 1.16 0.41 0.02 -1.73 -0.73 113.55 112.22 2gwx h SER 307 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2gwx h SER 307 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2gwx h SER 307 CO 0.01 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 176.47 2gwx h SER 308 N 0.00 0.00 -4.11 3.07 4.64 -1.74 -3.44 113.55 111.97 2gwx h SER 308 Ca 0.04 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.88 2gwx h SER 308 Cb 0.24 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.37 2gwx h SER 308 CO -0.00 0.00 0.39 -0.76 -0.87 0.00 0.00 176.83 175.59 2gwx s LEU 309 N -4.78 3.72 0.57 5.97 1.43 -0.28 -4.98 118.68 120.32 2gwx s LEU 309 Ca 0.07 1.96 -0.19 0.00 -1.03 0.00 0.00 54.13 54.94 2gwx s LEU 309 Cb 0.10 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.72 2gwx s LEU 309 CO 0.51 -1.01 1.18 -0.36 0.23 0.00 0.00 176.35 176.90 2gwx s PHE 310 N -2.07 2.49 0.34 0.29 0.08 -1.26 -4.79 117.98 113.06 2gwx s PHE 310 Ca 0.68 1.52 0.12 0.00 0.12 0.00 0.00 56.93 59.37 2gwx s PHE 310 Cb -0.18 -3.41 0.97 0.00 -0.57 0.00 0.00 43.02 39.82 2gwx s PHE 310 CO 0.27 -1.99 1.72 1.25 -0.10 0.00 0.00 175.22 176.38 2gwx h LEU 311 N 1.01 0.60 -1.11 -0.37 5.85 -1.94 0.09 115.31 119.44 2gwx h LEU 311 Ca -0.50 0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.29 2gwx h LEU 311 Cb 1.28 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.34 2gwx h LEU 311 CO 0.56 0.06 0.01 -0.55 -0.34 0.00 0.00 178.44 178.18 2gwx h ASN 312 N 0.50 0.59 0.55 1.25 -0.00 -2.00 -1.86 115.58 114.62 2gwx h ASN 312 Ca 0.65 -0.12 -0.17 0.00 -0.00 0.00 0.00 56.30 56.66 2gwx h ASN 312 Cb 1.37 -0.16 -0.01 0.00 -0.00 0.00 0.00 38.32 39.52 2gwx h ASN 312 CO -0.46 0.66 -0.77 0.44 -0.00 0.00 0.00 177.43 177.30 2gwx h ASP 313 N 0.60 0.21 -0.72 6.14 3.32 -1.35 -2.11 116.42 122.51 2gwx h ASP 313 Ca 0.12 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 2gwx h ASP 313 Cb 0.37 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 2gwx h ASP 313 CO 0.01 0.90 0.30 1.56 -1.72 0.00 0.00 179.24 180.30 2gwx h GLN 314 N 0.11 1.08 -0.27 3.56 4.20 -0.96 -1.91 115.11 120.93 2gwx h GLN 314 Ca -0.03 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.43 2gwx h GLN 314 Cb 1.35 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 2gwx h GLN 314 CO 0.12 0.87 -0.13 0.28 -0.67 0.00 0.00 178.83 179.30 2gwx h VAL 315 N 1.06 1.30 -0.28 -0.54 2.07 -1.18 -2.24 116.25 116.44 2gwx h VAL 315 Ca 0.25 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.58 2gwx h VAL 315 Cb 0.19 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2gwx h VAL 315 CO -0.02 0.38 0.10 0.74 0.02 0.00 0.00 177.57 178.79 2gwx h THR 316 N 0.30 0.92 -0.76 2.57 2.02 -1.20 0.54 112.91 117.30 2gwx h THR 316 Ca 0.06 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.20 2gwx h THR 316 Cb 0.64 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 2gwx h THR 316 CO 0.04 0.04 0.47 -0.07 0.37 0.00 0.00 175.52 176.37 2gwx h LEU 317 N 0.22 0.78 -0.42 2.58 3.38 -1.29 -2.50 115.31 118.06 2gwx h LEU 317 Ca 0.13 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.93 2gwx h LEU 317 Cb 0.09 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2gwx h LEU 317 CO -0.13 0.53 -0.45 -0.07 0.09 0.00 0.00 178.44 178.41 2gwx h LEU 318 N 0.92 0.90 -0.09 1.67 3.38 -1.06 -1.39 115.31 119.65 2gwx h LEU 318 Ca 0.31 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.87 2gwx h LEU 318 Cb 0.03 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 2gwx h LEU 318 CO -0.12 1.22 -0.14 0.50 0.09 0.00 0.00 178.44 179.99 2gwx h LYS 319 N 0.67 -0.18 -0.01 1.13 3.64 -0.48 0.81 116.57 122.14 2gwx h LYS 319 Ca 0.04 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2gwx h LYS 319 Cb 1.03 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 2gwx h LYS 319 CO 0.10 -0.12 -0.22 0.66 -2.27 0.00 0.00 179.45 177.60 2gwx n TYR 320 N -5.28 0.00 -0.03 1.91 4.01 -0.99 -4.41 117.16 112.37 2gwx n TYR 320 Ca -0.04 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.68 2gwx n TYR 320 Cb 0.20 -0.13 -0.06 0.00 -0.31 0.00 0.00 39.34 39.05 2gwx n TYR 320 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2gwx n GLY 321 N 1.32 -0.36 0.34 2.72 0.00 -0.52 -4.71 105.19 103.98 2gwx n GLY 321 Ca 0.13 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 46.04 2gwx n GLY 321 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2gwx h VAL 322 N 0.00 1.03 -0.14 1.61 -1.51 -1.06 -1.99 116.25 114.19 2gwx h VAL 322 Ca -0.16 -0.35 -0.10 0.00 -1.23 0.00 0.00 66.70 64.85 2gwx h VAL 322 Cb 1.25 -0.10 -0.01 0.00 -2.13 0.00 0.00 31.29 30.30 2gwx h VAL 322 CO 0.01 0.19 -0.36 0.45 -1.23 0.00 0.00 177.57 176.63 2gwx h HIS 323 N 1.03 0.33 -0.69 5.19 3.86 -1.85 0.22 115.15 123.24 2gwx h HIS 323 Ca 0.42 -0.08 -0.07 0.00 -1.16 0.00 0.00 60.37 59.48 2gwx h HIS 323 Cb 0.24 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.60 2gwx h HIS 323 CO -0.02 0.61 0.17 0.93 0.86 0.00 0.00 177.93 180.48 2gwx h GLU 324 N 0.25 1.11 -0.16 2.45 5.08 -1.67 -0.83 114.58 120.81 2gwx h GLU 324 Ca 0.03 -0.26 -0.15 0.00 -1.00 0.00 0.00 59.36 57.98 2gwx h GLU 324 Cb 0.75 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2gwx h GLU 324 CO 0.06 0.98 -0.53 0.00 -1.00 0.00 0.00 179.01 178.51 2gwx h ALA 325 N 1.12 0.78 -0.32 3.43 0.00 -0.91 -2.74 119.26 120.63 2gwx h ALA 325 Ca 0.22 -0.50 -0.15 0.00 0.00 0.00 0.00 54.91 54.48 2gwx h ALA 325 Cb 0.37 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2gwx h ALA 325 CO 0.00 0.68 -0.41 0.82 0.00 0.00 0.00 179.25 180.35 2gwx h ILE 326 N 0.36 1.28 0.00 0.00 2.04 -0.13 -2.22 117.51 118.85 2gwx h ILE 326 Ca 0.01 -1.58 -0.09 0.00 1.00 0.00 0.00 64.86 64.20 2gwx h ILE 326 Cb 1.05 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.59 2gwx h ILE 326 CO 0.10 0.52 -0.42 -0.26 0.00 0.00 0.00 178.15 178.08 2gwx h PHE 327 N 0.63 0.00 0.01 1.37 0.04 -1.14 -1.16 116.94 116.69 2gwx h PHE 327 Ca 0.05 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.82 2gwx h PHE 327 Cb 0.96 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.11 2gwx h PHE 327 CO 0.05 0.42 -0.00 0.00 -0.60 