#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 1.27 -0.49 0.52 2.07 -2.06 -1.84 116.25 115.72 1y19 h VAL 210 Ca 0.00 -1.08 -0.04 0.00 0.82 0.00 0.00 66.70 66.40 1y19 h VAL 210 Cb 0.00 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1y19 h VAL 210 CO 0.00 0.36 0.15 1.56 0.02 0.00 0.00 177.57 179.66 1y19 h GLN 211 N 0.56 0.72 -0.78 1.57 4.20 -2.05 -1.80 115.11 117.54 1y19 h GLN 211 Ca 0.11 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1y19 h GLN 211 Cb 0.53 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 1y19 h GLN 211 CO 0.03 0.63 0.37 1.25 -0.67 0.00 0.00 178.83 180.44 1y19 h LEU 212 N 0.71 1.02 -0.56 1.46 5.85 -1.91 -0.41 115.31 121.47 1y19 h LEU 212 Ca 0.16 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 1y19 h LEU 212 Cb 0.22 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1y19 h LEU 212 CO -0.01 0.87 0.03 -1.13 -0.34 0.00 0.00 178.44 177.86 1y19 h ASN 213 N 1.10 0.94 -0.18 1.25 -1.24 -0.59 0.43 115.58 117.29 1y19 h ASN 213 Ca 0.27 -0.29 -0.01 0.00 0.71 0.00 0.00 56.30 56.97 1y19 h ASN 213 Cb 0.13 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 1y19 h ASN 213 CO -0.03 1.01 0.09 -0.07 -1.29 0.00 0.00 177.43 177.13 1y19 h LEU 214 N 0.85 0.24 -1.39 0.34 3.38 -0.87 0.31 115.31 118.16 1y19 h LEU 214 Ca 0.16 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1y19 h LEU 214 Cb 0.51 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1y19 h LEU 214 CO 0.02 0.29 0.43 -0.07 0.09 0.00 0.00 178.44 179.21 1y19 h LEU 215 N 0.17 0.69 0.44 1.67 3.38 -0.90 -2.39 115.31 118.36 1y19 h LEU 215 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1y19 h LEU 215 Cb 0.11 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1y19 h LEU 215 CO -0.01 0.48 -0.21 0.22 0.09 0.00 0.00 178.44 179.01 1y19 h TYR 216 N 0.80 -0.55 -1.00 1.13 3.20 -0.02 -2.34 116.97 118.20 1y19 h TYR 216 Ca 0.26 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.29 1y19 h TYR 216 Cb 0.04 0.18 -0.10 0.00 1.54 0.00 0.00 36.73 38.40 1y19 h TYR 216 CO -0.00 -0.23 0.62 0.28 -1.64 0.00 0.00 178.16 177.19 1y19 h VAL 217 N -0.89 0.77 0.55 1.81 2.07 -0.85 -0.03 116.25 119.68 1y19 h VAL 217 Ca -0.06 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1y19 h VAL 217 Cb 0.57 -0.12 0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1y19 h VAL 217 CO 0.10 0.15 -0.26 -0.61 0.02 0.00 0.00 177.57 176.97 1y19 h GLN 218 N 0.82 -0.71 -0.98 1.57 5.75 -1.40 -1.08 115.11 119.08 1y19 h GLN 218 Ca 0.55 0.05 0.09 0.00 -0.15 0.00 0.00 58.65 59.19 1y19 h GLN 218 Cb 0.79 0.16 -0.07 0.00 1.07 0.00 0.00 27.48 29.42 1y19 h GLN 218 CO -0.34 -0.41 0.62 0.00 -2.65 0.00 0.00 178.83 176.06 1y19 h ALA 219 N -0.66 1.51 0.29 3.38 0.00 -0.98 -0.75 119.26 122.05 1y19 h ALA 219 Ca -0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1y19 h ALA 219 Cb 0.63 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1y19 h ALA 219 CO 0.12 0.29 -0.14 -0.09 0.00 0.00 0.00 179.25 179.44 1y19 h ARG 220 N 1.03 -0.37 -0.98 0.00 2.43 -0.99 -2.75 114.38 112.75 1y19 h ARG 220 Ca 0.45 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.73 1y19 h ARG 220 Cb 0.36 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.92 1y19 h ARG 220 CO -0.21 -0.04 0.62 -0.44 -1.51 0.00 0.00 179.97 178.40 1y19 h ASP 221 N -0.77 0.97 -0.28 -3.80 5.19 -0.94 0.98 116.42 117.76 1y19 h ASP 221 Ca -0.04 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.37 1y19 h ASP 221 Cb 0.50 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 1y19 h ASP 221 CO 0.06 0.59 0.11 0.44 -3.12 0.00 0.00 179.24 177.33 1y19 h ASP 222 N 1.09 0.45 0.04 6.45 3.32 -1.16 0.10 116.42 126.71 1y19 h ASP 222 Ca 0.44 -0.05 -0.19 0.00 0.02 0.00 0.00 57.03 57.25 1y19 h ASP 222 Cb 0.26 -0.11 0.02 0.00 0.22 0.00 0.00 39.33 39.71 1y19 h ASP 222 CO -0.20 0.43 -0.76 0.40 -1.72 0.00 0.00 179.24 177.39 1y19 h ILE 223 N 0.49 1.41 -0.22 0.35 2.04 -0.83 0.30 117.51 121.05 1y19 h ILE 223 Ca 0.12 -2.23 -0.12 0.00 1.00 0.00 0.00 64.86 63.62 1y19 h ILE 223 Cb 0.14 2.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.93 1y19 h ILE 223 CO -0.01 0.65 -0.39 -0.07 0.00 0.00 0.00 178.15 178.34 1y19 h LEU 224 N -0.07 0.53 -0.76 1.44 3.38 -0.62 -3.14 115.31 116.07 1y19 h LEU 224 Ca -0.11 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1y19 h LEU 224 Cb 1.49 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1y19 h LEU 224 CO 0.15 0.87 -0.07 -0.46 0.09 0.00 0.00 178.44 179.02 1y19 n ASN 225 N -4.04 1.25 0.00 -0.43 2.04 0.00 -4.06 115.26 110.02 1y19 n ASN 225 Ca -0.01 -1.28 0.00 0.00 -0.44 0.00 0.00 54.58 52.85 1y19 n ASN 225 Cb 0.50 0.03 0.00 0.00 -2.53 0.00 0.00 39.78 37.77 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 1.21 2.01 0.34 4.83 0.00 -1.18 -4.94 105.19 107.47 1y19 n GLY 226 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 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 0.72 -3.48 1.61 0.02 -1.48 -3.29 113.55 107.66 1y19 h SER 227 Ca 0.00 0.10 -0.72 0.00 -0.84 0.00 0.00 61.79 60.33 1y19 h SER 227 Cb 0.00 -0.03 -0.31 0.00 0.14 0.00 0.00 62.40 62.21 1y19 h SER 227 CO 0.00 0.25 -0.36 -2.28 -1.14 0.00 0.00 176.83 173.30 1y19 s HIS 228 N -5.88 3.47 -0.08 3.45 5.04 0.92 -4.79 115.29 117.43 1y19 s HIS 228 Ca -0.11 -2.07 -0.30 0.00 -1.54 0.00 0.00 55.06 51.04 1y19 s HIS 228 Cb 0.24 -3.46 -0.05 0.00 0.04 0.00 0.00 32.58 29.36 1y19 s HIS 228 CO 0.80 -0.97 1.61 -2.14 -2.34 0.00 0.00 174.74 171.69 1y19 s PRO 229 N 1.04 4.16 0.14 2.88 0.02 -1.24 -4.52 135.00 137.47 1y19 s PRO 229 Ca 0.09 2.09 0.04 0.00 0.02 0.00 0.00 61.00 63.23 1y19 s PRO 229 Cb -0.24 -3.97 -0.04 0.00 0.02 0.00 0.00 34.50 30.27 1y19 s PRO 229 CO -0.02 -0.87 -0.09 0.14 -0.33 0.00 0.00 177.00 175.83 1y19 s VAL 230 N 4.08 1.06 0.76 3.83 -7.23 -1.26 -4.82 120.40 116.83 1y19 s VAL 230 Ca 0.71 -2.04 -0.11 0.00 -1.81 0.00 0.00 61.98 58.74 1y19 s VAL 230 Cb -0.31 -1.84 0.05 0.00 0.56 0.00 0.00 36.38 34.83 1y19 s VAL 230 CO 0.28 -0.75 1.08 -0.94 -0.31 0.00 0.00 175.10 174.46 1y19 s SER 231 N -3.15 4.67 0.21 4.85 1.04 -1.26 -4.80 113.70 115.27 1y19 s SER 231 Ca 0.16 1.64 -0.09 0.00 0.48 0.00 0.00 55.95 58.15 1y19 s SER 231 Cb 0.03 -2.40 0.27 0.00 0.10 0.00 0.00 66.02 64.02 1y19 s SER 231 CO -0.00 -1.90 1.79 0.15 0.98 0.00 0.00 173.24 174.26 1y19 h PHE 232 N -1.04 0.60 -0.84 5.02 3.57 -1.88 0.26 116.94 122.64 1y19 h PHE 232 Ca -0.45 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.11 