#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y19 h VAL 210 N 0.00 1.25 -0.37 0.52 2.07 -2.06 -2.04 116.25 115.62 1y19 h VAL 210 Ca 0.00 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.63 1y19 h VAL 210 Cb 0.00 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1y19 h VAL 210 CO 0.00 0.33 0.00 1.56 0.02 0.00 0.00 177.57 179.49 1y19 h GLN 211 N 1.08 0.59 -0.19 1.57 4.20 -2.06 -2.16 115.11 118.13 1y19 h GLN 211 Ca 0.24 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.76 1y19 h GLN 211 Cb 0.25 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1y19 h GLN 211 CO -0.01 0.61 -0.16 1.25 -0.67 0.00 0.00 178.83 179.84 1y19 h LEU 212 N 0.56 0.31 -0.42 1.46 5.85 -1.83 -2.09 115.31 119.15 1y19 h LEU 212 Ca 0.12 -0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.60 1y19 h LEU 212 Cb 0.36 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1y19 h LEU 212 CO 0.01 0.50 -0.75 -1.13 -0.34 0.00 0.00 178.44 176.73 1y19 h ASN 213 N 0.30 0.00 -0.13 1.25 -1.24 -0.76 -1.36 115.58 113.64 1y19 h ASN 213 Ca 0.06 0.00 -0.12 0.00 0.71 0.00 0.00 56.30 56.95 1y19 h ASN 213 Cb 0.47 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.52 1y19 h ASN 213 CO 0.03 0.75 -0.38 -0.07 -1.29 0.00 0.00 177.43 176.47 1y19 h LEU 214 N 0.00 0.56 -0.76 0.34 3.38 -1.19 -1.60 115.31 116.04 1y19 h LEU 214 Ca -0.01 -0.59 -0.04 0.00 0.09 0.00 0.00 57.88 57.33 1y19 h LEU 214 Cb 1.37 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1y19 h LEU 214 CO 0.10 1.06 0.31 -0.07 0.09 0.00 0.00 178.44 179.93 1y19 h LEU 215 N 0.10 1.05 0.59 1.67 3.38 -1.38 -2.25 115.31 118.46 1y19 h LEU 215 Ca -0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1y19 h LEU 215 Cb 1.00 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.48 1y19 h LEU 215 CO 0.08 0.93 -0.28 0.22 0.09 0.00 0.00 178.44 179.48 1y19 h TYR 216 N 1.10 -0.73 -1.00 1.13 3.20 -1.22 -1.77 116.97 117.68 1y19 h TYR 216 Ca 0.26 -0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.26 1y19 h TYR 216 Cb 0.20 0.24 -0.09 0.00 1.54 0.00 0.00 36.73 38.62 1y19 h TYR 216 CO 0.02 -0.41 0.62 0.28 -1.64 0.00 0.00 178.16 177.03 1y19 h VAL 217 N -0.92 0.81 0.17 1.81 2.07 -1.26 0.76 116.25 119.69 1y19 h VAL 217 Ca -0.08 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1y19 h VAL 217 Cb 0.65 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1y19 h VAL 217 CO 0.13 0.16 -0.08 -0.61 0.02 0.00 0.00 177.57 177.19 1y19 h GLN 218 N 0.87 -0.22 -0.78 1.57 5.75 -1.30 -0.62 115.11 120.38 1y19 h GLN 218 Ca 0.53 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 59.05 1y19 h GLN 218 Cb 0.70 0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.26 1y19 h GLN 218 CO -0.31 0.08 0.48 0.00 -2.65 0.00 0.00 178.83 176.43 1y19 h ALA 219 N 0.24 1.00 0.16 3.38 0.00 -0.80 -0.90 119.26 122.34 1y19 h ALA 219 Ca -0.02 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1y19 h ALA 219 Cb 0.40 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1y19 h ALA 219 CO 0.04 0.46 -0.08 -0.09 0.00 0.00 0.00 179.25 179.58 1y19 h ARG 220 N 1.07 -0.20 -0.84 0.00 2.43 -0.85 -2.56 114.38 113.43 1y19 h ARG 220 Ca 0.28 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.52 1y19 h ARG 220 Cb -0.05 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 1y19 h ARG 220 CO -0.05 0.05 0.55 -0.44 -1.51 0.00 0.00 179.97 178.56 1y19 h ASP 221 N -0.44 0.83 0.54 -3.80 3.32 -0.98 0.90 116.42 116.79 1y19 h ASP 221 Ca -0.02 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1y19 h ASP 221 Cb 0.35 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1y19 h ASP 221 CO 0.04 0.54 -0.27 0.44 -1.72 0.00 0.00 179.24 178.27 1y19 h ASP 222 N 0.95 0.00 0.11 6.45 3.32 -1.08 -1.65 116.42 124.51 1y19 h ASP 222 Ca 0.35 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.16 1y19 h ASP 222 Cb 0.18 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 1y19 h ASP 222 CO -0.12 0.27 -1.21 0.40 -1.72 0.00 0.00 179.24 176.86 1y19 h ILE 223 N 0.00 1.16 -0.49 0.35 2.04 -0.77 0.73 117.51 120.52 1y19 h ILE 223 Ca -0.00 -2.41 -0.05 0.00 1.00 0.00 0.00 64.86 63.40 1y19 h ILE 223 Cb 0.62 2.81 -0.02 0.00 -0.74 0.00 0.00 36.82 39.49 1y19 h ILE 223 CO 0.04 0.68 0.10 -0.07 0.00 0.00 0.00 178.15 178.89 1y19 h LEU 224 N -0.40 0.70 -0.39 1.44 3.38 -0.84 -2.82 115.31 116.40 1y19 h LEU 224 Ca -0.26 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1y19 h LEU 224 Cb 1.67 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1y19 h LEU 224 CO 0.06 0.71 -0.24 -0.46 0.09 0.00 0.00 178.44 178.60 1y19 n ASN 225 N -4.28 0.84 0.00 -0.43 2.04 -0.63 -4.07 115.26 108.73 1y19 n ASN 225 Ca 0.03 -0.74 0.00 0.00 -0.44 0.00 0.00 54.58 53.43 1y19 n ASN 225 Cb 0.23 0.08 0.00 0.00 -2.53 0.00 0.00 39.78 37.56 1y19 n ASN 225 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1y19 n GLY 226 N 1.34 2.25 0.39 4.83 0.00 -1.06 -4.93 105.19 108.01 1y19 n GLY 226 Ca 0.12 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.37 1y19 n GLY 226 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1y19 h SER 227 N 0.00 0.50 -3.74 1.61 0.02 -1.53 -3.18 113.55 107.23 1y19 h SER 227 Ca 0.00 0.12 -0.69 0.00 -0.84 0.00 0.00 61.79 60.38 1y19 h SER 227 Cb 0.00 0.04 -0.36 0.00 0.14 0.00 0.00 62.40 62.23 1y19 h SER 227 CO 0.00 0.04 -0.51 -2.28 -1.14 0.00 0.00 176.83 172.93 1y19 s HIS 228 N -5.57 3.53 0.14 3.45 5.04 0.24 -4.86 115.29 117.26 1y19 s HIS 228 Ca -0.09 -2.59 -0.31 0.00 -1.54 0.00 0.00 55.06 50.52 1y19 s HIS 228 Cb 0.27 -3.17 -0.09 0.00 0.04 0.00 0.00 32.58 29.62 1y19 s HIS 228 CO 0.80 -0.92 1.58 -2.14 -2.34 0.00 0.00 174.74 171.71 1y19 s PRO 229 N 0.69 4.22 0.07 2.88 0.02 -1.21 -4.47 135.00 137.21 1y19 s PRO 229 Ca 0.11 2.33 -0.02 0.00 0.02 0.00 0.00 61.00 63.45 1y19 s PRO 229 Cb -0.22 -3.26 -0.04 0.00 0.02 0.00 0.00 34.50 31.00 1y19 s PRO 229 CO -0.04 -0.62 0.01 0.14 -0.33 0.00 0.00 177.00 176.16 1y19 s VAL 230 N 1.49 0.18 1.00 3.83 -7.23 -1.26 -4.77 120.40 113.64 1y19 s VAL 230 Ca 0.71 -1.77 -0.14 0.00 -1.81 0.00 0.00 61.98 58.96 1y19 s VAL 230 Cb -0.42 -1.63 0.19 0.00 0.56 0.00 0.00 36.38 35.08 1y19 s VAL 230 CO 0.31 -0.83 1.14 -0.94 -0.31 0.00 0.00 175.10 174.47 1y19 s SER 231 N -2.95 2.66 0.07 4.85 1.04 -1.26 -4.82 113.70 113.29 1y19 s SER 231 Ca 0.11 0.86 -0.21 0.00 0.48 0.00 0.00 55.95 57.20 1y19 s SER 231 Cb 0.08 -1.33 -0.11 0.00 0.10 0.00 0.00 66.02 64.75 1y19 s SER 231 CO -0.07 -3.07 1.54 0.15 0.98 0.00 0.00 173.24 172.77 1y19 h PHE 232 N -1.86 0.28 -0.21 5.02 3.57 -1.86 -0.89 116.94 120.98 1y19 h PHE 232 Ca -0.50 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.01 1y19 h PHE 232 Cb 1.31 -0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.93 1y19 h PHE 232 CO -0.39 0.43 -0.11 -0.44 -2.23 0.00 0.00 178.31 175.57 1y19 h ASP 233 N 0.05 -0.36 -0.43 0.41 3.32 -1.98 -1.65 116.42 115.78 1y19 h ASP 233 Ca 0.05 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 1y19 h ASP 233 Cb 0.29 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1y19 h ASP 233 CO 0.00 -0.14 0.14 0.11 -1.72 0.00 0.00 179.24 177.63 1y19 h LYS 234 N -0.09 0.74 -0.57 3.56 1.79 -1.91 -2.03 116.57 118.06 1y19 h LYS 234 Ca 0.12 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 58.41 1y19 h LYS 234 Cb 0.26 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 1y19 h LYS 234 CO -0.27 0.66 0.20 0.00 -1.08 0.00 0.00 179.45 178.97 1y19 h ALA 235 N 1.43 1.29 0.00 3.86 0.00 -0.45 -1.74 119.26 123.65 1y19 h ALA 235 Ca 0.17 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1y19 h ALA 235 Cb 0.24 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1y19 h ALA 235 CO -0.01 0.52 -0.59 0.00 0.00 0.00 0.00 179.25 179.18 1y19 h GLU 237 N 0.00 0.14 -0.07 0.00 5.08 -0.86 -1.77 114.58 117.10 1y19 h GLU 237 Ca -0.01 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1y19 h GLU 237 Cb 1.25 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 1y19 h GLU 237 CO 0.08 0.48 -0.09 0.74 -1.00 0.00 0.00 179.01 179.22 1y19 h PHE 238 N -0.22 -0.22 -0.90 4.33 0.05 -1.33 -1.61 116.94 117.04 1y19 h PHE 238 Ca 0.02 0.01 0.23 0.00 3.82 0.00 0.00 57.97 62.05 1y19 h PHE 238 Cb 0.44 0.11 -0.13 0.00 2.00 0.00 0.00 35.95 38.37 1y19 h PHE 238 CO 0.06 -0.14 0.36 0.00 -0.18 0.00 0.00 178.31 178.41 1y19 h ALA 239 N 0.93 1.44 -0.47 2.45 0.00 -1.28 0.61 119.26 122.94 1y19 h ALA 239 Ca 0.06 0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1y19 h ALA 239 Cb 0.21 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1y19 h ALA 239 CO -0.15 -0.40 0.29 0.78 0.00 0.00 0.00 179.25 179.77 1y19 h GLY 240 N 0.33 0.65 1.04 0.00 0.00 -0.39 0.30 103.07 105.01 1y19 h GLY 240 Ca 0.57 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.62 1y19 h GLY 240 CO -0.57 0.20 0.15 0.74 0.00 0.00 0.00 176.54 177.06 1y19 h PHE 241 N 0.58 1.10 -0.63 5.60 0.04 0.54 -2.06 116.94 122.11 1y19 h PHE 241 Ca 0.18 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 1y19 h PHE 241 Cb -0.02 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 37.79 1y19 h PHE 241 CO -0.06 0.91 0.36 0.37 -0.60 0.00 0.00 178.31 179.29 1y19 h GLN 242 N 0.97 0.86 0.21 1.51 4.15 0.40 -1.85 115.11 121.37 1y19 h GLN 242 Ca 0.20 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.52 1y19 h GLN 242 Cb 0.37 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1y19 h GLN 242 CO 0.00 0.64 -0.10 0.00 -1.93 0.00 0.00 178.83 177.44 1y19 h GLN 244 N -0.40 -0.05 -0.28 0.00 5.75 -1.30 1.02 115.11 119.86 1y19 h GLN 244 Ca -0.03 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1y19 h GLN 244 Cb 0.30 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 1y19 h GLN 244 CO 0.05 -0.03 0.16 0.82 -2.65 0.00 0.00 178.83 177.18 1y19 h ILE 245 N -0.05 1.03 0.00 2.39 2.04 -1.22 0.71 117.51 122.40 1y19 h ILE 245 Ca 0.18 -0.11 -0.18 0.00 1.00 0.00 0.00 64.86 65.75 1y19 h ILE 245 Cb 0.33 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1y19 h ILE 245 CO -0.41 0.06 -0.88 1.56 0.00 0.00 0.00 178.15 178.48 1y19 h GLN 246 N 0.33 0.00 0.00 2.37 4.20 -0.21 -3.39 115.11 118.41 1y19 h GLN 246 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1y19 h GLN 246 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1y19 h GLN 246 CO -0.05 0.85 -1.16 1.19 -0.67 0.00 0.00 178.83 178.99 1y19 n PHE 247 N -3.31 0.00 -0.51 2.96 0.99 0.35 -5.07 117.46 112.86 1y19 n PHE 247 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1y19 n PHE 247 Cb 0.89 -0.09 0.00 0.00 -1.00 0.00 0.00 39.48 39.27 1y19 n PHE 247 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1y19 n GLY 248 N 2.23 -2.70 3.45 1.37 0.00 0.25 -4.96 105.19 104.82 1y19 n GLY 248 Ca -0.01 -1.95 -0.40 0.00 0.00 0.00 0.00 46.02 43.66 1y19 n GLY 248 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y19 n PRO 249 N -0.10 0.54 -2.08 1.61 -0.02 -1.26 -4.21 135.00 129.49 1y19 n PRO 249 Ca 0.00 0.20 -0.41 0.00 -2.02 0.00 0.00 63.50 61.27 1y19 n PRO 249 Cb 0.00 -1.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.91 1y19 n PRO 249 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1y19 s HIS 250 N -1.57 3.10 -0.18 6.00 2.46 -1.26 -5.01 115.29 118.83 1y19 s HIS 250 Ca 0.64 1.07 0.00 0.00 0.47 0.00 0.00 55.06 57.24 1y19 s HIS 250 Cb -0.55 -3.75 0.04 0.00 -0.13 0.00 0.00 32.58 28.19 1y19 s HIS 250 CO 0.58 -2.45 -0.09 1.21 -2.47 0.00 0.00 174.74 171.52 1y19 s ASN 251 N 0.42 3.14 0.24 9.88 3.84 -1.26 -5.03 114.94 126.16 1y19 s ASN 251 Ca 0.59 -0.77 -0.05 0.00 0.21 0.00 0.00 52.86 52.84 1y19 s ASN 251 Cb -0.40 -1.13 0.42 0.00 -0.55 0.00 0.00 41.25 39.60 1y19 s ASN 251 CO 0.41 -0.15 1.71 -0.33 -2.79 0.00 0.00 177.10 175.95 1y19 h GLU 252 N 8.03 0.35 0.00 0.43 5.08 -1.95 0.67 114.58 127.19 1y19 h GLU 252 Ca -0.28 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1y19 h GLU 252 Cb 1.11 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 1y19 h GLU 252 CO 0.46 0.23 -0.05 1.96 -1.00 0.00 0.00 179.01 180.61 1y19 h GLN 253 N 0.37 0.00 0.00 2.33 4.20 -2.02 -3.35 115.11 116.64 1y19 h GLN 253 Ca 0.39 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.80 1y19 h GLN 253 Cb 0.61 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.34 1y19 h GLN 253 CO -0.43 0.05 -2.15 1.17 -0.67 0.00 0.00 178.83 176.80 1y19 n LYS 254 N -3.12 1.17 -3.53 1.46 4.81 -0.92 -4.75 118.16 113.28 1y19 n LYS 254 Ca 0.03 0.01 -0.38 0.00 -0.87 0.00 0.00 58.31 57.10 1y19 n LYS 254 Cb 0.52 -1.43 -0.05 0.00 0.02 0.00 0.00 35.03 34.10 1y19 n LYS 254 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1y19 n HIS 255 N -2.69 4.37 -4.42 5.64 8.25 0.23 -4.99 115.22 121.62 1y19 n HIS 255 Ca -0.29 -4.01 -0.24 0.00 -0.26 0.00 0.00 57.72 52.92 1y19 n HIS 255 Cb 1.02 -1.26 -0.09 0.00 1.12 0.00 0.00 29.99 30.78 1y19 n HIS 255 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 1y19 s LYS 256 N -1.47 1.88 0.02 -0.41 -2.85 -1.26 -4.64 119.74 111.00 1y19 s LYS 256 Ca 0.29 -1.67 -0.24 0.00 -1.00 0.00 0.00 55.97 53.35 1y19 s LYS 256 Cb -0.06 -1.89 -0.12 0.00 -2.06 0.00 0.00 37.83 33.70 1y19 s LYS 256 CO -0.10 0.33 0.62 0.00 0.10 0.00 0.00 175.35 176.30 1y19 n ALA 257 N -0.72 -2.46 0.00 0.59 0.00 -1.26 -0.94 120.51 115.72 1y19 n ALA 257 Ca -0.05 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1y19 n ALA 257 Cb 0.60 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1y19 