0.00 0.00 178.31 178.18 2gwx h ALA 328 N 1.58 -0.01 0.00 2.45 0.00 -1.33 -3.11 119.26 118.85 2gwx h ALA 328 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2gwx h ALA 328 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2gwx h ALA 328 CO 0.05 -0.22 0.00 0.52 0.00 0.00 0.00 179.25 179.61 2gwx h MET 329 N -0.59 0.00 0.00 0.00 2.86 -1.34 -2.14 114.93 113.72 2gwx h MET 329 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2gwx h MET 329 Cb 0.57 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 2gwx h MET 329 CO 0.00 0.00 -0.15 1.25 1.06 0.00 0.00 176.91 179.07 2gwx h LEU 330 N 0.00 0.00 -0.89 1.22 5.85 -1.13 -2.27 115.31 118.09 2gwx h LEU 330 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2gwx h LEU 330 Cb 0.32 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 2gwx h LEU 330 CO 0.00 0.15 0.26 0.00 -0.34 0.00 0.00 178.44 178.51 2gwx h ALA 331 N 1.85 1.11 -0.27 1.25 0.00 -1.49 -2.92 119.26 118.79 2gwx h ALA 331 Ca -0.00 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.79 2gwx h ALA 331 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2gwx h ALA 331 CO 0.02 0.62 0.39 0.77 0.00 0.00 0.00 179.25 181.05 2gwx h SER 332 N 1.04 0.00 -0.02 0.00 0.02 -1.59 -0.94 113.55 112.07 2gwx h SER 332 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2gwx h SER 332 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 2gwx h SER 332 CO -0.02 0.00 0.00 2.30 -1.14 0.00 0.00 176.83 177.97 2gwx n ILE 333 N -3.48 1.50 -3.86 3.27 -5.35 -1.11 -4.63 119.36 105.70 2gwx n ILE 333 Ca 0.04 -1.68 -0.30 0.00 -0.27 0.00 0.00 62.75 60.54 2gwx n ILE 333 Cb 0.52 0.09 -0.04 0.00 -1.74 0.00 0.00 39.64 38.47 2gwx n ILE 333 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2gwx s VAL 334 N -2.03 5.32 0.43 7.28 1.01 -0.36 -1.82 120.40 130.23 2gwx s VAL 334 Ca 0.19 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2gwx s VAL 334 Cb 0.16 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 2gwx s VAL 334 CO 0.02 0.05 0.12 0.21 0.00 0.00 0.00 175.10 175.51 2gwx s ASN 335 N -2.68 2.97 0.29 3.32 3.84 0.37 -4.96 114.94 118.10 2gwx s ASN 335 Ca 0.36 -1.69 0.11 0.00 0.21 0.00 0.00 52.86 51.85 2gwx s ASN 335 Cb -0.12 0.54 0.42 0.00 -0.55 0.00 0.00 41.25 41.54 2gwx s ASN 335 CO 0.28 -0.95 1.65 0.07 -2.79 0.00 0.00 177.10 175.36 2gwx h LYS 336 N 1.72 0.00 0.00 0.43 2.10 -1.99 -3.29 116.57 115.54 2gwx h LYS 336 Ca -0.36 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.26 2gwx h LYS 336 Cb 1.28 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.55 2gwx h LYS 336 CO 0.58 0.57 -0.41 -0.25 -2.00 0.00 0.00 179.45 177.93 2gwx n ASP 337 N -3.82 1.41 0.00 7.07 8.00 -1.26 -4.94 116.55 123.02 2gwx n ASP 337 Ca -0.01 -2.85 0.00 0.00 0.71 0.00 0.00 54.79 52.64 2gwx n ASP 337 Cb 0.58 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 2gwx n ASP 337 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2gwx n GLY 338 N -0.70 -0.61 3.17 0.44 0.00 -1.24 -1.99 105.19 104.25 2gwx n GLY 338 Ca 0.11 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2gwx n GLY 338 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2gwx s LEU 339 N 0.00 1.01 0.52 0.99 0.20 -0.54 0.14 118.68 121.00 2gwx s LEU 339 Ca 0.00 0.37 -0.18 0.00 0.69 0.00 0.00 54.13 55.01 2gwx s LEU 339 Cb 0.00 0.96 -0.07 0.00 -0.43 0.00 0.00 46.19 46.65 2gwx s LEU 339 CO 0.00 -0.19 1.01 -0.76 -0.29 0.00 0.00 176.35 176.12 2gwx s LEU 340 N -0.31 3.68 0.04 -0.68 1.43 -0.76 -1.02 118.68 121.05 2gwx s LEU 340 Ca -0.04 1.74 -0.03 0.00 -1.03 0.00 0.00 54.13 54.77 2gwx s LEU 340 Cb -0.03 -4.53 -0.02 0.00 0.03 0.00 0.00 46.19 41.64 2gwx s LEU 340 CO 0.01 -0.77 0.04 0.68 0.23 0.00 0.00 176.35 176.54 2gwx s VAL 341 N -2.37 0.14 -0.14 -1.59 -7.23 0.17 -4.84 120.40 104.54 2gwx s VAL 341 Ca 0.63 -1.19 -0.06 0.00 -1.81 0.00 0.00 61.98 59.54 2gwx s VAL 341 Cb -0.13 -0.85 0.01 0.00 0.56 0.00 0.00 36.38 35.96 2gwx s VAL 341 CO 0.28 -0.66 0.12 0.00 -0.31 0.00 0.00 175.10 174.53 2gwx n ALA 342 N 0.86 -2.37 -0.73 1.32 0.00 -1.26 -0.79 120.51 117.54 2gwx n ALA 342 Ca -0.19 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2gwx n ALA 342 Cb 0.58 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.05 2gwx n ALA 342 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2gwx n ASN 343 N 0.90 -3.08 0.00 0.00 5.15 -1.26 0.07 115.26 117.04 2gwx n ASN 343 Ca -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.97 2gwx n ASN 343 Cb 0.43 -2.89 0.00 0.00 -0.53 0.00 0.00 39.78 36.79 2gwx n ASN 343 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2gwx n GLY 344 N -0.33 0.93 0.23 8.20 0.00 -0.87 -4.92 105.19 108.45 2gwx n GLY 344 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 2gwx n GLY 344 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2gwx h SER 345 N 0.00 0.20 -1.93 1.61 4.64 -0.04 -3.42 113.55 114.61 2gwx h SER 345 Ca 0.00 -0.04 -0.56 0.00 -0.47 0.00 0.00 61.79 60.71 2gwx h SER 345 Cb 0.00 -0.05 -0.09 0.00 -0.31 0.00 0.00 62.40 61.95 2gwx h SER 345 CO 0.00 0.39 -0.58 -0.83 -0.87 0.00 0.00 176.83 174.94 2gwx s GLY 346 N -4.08 1.96 -0.27 -0.77 0.00 0.03 -1.54 107.32 102.65 2gwx s GLY 346 Ca -0.05 -1.86 -0.02 0.00 0.00 0.00 0.00 44.72 42.79 2gwx s GLY 346 CO 0.73 -1.81 0.26 -0.12 0.00 0.00 0.00 173.10 172.16 2gwx s PHE 347 N -2.45 -0.31 0.11 1.90 2.19 0.46 0.41 117.98 120.29 2gwx s PHE 347 Ca 0.36 -0.19 -0.24 0.00 0.33 0.00 0.00 56.93 57.18 2gwx s PHE 347 Cb -0.02 -0.50 -0.07 0.00 -1.31 0.00 0.00 43.02 41.12 2gwx s PHE 347 CO 0.21 -0.85 0.73 0.08 1.83 0.00 0.00 175.22 177.23 2gwx s VAL 348 N 2.32 4.55 0.17 3.12 1.01 -0.19 -1.61 120.40 129.77 2gwx s VAL 348 Ca 0.09 1.59 -0.23 0.00 0.00 0.00 0.00 61.98 63.43 2gwx s VAL 348 Cb -0.15 -4.08 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 2gwx s VAL 348 CO -0.29 0.48 0.73 0.42 0.00 0.00 0.00 175.10 176.43 2gwx s THR 349 N -0.79 4.49 0.30 3.92 -4.23 -0.51 -1.47 115.64 117.35 2gwx s THR 349 Ca 0.35 1.49 -0.01 0.00 -1.18 0.00 0.00 61.69 62.34 2gwx s THR 349 Cb -0.22 -4.01 0.27 0.00 1.34 0.00 0.00 72.50 69.88 2gwx s THR 349 CO 0.24 0.43 1.96 -0.09 -0.54 