1y19 h PHE 232 Cb 1.24 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.76 1y19 h PHE 232 CO 0.56 0.25 0.55 -0.44 -2.23 0.00 0.00 178.31 176.99 1y19 h ASP 233 N 0.59 0.90 0.82 0.41 3.32 -1.97 -2.34 116.42 118.16 1y19 h ASP 233 Ca 0.31 -0.01 -0.23 0.00 0.02 0.00 0.00 57.03 57.11 1y19 h ASP 233 Cb 0.27 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1y19 h ASP 233 CO -0.23 0.62 -1.08 0.11 -1.72 0.00 0.00 179.24 176.95 1y19 h LYS 234 N 1.05 0.12 -0.16 3.56 1.79 -1.69 -2.58 116.57 118.66 1y19 h LYS 234 Ca 0.33 -0.20 -0.05 0.00 -2.18 0.00 0.00 60.65 58.55 1y19 h LYS 234 Cb 0.01 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.72 1y19 h LYS 234 CO -0.09 1.08 -0.12 0.00 -1.08 0.00 0.00 179.45 179.24 1y19 h ALA 235 N 0.84 1.51 0.09 3.86 0.00 -0.62 -0.81 119.26 124.12 1y19 h ALA 235 Ca -0.06 -0.20 -0.27 0.00 0.00 0.00 0.00 54.91 54.38 1y19 h ALA 235 Cb 1.82 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 19.54 1y19 h ALA 235 CO 0.16 0.35 -1.15 0.00 0.00 0.00 0.00 179.25 178.61 1y19 h GLU 237 N 0.21 -0.31 0.06 0.00 5.08 -1.03 -0.92 114.58 117.67 1y19 h GLU 237 Ca -0.14 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1y19 h GLU 237 Cb 1.82 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 31.10 1y19 h GLU 237 CO 0.21 -0.19 -0.30 0.74 -1.00 0.00 0.00 179.01 178.47 1y19 h PHE 238 N -0.35 -0.81 -1.01 4.33 -1.00 -1.22 -0.61 116.94 116.28 1y19 h PHE 238 Ca -0.03 0.02 0.29 0.00 2.81 0.00 0.00 57.97 61.06 1y19 h PHE 238 Cb 0.27 0.35 -0.14 0.00 3.61 0.00 0.00 35.95 40.04 1y19 h PHE 238 CO -0.05 -0.40 0.58 0.00 -1.61 0.00 0.00 178.31 176.83 1y19 h ALA 239 N 0.24 1.90 -0.37 2.45 0.00 -1.19 0.43 119.26 122.71 1y19 h ALA 239 Ca 0.05 0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1y19 h ALA 239 Cb 0.54 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1y19 h ALA 239 CO -0.21 -0.46 0.22 0.78 0.00 0.00 0.00 179.25 179.57 1y19 h GLY 240 N 0.42 0.52 1.54 0.00 0.00 0.32 0.29 103.07 106.16 1y19 h GLY 240 Ca 0.70 -0.17 -0.07 0.00 0.00 0.00 0.00 47.33 47.79 1y19 h GLY 240 CO -0.55 0.15 -0.09 0.74 0.00 0.00 0.00 176.54 176.79 1y19 h PHE 241 N 0.45 0.60 0.00 5.60 0.04 0.17 -2.06 116.94 121.74 1y19 h PHE 241 Ca 0.15 -0.09 -0.07 0.00 2.80 0.00 0.00 57.97 60.76 1y19 h PHE 241 Cb 0.00 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 1y19 h PHE 241 CO -0.07 0.64 -0.35 0.37 -0.60 0.00 0.00 178.31 178.29 1y19 h GLN 242 N 0.52 0.00 -0.01 1.51 4.15 0.24 -1.09 115.11 120.43 1y19 h GLN 242 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 1y19 h GLN 242 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1y19 h GLN 242 CO 0.03 0.35 -0.04 0.00 -1.93 0.00 0.00 178.83 177.24 1y19 h GLN 244 N -0.53 0.39 -0.64 0.00 5.75 -1.23 0.37 115.11 119.21 1y19 h GLN 244 Ca -0.00 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.39 1y19 h GLN 244 Cb 0.64 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 1y19 h GLN 244 CO 0.01 0.26 0.07 0.82 -2.65 0.00 0.00 178.83 177.33 1y19 h ILE 245 N 0.40 1.26 0.00 2.39 2.04 -1.23 0.62 117.51 122.99 1y19 h ILE 245 Ca 0.28 -1.06 -0.11 0.00 1.00 0.00 0.00 64.86 64.96 1y19 h ILE 245 Cb 0.32 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1y19 h ILE 245 CO -0.27 0.39 -1.32 0.00 0.00 0.00 0.00 178.15 176.95 1y19 n GLN 246 N -4.20 0.62 -0.01 2.37 6.02 -0.86 -4.54 117.38 116.78 1y19 n GLN 246 Ca 0.04 0.17 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 1y19 n GLN 246 Cb 0.31 -1.80 -0.02 0.00 1.02 0.00 0.00 30.24 29.75 1y19 n GLN 246 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1y19 n PHE 247 N -2.79 0.00 -0.43 1.08 0.99 0.13 -5.09 117.46 111.34 1y19 n PHE 247 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.38 1y19 n PHE 247 Cb 0.74 -0.08 0.00 0.00 -1.00 0.00 0.00 39.48 39.14 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 2.63 -1.72 3.30 1.37 0.00 0.22 -4.98 105.19 106.00 1y19 n GLY 248 Ca -0.02 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.65 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 0.00 0.09 -2.53 1.61 -0.02 -1.26 -4.17 135.00 128.72 1y19 n PRO 249 Ca 0.00 0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.12 1y19 n PRO 249 Cb 0.00 -1.45 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 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 -2.01 3.55 -0.22 6.00 2.46 -1.26 -5.00 115.29 118.82 1y19 s HIS 250 Ca 0.56 1.50 0.02 0.00 0.47 0.00 0.00 55.06 57.62 1y19 s HIS 250 Cb -0.33 -3.29 0.04 0.00 -0.13 0.00 0.00 32.58 28.88 1y19 s HIS 250 CO 0.67 -0.73 -0.13 1.21 -2.47 0.00 0.00 174.74 173.30 1y19 s ASN 251 N 0.61 3.77 0.31 9.88 3.84 -1.26 -5.02 114.94 127.07 1y19 s ASN 251 Ca 0.54 -1.05 0.08 0.00 0.21 0.00 0.00 52.86 52.64 1y19 s ASN 251 Cb -0.27 -1.41 0.81 0.00 -0.55 0.00 0.00 41.25 39.82 1y19 s ASN 251 CO 0.31 -0.13 1.75 -0.33 -2.79 0.00 0.00 177.10 175.91 1y19 h GLU 252 N 7.89 0.65 0.00 0.43 4.39 -1.96 0.34 114.58 126.32 1y19 h GLU 252 Ca -0.28 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.38 1y19 h GLU 252 Cb 1.08 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 1y19 h GLU 252 CO 0.50 0.43 -0.28 1.04 -1.16 0.00 0.00 179.01 179.55 1y19 n GLN 253 N -4.83 0.26 -0.07 2.33 6.02 -1.26 -4.11 117.38 115.72 1y19 n GLN 253 Ca 0.25 0.15 -0.09 0.00 -0.01 0.00 0.00 57.00 57.30 1y19 n GLN 253 Cb 0.66 -1.74 -0.08 0.00 1.02 0.00 0.00 30.24 30.10 1y19 n GLN 253 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1y19 n LYS 254 N -2.15 1.13 -3.24 -1.09 4.81 -0.78 -4.77 118.16 112.06 1y19 n LYS 254 Ca 0.05 0.05 -0.39 0.00 -0.87 0.00 0.00 58.31 57.14 1y19 n LYS 254 Cb 0.43 -1.31 -0.02 0.00 0.02 0.00 0.00 35.03 34.15 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 -2.72 3.32 -4.20 5.64 8.25 0.11 -4.98 115.22 120.64 1y19 n HIS 255 Ca -0.24 -3.35 -0.23 0.00 -0.26 0.00 0.00 57.72 53.64 1y19 n HIS 255 Cb 0.84 -1.17 -0.07 0.00 1.12 0.00 0.00 29.99 30.71 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 -2.27 2.34 0.05 -0.41 -2.85 -1.26 -4.71 119.74 110.63 1y19 s LYS 256 Ca 0.32 -1.49 -0.24 0.00 -1.00 0.00 0.00 55.97 53.57 1y19 s LYS 256 Cb 0.02 -2.17 -0.13 0.00 -2.06 0.00 0.00 37.83 33.50 1y19 s LYS 256 CO 0.02 0.23 0.57 0.00 0.10 0.00 0.00 175.35 176.27 1y19 n ALA 257 N -1.03 -2.47 0.00 0.59 0.00 -1.26 -0.61 120.51 115.74 1y19 n ALA 257 Ca -0.05 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1y19 n ALA 257 Cb 0.60 