#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 -0.30 0.52 2.07 -2.06 -2.49 116.25 115.25 1y19 h VAL 210 Ca 0.00 -1.58 -0.06 0.00 0.82 0.00 0.00 66.70 65.88 1y19 h VAL 210 Cb 0.00 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1y19 h VAL 210 CO 0.00 0.53 -0.07 1.56 0.02 0.00 0.00 177.57 179.61 1y19 h GLN 211 N 0.74 0.49 -0.50 1.57 4.20 -2.06 -2.34 115.11 117.21 1y19 h GLN 211 Ca 0.05 -0.12 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1y19 h GLN 211 Cb 1.00 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.70 1y19 h GLN 211 CO 0.10 0.57 0.08 1.25 -0.67 0.00 0.00 178.83 180.16 1y19 h LEU 212 N 0.46 0.74 -0.63 1.46 5.85 -1.94 -2.37 115.31 118.87 1y19 h LEU 212 Ca 0.09 -0.14 -0.15 0.00 0.84 0.00 0.00 57.88 58.52 1y19 h LEU 212 Cb 0.41 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1y19 h LEU 212 CO 0.02 0.76 -0.57 -1.13 -0.34 0.00 0.00 178.44 177.18 1y19 h ASN 213 N 0.75 0.39 -0.27 1.25 -1.24 -0.99 -1.33 115.58 114.14 1y19 h ASN 213 Ca 0.16 -0.21 -0.15 0.00 0.71 0.00 0.00 56.30 56.81 1y19 h ASN 213 Cb 0.34 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.27 1y19 h ASN 213 CO 0.01 0.88 -0.39 -0.07 -1.29 0.00 0.00 177.43 176.57 1y19 h LEU 214 N 0.27 0.87 -0.47 0.34 3.38 -1.17 -1.00 115.31 117.52 1y19 h LEU 214 Ca 0.00 -0.39 -0.14 0.00 0.09 0.00 0.00 57.88 57.44 1y19 h LEU 214 Cb 1.08 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1y19 h LEU 214 CO 0.09 1.15 -0.29 -0.07 0.09 0.00 0.00 178.44 179.42 1y19 h LEU 215 N 0.67 1.00 0.84 1.67 3.38 -1.37 -2.52 115.31 118.97 1y19 h LEU 215 Ca 0.06 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.58 1y19 h LEU 215 Cb 0.95 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.43 1y19 h LEU 215 CO 0.09 1.20 -0.40 0.22 0.09 0.00 0.00 178.44 179.64 1y19 h TYR 216 N 0.81 -1.04 -0.94 1.13 3.20 -1.12 -1.42 116.97 117.59 1y19 h TYR 216 Ca 0.09 -0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.10 1y19 h TYR 216 Cb 0.87 0.34 -0.10 0.00 1.54 0.00 0.00 36.73 39.38 1y19 h TYR 216 CO 0.06 -0.64 0.54 0.28 -1.64 0.00 0.00 178.16 176.76 1y19 h VAL 217 N -1.22 0.73 -0.30 1.81 2.07 -1.23 0.21 116.25 118.31 1y19 h VAL 217 Ca -0.11 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 1y19 h VAL 217 Cb 0.87 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1y19 h VAL 217 CO 0.19 0.13 -0.07 -0.61 0.02 0.00 0.00 177.57 177.23 1y19 h GLN 218 N 0.73 0.59 -0.47 1.57 5.75 -1.38 -1.13 115.11 120.77 1y19 h GLN 218 Ca 0.53 -0.22 -0.13 0.00 -0.15 0.00 0.00 58.65 58.67 1y19 h GLN 218 Cb 0.77 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.27 1y19 h GLN 218 CO -0.37 0.78 -0.21 0.00 -2.65 0.00 0.00 178.83 176.38 1y19 h ALA 219 N 0.79 0.66 -0.05 3.38 0.00 -0.37 -1.41 119.26 122.26 1y19 h ALA 219 Ca 0.08 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1y19 h ALA 219 Cb 0.56 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1y19 h ALA 219 CO 0.03 0.64 0.01 -0.09 0.00 0.00 0.00 179.25 179.84 1y19 h ARG 220 N 0.82 