0.00 0.00 174.62 176.61 2gwx h ARG 350 N 4.06 1.07 -0.25 3.99 2.43 -1.74 -1.39 114.38 122.55 2gwx h ARG 350 Ca -0.48 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 58.61 2gwx h ARG 350 Cb 1.20 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 2gwx h ARG 350 CO 0.65 0.71 0.09 0.93 -1.51 0.00 0.00 179.97 180.84 2gwx h GLU 351 N 1.10 0.39 -0.41 0.20 4.39 -1.93 -0.68 114.58 117.63 2gwx h GLU 351 Ca 0.32 -0.08 0.05 0.00 0.34 0.00 0.00 59.36 59.99 2gwx h GLU 351 Cb -0.06 -0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.48 2gwx h GLU 351 CO -0.08 0.45 0.15 0.35 -1.16 0.00 0.00 179.01 178.72 2gwx h PHE 352 N 0.25 0.26 -0.99 4.33 3.57 -1.62 -1.63 116.94 121.11 2gwx h PHE 352 Ca 0.08 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2gwx h PHE 352 Cb 0.22 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 2gwx h PHE 352 CO -0.00 0.10 0.66 -0.07 -2.23 0.00 0.00 178.31 176.77 2gwx h LEU 353 N 0.31 1.14 -1.63 0.59 3.38 -1.02 -1.96 115.31 116.12 2gwx h LEU 353 Ca 0.19 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 2gwx h LEU 353 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2gwx h LEU 353 CO -0.19 0.82 -0.17 0.03 0.09 0.00 0.00 178.44 179.01 2gwx h ARG 354 N 1.34 0.00 -0.00 1.13 3.08 -0.33 -2.28 114.38 117.31 2gwx h ARG 354 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 2gwx h ARG 354 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.91 2gwx h ARG 354 CO -0.08 0.17 -0.01 -1.13 -1.07 0.00 0.00 179.97 177.85 2gwx n SER 355 N -3.59 0.27 -4.74 7.04 3.41 -0.69 -4.88 113.62 110.44 2gwx n SER 355 Ca -0.01 -0.90 -0.36 0.00 -0.26 0.00 0.00 58.87 57.34 2gwx n SER 355 Cb 0.31 -0.05 0.06 0.00 -0.26 0.00 0.00 64.21 64.27 2gwx n SER 355 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2gwx s LEU 356 N -2.13 3.54 0.42 1.04 1.43 -0.86 -4.89 118.68 117.22 2gwx s LEU 356 Ca 0.42 2.48 -0.22 0.00 -1.03 0.00 0.00 54.13 55.78 2gwx s LEU 356 Cb 0.21 -4.60 -0.14 0.00 0.03 0.00 0.00 46.19 41.69 2gwx s LEU 356 CO 0.39 -1.94 0.40 -1.14 0.23 0.00 0.00 176.35 174.29 2gwx n ARG 357 N -2.01 0.37 -0.03 1.70 0.63 -1.26 -4.20 116.66 111.85 2gwx n ARG 357 Ca 0.14 0.14 0.01 0.00 -0.92 0.00 0.00 57.85 57.22 2gwx n ARG 357 Cb 0.49 -1.34 0.02 0.00 0.45 0.00 0.00 32.46 32.08 2gwx n ARG 357 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2gwx n LYS 358 N 0.82 -0.01 -0.08 -0.14 4.76 -1.26 -2.22 118.16 120.03 2gwx n LYS 358 Ca 0.12 0.15 -0.16 0.00 -2.87 0.00 0.00 58.31 55.55 2gwx n LYS 358 Cb 0.40 -0.22 -0.12 0.00 -1.84 0.00 0.00 35.03 33.24 2gwx n LYS 358 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2gwx h PRO 359 N 0.00 0.00 0.00 1.97 0.13 -2.03 -3.37 132.00 128.70 2gwx h PRO 359 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2gwx h PRO 359 Cb 0.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.21 2gwx h PRO 359 CO -0.10 0.95 0.00 1.19 -0.23 0.00 0.00 178.00 179.81 2gwx n PHE 360 N -4.56 0.71 0.17 1.56 3.72 -1.00 -3.29 117.46 114.77 2gwx n PHE 360 Ca -0.17 0.29 0.02 0.00 -0.05 0.00 0.00 57.45 57.55 2gwx n PHE 360 Cb 0.52 -0.97 0.28 0.00 -0.94 0.00 0.00 39.48 38.37 2gwx n PHE 360 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2gwx h SER 361 N 0.00 0.00 -0.50 4.37 4.64 -1.61 -3.28 113.55 117.16 2gwx h SER 361 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2gwx h SER 361 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2gwx h SER 361 CO 0.00 0.48 0.00 -0.90 -0.87 0.00 0.00 176.83 175.54 2gwx n ASP 362 N -3.76 3.60 -0.63 4.97 5.68 -1.21 -4.18 116.55 121.02 2gwx n ASP 362 Ca -0.01 -1.99 0.13 0.00 -0.50 0.00 0.00 54.79 52.41 2gwx n ASP 362 Cb 0.53 -0.33 0.24 0.00 -1.14 0.00 0.00 41.12 40.42 2gwx n ASP 362 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2gwx n ILE 363 N 1.53 0.00 -0.01 2.12 -5.35 -1.24 -4.39 119.36 112.03 2gwx n ILE 363 Ca 0.21 -0.33 -0.01 0.00 -0.27 0.00 0.00 62.75 62.35 2gwx n ILE 363 Cb 0.61 1.02 -0.02 0.00 -1.74 0.00 0.00 39.64 39.51 2gwx n ILE 363 CO 0.00 0.00 0.00 2.30 -1.76 0.00 0.00 176.55 177.09 2gwx n ILE 364 N 0.47 0.13 -0.19 7.28 -0.00 -1.26 -4.76 119.36 121.03 2gwx n ILE 364 Ca 0.14 -0.09 -0.04 0.00 -0.00 0.00 0.00 62.75 62.77 2gwx n ILE 364 Cb 0.47 -0.82 0.15 0.00 -0.00 0.00 0.00 39.64 39.44 2gwx n ILE 364 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.55 176.47 2gwx h GLU 365 N 0.00 0.97 -0.05 6.28 4.57 -1.77 -2.67 114.58 121.92 2gwx h GLU 365 Ca -0.05 -0.18 -0.03 0.00 -1.18 0.00 0.00 59.36 57.91 2gwx h GLU 365 Cb 1.04 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.47 2gwx h GLU 365 CO 0.00 0.82 -0.12 -1.35 -1.18 0.00 0.00 179.01 177.19 2gwx h PRO 366 N 0.95 0.07 0.00 0.92 0.11 -1.86 -1.38 132.00 130.81 2gwx h PRO 366 Ca 0.21 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 2gwx h PRO 366 Cb 0.25 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.34 2gwx h PRO 366 CO -0.01 0.19 -0.02 0.87 -0.21 0.00 0.00 178.00 178.83 2gwx h LYS 367 N 0.07 0.00 0.03 1.05 1.57 -1.78 -2.92 116.57 114.60 2gwx h LYS 367 Ca 0.02 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 2gwx h LYS 367 Cb 0.25 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.57 2gwx h LYS 367 CO 0.02 0.02 -0.30 0.74 -0.57 0.00 0.00 179.45 179.36 2gwx h PHE 368 N 0.00 0.24 0.00 -1.35 0.04 -1.18 -2.27 116.94 112.42 2gwx h PHE 368 Ca -0.00 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.62 2gwx h PHE 368 Cb 0.78 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2gwx h PHE 368 CO 0.00 1.04 0.00 -0.85 -0.60 0.00 0.00 178.31 177.90 2gwx n GLU 369 N -4.45 0.26 -0.11 1.51 0.28 -0.84 -1.43 120.64 115.85 2gwx n GLU 369 Ca -0.11 0.07 -0.19 0.00 -0.16 0.00 0.00 57.16 56.78 2gwx n GLU 369 Cb 0.57 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.84 2gwx n GLU 369 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2gwx n PHE 370 N -1.11 0.00 -0.19 -1.84 -0.00 -1.11 -4.26 117.46 108.95 2gwx n PHE 370 Ca 0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.51 2gwx n PHE 370 Cb 0.05 -0.84 0.23 0.00 -0.00 0.00 0.00 39.48 38.93 2gwx n PHE 370 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2gwx