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.92 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 1.12 2.54 0.19 0.00 0.00 -1.26 -4.90 105.19 102.88 1y19 n GLY 258 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 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 0.58 -3.52 1.61 3.57 -1.24 -3.44 116.94 114.51 1y19 h PHE 259 Ca 0.00 -0.04 -0.53 0.00 3.53 0.00 0.00 57.97 60.94 1y19 h PHE 259 Cb 0.00 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1y19 h PHE 259 CO 0.00 0.50 0.24 -0.51 -2.23 0.00 0.00 178.31 176.31 1y19 s LEU 260 N -9.85 4.51 -0.90 0.59 1.43 -1.26 -5.00 118.68 108.20 1y19 s LEU 260 Ca -0.13 1.63 -0.17 0.00 -1.03 0.00 0.00 54.13 54.43 1y19 s LEU 260 Cb 0.10 -3.38 0.16 0.00 0.03 0.00 0.00 46.19 43.10 1y19 s LEU 260 CO 0.75 0.05 1.01 -0.62 0.23 0.00 0.00 176.35 177.77 1y19 s ASP 261 N -0.38 6.69 0.64 2.29 2.15 -1.26 -4.91 116.67 121.89 1y19 s ASP 261 Ca 0.40 -2.29 0.18 0.00 0.43 0.00 0.00 52.55 51.27 1y19 s ASP 261 Cb -0.22 -2.33 0.84 0.00 -0.30 0.00 0.00 42.92 40.90 1y19 s ASP 261 CO 0.26 -0.89 1.44 -0.07 -0.17 0.00 0.00 175.17 175.74 1y19 h LEU 262 N 9.50 0.00 -1.36 -1.34 3.38 -1.94 0.12 115.31 123.66 1y19 h LEU 262 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1y19 h LEU 262 Cb 1.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 1y19 h LEU 262 CO 0.99 0.00 -0.03 0.11 0.09 0.00 0.00 178.44 179.60 1y19 h LYS 263 N 0.00 0.00 -0.39 1.13 1.57 -1.91 -2.33 116.57 114.64 1y19 h LYS 263 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1y19 h LYS 263 Cb 1.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.04 1y19 h LYS 263 CO -0.00 0.03 0.00 -0.25 -0.57 0.00 0.00 179.45 178.66 1y19 n ASP 264 N -3.14 3.23 0.00 0.86 8.00 0.40 -4.46 116.55 121.44 1y19 n ASP 264 Ca 0.01 -1.93 0.00 0.00 0.71 0.00 0.00 54.79 53.58 1y19 n ASP 264 Cb 0.33 -0.26 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 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 1.17 0.00 -4.16 1.24 3.72 -1.13 -5.08 117.46 113.22 1y19 n PHE 265 Ca 0.17 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.42 1y19 n PHE 265 Cb 0.52 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.95 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 -1.29 2.38 0.47 4.37 1.43 -0.89 -4.38 118.68 120.77 1y19 s LEU 266 Ca 0.00 -0.77 -0.23 0.00 -1.03 0.00 0.00 54.13 52.10 1y19 s LEU 266 Cb 0.00 -0.30 -0.07 0.00 0.03 0.00 0.00 46.19 45.85 1y19 s LEU 266 CO 0.00 -0.25 1.20 -2.84 0.23 0.00 0.00 176.35 174.69 1y19 s PRO 267 N -2.61 3.65 0.11 1.29 0.02 -1.26 -4.77 135.00 131.43 1y19 s PRO 267 Ca 0.03 1.85 -0.21 0.00 0.02 0.00 0.00 61.00 62.69 1y19 s PRO 267 Cb -0.04 -2.38 -0.05 0.00 0.02 0.00 0.00 34.50 32.06 1y19 s PRO 267 CO 0.00 -0.66 1.15 1.63 -0.33 0.00 0.00 177.00 178.79 1y19 n LYS 268 N -0.59 -0.30 0.06 5.54 5.02 -1.26 -0.47 118.16 126.16 1y19 n LYS 268 Ca 0.08 1.13 0.01 0.00 -2.02 0.00 0.00 58.31 57.51 1y19 n LYS 268 Cb 0.48 -1.66 0.07 0.00 -0.02 0.00 0.00 35.03 33.89 1y19 n LYS 268 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1y19 n GLU 269 N -4.69 0.02 0.00 1.97 0.28 -1.26 -0.77 120.64 116.19 1y19 n GLU 269 Ca 0.01 0.29 0.03 0.00 -0.16 0.00 0.00 57.16 57.34 1y19 n GLU 269 Cb 0.18 -1.94 0.01 0.00 1.43 0.00 0.00 31.44 31.11 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 -1.43 0.00 -0.09 -1.84 0.53 0.38 -4.76 117.16 109.95 1y19 n TYR 270 Ca -0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 57.90 56.81 1y19 n TYR 270 Cb 0.38 0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.70 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 0.90 0.88 -0.19 -0.72 -1.51 -0.96 -2.23 116.25 112.42 1y19 h VAL 271 Ca 0.00 -0.08 -0.05 0.00 -1.23 0.00 0.00 66.70 65.35 1y19 h VAL 271 Cb 0.23 0.64 -0.03 0.00 -2.13 0.00 0.00 31.29 30.01 1y19 h VAL 271 CO 0.00 0.04 0.06 2.29 -1.23 0.00 0.00 177.57 178.73 1y19 n LYS 272 N -5.05 1.80 -0.05 5.19 2.85 -1.26 -4.07 118.16 117.57 1y19 n LYS 272 Ca 0.00 -0.83 0.12 0.00 -1.05 0.00 0.00 58.31 56.56 1y19 n LYS 272 Cb 0.13 -1.57 0.32 0.00 -0.65 0.00 0.00 35.03 33.25 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 0.13 2.01 -3.59 -1.58 1.13 -0.84 -4.98 117.38 109.66 1y19 n GLN 273 Ca 0.10 -1.50 -0.22 0.00 -1.94 0.00 0.00 57.00 53.44 1y19 n GLN 273 Cb 0.61 -1.46 0.01 0.00 0.11 0.00 0.00 30.24 29.51 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 0.77 -1.30 -0.11 -1.09 4.76 -1.26 -4.90 118.16 115.03 1y19 n LYS 274 Ca 0.17 0.81 0.04 0.00 -2.87 0.00 0.00 58.31 56.45 1y19 n LYS 274 Cb 0.46 -3.73 0.09 0.00 -1.84 0.00 0.00 35.03 30.02 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 -1.72 3.00 0.34 0.72 0.00 -1.26 -4.65 105.19 101.62 1y19 n GLY 275 Ca -0.16 -0.28 0.18 0.00 0.00 0.00 0.00 46.02 45.76 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 1.10 0.00 -0.09 1.61 4.81 -1.96 0.68 114.58 120.72 1y19 h GLU 276 Ca 0.00 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.04 1y19 h GLU 276 Cb 0.68 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.07 1y19 h GLU 276 CO 0.01 0.00 -0.69 0.00 -0.73 0.00 0.00 179.01 177.60 1y19 h ARG 277 N 0.00 0.63 -0.22 1.92 2.47 -1.99 -2.42 114.38 114.77 1y19 h ARG 277 Ca 0.10 -0.56 -0.08 0.00 -1.26 0.00 0.00 59.98 58.19 1y19 h ARG 277 Cb 0.58 0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 29.01 1y19 h ARG 277 CO -0.00 1.17 -0.20 0.87 0.56 0.00 0.00 179.97 182.37 1y19 h LYS 278 N 0.28 0.38 -0.13 0.04 1.57 -1.24 -0.74 116.57 116.73 1y19 h LYS 278 Ca -0.06 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 1y19 h LYS 278 Cb 1.34 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.62 1y19 h LYS 278 CO 0.14 0.57 -0.20 0.82 -0.57 0.00 0.00 179.45 180.21 1y19 h ILE 279 N 0.35 1.37 -0.09 1.86 2.04 -1.30 -1.69 117.51 120.05 1y19 h ILE 279 Ca 0.06 -1.44 -0.05 0.00 1.00 0.00 0.00 64.86 64.43 1y19 h ILE 279 Cb 0.55 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1y19 h ILE 279 CO 0.04 0.42 -0.15 -0.26 0.00 0.00 0.00 178.15 178.19 1y19 h PHE 280 N -0.05 0.15 -0.37 1.37 0.05 -1.27 0.61 116.94 117.43 1y19 h PHE 280 Ca 0.01 -0.02 -0.14 0.00 3.82 0.00 0.00 57.97 61.65 1y19 h PHE 280 Cb 0.77 -0.04 -0.01 0.00 2.00 0.00 0.00 35.95 38.67 1y19 h PHE 280 CO 0.10 0.30 -0.32 0.37 -0.18 0.00 0.00 178.31 178.58 1y19 h GLN 281 N 0.14 0.83 -0.04 1.51 5.75 -1.02 0.25 115.11 122.53 1y19 h GLN 281 Ca 0.03 -0.39 -0.23 0.00 -0.15 0.00 0.00 58.65 57.91 1y19 h GLN 281 Cb 0.36 -0.01 0.01 0.00 