n ALA 257 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y19 n GLY 258 N 1.02 1.99 0.33 0.00 0.00 -1.26 -4.89 105.19 102.37 1y19 n GLY 258 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.11 1y19 n GLY 258 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y19 h PHE 259 N 0.00 1.02 -3.26 1.61 3.57 -1.42 -3.43 116.94 115.03 1y19 h PHE 259 Ca 0.00 -0.07 -0.57 0.00 3.53 0.00 0.00 57.97 60.86 1y19 h PHE 259 Cb 0.00 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 38.38 1y19 h PHE 259 CO 0.00 0.79 -0.04 -0.51 -2.23 0.00 0.00 178.31 176.32 1y19 s LEU 260 N -9.56 4.46 -0.95 0.59 1.43 -1.26 -5.01 118.68 108.39 1y19 s LEU 260 Ca -0.11 1.18 -0.15 0.00 -1.03 0.00 0.00 54.13 54.02 1y19 s LEU 260 Cb 0.16 -2.89 0.19 0.00 0.03 0.00 0.00 46.19 43.68 1y19 s LEU 260 CO 0.81 0.19 1.02 -0.62 0.23 0.00 0.00 176.35 177.99 1y19 s ASP 261 N -0.61 6.82 0.61 2.29 2.15 -1.26 -4.90 116.67 121.77 1y19 s ASP 261 Ca 0.30 -2.60 0.26 0.00 0.43 0.00 0.00 52.55 50.94 1y19 s ASP 261 Cb -0.19 -2.30 0.91 0.00 -0.30 0.00 0.00 42.92 41.05 1y19 s ASP 261 CO 0.18 -0.74 1.30 -0.07 -0.17 0.00 0.00 175.17 175.67 1y19 h LEU 262 N 8.86 0.00 -1.84 -1.34 3.38 -1.95 0.23 115.31 122.65 1y19 h LEU 262 Ca 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1y19 h LEU 262 Cb 0.99 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 1y19 h LEU 262 CO 0.97 0.00 -0.14 0.11 0.09 0.00 0.00 178.44 179.48 1y19 h LYS 263 N 0.00 0.00 -0.02 1.13 1.57 -1.90 -2.32 116.57 115.02 1y19 h LYS 263 Ca 0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.27 1y19 h LYS 263 Cb 2.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 35.23 1y19 h LYS 263 CO -0.01 0.14 -0.16 -0.25 -0.57 0.00 0.00 179.45 178.60 1y19 n ASP 264 N -3.71 2.42 0.00 0.86 8.00 0.80 -4.42 116.55 120.50 1y19 n ASP 264 Ca -0.02 -1.73 0.00 0.00 0.71 0.00 0.00 54.79 53.75 1y19 n ASP 264 Cb 0.25 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1y19 n ASP 264 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1y19 n PHE 265 N 0.69 0.00 -3.97 1.24 3.72 -1.03 -5.07 117.46 113.04 1y19 n PHE 265 Ca 0.13 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.44 1y19 n PHE 265 Cb 0.52 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.96 1y19 n PHE 265 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1y19 s LEU 266 N -1.02 2.03 0.56 4.37 1.43 -0.90 -4.42 118.68 120.73 1y19 s LEU 266 Ca 0.00 -0.61 -0.20 0.00 -1.03 0.00 0.00 54.13 52.29 1y19 s LEU 266 Cb 0.00 0.41 -0.04 0.00 0.03 0.00 0.00 46.19 46.59 1y19 s LEU 266 CO 0.00 -0.48 1.23 -2.84 0.23 0.00 0.00 176.35 174.49 1y19 s PRO 267 N -2.60 3.13 0.20 1.29 0.02 -1.26 -4.76 135.00 131.02 1y19 s PRO 267 Ca -0.05 1.91 -0.22 0.00 0.02 0.00 0.00 61.00 62.65 1y19 s PRO 267 Cb -0.01 -2.07 0.13 0.00 0.02 0.00 0.00 34.50 32.56 1y19 s PRO 267 CO -0.05 -1.10 1.55 0.87 -0.33 0.00 0.00 177.00 177.94 1y19 h LYS 268 N 1.19 -0.02 0.00 5.54 1.57 -1.92 0.24 116.57 123.17 1y19 h LYS 268 Ca -0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1y19 h LYS 268 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1y19 h LYS 268 CO 0.56 -0.01 0.29 -0.85 -0.57 0.00 0.00 179.45 178.87 1y19 n GLU 269 N -5.40 0.09 0.00 3.15 0.28 -1.26 -1.50 120.64 116.00 1y19 n GLU 269 Ca 0.07 0.57 0.05 0.00 -0.16 0.00 0.00 57.16 57.69 1y19 n GLU 269 Cb 0.35 -2.09 0.01 0.00 1.43 0.00 0.00 31.44 31.14 1y19 n GLU 269 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1y19 n TYR 270 N -2.06 0.00 0.35 -1.84 0.53 0.83 -4.76 117.16 110.21 1y19 n TYR 270 Ca -0.01 0.00 -0.18 0.00 -1.02 0.00 0.00 57.90 56.69 1y19 n TYR 270 Cb 0.31 0.00 -0.09 0.00 -1.03 0.00 0.00 39.34 38.53 1y19 n TYR 270 CO 0.00 0.00 0.00 -0.39 -1.02 0.00 0.00 176.86 175.45 1y19 h VAL 271 N 1.48 0.00 0.00 -0.72 -1.51 -1.17 -2.69 116.25 111.64 1y19 h VAL 271 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1y19 h VAL 271 Cb 0.38 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.54 1y19 h VAL 271 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 177.57 178.63 1y19 n LYS 272 N -5.43 0.66 0.00 5.19 2.85 -1.26 -3.70 118.16 116.47 1y19 n LYS 272 Ca -0.13 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.24 1y19 n LYS 272 Cb 0.47 -1.17 0.03 0.00 -0.65 0.00 0.00 35.03 33.71 1y19 n LYS 272 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1y19 n GLN 273 N 0.69 1.57 -3.60 -1.58 1.13 -1.01 -4.99 117.38 109.58 1y19 n GLN 273 Ca 0.00 -1.30 -0.26 0.00 -1.94 0.00 0.00 57.00 53.50 1y19 n GLN 273 Cb 0.33 -1.47 0.05 0.00 0.11 0.00 0.00 30.24 29.25 1y19 n GLN 273 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1y19 n LYS 274 N 0.42 -2.08 -0.37 -1.09 4.76 -1.24 -4.90 118.16 113.65 1y19 n LYS 274 Ca 0.11 0.57 0.08 0.00 -2.87 0.00 0.00 58.31 56.20 1y19 n LYS 274 Cb 0.51 -4.67 0.23 0.00 -1.84 0.00 0.00 35.03 29.26 1y19 n LYS 274 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y19 n GLY 275 N -1.58 4.00 0.32 0.72 0.00 -1.26 -4.58 105.19 102.81 1y19 n GLY 275 Ca -0.13 -0.97 0.04 0.00 0.00 0.00 0.00 46.02 44.96 1y19 n GLY 275 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1y19 h GLU 276 N 1.59 0.65 -0.48 1.61 4.81 -1.95 -0.78 114.58 120.03 1y19 h GLU 276 Ca 0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1y19 h GLU 276 Cb 1.31 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 1y19 h GLU 276 CO 0.17 0.43 0.21 0.00 -0.73 0.00 0.00 179.01 179.10 1y19 h ARG 277 N 0.67 0.71 -0.17 1.92 2.47 -2.00 -0.47 114.38 117.51 1y19 h ARG 277 Ca 0.20 -0.12 -0.06 0.00 -1.26 0.00 0.00 59.98 58.75 1y19 h ARG 277 Cb -0.01 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.18 1y19 h ARG 277 CO -0.05 0.61 -0.15 0.87 0.56 0.00 0.00 179.97 181.82 1y19 h LYS 278 N 0.64 0.28 0.09 0.04 1.57 -1.53 -1.62 116.57 116.04 1y19 h LYS 278 Ca 0.16 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1y19 h LYS 278 Cb 0.16 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1y19 h LYS 278 CO -0.02 0.44 -0.04 0.82 -0.57 0.00 0.00 179.45 180.08 1y19 h ILE 279 N 0.27 1.16 0.00 1.86 2.04 -0.69 -1.96 117.51 120.18 1y19 h ILE 279 Ca 0.05 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 64.84 1y19 h ILE 279 Cb 0.43 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1y19 h ILE 279 CO 0.03 0.26 -0.01 -0.26 0.00 0.00 0.00 178.15 178.16 1y19 h PHE 280 N -0.63 0.00 -0.17 1.37 0.05 -0.95 0.64 116.94 117.25 1y19 h PHE 280 Ca -0.01 0.00 -0.22 0.00 3.82 0.00 0.00 57.97 61.56 1y19 h PHE 280 Cb 0.51 0.00 0.01 0.00 2.00 0.00 0.00 35.95 38.47 1y19 h PHE 280 CO 0.08 0.01 -0.74 0.37 -0.18 0.00 0.00 178.31 177.85 1y19 h GLN 281 N 0.00 0.77 -0.31 1.51 5.75 -1.20 0.17 