0.09 -0.71 0.00 2.43 -0.60 -2.40 114.38 114.00 1y19 h ARG 220 Ca 0.11 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1y19 h ARG 220 Cb 0.78 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.29 1y19 h ARG 220 CO 0.06 0.28 0.36 -0.44 -1.51 0.00 0.00 179.97 178.73 1y19 h ASP 221 N -0.13 0.91 0.14 -3.80 5.19 -1.20 0.69 116.42 118.22 1y19 h ASP 221 Ca 0.02 -0.12 -0.02 0.00 -0.62 0.00 0.00 57.03 56.29 1y19 h ASP 221 Cb 0.24 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1y19 h ASP 221 CO 0.00 0.77 -0.09 0.44 -3.12 0.00 0.00 179.24 177.24 1y19 h ASP 222 N 0.98 0.00 0.22 6.45 3.32 -1.16 -0.64 116.42 125.59 1y19 h ASP 222 Ca 0.25 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.95 1y19 h ASP 222 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1y19 h ASP 222 CO -0.03 0.09 -1.76 0.40 -1.72 0.00 0.00 179.24 176.22 1y19 h ILE 223 N 0.00 0.92 -0.07 0.35 2.04 -0.87 0.66 117.51 120.55 1y19 h ILE 223 Ca -0.00 -2.53 -0.13 0.00 1.00 0.00 0.00 64.86 63.20 1y19 h ILE 223 Cb 0.19 2.73 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 1y19 h ILE 223 CO 0.01 0.85 -0.56 -0.07 0.00 0.00 0.00 178.15 178.39 1y19 h LEU 224 N 0.10 0.22 -1.33 1.44 3.38 -0.54 -3.12 115.31 115.46 1y19 h LEU 224 Ca -0.34 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1y19 h LEU 224 Cb 2.08 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.77 1y19 h LEU 224 CO 0.17 0.73 0.00 -0.46 0.09 0.00 0.00 178.44 178.97 1y19 n ASN 225 N -3.90 2.05 0.00 -0.43 2.04 -0.28 -4.19 115.26 110.56 1y19 n ASN 225 Ca -0.02 -1.69 0.00 0.00 -0.44 0.00 0.00 54.58 52.43 1y19 n ASN 225 Cb 0.58 -0.01 0.00 0.00 -2.53 0.00 0.00 39.78 37.82 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 1.24 0.84 0.35 4.83 0.00 -1.18 -4.92 105.19 106.34 1y19 n GLY 226 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.21 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 0.80 -4.12 1.61 0.02 -1.36 -3.32 113.55 107.19 1y19 h SER 227 Ca 0.00 -0.02 -0.69 0.00 -0.84 0.00 0.00 61.79 60.24 1y19 h SER 227 Cb 0.00 -0.20 -0.36 0.00 0.14 0.00 0.00 62.40 61.99 1y19 h SER 227 CO 0.00 0.57 -0.41 -2.28 -1.14 0.00 0.00 176.83 173.58 1y19 s HIS 228 N -5.80 3.40 0.12 3.45 5.04 0.21 -4.86 115.29 116.86 1y19 s HIS 228 Ca -0.11 -2.75 -0.31 0.00 -1.54 0.00 0.00 55.06 50.36 1y19 s HIS 228 Cb 0.18 -3.16 -0.10 0.00 0.04 0.00 0.00 32.58 29.54 1y19 s HIS 228 CO 0.78 -0.84 1.78 -2.14 -2.34 0.00 0.00 174.74 171.97 1y19 s PRO 229 N -0.00 4.15 0.12 2.88 0.02 -1.25 -4.56 135.00 136.35 1y19 s PRO 229 Ca 0.16 2.53 0.02 0.00 0.02 0.00 0.00 61.00 63.74 1y19 s PRO 229 Cb -0.21 -3.55 -0.04 0.00 0.02 0.00 0.00 34.50 30.72 1y19 s PRO 229 CO -0.03 -0.81 -0.06 0.14 -0.33 0.00 0.00 177.00 175.91 1y19 s VAL 230 N 2.56 0.79 0.82 3.83 -7.23 -1.26 -4.80 120.40 115.11 1y19 s VAL 230 Ca 0.79 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.87 1y19 s VAL 230 Cb -0.45 -1.78 0.08 0.00 0.56 0.00 0.00 36.38 34.80 1y19 s VAL 230 CO 0.35 -0.79 1.10 -0.94 -0.31 0.00 0.00 