1.07 0.00 0.00 27.48 28.91 1y19 h GLN 281 CO 0.02 1.03 -0.91 0.00 -2.65 0.00 0.00 178.83 176.32 1y19 h ALA 282 N 0.94 0.32 -0.21 3.38 0.00 -0.39 -2.26 119.26 121.04 1y19 h ALA 282 Ca 0.07 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.29 1y19 h ALA 282 Cb 0.87 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1y19 h ALA 282 CO 0.08 0.74 0.05 1.25 0.00 0.00 0.00 179.25 181.37 1y19 h HIS 283 N 0.35 0.35 -0.32 0.00 -0.00 0.35 -3.06 115.15 112.83 1y19 h HIS 283 Ca -0.08 -0.04 0.05 0.00 -0.00 0.00 0.00 60.37 60.29 1y19 h HIS 283 Cb 1.54 -0.10 -0.04 0.00 -0.00 0.00 0.00 27.41 28.81 1y19 h HIS 283 CO 0.08 0.45 0.05 -0.22 -0.00 0.00 0.00 177.93 178.29 1y19 h LYS 284 N 0.15 0.16 0.00 5.26 3.64 -0.49 -2.04 116.57 123.26 1y19 h LYS 284 Ca 0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1y19 h LYS 284 Cb 0.28 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1y19 h LYS 284 CO 0.00 0.10 0.01 -0.91 -2.27 0.00 0.00 179.45 176.39 1y19 h ASN 285 N 0.16 0.00 0.95 4.20 2.35 -1.31 -0.89 115.58 121.05 1y19 h ASN 285 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1y19 h ASN 285 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1y19 h ASN 285 CO -0.21 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.57 1y19 n GLY 287 N 0.66 3.36 1.93 0.00 0.00 -0.34 -1.60 105.19 109.19 1y19 n GLY 287 Ca 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 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 14.00 3.91 -1.63 1.61 3.00 -1.26 -4.37 117.38 132.64 1y19 n GLN 288 Ca 0.00 -3.11 -0.45 0.00 -0.01 0.00 0.00 57.00 53.44 1y19 n GLN 288 Cb 0.00 -2.21 -0.02 0.00 0.00 0.00 0.00 30.24 28.01 1y19 n GLN 288 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1y19 n MET 289 N -0.03 1.67 -1.82 -1.09 0.00 -0.62 -4.96 117.12 110.27 1y19 n MET 289 Ca 0.38 0.59 -0.31 0.00 -0.00 0.00 0.00 57.70 58.36 1y19 n MET 289 Cb 1.33 -2.09 0.03 0.00 0.00 0.00 0.00 33.22 32.48 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 -0.23 5.90 0.23 6.12 1.04 -1.26 -4.74 113.70 120.75 1y19 s SER 290 Ca 0.62 1.39 -0.07 0.00 0.48 0.00 0.00 55.95 58.37 1y19 s SER 290 Cb -0.68 -2.35 0.33 0.00 0.10 0.00 0.00 66.02 63.42 1y19 s SER 290 CO 0.57 -1.08 1.79 -0.08 0.98 0.00 0.00 173.24 175.42 1y19 h GLU 291 N -0.47 0.62 -0.79 4.02 4.81 -1.92 -0.31 114.58 120.54 1y19 h GLU 291 Ca -0.44 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.70 1y19 h GLU 291 Cb 1.21 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 1y19 h GLU 291 CO 0.62 0.41 0.32 0.82 -0.73 0.00 0.00 179.01 180.44 1y19 h ILE 292 N 0.64 1.26 -0.31 2.32 2.04 -1.98 -0.91 117.51 120.57 1y19 h ILE 292 Ca 0.35 -0.82 -0.18 0.00 1.00 0.00 0.00 64.86 65.21 1y19 h ILE 292 Cb 0.35 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1y19 h ILE 292 CO -0.26 0.34 -0.51 -0.08 0.00 0.00 0.00 178.15 177.65 1y19 h GLU 293 N 1.16 0.89 -0.58 2.37 4.81 -1.74 -1.55 114.58 119.93 1y19 h GLU 293 Ca 0.26 -0.54 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1y19 h GLU 293 Cb 0.22 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1y19 h GLU 293 CO -0.02 1.18 0.32 0.00 -0.73 0.00 0.00 179.01 179.76 1y19 h ALA 294 N 0.72 0.74 -0.05 2.92 0.00 -0.87 -0.50 119.26 122.22 1y19 h ALA 294 Ca 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1y19 h ALA 294 Cb 1.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1y19 h ALA 294 CO 0.12 0.25 -0.01 0.87 0.00 0.00 0.00 179.25 180.48 1y19 h LYS 295 N 0.78 -0.00 -0.49 0.00 1.57 -1.07 0.16 116.57 117.52 1y19 h LYS 295 Ca 0.20 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 59.04 1y19 h LYS 295 Cb 0.04 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.30 1y19 h LYS 295 CO -0.03 -0.00 0.22 0.28 -0.57 0.00 0.00 179.45 179.35 1y19 h VAL 296 N -0.00 0.91 -0.53 0.50 2.07 -0.91 -1.48 116.25 116.82 1y19 h VAL 296 Ca 0.02 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 1y19 h VAL 296 Cb 0.04 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1y19 h VAL 296 CO -0.05 0.08 0.06 0.03 0.02 0.00 0.00 177.57 177.71 1y19 h ARG 297 N 0.43 0.86 0.40 1.57 3.08 -0.79 -1.49 114.38 118.44 1y19 h ARG 297 Ca 0.22 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1y19 h ARG 297 Cb 0.17 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 1y19 h ARG 297 CO -0.18 0.82 -0.25 -0.92 -1.07 0.00 0.00 179.97 178.37 1y19 h TYR 298 N 0.81 -0.64 -0.81 3.04 3.20 0.16 -0.43 116.97 122.30 1y19 h TYR 298 Ca 0.16 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.04 1y19 h TYR 298 Cb 0.40 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.86 1y19 h TYR 298 CO 0.02 -0.38 0.53 0.28 -1.64 0.00 0.00 178.16 176.98 1y19 h VAL 299 N -0.62 1.19 -0.57 1.81 2.07 -1.15 -1.39 116.25 117.60 1y19 h VAL 299 Ca -0.04 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 1y19 h VAL 299 Cb 0.51 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1y19 h VAL 299 CO 0.04 0.20 0.04 0.11 0.02 0.00 0.00 177.57 177.98 1y19 h LYS 300 N 1.08 0.98 0.08 1.57 1.57 -1.15 -0.36 116.57 120.35 1y19 h LYS 300 Ca 0.30 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1y19 h LYS 300 Cb -0.10 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1y19 h LYS 300 CO -0.07 0.96 -0.13 1.25 -0.57 0.00 0.00 179.45 180.88 1y19 h LEU 301 N 0.86 -0.36 -0.94 2.94 5.85 -0.65 -0.29 115.31 122.72 1y19 h LEU 301 Ca 0.17 0.04 0.10 0.00 0.84 0.00 0.00 57.88 59.03 1y19 h LEU 301 Cb 0.49 0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.58 1y19 h LEU 301 CO 0.02 -0.20 0.58 0.00 -0.34 0.00 0.00 178.44 178.51 1y19 h ALA 302 N 0.62 1.38 0.00 1.25 0.00 -1.04 -1.74 119.26 119.72 1y19 h ALA 302 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1y19 h ALA 302 Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1y19 h ALA 302 CO -0.07 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1y19 h ARG 303 N 0.96 0.00 -0.00 0.00 3.08 -0.47 -3.02 114.38 114.92 1y19 h ARG 303 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.50 1y19 h ARG 303 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1y19 h ARG 303 CO -0.25 0.00 -0.20 -1.13 -1.07 0.00 0.00 179.97 177.32 1y19 n SER 304 N -3.05 0.41 -4.74 7.04 3.41 -0.17 -4.87 113.62 111.65 1y19 n SER 304 Ca 0.03 -0.26 -0.40 0.00 -0.26 0.00 0.00 58.87 57.97 1y19 n SER 304 Cb 0.42 -0.07 -0.05 0.00 -0.26 0.00 0.00 64.21 64.26 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 -2.74 4.49 0.42 1.04 1.43 -1.14 -4.94 