h ALA 371 N -0.31 1.39 0.01 3.13 0.00 -0.73 0.21 119.26 122.96 2gwx h ALA 371 Ca -0.53 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 2gwx h ALA 371 Cb 1.67 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2gwx h ALA 371 CO -0.18 0.51 -0.01 0.28 0.00 0.00 0.00 179.25 179.85 2gwx h VAL 372 N 0.95 1.27 -0.78 0.00 2.07 -1.48 -0.46 116.25 117.81 2gwx h VAL 372 Ca 0.24 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 2gwx h VAL 372 Cb 0.00 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 2gwx h VAL 372 CO -0.04 0.22 0.31 0.11 0.02 0.00 0.00 177.57 178.19 2gwx h LYS 373 N -0.39 1.17 -0.68 1.57 1.57 -1.70 -2.73 116.57 115.39 2gwx h LYS 373 Ca -0.00 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 2gwx h LYS 373 Cb 0.38 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 2gwx h LYS 373 CO 0.00 0.95 0.44 0.35 -0.57 0.00 0.00 179.45 180.63 2gwx h PHE 374 N 1.14 0.84 0.00 -1.35 3.57 -0.43 -1.29 116.94 119.42 2gwx h PHE 374 Ca 0.26 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.78 2gwx h PHE 374 Cb 0.22 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2gwx h PHE 374 CO 0.02 0.51 0.00 0.09 -2.23 0.00 0.00 178.31 176.70 2gwx n ASN 375 N -4.63 0.52 0.23 0.41 3.02 -0.20 -1.82 115.26 112.79 2gwx n ASN 375 Ca 0.06 0.68 0.16 0.00 -0.03 0.00 0.00 54.58 55.45 2gwx n ASN 375 Cb 0.04 -0.77 0.71 0.00 -0.61 0.00 0.00 39.78 39.14 2gwx n ASN 375 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gwx h ALA 376 N 2.15 1.00 0.00 5.41 0.00 -1.09 -1.73 119.26 125.00 2gwx h ALA 376 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gwx h ALA 376 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2gwx h ALA 376 CO 0.00 0.00 -0.30 1.28 0.00 0.00 0.00 179.25 180.23 2gwx n LEU 377 N -2.73 0.62 -3.75 0.00 4.77 -0.75 -4.98 117.00 110.17 2gwx n LEU 377 Ca 0.00 0.36 -0.32 0.00 -0.03 0.00 0.00 56.01 56.03 2gwx n LEU 377 Cb 0.21 -0.28 0.03 0.00 -2.33 0.00 0.00 43.42 41.05 2gwx n LEU 377 CO 0.22 -0.07 -0.10 -0.62 -1.33 0.00 0.00 177.39 175.49 2gwx n GLU 378 N -2.00 -1.48 -2.96 3.23 1.02 -0.65 -4.98 120.64 112.82 2gwx n GLU 378 Ca 0.05 0.42 -0.29 0.00 -0.02 0.00 0.00 57.16 57.32 2gwx n GLU 378 Cb 0.41 -4.06 -0.03 0.00 -0.02 0.00 0.00 31.44 27.74 2gwx n GLU 378 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2gwx s LEU 379 N -6.62 3.86 0.00 -4.62 1.43 -1.26 -5.10 118.68 106.37 2gwx s LEU 379 Ca 0.41 0.98 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 2gwx s LEU 379 Cb -0.15 -3.85 0.03 0.00 0.03 0.00 0.00 46.19 42.24 2gwx s LEU 379 CO 0.87 -0.37 0.24 -0.90 0.23 0.00 0.00 176.35 176.42 2gwx n ASP 380 N -1.36 1.49 -0.13 2.29 5.68 -1.26 -4.95 116.55 118.31 2gwx n ASP 380 Ca 0.01 -1.79 -0.04 0.00 -0.50 0.00 0.00 54.79 52.48 2gwx n ASP 380 Cb 0.54 -0.07 0.17 0.00 -1.14 0.00 0.00 41.12 40.62 2gwx n ASP 380 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2gwx h ASP 381 N 0.21 0.79 -0.72 -1.12 3.32 -1.98 -1.83 116.42 115.09 2gwx h ASP 381 Ca -0.14 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.74 2gwx h ASP 381 Cb 0.56 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.87 2gwx h ASP 381 CO 0.22 0.80 0.41 0.77 -1.72 0.00 0.00 179.24 179.72 2gwx h SER 382 N 0.80 0.88 0.66 6.45 4.64 -1.95 -0.19 113.55 124.83 2gwx h SER 382 Ca 0.17 -0.08 -0.03 0.00 -0.47 0.00 0.00 61.79 61.37 2gwx h SER 382 Cb 0.35 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2gwx h SER 382 CO 0.01 0.71 -0.32 0.44 -0.87 0.00 0.00 176.83 176.80 2gwx h ASP 383 N 0.98 -0.75 -1.22 4.97 3.32 -1.91 -2.99 116.42 118.82 2gwx h ASP 383 Ca 0.25 -0.01 0.35 0.00 0.02 0.00 0.00 57.03 57.65 2gwx h ASP 383 Cb 0.01 0.19 -0.08 0.00 0.22 0.00 0.00 39.33 39.67 2gwx h ASP 383 CO -0.04 -0.42 0.83 0.25 -1.72 0.00 0.00 179.24 178.14 2gwx h LEU 384 N -1.08 0.21 -0.31 1.55 5.85 -1.14 0.13 115.31 120.52 2gwx h LEU 384 Ca -0.09 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2gwx h LEU 384 Cb 0.72 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2gwx h LEU 384 CO 0.15 -0.01 0.14 0.00 -0.34 0.00 0.00 178.44 178.38 2gwx h ALA 385 N 1.49 0.39 -0.11 1.25 0.00 -0.88 -0.48 119.26 120.93 2gwx h ALA 385 Ca 0.66 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 55.31 2gwx h ALA 385 Cb 2.18 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.84 2gwx h ALA 385 CO -0.20 -0.03 -0.60 -0.07 0.00 0.00 0.00 179.25 178.35 2gwx h LEU 386 N 0.35 0.43 -0.49 0.00 3.38 -0.81 -2.66 115.31 115.51 2gwx h LEU 386 Ca 0.10 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2gwx h LEU 386 Cb 0.14 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2gwx h LEU 386 CO -0.01 0.93 0.01 0.15 0.09 0.00 0.00 178.44 179.61 2gwx h PHE 387 N 0.28 0.93 -0.32 1.13 3.57 -0.87 -1.49 116.94 120.18 2gwx h PHE 387 Ca -0.01 -0.16 -0.13 0.00 3.53 0.00 0.00 57.97 61.20 2gwx h PHE 387 Cb 1.13 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 2gwx h PHE 387 CO 0.03 0.88 -0.33 0.82 -2.23 0.00 0.00 178.31 177.49 2gwx h ILE 388 N 0.72 1.29 -0.82 1.41 2.04 -1.12 -2.17 117.51 118.87 2gwx h ILE 388 Ca 0.14 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.51 2gwx h ILE 388 Cb 0.50 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.07 2gwx h ILE 388 CO 0.02 0.49 0.53 0.00 0.00 0.00 0.00 178.15 179.19 2gwx h ALA 389 N 0.72 1.39 -0.55 1.87 0.00 -1.40 -1.59 119.26 119.71 2gwx h ALA 389 Ca 0.05 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2gwx h ALA 389 Cb 0.91 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2gwx h ALA 389 CO 0.08 0.55 0.05 0.00 0.00 0.00 0.00 179.25 179.93 2gwx h ALA 390 N 1.47 1.05 -0.61 0.00 0.00 -1.10 -1.63 119.26 118.44 2gwx h ALA 390 Ca 0.30 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2gwx h ALA 390 Cb -0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 2gwx h ALA 390 CO -0.06 0.60 0.19 0.82 0.00 0.00 0.00 179.25 180.80 2gwx h ILE 391 N 0.85 1.24 -0.24 0.00 2.04 -0.66 -3.17 117.51 117.58 2gwx h ILE 391 Ca 0.17 -0.84 -0.17 0.00 1.00 0.00 0.00 64.86 65.02 2gwx h ILE 391 Cb 0.43 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 