115.11 121.80 1y19 h GLN 281 Ca -0.00 -0.61 -0.13 0.00 -0.15 0.00 0.00 58.65 57.76 1y19 h GLN 281 Cb 0.03 0.12 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 1y19 h GLN 281 CO 0.00 1.22 -0.33 0.00 -2.65 0.00 0.00 178.83 177.07 1y19 h ALA 282 N 0.61 0.46 -0.70 3.38 0.00 -0.04 -1.71 119.26 121.26 1y19 h ALA 282 Ca -0.04 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1y19 h ALA 282 Cb 1.36 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1y19 h ALA 282 CO 0.15 0.51 0.27 1.25 0.00 0.00 0.00 179.25 181.43 1y19 h HIS 283 N 0.53 1.07 -0.62 0.00 -0.00 0.23 -2.93 115.15 113.43 1y19 h HIS 283 Ca 0.05 -0.08 -0.08 0.00 -0.00 0.00 0.00 60.37 60.25 1y19 h HIS 283 Cb 0.91 -0.32 -0.03 0.00 -0.00 0.00 0.00 27.41 27.98 1y19 h HIS 283 CO 0.07 0.83 0.08 -0.22 -0.00 0.00 0.00 177.93 178.69 1y19 h LYS 284 N 1.00 1.01 0.00 5.26 3.64 -0.48 -2.30 116.57 124.70 1y19 h LYS 284 Ca 0.23 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1y19 h LYS 284 Cb 0.22 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1y19 h LYS 284 CO -0.02 0.94 0.00 0.09 -2.27 0.00 0.00 179.45 178.20 1y19 n ASN 285 N -4.21 0.00 0.15 4.20 3.02 -0.66 -2.48 115.26 115.28 1y19 n ASN 285 Ca 0.04 -0.05 0.13 0.00 -0.03 0.00 0.00 54.58 54.68 1y19 n ASN 285 Cb 0.29 -0.25 0.43 0.00 -0.61 0.00 0.00 39.78 39.64 1y19 n ASN 285 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y19 n GLY 287 N 0.72 3.03 1.56 0.00 0.00 -1.03 -2.13 105.19 107.33 1y19 n GLY 287 Ca 0.04 -0.33 0.02 0.00 0.00 0.00 0.00 46.02 45.75 1y19 n GLY 287 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y19 n GLN 288 N 13.93 3.63 -1.55 1.61 1.13 -1.26 -4.54 117.38 130.31 1y19 n GLN 288 Ca 0.00 -2.28 -0.50 0.00 -1.94 0.00 0.00 57.00 52.28 1y19 n GLN 288 Cb 0.00 -2.04 -0.05 0.00 0.11 0.00 0.00 30.24 28.27 1y19 n GLN 288 CO 0.00 0.00 0.00 -0.12 -1.44 0.00 0.00 177.06 175.50 1y19 n MET 289 N 0.32 0.91 -1.45 -1.09 0.00 -0.91 -4.95 117.12 109.95 1y19 n MET 289 Ca 0.23 0.32 -0.30 0.00 -0.00 0.00 0.00 57.70 57.95 1y19 n MET 289 Cb 0.99 -1.79 0.08 0.00 0.00 0.00 0.00 33.22 32.50 1y19 n MET 289 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1y19 s SER 290 N -0.04 4.65 0.16 6.12 1.04 -1.26 -4.76 113.70 119.61 1y19 s SER 290 Ca 0.76 1.54 -0.16 0.00 0.48 0.00 0.00 55.95 58.57 1y19 s SER 290 Cb -0.92 -2.31 0.03 0.00 0.10 0.00 0.00 66.02 62.92 1y19 s SER 290 CO 0.53 -1.90 1.82 -0.08 0.98 0.00 0.00 173.24 174.59 1y19 h GLU 291 N -1.04 0.56 -0.51 4.02 4.81 -1.92 -1.13 114.58 119.39 1y19 h GLU 291 Ca -0.46 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.78 1y19 h GLU 291 Cb 1.24 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 1y19 h GLU 291 CO 0.56 0.37 0.26 0.82 -0.73 0.00 0.00 179.01 180.30 1y19 h ILE 292 N 0.58 0.97 -0.54 2.32 1.08 -1.98 0.37 117.51 120.31 1y19 h ILE 292 Ca 0.16 -0.18 -0.06 0.00 -0.39 0.00 0.00 64.86 64.40 1y19 h ILE 292 Cb -0.06 0.41 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 1y19 h ILE 292 CO -0.04 0.09 0.12 -0.08 -0.69 0.00 0.00 178.15 177.56 1y19 h GLU 293 N 0.51 0.88 -0.33 2.37 4.81 -1.84 -0.60 114.58 120.38 1y19 h GLU 293 Ca 0.22 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1y19 h GLU 293 Cb 0.12 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1y19 h GLU 293 CO -0.15 0.83 0.15 0.00 -0.73 0.00 0.00 179.01 179.12 1y19 h ALA 294 N 1.01 0.42 -0.37 2.92 0.00 -0.86 0.06 119.26 122.44 1y19 h ALA 294 Ca 0.17 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1y19 h ALA 294 Cb 0.36 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1y19 h ALA 294 CO 0.00 -0.01 0.07 0.87 0.00 0.00 0.00 179.25 180.19 1y19 h LYS 295 N 0.39 0.19 -0.30 0.00 1.57 -0.65 0.14 116.57 117.91 1y19 h LYS 295 Ca 0.11 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.93 1y19 h LYS 295 Cb 0.13 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.35 1y19 h LYS 295 CO -0.01 0.13 0.02 0.28 -0.57 0.00 0.00 179.45 179.30 1y19 h VAL 296 N 0.20 0.80 -0.14 0.50 2.07 -0.72 -1.80 116.25 117.16 1y19 h VAL 296 Ca 0.17 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 1y19 h VAL 296 Cb 0.20 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1y19 h VAL 296 CO -0.23 0.02 -0.13 0.03 0.02 0.00 0.00 177.57 177.28 1y19 h ARG 297 N 0.12 0.23 0.70 1.57 3.08 -0.30 -2.18 114.38 117.60 1y19 h ARG 297 Ca 0.14 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1y19 h ARG 297 Cb 0.18 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.21 1y19 h ARG 297 CO -0.22 0.37 -0.34 -0.92 -1.07 0.00 0.00 179.97 177.78 1y19 h TYR 298 N 0.22 -0.88 -0.04 3.04 3.20 0.08 -2.32 116.97 120.27 1y19 h TYR 298 Ca 0.04 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.92 1y19 h TYR 298 Cb 0.37 0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 1y19 h TYR 298 CO 0.01 -0.52 -0.17 0.28 -1.64 0.00 0.00 178.16 176.11 1y19 h VAL 299 N -1.06 0.57 -0.99 1.81 2.07 -1.29 -1.72 116.25 115.65 1y19 h VAL 299 Ca -0.10 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.56 1y19 h VAL 299 Cb 0.75 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 31.01 1y19 h VAL 299 CO 0.16 0.00 0.61 0.11 0.02 0.00 0.00 177.57 178.47 1y19 h LYS 300 N -0.26 0.89 -0.35 1.57 1.57 -1.44 0.12 116.57 118.67 1y19 h LYS 300 Ca 0.07 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1y19 h LYS 300 Cb 0.35 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1y19 h LYS 300 CO -0.19 0.59 0.11 1.25 -0.57 0.00 0.00 179.45 180.63 1y19 h LEU 301 N 0.92 0.51 -1.09 2.94 5.85 -0.94 -1.12 115.31 122.39 1y19 h LEU 301 Ca 0.51 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 1y19 h LEU 301 Cb 0.58 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1y19 h LEU 301 CO -0.30 0.58 0.14 0.00 -0.34 0.00 0.00 178.44 178.52 1y19 h ALA 302 N 0.95 1.26 0.00 1.25 0.00 -0.33 -2.54 119.26 119.86 1y19 h ALA 302 Ca 0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1y19 h ALA 302 Cb 0.26 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1y19 h ALA 302 CO -0.00 0.52 -0.01 0.00 0.00 0.00 0.00 179.25 179.76 1y19 h ARG 303 N 0.76 0.00 -0.00 0.00 3.08 -0.61 -3.17 114.38 114.45 1y19 h ARG 303 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1y19 h ARG 303 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1y19 h ARG 303 CO -0.00 0.01 -0.19 -1.13 -1.07 0.00 0.00 179.97 177.58 1y19 n SER 304 N -3.10 0.26 -4.73 7.04 3.41 -0.44 -4.88 113.62 111.18 1y19 n SER 304 Ca 0.03 0.03 -0.41 0.00 -0.26 0.00 0.00 58.87 58.26 1y19 n SER 304 Cb 0.48 -0.16 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 1y19 n SER 304 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1y19 