118.68 117.25 1y19 s LEU 305 Ca 0.20 1.65 0.18 0.00 -1.03 0.00 0.00 54.13 55.13 1y19 s LEU 305 Cb 0.19 -3.43 1.09 0.00 0.03 0.00 0.00 46.19 44.07 1y19 s LEU 305 CO 0.55 -0.01 1.86 0.50 0.23 0.00 0.00 176.35 179.48 1y19 h LYS 306 N 5.50 0.39 -0.00 1.70 1.63 -1.89 -0.01 116.57 123.89 1y19 h LYS 306 Ca -0.44 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 1y19 h LYS 306 Cb 1.21 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.75 1y19 h LYS 306 CO 0.71 0.26 -0.01 0.25 -3.45 0.00 0.00 179.45 177.20 1y19 n THR 307 N -4.50 0.00 -2.10 1.00 -2.24 -1.26 -4.88 114.28 100.30 1y19 n THR 307 Ca 0.19 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.53 1y19 n THR 307 Cb 0.69 -0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 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 -2.33 2.96 -0.75 4.78 5.04 -0.02 -3.15 117.35 123.87 1y19 s TYR 308 Ca 0.36 0.74 -0.00 0.00 -2.44 0.00 0.00 57.07 55.73 1y19 s TYR 308 Cb 0.21 -3.77 0.00 0.00 0.35 0.00 0.00 41.96 38.75 1y19 s TYR 308 CO 0.43 -2.86 0.06 0.41 -1.34 0.00 0.00 175.55 172.25 1y19 n GLY 309 N 3.67 0.04 3.28 8.97 0.00 -1.26 -5.03 105.19 114.86 1y19 n GLY 309 Ca 0.13 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.53 2.36 -0.18 1.61 1.01 -1.19 -4.91 120.40 116.56 1y19 s VAL 310 Ca 0.03 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 60.80 1y19 s VAL 310 Cb -0.01 -1.91 -0.00 0.00 0.00 0.00 0.00 36.38 34.45 1y19 s VAL 310 CO 0.04 0.56 0.97 -0.44 0.00 0.00 0.00 175.10 176.23 1y19 s SER 311 N 0.16 7.10 0.16 3.32 0.01 -1.10 -4.87 113.70 118.47 1y19 s SER 311 Ca -0.12 1.36 0.07 0.00 1.31 0.00 0.00 55.95 58.58 1y19 s SER 311 Cb -0.16 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.51 1y19 s SER 311 CO 0.06 -0.54 -0.01 -0.36 0.41 0.00 0.00 173.24 172.81 1y19 s PHE 312 N 2.59 2.85 0.02 2.43 0.40 -1.26 -1.11 117.98 123.91 1y19 s PHE 312 Ca 0.44 -0.13 0.03 0.00 -0.60 0.00 0.00 56.93 56.67 1y19 s PHE 312 Cb -0.16 -1.40 -0.02 0.00 0.51 0.00 0.00 43.02 41.95 1y19 s PHE 312 CO 0.11 0.50 -0.09 -0.06 0.70 0.00 0.00 175.22 176.39 1y19 s PHE 313 N -1.63 0.74 -0.42 0.36 0.40 -0.47 -4.97 117.98 111.99 1y19 s PHE 313 Ca 0.27 -0.31 -0.17 0.00 -0.60 0.00 0.00 56.93 56.12 1y19 s PHE 313 Cb -0.10 -0.45 0.02 0.00 0.51 0.00 0.00 43.02 43.00 1y19 s PHE 313 CO 0.18 -0.03 0.40 -1.17 0.70 0.00 0.00 175.22 175.31 1y19 s LEU 314 N -0.92 4.95 0.00 -0.37 2.96 -1.26 -1.55 118.68 122.49 1y19 s LEU 314 Ca -0.03 -0.76 0.00 0.00 -0.22 0.00 0.00 54.13 53.13 1y19 s LEU 314 Cb -0.07 -2.32 0.00 0.00 0.50 0.00 0.00 46.19 44.30 1y19 s LEU 314 CO 0.00 -0.55 0.00 1.33 -1.32 0.00 0.00 176.35 175.81 1y19 n VAL 315 N 5.36 0.00 -3.94 1.68 0.24 -0.66 -4.92 118.33 116.08 1y19 n VAL 315 Ca -0.08 -0.02 -0.16 0.00 -2.04 0.00 0.00 64.34 62.03 1y19 n VAL 315 Cb 0.47 -0.28 -0.16 0.00 -1.47 0.00 0.00 33.84 32.40 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 -2.02 0.29 -0.15 7.34 1.02 -0.90 -1.72 119.74 123.60 1y19 s LYS 316 Ca 0.00 0.05 -0.05 0.00 0.02 0.00 0.00 55.97 55.99 1y19 s LYS 316 Cb -0.00 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.84 1y19 s LYS 316 CO 0.00 -0.10 0.03 -1.21 -0.92 0.00 0.00 175.35 173.14 1y19 s GLU 317 N 0.85 3.61 -0.60 1.68 2.02 0.15 -1.34 118.70 125.07 1y19 s GLU 317 Ca -0.09 -0.39 -0.11 0.00 0.02 0.00 0.00 54.97 54.41 1y19 s GLU 317 Cb -0.12 -3.03 0.15 0.00 0.10 0.00 0.00 34.13 31.23 1y19 s GLU 317 CO -0.01 0.42 0.49 0.21 0.02 0.00 0.00 175.26 176.38 1y19 s LYS 318 N -0.06 2.86 0.13 1.61 2.47 -1.26 0.11 119.74 125.60 1y19 s LYS 318 Ca 0.05 -2.05 0.07 0.00 -1.56 0.00 0.00 55.97 52.48 1y19 s LYS 318 Cb -0.12 -4.09 -0.04 0.00 -1.46 0.00 0.00 37.83 32.12 1y19 s LYS 318 CO 0.02 -1.24 -0.15 -1.64 0.16 0.00 0.00 175.35 172.49 1y19 s MET 319 N 0.89 1.09 0.67 4.03 -1.94 -1.26 -5.04 119.30 117.74 1y19 s MET 319 Ca 0.10 -1.28 -0.14 0.00 -1.71 0.00 0.00 55.69 52.66 1y19 s MET 319 Cb -0.22 -1.03 -0.10 0.00 2.01 0.00 0.00 34.83 35.49 1y19 s MET 319 CO -0.02 0.20 -0.80 0.36 -0.01 0.00 0.00 175.02 174.75 1y19 n LYS 320 N 0.48 0.00 0.00 2.03 2.85 -1.26 -3.91 118.16 118.35 1y19 n LYS 320 Ca -0.15 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.11 1y19 n LYS 320 Cb 0.57 -0.84 0.00 0.00 -0.65 0.00 0.00 35.03 34.11 1y19 n LYS 320 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1y19 n GLY 321 N 2.76 3.24 1.66 2.58 0.00 -1.26 -4.91 105.19 109.26 1y19 n GLY 321 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.93 0.17 0.00 1.61 2.85 -1.25 -5.02 118.16 114.59 1y19 n LYS 322 Ca 0.00 -0.47 0.05 0.00 -1.05 0.00 0.00 58.31 56.84 1y19 n LYS 322 Cb 0.00 0.69 0.02 0.00 -0.65 0.00 0.00 35.03 35.09 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 -0.71 1.51 -4.85 -5.58 0.23 -1.26 -4.78 115.26 99.82 1y19 n ASN 323 Ca 0.01 -1.25 -0.32 0.00 -0.53 0.00 0.00 54.58 52.49 1y19 n ASN 323 Cb 0.25 0.22 -0.02 0.00 -2.08 0.00 0.00 39.78 38.15 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 -1.03 3.81 -0.20 -3.83 2.20 -1.26 -5.00 119.74 114.43 1y19 s LYS 324 Ca 0.10 0.85 -0.11 0.00 -0.36 0.00 0.00 55.97 56.45 1y19 s LYS 324 Cb 0.08 -2.13 -0.05 0.00 -1.51 0.00 0.00 37.83 34.22 1y19 s LYS 324 CO 0.17 -0.37 0.18 -0.51 -0.36 0.00 0.00 175.35 174.46 1y19 s LEU 325 N -4.48 4.20 -0.33 5.43 1.02 -1.26 -4.39 118.68 118.87 1y19 s LEU 325 Ca 0.57 0.28 -0.22 0.00 0.02 0.00 0.00 54.13 54.78 1y19 s LEU 325 Cb -0.10 -2.17 0.00 0.00 0.02 0.00 0.00 46.19 43.94 1y19 s LEU 325 CO 0.40 0.13 0.73 -0.69 0.02 0.00 0.00 176.35 176.94 1y19 s VAL 326 N 0.53 4.82 0.25 -1.59 1.01 0.31 -4.78 120.40 120.95 1y19 s VAL 326 Ca 0.10 0.95 -0.31 0.00 0.00 0.00 0.00 61.98 62.73 1y19 s VAL 326 Cb -0.12 -4.12 -0.11 0.00 0.00 0.00 0.00 36.38 32.03 1y19 s VAL 326 CO 0.01 -0.29 1.59 -2.84 0.00 0.00 0.00 175.10 173.57 1y19 s PRO 327 N 2.89 4.16 0.08 2.72 0.02 -1.26 0.30 135.00 143.91 1y19 s PRO 327 Ca 0.29 2.51 0.02 0.00 0.02 0.00 0.00 61.00 63.84 1y19 s PRO 327 Cb -0.14 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.27 1y19 s PRO 327 CO 0.14 -0.62 -0.07 0.50 -0.33 0.00 0.00 177.00 176.62 1y19 s ARG 328 N 0.15 0.76 -0.23 5.54 6.06 -0.70 -4.35 118.95 126.18 1y19 s ARG 328 Ca 0.66 -1.20 -0.09 0.00 -2.50 0.00 0.00 55.73 52.61 1y19 s ARG 328 Cb -0.47 -0.22 -0.04 0.00 0.06 0.00 0.00 34.95 34.28 1y19 s ARG 328 CO 0.41 -0.00 0.11 -0.51 -2.50 0.00 0.00 175.30 172.80 1y19 s LEU 329 N -2.69 3.78 -0.26 -0.88 1.43 -0.19 -1.66 118.68 118.21 1y19 s