2gwx h ILE 391 CO 0.02 0.32 -0.54 0.40 0.00 0.00 0.00 178.15 178.34 2gwx h ILE 392 N 0.87 1.30 -0.84 -0.67 2.04 -1.11 -3.33 117.51 115.78 2gwx h ILE 392 Ca 0.20 -1.76 -0.73 0.00 1.00 0.00 0.00 64.86 63.57 2gwx h ILE 392 Cb 0.29 1.69 -0.10 0.00 -0.74 0.00 0.00 36.82 37.96 2gwx h ILE 392 CO -0.01 0.56 2.57 0.18 0.00 0.00 0.00 178.15 181.45 2gwx n LEU 393 N -3.98 7.15 -4.38 1.44 7.99 -0.63 -4.76 117.00 119.83 2gwx n LEU 393 Ca -0.04 -4.52 -0.38 0.00 -0.01 0.00 0.00 56.01 51.06 2gwx n LEU 393 Cb 0.62 -1.52 -0.12 0.00 -0.11 0.00 0.00 43.42 42.29 2gwx n LEU 393 CO 0.49 1.49 -0.23 0.00 -1.51 0.00 0.00 177.39 177.63 2gwx n GLY 395 N 4.92 -0.80 0.94 0.00 0.00 -1.26 -3.35 105.19 105.64 2gwx n GLY 395 Ca -0.14 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 45.88 2gwx n GLY 395 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gwx n ASP 396 N -0.80 3.16 -4.76 1.61 -0.08 -1.26 -4.86 116.55 109.57 2gwx n ASP 396 Ca 0.12 -1.91 -0.37 0.00 -1.51 0.00 0.00 54.79 51.11 2gwx n ASP 396 Cb 0.05 -0.24 0.02 0.00 2.34 0.00 0.00 41.12 43.29 2gwx n ASP 396 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2gwx s ARG 397 N -1.19 3.35 -0.04 -0.67 1.81 -1.21 -4.94 118.95 116.06 2gwx s ARG 397 Ca 0.32 1.89 -0.30 0.00 -1.72 0.00 0.00 55.73 55.92 2gwx s ARG 397 Cb 0.18 -2.20 -0.04 0.00 -0.45 0.00 0.00 34.95 32.44 2gwx s ARG 397 CO 0.25 -0.92 1.20 -1.25 -0.68 0.00 0.00 175.30 173.90 2gwx s PRO 398 N -2.97 4.37 0.00 3.54 0.04 -1.26 -3.31 135.00 135.41 2gwx s PRO 398 Ca 0.70 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2gwx s PRO 398 Cb -0.32 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.70 2gwx s PRO 398 CO 0.37 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.41 2gwx n GLY 399 N 3.34 0.77 3.73 0.56 0.00 -1.26 -5.05 105.19 107.28 2gwx n GLY 399 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2gwx n GLY 399 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gwx s LEU 400 N 0.00 4.37 -0.17 0.99 1.43 -1.21 -4.93 118.68 119.16 2gwx s LEU 400 Ca 0.00 2.68 -0.24 0.00 -1.03 0.00 0.00 54.13 55.54 2gwx s LEU 400 Cb 0.00 -3.61 -0.21 0.00 0.03 0.00 0.00 46.19 42.40 2gwx s LEU 400 CO 0.00 -0.81 0.44 -0.03 0.23 0.00 0.00 176.35 176.18 2gwx h MET 401 N 6.10 0.00 -3.02 1.70 1.85 -1.95 -3.41 114.93 116.20 2gwx h MET 401 Ca -0.44 0.00 -0.70 0.00 -0.61 0.00 0.00 59.70 57.95 2gwx h MET 401 Cb 1.21 0.00 -0.35 0.00 0.43 0.00 0.00 31.60 32.89 2gwx h MET 401 CO 0.87 0.94 -0.03 -1.71 -0.40 0.00 0.00 176.91 176.58 2gwx n ASN 402 N -4.53 4.53 -0.17 1.39 4.05 -1.26 -4.90 115.26 114.37 2gwx n ASN 402 Ca -0.21 -3.25 -0.08 0.00 0.45 0.00 0.00 54.58 51.50 2gwx n ASN 402 Cb 0.56 -1.02 0.01 0.00 1.23 0.00 0.00 39.78 40.57 2gwx n ASN 402 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 2gwx h VAL 403 N 3.75 1.18 -0.45 3.44 2.07 -1.89 -2.86 116.25 121.48 2gwx h VAL 403 Ca 0.18 -0.47 0.05 0.00 0.82 0.00 0.00 66.70 67.28 2gwx h VAL 403 Cb 0.74 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 2gwx h VAL 403 CO 0.94 0.19 0.20 -0.65 0.02 0.00 0.00 177.57 178.27 2gwx h PRO 404 N 0.64 0.39 -0.41 1.57 0.11 -1.93 0.91 132.00 133.28 2gwx h PRO 404 Ca 0.17 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.27 2gwx h PRO 404 Cb 0.07 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 2gwx h PRO 404 CO -0.03 0.26 0.26 -0.09 -0.21 0.00 0.00 178.00 178.19 2gwx h ARG 405 N 0.40 0.51 -0.27 1.05 9.65 -1.97 -0.75 114.38 123.00 2gwx h ARG 405 Ca 0.20 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 2gwx h ARG 405 Cb 0.15 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 2gwx h ARG 405 CO -0.17 0.33 0.11 0.28 2.80 0.00 0.00 179.97 183.32 2gwx h VAL 406 N 0.52 1.17 -0.78 0.20 2.07 -1.23 -1.53 116.25 116.68 2gwx h VAL 406 Ca 0.16 -0.53 0.08 0.00 0.82 0.00 0.00 66.70 67.22 2gwx h VAL 406 Cb -0.02 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.73 2gwx h VAL 406 CO -0.06 0.18 0.51 -0.33 0.02 0.00 0.00 177.57 177.90 2gwx h GLU 407 N 0.28 0.77 -0.15 1.57 5.08 -0.56 0.68 114.58 122.25 2gwx h GLU 407 Ca 0.09 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2gwx h GLU 407 Cb 0.18 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2gwx h GLU 407 CO -0.01 0.51 0.02 0.00 -1.00 0.00 0.00 179.01 178.53 2gwx h ALA 408 N 1.59 0.20 -0.17 3.43 0.00 -0.62 -0.36 119.26 123.33 2gwx h ALA 408 Ca 0.35 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2gwx h ALA 408 Cb 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2gwx h ALA 408 CO -0.13 -0.13 0.10 0.82 0.00 0.00 0.00 179.25 179.91 2gwx h ILE 409 N 0.02 1.09 -0.42 0.00 2.04 -0.74 -2.91 117.51 116.59 2gwx h ILE 409 Ca 0.04 -0.22 0.08 0.00 1.00 0.00 0.00 64.86 65.76 2gwx h ILE 409 Cb 0.32 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 37.26 2gwx h ILE 409 CO 0.00 0.08 0.01 -0.61 0.00 0.00 0.00 178.15 177.63 2gwx h GLN 410 N 0.19 0.11 -0.94 2.37 4.15 -0.69 -1.59 115.11 118.71 2gwx h GLN 410 Ca 0.06 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.61 2gwx h GLN 410 Cb 0.04 -0.03 -0.09 0.00 0.21 0.00 0.00 27.48 27.62 2gwx h GLN 410 CO -0.01 0.07 0.56 0.22 -1.93 0.00 0.00 178.83 177.74 2gwx h ASP 411 N 0.12 0.76 -0.41 -0.69 3.58 -0.88 0.42 116.42 119.32 2gwx h ASP 411 Ca 0.21 0.07 -0.12 0.00 0.42 0.00 0.00 57.03 57.61 2gwx h ASP 411 Cb 0.30 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 2gwx h ASP 411 CO -0.34 0.36 -0.20 0.71 -2.88 0.00 0.00 179.24 176.89 2gwx h THR 412 N 0.82 1.28 -0.51 2.25 1.35 -1.14 0.12 112.91 117.08 2gwx h THR 412 Ca 0.49 -1.34 0.02 0.00 -0.55 0.00 0.00 66.41 65.03 2gwx h THR 412 Cb 0.60 1.26 -0.03 0.00 -1.73 0.00 0.00 68.15 68.25 2gwx h THR 412 CO -0.31 0.45 0.32 0.40 -0.25 0.00 0.00 175.52 176.12 2gwx h ILE 413 N 0.69 1.08 -0.48 6.82 2.04 -0.53 0.32 117.51 127.43 2gwx h ILE 413 Ca 0.09 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.69 2gwx h ILE 413 Cb 0.76 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2gwx h ILE 413 CO 0.06 0.12 0.09 -0.07 0.00 0.00 0.00 178.15 178.35 2gwx h LEU 414 N 0.63 0.69 -0.15 1.44 4.07 -0.65 0.42 115.31 121.75 2gwx