s LEU 305 N -2.89 4.49 0.63 1.04 1.43 -1.17 -4.94 118.68 117.27 1y19 s LEU 305 Ca 0.16 1.70 0.31 0.00 -1.03 0.00 0.00 54.13 55.27 1y19 s LEU 305 Cb 0.19 -3.48 1.72 0.00 0.03 0.00 0.00 46.19 44.65 1y19 s LEU 305 CO 0.58 -0.03 2.03 0.50 0.23 0.00 0.00 176.35 179.66 1y19 h LYS 306 N 5.54 0.00 -0.01 1.70 1.63 -1.90 0.11 116.57 123.63 1y19 h LYS 306 Ca -0.43 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.37 1y19 h LYS 306 Cb 1.21 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 1y19 h LYS 306 CO 0.71 0.00 -0.22 0.25 -3.45 0.00 0.00 179.45 176.74 1y19 n THR 307 N -3.32 0.00 -2.31 1.00 -2.24 -1.26 -4.87 114.28 101.28 1y19 n THR 307 Ca 0.01 -0.21 -0.41 0.00 -2.27 0.00 0.00 64.05 61.17 1y19 n THR 307 Cb 0.37 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 1y19 n THR 307 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1y19 s TYR 308 N -2.35 3.36 -1.46 4.78 5.04 0.38 -3.25 117.35 123.84 1y19 s TYR 308 Ca 0.26 1.29 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 1y19 s TYR 308 Cb 0.19 -3.51 0.00 0.00 0.35 0.00 0.00 41.96 39.00 1y19 s TYR 308 CO 0.47 -1.55 0.00 0.41 -1.34 0.00 0.00 175.55 173.54 1y19 n GLY 309 N 2.59 0.81 3.43 8.97 0.00 -1.26 -5.00 105.19 114.72 1y19 n GLY 309 Ca 0.07 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 1y19 n GLY 309 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y19 s VAL 310 N -2.63 3.78 -0.19 1.61 1.01 -1.20 -4.95 120.40 117.83 1y19 s VAL 310 Ca 0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.31 1y19 s VAL 310 Cb 0.00 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 1y19 s VAL 310 CO 0.00 0.44 1.39 -0.44 0.00 0.00 0.00 175.10 176.50 1y19 s SER 311 N 0.93 6.74 0.14 3.32 0.01 -1.07 -4.84 113.70 118.93 1y19 s SER 311 Ca 0.00 1.64 0.05 0.00 1.31 0.00 0.00 55.95 58.96 1y19 s SER 311 Cb -0.14 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.51 1y19 s SER 311 CO 0.01 -0.95 0.07 -0.36 0.41 0.00 0.00 173.24 172.42 1y19 s PHE 312 N 4.09 3.05 -0.03 2.43 0.40 -1.26 -0.23 117.98 126.43 1y19 s PHE 312 Ca 0.61 -0.04 0.01 0.00 -0.60 0.00 0.00 56.93 56.91 1y19 s PHE 312 Cb -0.23 -1.50 0.03 0.00 0.51 0.00 0.00 43.02 41.83 1y19 s PHE 312 CO 0.21 0.51 -0.01 -0.06 0.70 0.00 0.00 175.22 176.58 1y19 s PHE 313 N -1.61 0.35 -0.46 0.36 0.40 0.77 -4.96 117.98 112.83 1y19 s PHE 313 Ca 0.29 -0.02 -0.26 0.00 -0.60 0.00 0.00 56.93 56.33 1y19 s PHE 313 Cb -0.10 -0.42 0.03 0.00 0.51 0.00 0.00 43.02 43.03 1y19 s PHE 313 CO 0.21 -0.13 0.98 -1.17 0.70 0.00 0.00 175.22 175.81 1y19 s LEU 314 N 0.95 3.91 0.00 -0.37 2.96 -1.26 -1.31 118.68 123.56 1y19 s LEU 314 Ca -0.10 0.25 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 1y19 s LEU 314 Cb -0.13 -3.29 0.00 0.00 0.50 0.00 0.00 46.19 43.27 1y19 s LEU 314 CO -0.01 -1.08 0.00 1.33 -1.32 0.00 0.00 176.35 175.26 1y19 n VAL 315 N 6.48 0.00 -4.26 1.68 0.24 -0.46 -4.91 118.33 117.10 1y19 n VAL 315 Ca 0.08 -1.67 -0.20 0.00 -2.04 0.00 0.00 64.34 60.50 1y19 n VAL 315 Cb 0.49 0.33 -0.16 0.00 -1.47 0.00 0.00 33.84 33.03 1y19 n VAL 315 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1y19 s LYS 316 N -3.28 0.96 -0.20 7.34 1.02 -1.00 -0.36 119.74 124.23 1y19 s LYS 316 Ca 0.00 -0.18 -0.08 0.00 0.02 0.00 0.00 55.97 55.73 1y19 s LYS 316 Cb -0.00 -0.91 -0.04 0.00 -0.52 0.00 0.00 37.83 36.36 1y19 s LYS 316 CO 0.00 -0.03 0.09 -1.21 -0.92 0.00 0.00 175.35 173.28 1y19 s GLU 317 N 0.73 3.99 -0.41 1.68 2.02 0.51 -1.26 118.70 125.96 1y19 s GLU 317 Ca -0.11 -0.32 -0.14 0.00 0.02 0.00 0.00 54.97 54.41 1y19 s GLU 317 Cb -0.14 -3.31 0.03 0.00 0.10 0.00 0.00 34.13 30.81 1y19 s GLU 317 CO 0.01 0.20 0.30 0.21 0.02 0.00 0.00 175.26 175.99 1y19 s LYS 318 N 0.61 2.94 0.07 1.61 2.47 -1.26 -0.01 119.74 126.17 1y19 s LYS 318 Ca 0.05 -1.09 0.00 0.00 -1.56 0.00 0.00 55.97 53.37 1y19 s LYS 318 Cb -0.13 -3.96 -0.00 0.00 -1.46 0.00 0.00 37.83 32.28 1y19 s LYS 318 CO 0.01 -0.79 0.02 -1.33 0.16 0.00 0.00 175.35 173.42 1y19 n MET 319 N 5.14 1.10 -0.29 4.03 2.81 -1.26 -5.06 117.12 123.59 1y19 n MET 319 Ca -0.11 -0.54 -0.03 0.00 -1.81 0.00 0.00 57.70 55.20 1y19 n MET 319 Cb 0.46 0.26 0.02 0.00 -0.71 0.00 0.00 33.22 33.25 1y19 n MET 319 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1y19 n LYS 320 N -0.15 -0.06 0.00 0.03 0.00 -1.26 -4.27 118.16 112.44 1y19 n LYS 320 Ca -0.01 -0.24 0.00 0.00 -0.00 0.00 0.00 58.31 58.05 1y19 n LYS 320 Cb 0.10 -0.15 0.00 0.00 -0.00 0.00 0.00 35.03 34.98 1y19 n LYS 320 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1y19 n GLY 321 N 4.03 3.02 3.70 2.58 0.00 -1.26 -4.88 105.19 112.38 1y19 n GLY 321 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1y19 n GLY 321 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1y19 n LYS 322 N -1.53 0.31 0.00 1.61 2.85 -1.26 -5.02 118.16 115.12 1y19 n LYS 322 Ca 0.00 -0.94 0.07 0.00 -1.05 0.00 0.00 58.31 56.39 1y19 n LYS 322 Cb 0.00 1.42 0.02 0.00 -0.65 0.00 0.00 35.03 35.82 1y19 n LYS 322 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1y19 n ASN 323 N -1.10 1.72 -4.83 -5.58 0.23 -1.26 -4.73 115.26 99.71 1y19 n ASN 323 Ca 0.02 -1.36 -0.33 0.00 -0.53 0.00 0.00 54.58 52.39 1y19 n ASN 323 Cb 0.54 0.30 -0.06 0.00 -2.08 0.00 0.00 39.78 38.49 1y19 n ASN 323 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1y19 s LYS 324 N -1.51 4.13 -0.12 -3.83 2.20 -1.26 -5.00 119.74 114.34 1y19 s LYS 324 Ca 0.13 1.00 -0.16 0.00 -0.36 0.00 0.00 55.97 56.58 1y19 s LYS 324 Cb 0.11 -2.21 -0.05 0.00 -1.51 0.00 0.00 37.83 34.18 1y19 s LYS 324 CO 0.28 -0.05 0.40 -0.51 -0.36 0.00 0.00 175.35 175.11 1y19 s LEU 325 N -3.36 4.28 -0.43 5.43 1.02 -1.26 -4.57 118.68 119.80 1y19 s LEU 325 Ca 0.60 0.71 -0.22 0.00 0.02 0.00 0.00 54.13 55.23 1y19 s LEU 325 Cb -0.09 -2.55 0.02 0.00 0.02 0.00 0.00 46.19 43.58 1y19 s LEU 325 CO 0.18 0.08 0.75 -0.69 0.02 0.00 0.00 176.35 176.68 1y19 s VAL 326 N 0.38 4.71 0.38 -1.59 1.01 0.99 -4.79 120.40 121.48 1y19 s VAL 326 Ca 0.22 0.45 -0.26 0.00 0.00 0.00 0.00 61.98 62.39 1y19 s VAL 326 Cb -0.14 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.86 1y19 s VAL 326 CO 0.08 -0.63 1.23 -2.65 0.00 0.00 0.00 175.10 173.13 1y19 n PRO 327 N 6.55 1.91 -3.86 2.72 -0.02 -1.26 -0.36 135.00 140.68 1y19 n PRO 327 Ca 0.01 0.67 -0.11 0.00 -2.02 0.00 0.00 63.50 62.06 1y19 n PRO 327 Cb 0.48 -2.29 -0.09 0.00 -0.02 0.00 0.00 33.50 31.58 1y19 n PRO 327 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1y19 s ARG 328 N -2.01 0.61 -0.28 -0.52 6.06 0.51 -4.49 118.95 118.83 1y19 s ARG 328 Ca 0.59 -0.54 -0.13 0.00 -2.50 0.00 0.00 55.73 53.14 1y19 s ARG 328 Cb -0.55 0.25 -0.04 0.00 0.06 0.00 0.00 34.95 34.68 1y19 