LEU 329 Ca 0.07 -0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 1y19 s LEU 329 Cb 0.02 -2.00 -0.00 0.00 0.03 0.00 0.00 46.19 44.23 1y19 s LEU 329 CO -0.04 0.04 0.04 -0.22 0.23 0.00 0.00 176.35 176.40 1y19 s LEU 330 N 1.18 3.46 -0.05 1.79 2.96 -0.60 0.22 118.68 127.65 1y19 s LEU 330 Ca 0.06 -0.52 0.00 0.00 -0.22 0.00 0.00 54.13 53.45 1y19 s LEU 330 Cb -0.14 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 1y19 s LEU 330 CO 0.04 -0.11 -0.02 -0.83 -1.32 0.00 0.00 176.35 174.12 1y19 s GLY 331 N 1.51 1.81 -0.04 7.98 0.00 -0.60 -1.37 107.32 116.60 1y19 s GLY 331 Ca 0.04 -0.89 0.04 0.00 0.00 0.00 0.00 44.72 43.92 1y19 s GLY 331 CO 0.01 -0.69 -0.16 -0.42 0.00 0.00 0.00 173.10 171.83 1y19 s ILE 332 N -0.93 1.36 0.19 0.90 -1.09 -0.26 -0.36 121.20 121.00 1y19 s ILE 332 Ca 0.15 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 57.90 1y19 s ILE 332 Cb -0.11 -1.16 -0.05 0.00 -1.58 0.00 0.00 42.46 39.56 1y19 s ILE 332 CO 0.05 0.39 0.02 0.42 -1.23 0.00 0.00 174.94 174.59 1y19 s THR 333 N -0.00 0.63 -1.88 2.92 -4.23 0.14 -2.71 115.64 110.51 1y19 s THR 333 Ca -0.02 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.50 1y19 s THR 333 Cb -0.11 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.50 1y19 s THR 333 CO 0.02 -0.36 0.56 2.29 -0.54 0.00 0.00 174.62 176.58 1y19 n LYS 334 N -0.29 0.00 0.00 3.99 2.85 -1.26 -2.33 118.16 121.12 1y19 n LYS 334 Ca -0.05 0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 1y19 n LYS 334 Cb 0.64 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.52 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 -1.06 0.00 -3.63 -1.58 0.28 -1.26 -4.88 120.64 108.51 1y19 n GLU 335 Ca 0.00 -0.21 -0.01 0.00 -0.16 0.00 0.00 57.16 56.78 1y19 n GLU 335 Cb 0.00 -0.40 -0.01 0.00 1.43 0.00 0.00 31.44 32.46 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 -2.64 1.52 0.12 0.00 1.01 -0.48 0.27 120.40 120.19 1y19 s VAL 337 Ca 0.12 -0.80 0.04 0.00 0.00 0.00 0.00 61.98 61.34 1y19 s VAL 337 Cb 0.02 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1y19 s VAL 337 CO -0.03 0.43 -0.10 0.00 0.00 0.00 0.00 175.10 175.40 1y19 s MET 338 N -0.22 0.94 -0.25 2.72 0.23 0.51 -0.24 119.30 122.99 1y19 s MET 338 Ca 0.02 -1.29 -0.07 0.00 -1.03 0.00 0.00 55.69 53.32 1y19 s MET 338 Cb -0.10 -0.56 -0.02 0.00 -1.53 0.00 0.00 34.83 32.63 1y19 s MET 338 CO 0.01 0.07 0.06 1.03 -2.03 0.00 0.00 175.02 174.16 1y19 s ARG 339 N -3.25 3.55 -0.09 3.16 0.52 0.29 -1.56 118.95 121.56 1y19 s ARG 339 Ca 0.11 -0.54 0.04 0.00 -0.52 0.00 0.00 55.73 54.81 1y19 s ARG 339 Cb -0.00 -3.29 -0.00 0.00 0.52 0.00 0.00 34.95 32.18 1y19 s ARG 339 CO -0.00 -0.22 -0.24 0.08 0.02 0.00 0.00 175.30 174.94 1y19 s VAL 340 N 1.58 2.03 0.07 3.52 1.01 0.13 -0.29 120.40 128.46 1y19 s VAL 340 Ca 0.06 -1.01 -0.33 0.00 0.00 0.00 0.00 61.98 60.70 1y19 s VAL 340 Cb -0.15 -1.75 -0.12 0.00 0.00 0.00 0.00 36.38 34.36 1y19 s VAL 340 CO 0.03 0.56 1.77 -0.67 0.00 0.00 0.00 175.10 176.78 1y19 n ASP 341 N 3.43 3.53 0.26 3.32 -0.08 -0.02 -1.02 116.55 125.97 1y19 n ASP 341 Ca -0.19 1.01 0.14 0.00 -1.51 0.00 0.00 54.79 54.25 1y19 n ASP 341 Cb 0.53 -1.45 0.84 0.00 2.34 0.00 0.00 41.12 43.38 1y19 n ASP 341 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1y19 h GLU 342 N 7.92 0.00 0.00 -0.67 4.22 -1.91 0.22 114.58 124.36 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 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1y19 h GLU 342 CO 0.93 0.00 -0.70 1.17 -2.18 0.00 0.00 179.01 178.23 1y19 n LYS 343 N -3.98 0.37 0.25 1.92 4.81 -1.26 -4.66 118.16 115.61 1y19 n LYS 343 Ca -0.02 0.15 0.14 0.00 -0.87 0.00 0.00 58.31 57.71 1y19 n LYS 343 Cb 0.16 -1.14 0.55 0.00 0.02 0.00 0.00 35.03 34.61 1y19 n LYS 343 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1y19 h THR 344 N -0.70 0.25 -0.38 3.15 1.35 -1.96 -3.41 112.91 111.20 1y19 h THR 344 Ca 0.00 -0.82 -0.16 0.00 -0.55 0.00 0.00 66.41 64.87 1y19 h THR 344 Cb 0.70 1.66 -0.07 0.00 -1.73 0.00 0.00 68.15 68.71 1y19 h THR 344 CO 0.00 0.10 -0.15 0.29 -0.25 0.00 0.00 175.52 175.51 1y19 n LYS 345 N -3.22 -1.04 -2.72 4.72 4.76 0.07 -4.21 118.16 116.51 1y19 n LYS 345 Ca 0.01 0.71 -0.37 0.00 -2.87 0.00 0.00 58.31 55.79 1y19 n LYS 345 Cb 0.38 -4.72 -0.06 0.00 -1.84 0.00 0.00 35.03 28.79 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 -2.39 4.50 -0.57 1.97 0.41 -1.26 -4.62 118.70 116.74 1y19 s GLU 346 Ca 0.00 1.39 -0.28 0.00 -0.41 0.00 0.00 54.97 55.67 1y19 s GLU 346 Cb 0.00 -2.77 0.03 0.00 -1.78 0.00 0.00 34.13 29.61 1y19 s GLU 346 CO 0.00 0.19 1.24 0.08 -0.49 0.00 0.00 175.26 176.28 1y19 s VAL 347 N -1.61 3.97 -0.02 2.63 1.01 -1.26 -0.84 120.40 124.28 1y19 s VAL 347 Ca 0.51 0.87 -0.19 0.00 0.00 0.00 0.00 61.98 63.17 1y19 s VAL 347 Cb -0.20 -4.66 -0.10 0.00 0.00 0.00 0.00 36.38 31.41 1y19 s VAL 347 CO 0.25 -1.30 0.78 0.40 0.00 0.00 0.00 175.10 175.24 1y19 h ILE 348 N 6.21 0.00 -3.88 2.22 2.04 -1.02 -3.47 117.51 119.61 1y19 h ILE 348 Ca -0.25 -0.50 -0.19 0.00 1.00 0.00 0.00 64.86 64.92 1y19 h ILE 348 Cb 1.06 0.00 -0.23 0.00 -0.74 0.00 0.00 36.82 36.91 1y19 h ILE 348 CO 1.18 0.00 -0.70 -1.58 0.00 0.00 0.00 178.15 177.05 1y19 s GLN 349 N -3.76 0.22 -0.01 2.37 0.74 -1.19 -4.99 119.66 113.04 1y19 s GLN 349 Ca -0.10 -0.40 0.02 0.00 0.05 0.00 0.00 55.36 54.92 1y19 s GLN 349 Cb 0.01 0.08 -0.00 0.00 1.10 0.00 0.00 33.01 34.20 1y19 s GLN 349 CO 0.30 -0.04 -0.05 -2.00 -0.55 0.00 0.00 175.29 172.95 1y19 s GLU 350 N -0.98 0.46 0.15 1.67 2.12 -1.26 0.10 118.70 120.97 1y19 s GLU 350 Ca -0.11 -0.17 0.09 0.00 0.36 0.00 0.00 54.97 55.14 1y19 s GLU 350 Cb -0.07 -0.46 -0.04 0.00 0.26 0.00 0.00 34.13 33.82 1y19 s GLU 350 CO -0.01 0.09 -0.21 -1.58 -0.54 0.00 0.00 175.26 173.01 1y19 s TRP 351 N 0.03 1.95 -0.19 5.30 0.51 0.67 -5.00 118.94 122.20 1y19 s TRP 351 Ca 0.00 -0.43 -0.12 0.00 -2.12 0.00 0.00 56.10 53.43 1y19 s TRP 351 Cb -0.04 -1.00 -0.05 0.00 -0.81 0.00 0.00 33.47 31.58 1y19 s TRP 351 CO -0.00 0.34 0.23 0.45 -0.51 0.00 0.00 176.95 177.45 1y19 s SER 352 N -2.45 6.32 0.58 2.95 0.15 -1.26 -1.39 113.70 118.59 1y19 s SER 352 Ca 0.14 0.36 0.34 0.00 0.70 0.00 0.00 55.95 57.50 1y19 s SER 352 Cb -0.07 -2.14 1.40 0.00 -1.71 0.00 0.00 66.02 63.49 1y19 s SER 352 CO 0.07 0.11 1.66 -0.07 1.20 0.00 0.00 173.24 176.20 1y19 h LEU 353 N 6.85 0.00 -0.83 3.45 3.38 -1.86 0.66 115.31 126.96 1y19 h LEU 353 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1y19 h LEU 353 