h LEU 414 Ca 0.20 -0.12 -0.17 0.00 0.08 0.00 0.00 57.88 57.87 2gwx h LEU 414 Cb -0.01 -0.18 0.01 0.00 1.08 0.00 0.00 40.66 41.56 2gwx h LEU 414 CO -0.08 0.70 -0.58 0.03 -1.08 0.00 0.00 178.44 177.43 2gwx h ARG 415 N 0.71 0.66 -0.32 1.13 3.08 -0.23 -0.62 114.38 118.80 2gwx h ARG 415 Ca 0.16 -0.51 0.03 0.00 0.07 0.00 0.00 59.98 59.73 2gwx h ARG 415 Cb 0.30 0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2gwx h ARG 415 CO 0.00 1.13 0.13 0.00 -1.07 0.00 0.00 179.97 180.16 2gwx h ALA 416 N 0.54 0.37 0.08 0.04 0.00 0.06 -2.23 119.26 118.13 2gwx h ALA 416 Ca -0.03 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2gwx h ALA 416 Cb 1.21 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2gwx h ALA 416 CO 0.12 -0.25 -0.16 1.25 0.00 0.00 0.00 179.25 180.21 2gwx h LEU 417 N 0.29 -0.45 -0.48 0.00 5.85 -0.10 -1.11 115.31 119.31 2gwx h LEU 417 Ca 0.14 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2gwx h LEU 417 Cb 0.08 0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 2gwx h LEU 417 CO -0.12 -0.23 -0.37 -0.08 -0.34 0.00 0.00 178.44 177.30 2gwx h GLU 418 N -0.31 -0.11 0.50 1.25 4.57 -0.61 -1.76 114.58 118.11 2gwx h GLU 418 Ca 0.03 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 2gwx h GLU 418 Cb 0.33 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 2gwx h GLU 418 CO -0.10 -0.07 -0.45 0.74 -1.18 0.00 0.00 179.01 177.95 2gwx h PHE 419 N -0.12 -1.23 -0.83 0.92 0.04 -1.28 -2.28 116.94 112.16 2gwx h PHE 419 Ca 0.08 0.00 0.31 0.00 2.80 0.00 0.00 57.97 61.16 2gwx h PHE 419 Cb 0.32 0.47 -0.15 0.00 2.20 0.00 0.00 35.95 38.79 2gwx h PHE 419 CO -0.86 -0.61 0.31 1.58 -0.60 0.00 0.00 178.31 178.14 2gwx n HIS 420 N -5.16 0.83 -0.03 -0.55 -0.00 -0.43 0.16 115.22 110.04 2gwx n HIS 420 Ca -0.11 0.98 -0.11 0.00 0.46 0.00 0.00 57.72 58.94 2gwx n HIS 420 Cb 0.42 -1.31 -0.06 0.00 -0.12 0.00 0.00 29.99 28.92 2gwx n HIS 420 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 2gwx h LEU 421 N 0.00 0.19 -0.75 0.27 4.07 -0.76 0.16 115.31 118.49 2gwx h LEU 421 Ca 0.64 -0.21 0.16 0.00 0.08 0.00 0.00 57.88 58.56 2gwx h LEU 421 Cb 1.60 -0.05 -0.11 0.00 1.08 0.00 0.00 40.66 43.19 2gwx h LEU 421 CO -0.68 0.35 0.19 1.56 -1.08 0.00 0.00 178.44 178.78 2gwx h GLN 422 N 0.02 0.27 0.00 1.13 4.20 0.19 1.29 115.11 122.22 2gwx h GLN 422 Ca 0.04 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.73 2gwx h GLN 422 Cb 0.23 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2gwx h GLN 422 CO -0.00 0.18 0.00 0.00 -0.67 0.00 0.00 178.83 178.34 2gwx n ALA 423 N -2.65 -0.23 -0.29 3.87 0.00 -0.86 -3.56 120.51 116.79 2gwx n ALA 423 Ca 0.15 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.74 2gwx n ALA 423 Cb 0.47 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.33 2gwx n ALA 423 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2gwx h ASN 424 N 0.00 0.60 -3.29 0.00 4.21 -0.53 -3.34 115.58 113.22 2gwx h ASN 424 Ca 0.00 0.06 -0.60 0.00 1.21 0.00 0.00 56.30 56.97 2gwx h ASN 424 Cb 0.00 -0.05 -0.40 0.00 -1.12 0.00 0.00 38.32 36.75 2gwx h ASN 424 CO 0.00 0.24 -0.75 -1.00 -1.29 0.00 0.00 177.43 174.63 2gwx s HIS 425 N -5.63 1.86 0.01 1.19 3.76 0.44 -4.97 115.29 111.96 2gwx s HIS 425 Ca -0.10 -2.07 0.03 0.00 -0.15 0.00 0.00 55.06 52.78 2gwx s HIS 425 Cb 0.23 -1.80 -0.25 0.00 1.11 0.00 0.00 32.58 31.87 2gwx s HIS 425 CO 0.79 -0.84 0.89 -1.00 -0.85 0.00 0.00 174.74 173.73 2gwx h PRO 426 N 7.47 0.13 -0.02 8.40 0.13 -1.70 -3.38 132.00 143.04 2gwx h PRO 426 Ca -0.07 -0.23 -0.02 0.00 -0.87 0.00 0.00 66.00 64.81 2gwx h PRO 426 Cb 0.98 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.19 2gwx h PRO 426 CO 0.47 0.94 -0.06 0.38 -0.23 0.00 0.00 178.00 179.50 2gwx h ASP 427 N 0.04 0.09 -0.44 1.44 2.03 -1.93 -3.47 116.42 114.17 2gwx h ASP 427 Ca -0.21 -0.63 0.00 0.00 -0.73 0.00 0.00 57.03 55.47 2gwx h ASP 427 Cb 1.96 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 40.43 2gwx h ASP 427 CO 0.13 0.70 0.00 0.00 -1.03 0.00 0.00 179.24 179.04 2gwx n ALA 428 N -2.43 0.00 -3.64 4.15 0.00 -1.26 -5.05 120.51 112.28 2gwx n ALA 428 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.26 2gwx n ALA 428 Cb 0.35 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 2gwx n ALA 428 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2gwx s GLN 429 N -1.31 0.29 -1.04 0.00 -1.52 -1.26 -4.92 119.66 109.89 2gwx s GLN 429 Ca 0.00 0.95 -0.01 0.00 -1.95 0.00 0.00 55.36 54.34 2gwx s GLN 429 Cb 0.00 0.21 -0.02 0.00 -0.22 0.00 0.00 33.01 32.98 2gwx s GLN 429 CO 0.00 -0.28 0.88 0.00 -0.25 0.00 0.00 175.29 175.64 2gwx n GLN 430 N 5.38 -4.94 -0.04 2.91 -0.00 -1.26 -4.94 117.38 114.49 2gwx n GLN 430 Ca -0.08 0.77 -0.17 0.00 -0.00 0.00 0.00 57.00 57.52 2gwx n GLN 430 Cb 0.49 -5.49 -0.13 0.00 -0.00 0.00 0.00 30.24 25.11 2gwx n GLN 430 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.06 178.31 2gwx h LEU 431 N -1.52 0.13 -0.40 2.61 6.46 -1.98 -2.90 115.31 117.71 2gwx h LEU 431 Ca -0.53 -0.89 0.08 0.00 -0.12 0.00 0.00 57.88 56.42 2gwx h LEU 431 Cb 1.30 -0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 41.09 2gwx h LEU 431 CO 0.44 1.23 -0.31 0.15 -0.62 0.00 0.00 178.44 179.32 2gwx h PHE 432 N -0.80 -0.86 0.00 1.25 3.57 -1.95 0.09 116.94 118.24 2gwx h PHE 432 Ca -0.12 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2gwx h PHE 432 Cb 1.26 0.44 0.00 0.00 2.79 0.00 0.00 35.95 40.44 2gwx h PHE 432 CO 0.22 -0.37 0.00 -1.35 -2.23 0.00 0.00 178.31 174.57 2gwx h PRO 433 N -0.24 0.00 -0.05 6.41 0.11 -1.98 -1.45 132.00 134.80 2gwx h PRO 433 Ca 0.18 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.07 2gwx h PRO 433 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 2gwx h PRO 433 CO -0.54 0.00 -0.87 0.87 -0.21 0.00 0.00 178.00 177.26 2gwx h LYS 434 N 0.00 0.52 -0.01 1.05 6.56 -1.05 -2.52 116.57 121.12 2gwx h LYS 434 Ca 0.00 -0.49 -0.17 0.00 -1.06 0.00 0.00 60.65 58.93 2gwx h LYS 434 Cb 0.70 0.12 -0.02 0.00 -0.57 0.00 0.00 32.23 32.47 2gwx h LYS 434 CO 0.00 1.12 -0.79 -0.07 -2.06 0.00 0.00 179.45 177.66 2gwx h LEU 435 N 0.32 0.12 -0.61 2.94 3.38 -0.61 -2.10 115.31 