s ARG 328 CO 0.60 -0.17 0.30 -0.51 -2.50 0.00 0.00 175.30 173.02 1y19 s LEU 329 N -1.82 4.08 -0.25 -0.88 1.43 -0.22 -1.35 118.68 119.67 1y19 s LEU 329 Ca -0.09 0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1y19 s LEU 329 Cb -0.03 -2.29 -0.01 0.00 0.03 0.00 0.00 46.19 43.88 1y19 s LEU 329 CO -0.02 -0.15 0.05 -0.22 0.23 0.00 0.00 176.35 176.25 1y19 s LEU 330 N 1.94 3.42 -0.07 1.79 2.96 -0.43 0.82 118.68 129.12 1y19 s LEU 330 Ca 0.11 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1y19 s LEU 330 Cb -0.16 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 1y19 s LEU 330 CO 0.11 -0.07 -0.12 -0.83 -1.32 0.00 0.00 176.35 174.11 1y19 s GLY 331 N 1.56 1.57 -0.09 7.98 0.00 -0.46 -0.16 107.32 117.71 1y19 s GLY 331 Ca 0.05 -0.94 0.04 0.00 0.00 0.00 0.00 44.72 43.88 1y19 s GLY 331 CO 0.02 -0.62 -0.23 -0.42 0.00 0.00 0.00 173.10 171.85 1y19 s ILE 332 N -0.51 1.97 0.40 0.90 -1.09 0.68 -1.04 121.20 122.51 1y19 s ILE 332 Ca 0.07 -0.98 0.03 0.00 -2.23 0.00 0.00 60.65 57.55 1y19 s ILE 332 Cb -0.12 -1.70 -0.03 0.00 -1.58 0.00 0.00 42.46 39.03 1y19 s ILE 332 CO 0.02 0.54 0.08 0.42 -1.23 0.00 0.00 174.94 174.77 1y19 s THR 333 N 0.26 0.90 -1.57 2.92 -4.23 -0.36 -2.61 115.64 110.96 1y19 s THR 333 Ca -0.15 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.47 1y19 s THR 333 Cb -0.17 -2.46 0.22 0.00 1.34 0.00 0.00 72.50 71.43 1y19 s THR 333 CO 0.07 0.00 1.20 2.29 -0.54 0.00 0.00 174.62 177.65 1y19 n LYS 334 N -0.92 0.20 0.00 3.99 2.85 -1.26 -3.34 118.16 119.69 1y19 n LYS 334 Ca -0.07 0.14 0.00 0.00 -1.05 0.00 0.00 58.31 57.33 1y19 n LYS 334 Cb 0.66 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.54 1y19 n LYS 334 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1y19 n GLU 335 N -1.22 0.00 -3.78 -1.58 0.28 -1.26 -4.84 120.64 108.24 1y19 n GLU 335 Ca 0.06 0.00 -0.08 0.00 -0.16 0.00 0.00 57.16 56.98 1y19 n GLU 335 Cb 0.07 -0.45 -0.02 0.00 1.43 0.00 0.00 31.44 32.48 1y19 n GLU 335 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1y19 s VAL 337 N -3.89 1.49 0.06 0.00 1.01 0.07 -1.22 120.40 117.92 1y19 s VAL 337 Ca 0.09 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1y19 s VAL 337 Cb -0.05 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 1y19 s VAL 337 CO 0.03 0.43 -0.12 0.00 0.00 0.00 0.00 175.10 175.44 1y19 s MET 338 N 0.30 0.76 -0.27 2.72 0.23 -0.21 0.85 119.30 123.68 1y19 s MET 338 Ca -0.11 -0.85 -0.09 0.00 -1.03 0.00 0.00 55.69 53.61 1y19 s MET 338 Cb -0.14 -0.71 -0.04 0.00 -1.53 0.00 0.00 34.83 32.41 1y19 s MET 338 CO 0.04 0.16 0.14 1.03 -2.03 0.00 0.00 175.02 174.36 1y19 s ARG 339 N -1.54 3.77 -0.05 3.16 0.52 0.11 -1.36 118.95 123.56 1y19 s ARG 339 Ca -0.03 -0.42 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 1y19 s ARG 339 Cb -0.09 -3.52 -0.02 0.00 0.52 0.00 0.00 34.95 31.84 1y19 s ARG 339 CO 0.02 -0.21 -0.23 0.08 0.02 0.00 0.00 175.30 174.98 1y19 s VAL 340 N 1.69 2.32 -0.01 3.52 1.01 0.24 -0.74 120.40 128.43 1y19 s VAL 340 Ca 0.07 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 1y19 s VAL 340 Cb -0.16 -1.85 -0.08 0.00 0.00 0.00 0.00 36.38 34.30 1y19 s VAL 340 CO 0.08 0.58 1.94 -0.62 0.00 0.00 0.00 175.10 177.08 1y19 s ASP 341 N -0.42 6.37 0.55 3.32 -1.08 0.82 -1.05 116.67 125.17 1y19 s ASP 341 Ca 0.04 2.50 0.32 0.00 -0.52 0.00 0.00 52.55 54.89 1y19 s ASP 341 Cb -0.12 -2.53 1.48 0.00 -1.46 0.00 0.00 42.92 40.30 1y19 s ASP 341 CO 0.01 -1.14 1.86 -0.08 0.52 0.00 0.00 175.17 176.34 1y19 h GLU 342 N 10.94 0.00 0.00 4.34 4.22 -1.90 0.92 114.58 133.10 1y19 h GLU 342 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.97 1y19 h GLU 342 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1y19 h GLU 342 CO 0.95 0.00 -0.60 1.17 -2.18 0.00 0.00 179.01 178.34 1y19 n LYS 343 N -4.15 0.32 0.28 1.92 4.81 -1.26 -4.65 118.16 115.43 1y19 n LYS 343 Ca 0.19 0.13 0.15 0.00 -0.87 0.00 0.00 58.31 57.90 1y19 n LYS 343 Cb 0.99 -1.04 0.79 0.00 0.02 0.00 0.00 35.03 35.79 1y19 n LYS 343 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1y19 h THR 344 N -0.60 0.42 -0.47 3.15 2.02 -1.95 -3.45 112.91 112.03 1y19 h THR 344 Ca 0.00 -0.46 -0.20 0.00 0.77 0.00 0.00 66.41 66.52 1y19 h THR 344 Cb 0.60 1.32 -0.08 0.00 -1.74 0.00 0.00 68.15 68.25 1y19 h THR 344 CO 0.00 0.09 -0.18 0.29 0.37 0.00 0.00 175.52 176.08 1y19 n LYS 345 N -3.51 -1.00 -2.78 6.66 4.76 0.32 -4.34 118.16 118.27 1y19 n LYS 345 Ca -0.02 0.80 -0.32 0.00 -2.87 0.00 0.00 58.31 55.90 1y19 n LYS 345 Cb 0.22 -4.83 -0.05 0.00 -1.84 0.00 0.00 35.03 28.53 1y19 n LYS 345 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1y19 s GLU 346 N -2.64 4.00 -0.57 1.97 0.41 -1.26 -4.68 118.70 115.93 1y19 s GLU 346 Ca 0.00 0.83 -0.22 0.00 -0.41 0.00 0.00 54.97 55.17 1y19 s GLU 346 Cb 0.00 -2.27 0.06 0.00 -1.78 0.00 0.00 34.13 30.14 1y19 s GLU 346 CO 0.00 -0.06 0.86 0.08 -0.49 0.00 0.00 175.26 175.66 1y19 s VAL 347 N -2.30 4.51 0.01 2.63 1.01 -1.26 -0.13 120.40 124.86 1y19 s VAL 347 Ca 0.57 -0.15 -0.25 0.00 0.00 0.00 0.00 61.98 62.16 1y19 s VAL 347 Cb -0.10 -4.52 -0.16 0.00 0.00 0.00 0.00 36.38 31.60 1y19 s VAL 347 CO 0.23 -1.14 1.19 0.40 0.00 0.00 0.00 175.10 175.78 1y19 h ILE 348 N 5.96 0.61 -3.13 2.22 2.04 -1.29 -3.46 117.51 120.45 1y19 h ILE 348 Ca -0.27 -0.58 -0.16 0.00 1.00 0.00 0.00 64.86 64.84 1y19 h ILE 348 Cb 1.08 0.87 -0.26 0.00 -0.74 0.00 0.00 36.82 37.78 1y19 h ILE 348 CO 1.09 0.10 -0.43 -1.58 0.00 0.00 0.00 178.15 177.33 1y19 s GLN 349 N -4.58 0.29 -0.01 2.37 0.74 -1.21 -5.01 119.66 112.27 1y19 s GLN 349 Ca -0.14 0.35 0.05 0.00 0.05 0.00 0.00 55.36 55.67 1y19 s GLN 349 Cb 0.02 0.14 -0.01 0.00 1.10 0.00 0.00 33.01 34.26 1y19 s GLN 349 CO 0.52 -0.03 -0.17 -2.00 -0.55 0.00 0.00 175.29 173.06 1y19 s GLU 350 N 0.13 1.34 0.16 1.67 2.12 -1.26 0.07 118.70 122.93 1y19 s GLU 350 Ca -0.00 -0.63 0.10 0.00 0.36 0.00 0.00 54.97 54.80 1y19 s GLU 350 Cb -0.02 -1.31 -0.04 0.00 0.26 0.00 0.00 34.13 33.02 1y19 s GLU 350 CO 0.00 0.36 -0.24 -1.58 -0.54 0.00 0.00 175.26 173.26 1y19 s TRP 351 N -0.45 2.17 -0.11 5.30 0.51 0.25 -4.98 118.94 121.62 1y19 s TRP 351 Ca 0.06 -0.39 -0.14 0.00 -2.12 0.00 0.00 56.10 53.52 1y19 s TRP 351 Cb -0.07 -1.12 -0.05 0.00 -0.81 0.00 0.00 33.47 31.43 1y19 s TRP 351 CO -0.00 0.39 0.32 0.45 -0.51 0.00 0.00 176.95 177.60 1y19 s SER 352 N -2.38 6.55 0.48 2.95 0.15 -1.26 -0.75 113.70 119.43 1y19 s SER 352 Ca 0.16 0.65 0.25 0.00 0.70 0.00 0.00 55.95 57.71 1y19 s SER 352 Cb -0.09 -2.20 1.29 0.00 -1.71 0.00 0.00 66.02 63.32 1y19 s SER 352 CO 0.07 0.18 1.86 -0.07 1.20 0.00 0.00 173.24 176.49 1y19 h LEU 353 N 5.97 0.20 -0.38 3.45 3.38 -1.80 0.25 115.31 126.38 1y19 