175.10 174.51 1y19 s SER 231 N -3.09 4.26 0.22 4.85 1.04 -1.26 -4.80 113.70 114.92 1y19 s SER 231 Ca 0.14 1.29 -0.09 0.00 0.48 0.00 0.00 55.95 57.78 1y19 s SER 231 Cb 0.05 -2.00 0.24 0.00 0.10 0.00 0.00 66.02 64.41 1y19 s SER 231 CO -0.03 -2.12 1.84 0.15 0.98 0.00 0.00 173.24 174.07 1y19 h PHE 232 N -1.19 0.82 -0.31 5.02 3.57 -1.87 -0.47 116.94 122.51 1y19 h PHE 232 Ca -0.48 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.07 1y19 h PHE 232 Cb 1.28 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 1y19 h PHE 232 CO 0.44 0.44 0.16 -0.44 -2.23 0.00 0.00 178.31 176.68 1y19 h ASP 233 N 0.84 0.25 -0.55 0.41 3.32 -1.98 -2.68 116.42 116.04 1y19 h ASP 233 Ca 0.31 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.28 1y19 h ASP 233 Cb 0.10 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1y19 h ASP 233 CO -0.14 0.19 0.00 0.11 -1.72 0.00 0.00 179.24 177.68 1y19 h LYS 234 N 0.34 1.00 -0.95 3.56 1.79 -1.81 -2.59 116.57 117.90 1y19 h LYS 234 Ca 0.12 -0.30 0.07 0.00 -2.18 0.00 0.00 60.65 58.36 1y19 h LYS 234 Cb 0.03 -0.10 -0.07 0.00 -1.58 0.00 0.00 32.23 30.51 1y19 h LYS 234 CO -0.08 0.98 0.61 0.00 -1.08 0.00 0.00 179.45 179.88 1y19 h ALA 235 N 1.08 1.33 -0.15 3.86 0.00 -0.82 -0.99 119.26 123.57 1y19 h ALA 235 Ca 0.17 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 1y19 h ALA 235 Cb 0.53 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1y19 h ALA 235 CO 0.03 0.36 -0.57 0.00 0.00 0.00 0.00 179.25 179.06 1y19 h GLU 237 N 0.35 0.39 -0.69 0.00 5.08 -0.92 0.38 114.58 119.16 1y19 h GLU 237 Ca 0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1y19 h GLU 237 Cb 1.10 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.25 1y19 h GLU 237 CO 0.10 0.33 0.39 0.74 -1.00 0.00 0.00 179.01 179.57 1y19 h PHE 238 N 0.34 0.94 -0.26 4.33 0.05 -1.09 -1.16 116.94 120.09 1y19 h PHE 238 Ca 0.10 -0.02 0.01 0.00 3.82 0.00 0.00 57.97 61.88 1y19 h PHE 238 Cb 0.06 -0.30 -0.01 0.00 2.00 0.00 0.00 35.95 37.69 1y19 h PHE 238 CO -0.03 0.66 0.17 0.00 -0.18 0.00 0.00 178.31 178.93 1y19 h ALA 239 N 1.19 1.84 0.14 2.45 0.00 -0.68 0.81 119.26 125.03 1y19 h ALA 239 Ca 0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1y19 h ALA 239 Cb 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1y19 h ALA 239 CO -0.04 0.14 -0.07 0.78 0.00 0.00 0.00 179.25 180.06 1y19 h GLY 240 N 0.33 -0.20 1.09 0.00 0.00 0.31 0.20 103.07 104.80 1y19 h GLY 240 Ca 0.10 0.07 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 1y19 h GLY 240 CO -0.02 -0.07 0.49 0.74 0.00 0.00 0.00 176.54 177.68 1y19 h PHE 241 N -0.33 1.17 -0.60 5.60 0.05 -0.93 -0.80 116.94 121.10 1y19 h PHE 241 Ca -0.02 -0.02 0.03 0.00 3.82 0.00 0.00 57.97 61.78 1y19 h PHE 241 Cb 0.26 -0.38 -0.04 0.00 2.00 0.00 0.00 35.95 37.80 1y19 h PHE 241 CO -0.02 0.80 0.36 0.37 -0.18 0.00 0.00 178.31 179.64 1y19 h GLN 242 N 1.21 0.69 -0.24 1.51 4.15 -0.47 0.92 115.11 122.88 1y19 h GLN 242 Ca 0.31 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.67 1y19 h GLN 242 