118.76 2gwx h LEU 435 Ca -0.07 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 2gwx h LEU 435 Cb 1.49 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 2gwx h LEU 435 CO 0.16 0.86 -0.16 -0.07 0.09 0.00 0.00 178.44 179.31 2gwx h LEU 436 N 0.06 0.94 -1.07 1.67 3.38 -1.27 -1.31 115.31 117.71 2gwx h LEU 436 Ca -0.02 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.55 2gwx h LEU 436 Cb 1.38 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2gwx h LEU 436 CO 0.11 1.09 -0.18 -0.61 0.09 0.00 0.00 178.44 178.93 2gwx h GLN 437 N 0.82 0.44 -0.27 1.13 5.75 -1.30 -2.07 115.11 119.62 2gwx h GLN 437 Ca 0.12 -0.14 -0.08 0.00 -0.15 0.00 0.00 58.65 58.40 2gwx h GLN 437 Cb 0.71 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.20 2gwx h GLN 437 CO 0.05 0.61 -0.17 0.87 -2.65 0.00 0.00 178.83 177.55 2gwx h LYS 438 N 0.40 0.48 -0.66 1.69 1.79 -0.80 0.13 116.57 119.61 2gwx h LYS 438 Ca 0.07 -0.15 -0.05 0.00 -2.18 0.00 0.00 60.65 58.34 2gwx h LYS 438 Cb 0.56 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.13 2gwx h LYS 438 CO 0.04 0.64 0.21 0.52 -1.08 0.00 0.00 179.45 179.78 2gwx h MET 439 N 0.44 1.01 -0.40 3.15 2.86 -0.58 0.47 114.93 121.88 2gwx h MET 439 Ca 0.08 -0.20 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 2gwx h MET 439 Cb 0.55 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 2gwx h MET 439 CO 0.04 0.86 -0.27 0.00 1.06 0.00 0.00 176.91 178.60 2gwx h ALA 440 N 1.26 0.57 -0.20 6.32 0.00 -0.89 -2.23 119.26 124.08 2gwx h ALA 440 Ca 0.22 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.73 2gwx h ALA 440 Cb 0.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2gwx h ALA 440 CO -0.01 0.58 0.12 -0.44 0.00 0.00 0.00 179.25 179.50 2gwx h ASP 441 N 0.70 0.20 -0.89 0.00 3.32 -0.00 -2.50 116.42 117.25 2gwx h ASP 441 Ca 0.08 -0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.22 2gwx h ASP 441 Cb 0.84 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.28 2gwx h ASP 441 CO 0.07 0.15 0.57 -0.07 -1.72 0.00 0.00 179.24 178.25 2gwx h LEU 442 N 0.25 0.81 -1.29 1.55 3.38 0.04 -0.18 115.31 119.87 2gwx h LEU 442 Ca 0.08 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2gwx h LEU 442 Cb -0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2gwx h LEU 442 CO -0.03 0.48 -0.35 -0.09 0.09 0.00 0.00 178.44 178.54 2gwx h ARG 443 N 0.90 0.00 0.07 1.13 2.43 -0.97 -1.76 114.38 116.18 2gwx h ARG 443 Ca 0.41 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.32 2gwx h ARG 443 Cb 0.38 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2gwx h ARG 443 CO -0.17 0.35 -1.11 0.37 -1.51 0.00 0.00 179.97 177.91 2gwx h GLN 444 N 0.00 0.42 -0.53 0.20 5.75 -0.78 -2.85 115.11 117.31 2gwx h GLN 444 Ca -0.00 -0.55 -0.00 0.00 -0.15 0.00 0.00 58.65 57.94 2gwx h GLN 444 Cb 0.63 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 29.33 2gwx h GLN 444 CO 0.05 1.21 0.32 1.25 -2.65 0.00 0.00 178.83 179.01 2gwx h LEU 445 N 0.20 0.64 -0.75 -2.39 6.46 -0.70 -2.55 115.31 116.21 2gwx h LEU 445 Ca -0.12 -0.06 -0.08 0.00 -0.12 0.00 0.00 57.88 57.50 2gwx h LEU 445 Cb 1.78 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 41.52 2gwx h LEU 445 CO 0.19 0.51 0.09 0.58 -0.62 0.00 0.00 178.44 179.19 2gwx h VAL 446 N 0.72 1.26 -0.27 1.05 2.07 -1.37 -1.01 116.25 118.69 2gwx h VAL 446 Ca 0.19 -1.03 0.05 0.00 0.82 0.00 0.00 66.70 66.73 2gwx h VAL 446 Cb -0.01 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 2gwx h VAL 446 CO -0.04 0.38 0.01 0.74 0.02 0.00 0.00 177.57 178.69 2gwx h THR 447 N 0.97 0.81 -0.58 2.57 2.02 -1.23 0.36 112.91 117.83 2gwx h THR 447 Ca 0.19 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.24 2gwx h THR 447 Cb 0.44 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2gwx h THR 447 CO 0.01 0.02 -0.04 -0.33 0.37 0.00 0.00 175.52 175.56 2gwx h GLU 448 N 0.10 1.06 -0.05 6.66 4.39 -1.31 -2.01 114.58 123.41 2gwx h GLU 448 Ca 0.13 -0.36 0.02 0.00 0.34 0.00 0.00 59.36 59.49 2gwx h GLU 448 Cb 0.16 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 2gwx h GLU 448 CO -0.21 1.05 -0.05 1.25 -1.16 0.00 0.00 179.01 179.89 2gwx h HIS 449 N 0.95 -0.12 -0.94 4.33 2.76 -0.40 -0.21 115.15 121.52 2gwx h HIS 449 Ca 0.16 0.01 0.13 0.00 -2.20 0.00 0.00 60.37 58.47 2gwx h HIS 449 Cb 0.60 0.06 -0.09 0.00 1.55 0.00 0.00 27.41 29.54 2gwx h HIS 449 CO 0.04 -0.08 0.56 0.00 -1.30 0.00 0.00 177.93 177.15 2gwx h ALA 450 N 0.97 1.41 0.23 5.26 0.00 -0.12 -0.00 119.26 127.01 2gwx h ALA 450 Ca 0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2gwx h ALA 450 Cb 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2gwx h ALA 450 CO -0.09 0.11 -0.11 1.96 0.00 0.00 0.00 179.25 181.12 2gwx h GLN 451 N 0.86 -0.30 -0.88 0.00 4.20 -0.57 -0.58 115.11 117.83 2gwx h GLN 451 Ca 0.48 0.02 0.10 0.00 0.06 0.00 0.00 58.65 59.31 2gwx h GLN 451 Cb 0.53 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.32 2gwx h GLN 451 CO -0.29 -0.10 0.57 0.52 -0.67 0.00 0.00 178.83 178.86 2gwx h MET 452 N -0.45 0.83 -0.24 1.46 2.86 -0.38 -0.45 114.93 118.57 2gwx h MET 452 Ca -0.03 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.43 2gwx h MET 452 Cb 0.34 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2gwx h MET 452 CO 0.05 0.55 -0.39 0.52 1.06 0.00 0.00 176.91 178.70 2gwx h MET 453 N 0.86 0.56 -0.31 1.72 2.86 -0.71 -2.23 114.93 117.68 2gwx h MET 453 Ca 0.41 -0.28 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 2gwx h MET 453 Cb 0.43 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 2gwx h MET 453 CO -0.18 0.86 0.02 1.96 1.06 0.00 0.00 176.91 180.64 2gwx h GLN 454 N 0.46 0.52 -0.72 1.72 4.20 0.43 -1.81 115.11 119.92 2gwx h GLN 454 Ca 0.04 -0.15 0.05 0.00 0.06 0.00 0.00 58.65 58.65 2gwx h GLN 454 Cb 0.89 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.57 2gwx h GLN 454 CO 0.08 0.65 0.47 0.00 -0.67 0.00 0.00 178.83 179.35 2gwx h ARG 455 N 0.33 0.79 -0.18 1.46 2.47 -1.11 -2.16 114.38 115.98 2gwx h ARG 455 Ca 0.09 -0.05 -0.06 0.00 -1.26 0.00 0.00 59.98 58.71 2gwx h ARG 455 Cb 0.39 -0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 28.53 2gwx