h LEU 353 Ca -0.45 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1y19 h LEU 353 Cb 1.19 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1y19 h LEU 353 CO 0.70 0.07 0.00 0.35 0.09 0.00 0.00 178.44 179.65 1y19 n THR 354 N -4.40 0.97 1.17 0.22 -2.24 -1.26 -1.98 114.28 106.76 1y19 n THR 354 Ca 0.20 0.28 0.13 0.00 -2.27 0.00 0.00 64.05 62.38 1y19 n THR 354 Cb 0.86 -1.13 0.32 0.00 -2.10 0.00 0.00 70.33 68.28 1y19 n THR 354 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1y19 n ASN 355 N -1.86 0.92 -4.66 3.42 3.02 0.86 -4.86 115.26 112.09 1y19 n ASN 355 Ca 0.02 -0.74 -0.42 0.00 -0.03 0.00 0.00 54.58 53.41 1y19 n ASN 355 Cb 0.18 0.19 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1y19 n ASN 355 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1y19 s ILE 356 N -2.64 4.77 -0.15 2.41 1.01 -0.84 -4.35 121.20 121.41 1y19 s ILE 356 Ca 0.20 1.86 -0.15 0.00 0.00 0.00 0.00 60.65 62.56 1y19 s ILE 356 Cb 0.19 -4.24 -0.24 0.00 0.01 0.00 0.00 42.46 38.18 1y19 s ILE 356 CO 0.58 -0.09 0.37 0.50 0.00 0.00 0.00 174.94 176.29 1y19 h LYS 357 N 7.43 0.16 -2.59 2.79 3.64 -0.53 -3.49 116.57 123.98 1y19 h LYS 357 Ca -0.23 -0.27 0.10 0.00 -1.27 0.00 0.00 60.65 58.97 1y19 h LYS 357 Cb 1.09 0.10 -0.10 0.00 -0.41 0.00 0.00 32.23 32.91 1y19 h LYS 357 CO 0.91 1.13 0.38 -0.98 -2.27 0.00 0.00 179.45 178.62 1y19 s ARG 358 N -2.46 1.23 -0.00 1.90 1.70 -0.92 -5.03 118.95 115.36 1y19 s ARG 358 Ca -0.24 -0.59 -0.10 0.00 -0.47 0.00 0.00 55.73 54.33 1y19 s ARG 358 Cb 0.06 0.48 0.01 0.00 -0.57 0.00 0.00 34.95 34.92 1y19 s ARG 358 CO 0.70 -0.55 0.21 1.67 -1.08 0.00 0.00 175.30 176.25 1y19 s TRP 359 N -3.46 -0.05 -0.08 5.89 -2.14 -1.26 0.20 118.94 118.04 1y19 s TRP 359 Ca 0.08 0.03 0.03 0.00 2.66 0.00 0.00 56.10 58.89 1y19 s TRP 359 Cb -0.02 0.01 0.01 0.00 -3.10 0.00 0.00 33.47 30.37 1y19 s TRP 359 CO -0.03 -0.33 -0.17 0.00 -2.66 0.00 0.00 176.95 173.76 1y19 s ALA 360 N -1.36 1.67 -0.26 2.67 0.00 -0.31 -4.97 121.76 119.20 1y19 s ALA 360 Ca -0.14 -0.67 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 1y19 s ALA 360 Cb -0.07 -0.69 0.04 0.00 0.00 0.00 0.00 23.12 22.40 1y19 s ALA 360 CO 0.03 0.17 -0.07 0.00 0.00 0.00 0.00 175.76 175.89 1y19 s ALA 361 N 0.56 2.67 0.27 0.00 0.00 -1.26 -0.33 121.76 123.68 1y19 s ALA 361 Ca -0.16 -1.57 0.09 0.00 0.00 0.00 0.00 51.96 50.32 1y19 s ALA 361 Cb -0.17 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 1y19 s ALA 361 CO 0.05 -0.96 0.07 -1.54 0.00 0.00 0.00 175.76 173.38 1y19 s SER 362 N 1.26 4.79 0.00 0.00 1.04 0.47 -4.88 113.70 116.38 1y19 s SER 362 Ca -0.02 -0.57 0.09 0.00 0.48 0.00 0.00 55.95 55.92 1y19 s SER 362 Cb -0.18 -0.95 0.53 0.00 0.10 0.00 0.00 66.02 65.51 1y19 s SER 362 CO -0.04 -0.06 0.97 -0.81 0.98 0.00 0.00 173.24 174.28 1y19 n PRO 363 N -1.00 0.49 0.00 4.02 -0.04 -1.26 -2.40 135.00 134.80 1y19 n PRO 363 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1y19 n PRO 363 Cb 0.59 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 1y19 n PRO 363 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1y19 n LYS 364 N -0.78 1.21 -3.72 0.54 4.81 -1.24 -4.55 118.16 114.43 1y19 n LYS 364 Ca 0.07 -0.11 -0.02 0.00 -0.87 0.00 0.00 58.31 57.38 1y19 n LYS 364 Cb 0.03 -0.46 -0.01 0.00 0.02 0.00 0.00 35.03 34.61 1y19 n LYS 364 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1y19 s SER 365 N -0.20 -0.13 -0.01 3.14 1.04 -1.01 -2.51 113.70 114.01 1y19 s SER 365 Ca 0.00 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.11 1y19 s SER 365 Cb 0.00 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.51 1y19 s SER 365 CO 0.00 -0.72 -0.02 0.12 0.98 0.00 0.00 173.24 173.61 1y19 s PHE 366 N -3.00 0.25 0.01 5.02 5.36 -0.96 -0.40 117.98 124.27 1y19 s PHE 366 Ca 0.13 -0.03 0.05 0.00 -0.96 0.00 0.00 56.93 56.12 1y19 s PHE 366 Cb 0.01 -0.21 -0.02 0.00 -0.34 0.00 0.00 43.02 42.46 1y19 s PHE 366 CO 0.00 -0.03 -0.15 0.99 -1.46 0.00 0.00 175.22 174.57 1y19 s THR 367 N 0.20 1.16 -0.11 0.12 2.01 0.56 -2.32 115.64 117.26 1y19 s THR 367 Ca -0.02 -0.79 0.04 0.00 0.31 0.00 0.00 61.69 61.23 1y19 s THR 367 Cb -0.04 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.47 1y19 s THR 367 CO -0.01 0.20 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.14 1y19 s LEU 368 N -0.68 2.06 -0.28 4.42 1.43 -0.91 -1.16 118.68 123.56 1y19 s LEU 368 Ca 0.04 -0.55 -0.03 0.00 -1.03 0.00 0.00 54.13 52.56 1y19 s LEU 368 Cb -0.07 -1.38 0.03 0.00 0.03 0.00 0.00 46.19 44.81 1y19 s LEU 368 CO 0.00 0.13 -0.01 -0.62 0.23 0.00 0.00 176.35 176.08 1y19 s ASP 369 N 0.47 4.70 0.00 2.29 2.15 0.13 -2.73 116.67 123.69 1y19 s ASP 369 Ca -0.16 -1.03 0.24 0.00 0.43 0.00 0.00 52.55 52.03 1y19 s ASP 369 Cb -0.17 -1.72 0.64 0.00 -0.30 0.00 0.00 42.92 41.37 1y19 s ASP 369 CO 0.06 -0.20 1.51 0.49 -0.17 0.00 0.00 175.17 176.86 1y19 n PHE 370 N 4.68 0.16 0.00 -5.34 3.72 -1.26 0.16 117.46 119.58 1y19 n PHE 370 Ca -0.15 -0.08 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 1y19 n PHE 370 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 1y19 n PHE 370 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1y19 n GLY 371 N 1.27 0.48 1.52 1.37 0.00 -1.26 -2.77 105.19 105.80 1y19 n GLY 371 Ca 0.17 0.73 -0.08 0.00 0.00 0.00 0.00 46.02 46.84 1y19 n GLY 371 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y19 n ASP 372 N 5.01 4.55 -0.01 1.61 9.92 -1.26 -4.25 116.55 132.11 1y19 n ASP 372 Ca 0.00 -2.60 -0.03 0.00 -0.53 0.00 0.00 54.79 51.63 1y19 n ASP 372 Cb 0.00 -0.83 -0.01 0.00 -0.64 0.00 0.00 41.12 39.64 1y19 n ASP 372 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1y19 n TYR 373 N 0.44 0.00 -4.04 1.24 9.36 -1.11 -5.11 117.16 117.94 1y19 n TYR 373 Ca 0.16 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.30 1y19 n TYR 373 Cb 0.68 -0.10 -0.09 0.00 -0.63 0.00 0.00 39.34 39.20 1y19 n TYR 373 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 1y19 s GLN 374 N -2.06 0.91 0.28 2.98 -2.07 -1.26 -5.15 119.66 113.30 1y19 s GLN 374 Ca -0.04 -1.24 -0.27 0.00 -1.82 0.00 0.00 55.36 51.98 1y19 s GLN 374 Cb 0.02 0.29 -0.09 0.00 -1.09 0.00 0.00 33.01 32.13 1y19 s GLN 374 CO 0.05 -0.28 0.92 -0.51 -1.32 0.00 0.00 175.29 174.16 1y19 s ASP 375 N -2.97 7.43 0.24 12.60 1.11 -1.26 -4.72 116.67 129.09 1y19 s ASP 375 Ca 0.16 1.84 0.00 0.00 0.18 0.00 0.00 52.55 54.73 1y19 s ASP 375 Cb 0.06 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.47 1y19 s ASP 375 CO -0.03 0.02 0.00 0.61 1.18 0.00 0.00 175.17 176.95 1y19 n GLY 376 N 0.91 -2.50 0.00 0.21 0.00 -1.26 -5.01 105.19 97.54 1y19 n GLY 376 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1y19 n GLY 376 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1y19 n TYR 377 N -3.22 0.00 -3.29 1.61 4.01 -1.26 -4.77 117.16 110.24 1y19 n TYR 377 Ca -0.03 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.63 1y19 n TYR 377 Cb 0.30 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.28 1y19 n TYR 377 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1y19 s TYR 378 N 1.65 -1.06 0.09 -0.72 5.04 -1.10 -4.98 117.35 116.27 1y19 s TYR 378 Ca 0.00 0.42 0.07 0.00 -2.44 0.00 0.00 57.07 55.12 1y19 s TYR 378 Cb 0.00 -0.10 -0.04 0.00 0.35 0.00 0.00 41.96 42.17 1y19 s TYR 378 CO 0.00 -0.97 -0.09 -1.12 -1.34 0.00 0.00 175.55 172.02 1y19 s SER 379 N 2.57 4.46 0.06 4.32 0.01 -1.26 -2.14 113.70 121.72 1y19 s SER 379 Ca 0.10 -0.