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1y19 h LEU 353 CO 0.74 0.00 0.00 0.71 0.09 0.00 0.00 178.44 179.98 1y19 h THR 354 N 0.00 0.00 -0.02 0.22 1.35 -1.93 -2.59 112.91 109.95 1y19 h THR 354 Ca 0.52 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 66.05 1y19 h THR 354 Cb 2.42 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 69.99 1y19 h THR 354 CO -0.01 0.00 -0.12 0.59 -0.25 0.00 0.00 175.52 175.73 1y19 n ASN 355 N -2.47 1.65 -4.60 5.36 3.02 0.23 -4.84 115.26 113.61 1y19 n ASN 355 Ca 0.02 -1.40 -0.43 0.00 -0.03 0.00 0.00 54.58 52.74 1y19 n ASN 355 Cb 0.27 0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.50 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 -2.19 4.24 -0.09 2.41 1.01 -0.98 -4.22 121.20 121.38 1y19 s ILE 356 Ca 0.31 1.21 -0.26 0.00 0.00 0.00 0.00 60.65 61.91 1y19 s ILE 356 Cb 0.20 -4.59 -0.22 0.00 0.01 0.00 0.00 42.46 37.87 1y19 s ILE 356 CO 0.41 -0.98 0.87 0.50 0.00 0.00 0.00 174.94 175.74 1y19 h LYS 357 N 9.16 -0.03 -3.14 2.79 3.64 -0.31 -3.49 116.57 125.20 1y19 h LYS 357 Ca -0.23 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.14 1y19 h LYS 357 Cb 1.06 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 1y19 h LYS 357 CO 1.12 0.70 0.20 -0.98 -2.27 0.00 0.00 179.45 178.22 1y19 s ARG 358 N -2.89 2.02 0.00 1.90 1.70 -0.90 -5.03 118.95 115.75 1y19 s ARG 358 Ca -0.16 -1.31 -0.18 0.00 -0.47 0.00 0.00 55.73 53.61 1y19 s ARG 358 Cb -0.01 0.60 0.03 0.00 -0.57 0.00 0.00 34.95 35.00 1y19 s ARG 358 CO 0.62 -0.93 0.39 1.67 -1.08 0.00 0.00 175.30 175.97 1y19 s TRP 359 N -3.00 -0.26 -0.06 5.89 -2.14 -1.26 -1.13 118.94 116.98 1y19 s TRP 359 Ca 0.16 0.34 0.02 0.00 2.66 0.00 0.00 56.10 59.27 1y19 s TRP 359 Cb -0.05 0.17 0.01 0.00 -3.10 0.00 0.00 33.47 30.51 1y19 s TRP 359 CO 0.11 -0.48 -0.10 0.00 -2.66 0.00 0.00 176.95 173.81 1y19 s ALA 360 N -1.75 1.10 -0.11 2.67 0.00 -0.44 -4.99 121.76 118.25 1y19 s ALA 360 Ca -0.10 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.57 1y19 s ALA 360 Cb -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.58 1y19 s ALA 360 CO 0.02 0.09 -0.23 0.00 0.00 0.00 0.00 175.76 175.64 1y19 s ALA 361 N 0.70 2.19 0.12 0.00 0.00 -1.26 -0.42 121.76 123.09 1y19 s ALA 361 Ca -0.14 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 50.88 1y19 s ALA 361 Cb -0.15 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.05 1y19 s ALA 361 CO 0.03 0.16 -0.16 -1.54 0.00 0.00 0.00 175.76 174.25 1y19 s SER 362 N 0.53 2.20 0.00 0.00 1.04 -0.23 -4.93 113.70 112.31 1y19 s SER 362 Ca -0.14 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.51 1y19 s SER 362 Cb -0.17 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.85 1y19 s SER 362 CO 0.05 -0.08 0.05 -0.81 0.98 0.00 0.00 173.24 173.43 1y19 n PRO 363 N 0.66 0.06 0.00 4.02 -0.04 -1.26 -1.33 135.00 137.11 1y19 n PRO 363 Ca -0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 1y19 n PRO 363 Cb 0.56 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 33.01 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 -0.18 0.00 -3.83 0.54 4.81 -1.23 -4.61 118.16 113.67 1y19 n LYS 364 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.38 1y19 n LYS 364 Cb 0.00 -0.08 0.00 0.00 0.02 0.00 0.00 35.03 34.98 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 0.00 -0.10 -0.13 3.14 1.04 -0.44 -2.04 113.70 115.16 1y19 s SER 365 Ca 0.00 -0.78 -0.06 0.00 0.48 0.00 0.00 55.95 55.59 1y19 s SER 365 Cb 0.00 0.69 0.06 0.00 0.10 0.00 0.00 66.02 66.86 1y19 s SER 365 CO 0.00 -1.32 0.30 0.12 0.98 0.00 0.00 173.24 173.32 1y19 s PHE 366 N -2.88 -0.45 -0.01 5.02 5.36 -0.87 -1.07 117.98 123.08 1y19 s PHE 366 Ca 0.15 1.01 0.08 0.00 -0.96 0.00 0.00 56.93 57.21 1y19 s PHE 366 Cb -0.04 0.11 -0.02 0.00 -0.34 0.00 0.00 43.02 42.72 1y19 s PHE 366 CO 0.07 -0.31 -0.25 0.99 -1.46 0.00 0.00 175.22 174.27 1y19 s THR 367 N 1.64 1.99 -0.10 0.12 2.01 0.44 -2.41 115.64 119.34 1y19 s THR 367 Ca -0.07 -1.12 0.03 0.00 0.31 0.00 0.00 61.69 60.85 1y19 s THR 367 Cb -0.10 -1.66 -0.00 0.00 0.01 0.00 0.00 72.50 70.74 1y19 s THR 367 CO -0.10 0.53 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.38 1y19 s LEU 368 N -0.69 2.24 -0.32 4.42 1.43 -0.94 -1.32 118.68 123.50 1y19 s LEU 368 Ca 0.10 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1y19 s LEU 368 Cb -0.10 -1.45 0.08 0.00 0.03 0.00 0.00 46.19 44.74 1y19 s LEU 368 CO -0.01 0.17 0.02 -0.62 0.23 0.00 0.00 176.35 176.15 1y19 s ASP 369 N 0.28 4.83 0.07 2.29 2.15 -0.28 -2.55 116.67 123.45 1y19 s ASP 369 Ca -0.15 -1.66 0.27 0.00 0.43 0.00 0.00 52.55 51.44 1y19 s ASP 369 Cb -0.17 -1.68 0.81 0.00 -0.30 0.00 0.00 42.92 41.58 1y19 s ASP 369 CO 0.08 -0.33 1.66 0.49 -0.17 0.00 0.00 175.17 176.90 1y19 n PHE 370 N 4.48 0.32 0.00 -5.34 3.72 -1.26 0.32 117.46 119.71 1y19 n PHE 370 Ca -0.07 0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1y19 n PHE 370 Cb 0.42 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 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 1.43 1.02 0.47 1.37 0.00 -1.26 -3.39 105.19 104.83 1y19 n GLY 371 Ca 0.06 0.35 0.02 0.00 0.00 0.00 0.00 46.02 46.45 1y19 n GLY 371 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1y19 n ASP 372 N 8.02 1.28 -0.08 1.61 5.75 -1.26 -4.22 116.55 127.65 1y19 n ASP 372 Ca 0.00 -2.07 -0.07 0.00 -0.01 0.00 0.00 54.79 52.64 1y19 n ASP 372 Cb 0.00 -0.25 -0.03 0.00 -1.03 0.00 0.00 41.12 39.81 1y19 n ASP 372 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1y19 n TYR 373 N 0.05 0.78 -4.28 2.11 9.36 -1.22 -5.03 117.16 118.93 1y19 n TYR 373 Ca 0.06 0.34 -0.15 0.00 3.32 0.00 0.00 57.90 61.47 1y19 n TYR 373 Cb 0.24 -0.77 -0.10 0.00 -0.63 0.00 0.00 39.34 38.08 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 -2.36 1.23 0.35 2.98 -2.07 -1.26 -5.15 119.66 113.39 1y19 s GLN 374 Ca -0.19 -1.61 -0.14 0.00 -1.82 0.00 0.00 55.36 51.60 1y19 s GLN 374 Cb 0.03 -0.39 -0.08 0.00 -1.09 0.00 0.00 33.01 31.48 1y19 s GLN 374 CO 0.29 -0.14 0.76 -0.51 -1.32 0.00 0.00 175.29 174.37 1y19 s ASP 375 N -3.24 6.71 0.35 12.60 1.11 -1.26 -4.62 116.67 128.32 1y19 s ASP 375 Ca 0.27 1.27 0.00 0.00 0.18 0.00 0.00 52.55 54.27 1y19 s ASP 375 Cb 0.06 -2.37 0.00 0.00 1.07 0.00 0.00 42.92 41.68 1y19 s ASP 375 CO 0.07 -0.27 0.00 0.61 1.18 0.00 0.00 175.17 176.75 1y19 n GLY 376 N -0.66 -2.98 0.00 0.21 0.00 -1.26 -5.01 105.19 95.49 1y19 n GLY 376 Ca 0.03 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 -3.38 0.00 -3.30 1.61 4.01 -1.26 -4.81 117.16 110.03 1y19 n TYR 377 Ca -0.05 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.59 1y19 n TYR 377 Cb 0.40 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.37 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 1.39 -0.93 -0.09 -0.72 5.04 -1.06 -4.98 117.35 116.00 1y19 s TYR 378 Ca 0.00 0.01 -0.02 0.00 -2.44 0.00 0.00 57.07 54.62 1y19 s TYR 378 Cb 0.00 -0.15 -0.03 0.00 0.35 0.00 0.00 41.96 42.12 1y19 s TYR 378 CO 0.00 -1.01 -0.00 -1.12 -1.34 0.00 0.00 175.55 172.08 1y19 s SER 379 N 2.15 5.18 0.03 4.32 0.01 -1.26 -2.22 113.70 121.91 1y19 s SER 379 Ca 0.12 0.11 0.01 0.00 1.31 0.00 0.00 55.95 57.50 1y19 s SER 379 Cb -0.12 -1.50 -0.02 0.00 0.21 0.00 0.00 66.02 64.59 1y19 s SER 379 CO -0.20 0.35 -0.05 0.68 0.41 0.00 0.00 173.24 174.43 1y19 s VAL 380 N -0.73 0.34 -0.06 3.43 -7.23 -1.01 -4.66 120.40 110.48 1y19 s VAL 380 Ca 0.11 -1.04 -0.24 0.00 -1.81 0.00 0.00 61.98 59.00 1y19 s VAL 380 Cb -0.12 -0.50 -0.04 0.00 0.56 0.00 0.00 36.38 36.29 1y19 s VAL 380 CO 0.02 -0.46 0.73 -1.58 -0.31 0.00 0.00 175.10 173.50 1y19 s GLN 381 N -1.63 4.44 -0.04 4.82 0.74 -0.45 -2.06 119.66 125.49 1y19 s GLN 381 Ca -0.12 0.93 -0.29 0.00 0.05 0.00 0.00 55.36 55.93 1y19 s GLN 381 Cb -0.09 -3.45 0.10 0.00 1.10 0.00 0.00 33.01 30.67 1y19 s GLN 381 CO -0.01 0.05 0.88 -0.08 -0.55 0.00 0.00 175.29 175.58 1y19 s THR 382 N 0.85 0.00 -1.54 -0.34 -1.32 -0.87 -2.12 115.64 110.30 1y19 s THR 382 Ca 0.39 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 61.02 1y19 s THR 382 Cb -0.18 -1.00 0.33 0.00 -1.51 0.00 0.00 72.50 70.14 1y19 s THR 382 CO 0.19 0.00 1.24 0.35 -2.21 0.00 0.00 174.62 174.19 1y19 n THR 383 N 0.08 0.67 -1.13 5.08 -2.24 -1.26 -2.66 114.28 112.82 1y19 n THR 383 Ca -0.10 -0.84 0.07 0.00 -2.27 0.00 0.00 64.05 60.91 1y19 n THR 383 Cb 0.61 0.77 0.20 0.00 -2.10 0.00 0.00 70.33 69.81 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 0.93 2.05 -0.20 -0.78 1.02 -1.26 -4.74 120.64 117.67 1y19 n GLU 384 Ca 0.14 -2.83 0.15 0.00 -0.02 0.00 0.00 57.16 54.61 1y19 n GLU 384 Cb 0.47 -1.69 0.48 0.00 -0.02 0.00 0.00 31.44 30.67 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 0.95 0.83 1.02 0.62 0.00 -1.78 -0.87 103.07 103.83 1y19 h GLY 385 Ca 0.03 -0.21 -0.12 0.00 0.00 0.00 0.00 47.33 47.03 1y19 h GLY 385 CO 0.14 0.06 -0.26 -2.09 0.00 0.00 0.00 176.54 174.40 1y19 h GLU 386 N 0.47 0.80 -0.35 4.80 4.57 -1.85 -0.81 114.58 122.22 1y19 h GLU 386 Ca 0.40 -0.39 -0.07 0.00 -1.18 0.00 0.00 59.36 58.12 1y19 h GLU 386 Cb 0.86 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.44 1y19 h GLU 386 CO -0.14 1.02 -0.07 1.96 -1.18 0.00 0.00 179.01 180.60 1y19 h GLN 387 N 0.59 0.66 -0.01 1.92 7.50 -1.62 -1.13 115.11 123.02 1y19 h GLN 387 Ca 0.07 -0.24 -0.00 0.00 0.50 0.00 0.00 58.65 58.97 1y19 h GLN 387 Cb 0.83 -0.04 -0.00 0.00 0.05 0.00 0.00 27.48 28.31 1y19 h GLN 387 CO 0.07 0.81 0.00 0.82 -1.50 0.00 0.00 178.83 179.04 1y19 h ILE 388 N 0.45 1.09 -0.06 2.54 2.04 -1.20 -1.82 117.51 120.54 1y19 h ILE 388 Ca 0.09 -0.27 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1y19 h ILE 388 Cb 0.56 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1y19 h ILE 388 CO 0.03 0.07 -0.08 0.00 0.00 0.00 0.00 178.15 178.17 1y19 h ALA 389 N 0.89 -0.03 -0.92 1.87 0.00 -1.10 -1.90 119.26 118.08 1y19 h ALA 389 Ca 0.00 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1y19 h ALA 389 Cb 0.11 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1y19 h ALA 389 CO -0.00 -0.55 0.58 0.37 0.00 0.00 0.00 179.25 179.65 1y19 h GLN 390 N -0.11 1.04 0.21 0.00 4.15 -1.15 -0.66 115.11 118.59 1y19 h GLN 390 Ca 0.05 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 1y19 h GLN 390 Cb 0.19 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 1y19 h GLN 390 CO -0.13 0.69 -0.16 1.25 -1.93 0.00 0.00 178.83 178.55 1y19 h LEU 391 N 1.07 -0.40 -0.87 -2.39 5.85 -0.84 -1.01 115.31 116.72 1y19 h LEU 391 Ca 0.39 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.14 1y19 h LEU 391 Cb 0.15 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.26 1y19 h LEU 391 CO -0.17 -0.25 0.54 0.40 -0.34 0.00 0.00 178.44 178.63 1y19 h ILE 392 N -0.37 1.23 -0.85 4.05 2.04 -0.99 -2.25 117.51 120.38 1y19 h ILE 392 Ca -0.01 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1y19 h ILE 392 Cb 0.33 -0.01 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 1y19 h ILE 392 CO -0.00 0.24 0.46 0.00 0.00 0.00 0.00 178.15 178.85 1y19 h ALA 393 N 1.30 1.09 -0.65 1.87 0.00 -0.89 -1.26 119.26 120.73 1y19 h ALA 393 Ca 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1y19 h ALA 393 Cb -0.08 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.34 1y19 h ALA 393 CO -0.06 0.61 0.37 0.78 0.00 0.00 0.00 179.25 180.95 1y19 h GLY 394 N 1.19 0.96 1.02 0.00 0.00 -0.61 -2.16 103.07 103.47 1y19 h GLY 394 Ca 0.30 -0.42 -0.13 0.00 0.00 0.00 0.00 47.33 47.08 1y19 h GLY 394 CO -0.05 0.40 -0.30 -0.97 0.00 0.00 0.00 176.54 175.63 1y19 h TYR 395 N 0.88 0.94 -0.02 5.60 0.99 -1.15 -3.15 116.97 121.07 1y19 h TYR 395 Ca 0.23 -0.28 -0.06 0.00 2.00 0.00 0.00 58.73 60.62 1y19 h TYR 395 Cb 0.01 -0.20 -0.01 0.00 1.00 0.00 0.00 36.73 37.53 1y19 h TYR 395 CO -0.01 1.05 -0.29 0.82 -0.00 0.00 0.00 178.16 179.73 1y19 h ILE 396 N 0.57 1.21 0.00 -2.88 2.04 -1.14 -2.55 117.51 114.76 1y19 h ILE 396 Ca 0.06 -1.02 -0.06 0.00 1.00 0.00 0.00 64.86 64.84 1y19 h ILE 396 Cb 0.88 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 1y19 h ILE 396 CO 0.08 0.29 -0.27 0.44 0.00 0.00 0.00 178.15 178.69 1y19 h ASP 397 N 0.03 0.00 0.98 1.72 3.32 -1.35 -3.08 116.42 118.03 1y19 h ASP 397 Ca 0.00 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1y19 h ASP 397 Cb 0.52 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 1y19 h ASP 397 CO 0.04 0.27 -1.08 0.40 -1.72 0.00 0.00 179.24 177.14 1y19 h ILE 398 N 0.00 1.15 -0.41 0.35 2.04 -1.47 -3.36 117.51 115.81 1y19 h ILE 398 Ca -0.00 -2.77 -0.04 0.00 1.00 0.00 0.00 64.86 63.05 1y19 h ILE 398 Cb 0.66 2.53 -0.02 0.00 -0.74 0.00 0.00 36.82 39.26 1y19 h ILE 398 CO 0.03 0.65 0.12 0.40 0.00 0.00 0.00 178.15 179.36 1y19 h ILE 399 N 0.00 1.22 0.00 -0.67 2.04 -1.42 -3.52 117.51 115.16 1y19 h ILE 399 Ca -0.09 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1y19 h ILE 399 Cb 1.70 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1y19 h ILE 399 CO 0.09 0.26 0.00 -0.11 0.00 0.00 0.00 178.15 178.39