h ARG 455 CO 0.01 0.52 -0.11 0.82 0.56 0.00 0.00 179.97 181.77 2gwx h ILE 456 N 0.81 1.32 -0.74 2.04 2.04 -1.10 -0.83 117.51 121.05 2gwx h ILE 456 Ca 0.30 -1.20 0.15 0.00 1.00 0.00 0.00 64.86 65.11 2gwx h ILE 456 Cb 0.16 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 37.92 2gwx h ILE 456 CO -0.09 0.36 0.49 0.50 0.00 0.00 0.00 178.15 179.41 2gwx h LYS 457 N 0.06 0.36 0.00 2.37 1.63 -0.79 0.46 116.57 120.66 2gwx h LYS 457 Ca 0.04 -0.02 -0.24 0.00 -0.85 0.00 0.00 60.65 59.58 2gwx h LYS 457 Cb 0.61 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.12 2gwx h LYS 457 CO 0.03 0.24 -1.56 -0.22 -3.45 0.00 0.00 179.45 174.48 2gwx h LYS 458 N 0.37 0.00 0.00 1.90 3.64 -1.25 -3.41 116.57 117.82 2gwx h LYS 458 Ca 0.36 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.43 2gwx h LYS 458 Cb 0.88 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.65 2gwx h LYS 458 CO -0.11 0.42 -2.16 -2.37 -2.27 0.00 0.00 179.45 172.97 2gwx n THR 459 N -2.99 1.16 -1.35 1.00 5.66 -0.33 -4.59 114.28 112.83 2gwx n THR 459 Ca -0.13 -0.41 -0.23 0.00 -3.05 0.00 0.00 64.05 60.22 2gwx n THR 459 Cb 0.96 -1.34 -0.09 0.00 -1.55 0.00 0.00 70.33 68.31 2gwx n THR 459 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2gwx n GLU 460 N -3.28 2.49 0.26 1.09 -0.58 0.16 -4.71 120.64 116.07 2gwx n GLU 460 Ca -0.37 -1.97 0.08 0.00 -0.42 0.00 0.00 57.16 54.49 2gwx n GLU 460 Cb 0.86 -2.16 0.32 0.00 -0.57 0.00 0.00 31.44 29.89 2gwx n GLU 460 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 2gwx h THR 461 N 2.09 0.02 0.12 2.62 1.35 -1.79 0.33 112.91 117.65 2gwx h THR 461 Ca 0.37 0.00 -0.29 0.00 -0.55 0.00 0.00 66.41 65.94 2gwx h THR 461 Cb 0.94 0.22 -0.00 0.00 -1.73 0.00 0.00 68.15 67.58 2gwx h THR 461 CO 0.74 0.00 -1.37 -0.33 -0.25 0.00 0.00 175.52 174.31 2gwx h GLU 462 N 0.00 0.25 -6.64 4.72 4.39 -1.93 -3.46 114.58 111.91 2gwx h GLU 462 Ca 0.06 -0.42 -0.52 0.00 0.34 0.00 0.00 59.36 58.82 2gwx h GLU 462 Cb 1.67 0.16 0.02 0.00 -0.10 0.00 0.00 28.75 30.50 2gwx h GLU 462 CO -0.00 1.15 0.62 -0.08 -1.16 0.00 0.00 179.01 179.54 2gwx s THR 463 N -2.64 3.41 -0.14 1.13 -1.32 0.12 -5.01 115.64 111.18 2gwx s THR 463 Ca -0.06 1.13 -0.17 0.00 -1.21 0.00 0.00 61.69 61.38 2gwx s THR 463 Cb 0.07 -3.72 -0.04 0.00 -1.51 0.00 0.00 72.50 67.30 2gwx s THR 463 CO 0.87 0.16 0.43 -0.94 -2.21 0.00 0.00 174.62 172.92 2gwx s SER 464 N 0.43 6.59 -0.06 8.08 1.04 -1.26 -5.00 113.70 123.52 2gwx s SER 464 Ca 0.57 0.70 -0.03 0.00 0.48 0.00 0.00 55.95 57.66 2gwx s SER 464 Cb -0.35 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.48 2gwx s SER 464 CO 0.36 -0.00 0.10 -1.48 0.98 0.00 0.00 173.24 173.20 2gwx s LEU 465 N 0.75 4.07 0.20 2.42 -0.00 -1.26 -4.99 118.68 119.87 2gwx s LEU 465 Ca 0.23 0.28 -0.30 0.00 -0.00 0.00 0.00 54.13 54.34 2gwx s LEU 465 Cb -0.15 -2.17 -0.09 0.00 -0.00 0.00 0.00 46.19 43.78 2gwx s LEU 465 CO 0.08 0.34 1.42 -2.28 -0.00 0.00 0.00 176.35 175.91 2gwx s HIS 466 N -1.10 3.13 0.49 3.48 5.65 -1.26 -4.91 115.29 120.76 2gwx s HIS 466 Ca 0.19 1.00 0.21 0.00 0.25 0.00 0.00 55.06 56.71 2gwx s HIS 466 Cb -0.12 -3.76 1.25 0.00 -1.18 0.00 0.00 32.58 28.77 2gwx s HIS 466 CO 0.09 -2.53 1.97 -1.00 -0.65 0.00 0.00 174.74 172.63 2gwx h PRO 467 N 5.70 0.17 -0.11 2.88 0.13 -1.99 -1.69 132.00 137.09 2gwx h PRO 467 Ca -0.44 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.64 2gwx h PRO 467 Cb 1.21 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2gwx h PRO 467 CO 0.81 0.11 -0.06 1.25 -0.23 0.00 0.00 178.00 179.88 2gwx h LEU 468 N 0.18 0.25 -1.71 1.56 6.46 -2.00 -2.43 115.31 117.62 2gwx h LEU 468 Ca 0.29 -0.42 -0.03 0.00 -0.12 0.00 0.00 57.88 57.59 2gwx h LEU 468 Cb 0.89 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.74 2gwx h LEU 468 CO -0.05 0.62 -0.15 -0.07 -0.62 0.00 0.00 178.44 178.18 2gwx h LEU 469 N -0.12 0.00 -0.55 2.25 3.38 -1.74 -2.14 115.31 116.39 2gwx h LEU 469 Ca 0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 2gwx h LEU 469 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2gwx h LEU 469 CO 0.02 0.15 -0.64 -0.61 0.09 0.00 0.00 178.44 177.45 2gwx h GLN 470 N 0.00 0.00 0.00 1.13 4.15 -1.14 -2.50 115.11 116.75 2gwx h GLN 470 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 2gwx h GLN 470 Cb 0.27 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2gwx h GLN 470 CO 0.02 0.64 -0.30 0.93 -1.93 0.00 0.00 178.83 178.19 2gwx h GLU 471 N 0.00 0.00 0.05 1.69 4.39 -0.90 -2.42 114.58 117.39 2gwx h GLU 471 Ca -0.01 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2gwx h GLU 471 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 2gwx h GLU 471 CO 0.08 0.30 -0.02 0.82 -1.16 0.00 0.00 179.01 179.03 2gwx h ILE 472 N 0.00 0.84 0.00 3.13 2.04 -1.23 -3.37 117.51 118.92 2gwx h ILE 472 Ca -0.00 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.35 2gwx h ILE 472 Cb 0.79 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 2gwx h ILE 472 CO 0.04 0.27 0.00 1.88 0.00 0.00 0.00 178.15 180.34 2gwx h TYR 473 N -0.97 0.00 -0.96 1.37 0.05 -1.53 -3.37 116.97 111.55 2gwx h TYR 473 Ca -0.01 0.00 0.21 0.00 0.05 0.00 0.00 58.73 58.99 2gwx h TYR 473 Cb 0.49 0.00 -0.18 0.00 1.01 0.00 0.00 36.73 38.05 2gwx h TYR 473 CO 0.12 0.00 -0.17 1.17 -1.05 0.00 0.00 178.16 178.23 2gwx n LYS 474 N -3.07 -0.08 0.00 4.88 4.81 -0.91 -1.63 118.16 122.16 2gwx n LYS 474 Ca 0.02 1.48 0.11 0.00 -0.87 0.00 0.00 58.31 59.06 2gwx n LYS 474 Cb 0.42 -2.25 0.03 0.00 0.02 0.00 0.00 35.03 33.24 2gwx n LYS 474 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2gwx n ASP 475 N -5.53 2.04 -4.79 3.14 8.00 -1.26 -4.98 116.55 113.17 2gwx n ASP 475 Ca 0.17 -1.51 -0.33 0.00 0.71 0.00 0.00 54.79 53.83 2gwx n ASP 475 Cb 0.55 0.43 0.02 0.00 -0.02 0.00 0.00 41.12 42.10 2gwx n ASP 475 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2gwx s MET 476 N -2.45 3.15 0.00 -1.24 -1.94 -0.64 -5.22 119.30 110.96 2gwx s MET 476 Ca 0.19 1.30 0.00 0.00 -1.71 0.00 0.00 55.69 55.47 2gwx s MET 476 Cb 0.18 -2.00 0.00 0.00 2.01 0.00 0.00 34.83 35.02 2gwx s MET 476 CO 0.55 -0.96 0.00 2.48 -0.01 0.00 0.00 175.02 177.08