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.95 1y19 s SER 379 Cb -0.12 -0.88 -0.01 0.00 0.21 0.00 0.00 66.02 65.21 1y19 s SER 379 CO -0.29 0.19 0.11 0.68 0.41 0.00 0.00 173.24 174.34 1y19 s VAL 380 N -1.20 0.16 -0.20 3.43 -7.23 -0.98 -4.64 120.40 109.74 1y19 s VAL 380 Ca 0.21 -1.31 -0.16 0.00 -1.81 0.00 0.00 61.98 58.91 1y19 s VAL 380 Cb -0.11 -1.26 -0.04 0.00 0.56 0.00 0.00 36.38 35.53 1y19 s VAL 380 CO 0.14 -0.72 0.42 -1.58 -0.31 0.00 0.00 175.10 173.04 1y19 s GLN 381 N -3.52 4.19 -0.03 4.82 0.74 -0.39 -2.25 119.66 123.21 1y19 s GLN 381 Ca 0.03 0.25 -0.29 0.00 0.05 0.00 0.00 55.36 55.40 1y19 s GLN 381 Cb 0.04 -3.53 0.10 0.00 1.10 0.00 0.00 33.01 30.71 1y19 s GLN 381 CO -0.09 -0.04 0.82 -0.08 -0.55 0.00 0.00 175.29 175.35 1y19 s THR 382 N 1.32 0.00 -2.74 -0.34 -1.32 -1.04 -2.36 115.64 109.15 1y19 s THR 382 Ca 0.20 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.92 1y19 s THR 382 Cb -0.15 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.16 1y19 s THR 382 CO 0.08 0.00 1.36 0.35 -2.21 0.00 0.00 174.62 174.20 1y19 n THR 383 N 0.29 0.20 -1.31 5.08 -2.24 -1.26 -2.70 114.28 112.33 1y19 n THR 383 Ca -0.13 -0.57 0.01 0.00 -2.27 0.00 0.00 64.05 61.09 1y19 n THR 383 Cb 0.60 1.19 0.21 0.00 -2.10 0.00 0.00 70.33 70.23 1y19 n THR 383 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1y19 n GLU 384 N 1.29 2.05 0.03 -0.78 1.02 -1.26 -4.67 120.64 118.31 1y19 n GLU 384 Ca 0.16 -3.05 0.18 0.00 -0.02 0.00 0.00 57.16 54.43 1y19 n GLU 384 Cb 0.58 -1.78 0.67 0.00 -0.02 0.00 0.00 31.44 30.88 1y19 n GLU 384 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1y19 h GLY 385 N 1.11 0.05 0.59 0.62 0.00 -1.75 -0.72 103.07 102.98 1y19 h GLY 385 Ca 0.13 -0.01 -0.06 0.00 0.00 0.00 0.00 47.33 47.39 1y19 h GLY 385 CO 0.29 0.01 -0.20 -2.09 0.00 0.00 0.00 176.54 174.54 1y19 h GLU 386 N 0.04 0.24 -0.47 4.80 4.57 -1.83 -2.04 114.58 119.89 1y19 h GLU 386 Ca 0.22 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1y19 h GLU 386 Cb 0.82 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.41 1y19 h GLU 386 CO -0.01 0.81 0.30 1.96 -1.18 0.00 0.00 179.01 180.89 1y19 h GLN 387 N -0.28 0.58 0.01 1.92 7.50 -1.63 -1.10 115.11 122.11 1y19 h GLN 387 Ca -0.01 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.11 1y19 h GLN 387 Cb 0.84 -0.13 0.00 0.00 0.05 0.00 0.00 27.48 28.23 1y19 h GLN 387 CO 0.04 0.39 -0.00 0.82 -1.50 0.00 0.00 178.83 178.58 1y19 h ILE 388 N 0.60 1.13 -0.26 2.54 2.04 -1.24 -2.23 117.51 120.10 1y19 h ILE 388 Ca 0.18 -0.41 0.05 0.00 1.00 0.00 0.00 64.86 65.68 1y19 h ILE 388 Cb -0.03 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 1y19 h ILE 388 CO -0.06 0.11 -0.02 0.00 0.00 0.00 0.00 178.15 178.17 1y19 h ALA 389 N 0.80 0.21 -0.97 1.87 0.00 -1.19 -1.86 119.26 118.12 1y19 h ALA 389 Ca -0.00 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1y19 h ALA 389 Cb 0.18 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 1y19 h ALA 389 CO 0.00 -0.44 0.64 0.37 0.00 0.00 0.00 179.25 179.82 1y19 h GLN 390 N 0.05 1.19 -0.39 0.00 4.15 -1.16 -0.94 115.11 118.02 1y19 h GLN 390 Ca 0.12 -0.07 0.02 0.00 0.77 0.00 0.00 58.65 59.49 1y19 h GLN 390 Cb 0.17 -0.27 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 1y19 h GLN 390 CO -0.23 0.79 0.22 1.25 -1.93 0.00 0.00 178.83 178.93 1y19 h LEU 391 N 1.23 0.34 -0.01 -2.39 5.85 -0.73 -1.57 115.31 118.03 1y19 h LEU 391 Ca 0.39 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.12 1y19 h LEU 391 Cb 0.01 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 1y19 h LEU 391 CO -0.12 0.24 0.00 0.40 -0.34 0.00 0.00 178.44 178.62 1y19 h ILE 392 N 0.44 1.24 -0.43 4.05 2.04 -0.78 -2.68 117.51 121.40 1y19 h ILE 392 Ca 0.16 -0.71 0.09 0.00 1.00 0.00 0.00 64.86 65.40 1y19 h ILE 392 Cb 0.03 1.70 -0.09 0.00 -0.74 0.00 0.00 36.82 37.73 1y19 h ILE 392 CO -0.09 0.19 -0.14 0.00 0.00 0.00 0.00 178.15 178.11 1y19 h ALA 393 N 0.71 0.23 -0.11 1.87 0.00 -1.05 -0.29 119.26 120.61 1y19 h ALA 393 Ca 0.00 0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.11 1y19 h ALA 393 Cb 0.30 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1y19 h ALA 393 CO 0.00 -0.49 -0.12 0.78 0.00 0.00 0.00 179.25 179.42 1y19 h GLY 394 N -0.05 -0.04 0.83 0.00 0.00 -1.26 -0.32 103.07 102.24 1y19 h GLY 394 Ca 0.21 0.15 0.03 0.00 0.00 0.00 0.00 47.33 47.71 1y19 h GLY 394 CO -0.47 -0.13 0.30 -0.97 0.00 0.00 0.00 176.54 175.27 1y19 h TYR 395 N -0.15 0.55 -0.86 5.60 0.99 -1.04 -2.37 116.97 119.69 1y19 h TYR 395 Ca 0.08 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.81 1y19 h TYR 395 Cb 0.27 -0.17 -0.04 0.00 1.00 0.00 0.00 36.73 37.78 1y19 h TYR 395 CO -0.23 0.30 0.44 0.82 -0.00 0.00 0.00 178.16 179.49 1y19 h ILE 396 N 0.58 1.26 -0.09 -2.88 2.04 -0.79 -2.70 117.51 114.94 1y19 h ILE 396 Ca 0.21 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1y19 h ILE 396 Cb 0.06 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.26 1y19 h ILE 396 CO -0.11 0.30 0.06 0.44 0.00 0.00 0.00 178.15 178.84 1y19 h ASP 397 N 1.22 0.00 0.91 1.72 3.32 -0.53 -2.69 116.42 120.38 1y19 h ASP 397 Ca 0.30 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.13 1y19 h ASP 397 Cb 0.08 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1y19 h ASP 397 CO -0.04 0.00 -1.15 0.40 -1.72 0.00 0.00 179.24 176.73 1y19 h ILE 398 N 0.00 1.33 0.04 0.35 2.04 -1.30 -3.37 117.51 116.62 1y19 h ILE 398 Ca 0.04 -3.03 0.01 0.00 1.00 0.00 0.00 64.86 62.88 1y19 h ILE 398 Cb 0.17 2.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1y19 h ILE 398 CO -0.00 0.76 -0.07 0.40 0.00 0.00 0.00 178.15 179.24 1y19 h ILE 399 N 0.00 0.84 0.00 -0.67 2.04 -1.35 -3.52 117.51 114.85 1y19 h ILE 399 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1y19 h ILE 399 Cb 1.78 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1y19 h ILE 399 CO 0.11 0.00 0.00 -0.11 0.00 0.00 0.00 178.15 178.15