Cb 0.00 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.52 1y19 h GLN 242 CO -0.05 0.46 0.10 0.00 -1.93 0.00 0.00 178.83 177.40 1y19 h GLN 244 N 0.24 0.47 -0.17 0.00 5.75 -0.63 0.27 115.11 121.04 1y19 h GLN 244 Ca 0.08 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 1y19 h GLN 244 Cb 0.17 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1y19 h GLN 244 CO -0.01 0.31 0.05 0.82 -2.65 0.00 0.00 178.83 177.35 1y19 h ILE 245 N 0.48 1.19 0.00 2.39 2.04 -0.49 0.70 117.51 123.82 1y19 h ILE 245 Ca 0.28 -0.58 -0.13 0.00 1.00 0.00 0.00 64.86 65.43 1y19 h ILE 245 Cb 0.27 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1y19 h ILE 245 CO -0.24 0.18 -0.77 1.56 0.00 0.00 0.00 178.15 178.88 1y19 h GLN 246 N 0.09 0.00 0.00 2.37 4.20 -0.84 -3.39 115.11 117.54 1y19 h GLN 246 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1y19 h GLN 246 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1y19 h GLN 246 CO -0.00 0.48 -0.88 1.19 -0.67 0.00 0.00 178.83 178.95 1y19 n PHE 247 N -3.15 0.00 -1.82 2.96 0.99 0.92 -5.08 117.46 112.28 1y19 n PHE 247 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 1y19 n PHE 247 Cb 0.77 -0.01 0.00 0.00 -1.00 0.00 0.00 39.48 39.24 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 2.26 -2.21 3.32 1.37 0.00 0.24 -4.95 105.19 105.23 1y19 n GLY 248 Ca -0.00 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.14 0.07 -2.23 1.61 -0.02 -1.26 -4.34 135.00 128.69 1y19 n PRO 249 Ca 0.00 0.03 -0.42 0.00 -2.02 0.00 0.00 63.50 61.08 1y19 n PRO 249 Cb 0.00 -1.07 -0.03 0.00 -0.02 0.00 0.00 33.50 32.39 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 -1.66 2.76 -0.25 6.00 2.46 -1.26 -5.01 115.29 118.33 1y19 s HIS 250 Ca 0.60 0.78 -0.03 0.00 0.47 0.00 0.00 55.06 56.87 1y19 s HIS 250 Cb -0.63 -3.67 0.02 0.00 -0.13 0.00 0.00 32.58 28.17 1y19 s HIS 250 CO 0.62 -2.50 -0.02 1.21 -2.47 0.00 0.00 174.74 171.58 1y19 s ASN 251 N 2.06 4.51 0.31 9.88 3.84 -1.26 -5.00 114.94 129.27 1y19 s ASN 251 Ca 0.64 -0.75 0.04 0.00 0.21 0.00 0.00 52.86 52.99 1y19 s ASN 251 Cb -0.30 -1.73 0.64 0.00 -0.55 0.00 0.00 41.25 39.30 1y19 s ASN 251 CO 0.25 -0.12 1.85 -0.33 -2.79 0.00 0.00 177.10 175.96 1y19 h GLU 252 N 8.08 0.88 0.00 0.43 4.39 -1.95 0.39 114.58 126.80 1y19 h GLU 252 Ca -0.34 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1y19 h GLU 252 Cb 1.12 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1y19 h GLU 252 CO 0.59 0.58 -0.38 1.96 -1.16 0.00 0.00 179.01 180.60 1y19 h GLN 253 N 0.90 0.00 0.00 2.33 4.20 -2.03 -3.37 115.11 117.15 1y19 h GLN 253 Ca 0.48 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.95 1y19 h GLN 253 Cb 0.54 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1y19 h GLN 253 CO -0.24 0.00 -1.88 1.17 -0.67 0.00 0.00 178.83 177.21 1y19 n LYS 254 N -2.33 1.51 -3.45 1.46 4.81 -0.96 -4.79 118.16 114.42 1y19 n LYS 254 Ca 0.04 0.02 -0.40 0.00 -0.87 0.00 0.00 58.31 57.10 1y19 n LYS 254 Cb 0.46 -1.32 -0.03 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 -2.61 4.39 -4.36 5.64 8.25 0.13 -5.00 115.22 121.67 1y19 n HIS 255 Ca -0.23 -3.88 -0.24 0.00 -0.26 0.00 0.00 57.72 53.11 1y19 n HIS 255 Cb 0.88 -1.34 -0.09 0.00 1.12 0.00 0.00 29.99 30.56 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 -1.57 2.04 0.12 -0.41 -2.85 -1.26 -4.68 119.74 111.13 1y19 s LYS 256 Ca 0.30 -1.69 -0.26 0.00 -1.00 0.00 0.00 55.97 53.32 1y19 s LYS 256 Cb -0.06 -1.94 -0.15 0.00 -2.06 0.00 0.00 37.83 33.63 1y19 s LYS 256 CO -0.08 0.22 0.55 0.00 0.10 0.00 0.00 175.35 176.14 1y19 n ALA 257 N -0.87 -2.71 -0.55 0.59 0.00 -1.26 -0.79 120.51 114.92 1y19 n ALA 257 Ca -0.05 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1y19 n ALA 257 Cb 0.61 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 1.56 1.32 0.13 0.00 0.00 -1.26 -4.89 105.19 102.06 1y19 n GLY 258 Ca 0.15 0.00 -0.06 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 0.20 -3.39 1.61 3.57 -1.35 -3.44 116.94 114.15 1y19 h PHE 259 Ca 0.00 -0.10 -0.60 0.00 3.53 0.00 0.00 57.97 60.80 1y19 h PHE 259 Cb 0.00 -0.03 -0.11 0.00 2.79 0.00 0.00 35.95 38.60 1y19 h PHE 259 CO 0.00 0.85 -0.31 -0.51 -2.23 0.00 0.00 178.31 176.11 1y19 s LEU 260 N -7.53 4.20 -1.11 0.59 1.43 -1.26 -5.00 118.68 109.99 1y19 s LEU 260 Ca -0.02 0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 53.35 1y19 s LEU 260 Cb 0.11 -2.39 0.08 0.00 0.03 0.00 0.00 46.19 44.03 1y19 s LEU 260 CO 0.81 0.04 1.48 -0.62 0.23 0.00 0.00 176.35 178.29 1y19 s ASP 261 N 0.72 6.70 0.64 2.29 2.15 -1.26 -4.84 116.67 123.07 1y19 s ASP 261 Ca 0.16 -2.04 0.13 0.00 0.43 0.00 0.00 52.55 51.23 1y19 s ASP 261 Cb -0.14 -2.52 0.54 0.00 -0.30 0.00 0.00 42.92 40.50 1y19 s ASP 261 CO 0.05 -1.24 1.25 -0.07 -0.17 0.00 0.00 175.17 174.99 1y19 h LEU 262 N 11.96 0.00 -1.25 -1.34 3.38 -1.94 0.31 115.31 126.43 1y19 h LEU 262 Ca 0.28 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.18 1y19 h LEU 262 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1y19 h LEU 262 CO 1.36 0.00 -0.37 0.11 0.09 0.00 0.00 178.44 179.64 1y19 h LYS 263 N 0.00 0.00 -0.32 1.13 1.57 -1.88 -2.34 116.57 114.73 1y19 h LYS 263 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 1y19 h LYS 263 Cb 2.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.36 1y19 h LYS 263 CO -0.00 0.37 0.00 -0.25 -0.57 0.00 0.00 179.45 178.99 1y19 n ASP 264 N -3.98 2.65 0.00 0.86 8.00 0.11 -4.34 116.55 119.86 1y19 n ASP 264 Ca -0.02 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.60 1y19 n ASP 264 Cb 0.42 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 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 0.96 0.00 -3.95 1.24 3.72 -1.07 -5.08 117.46 113.28 1y19 n PHE 265 Ca 0.18 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.48 1y19 n PHE 265 Cb 0.47 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.91 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 -0.61 1.98 0.73 4.37 1.43 -0.90 -4.38 118.68 121.31 1y19 s LEU 266 Ca 0.00 -0.51 -0.15 0.00 -1.03 0.00 0.00 54.13 52.44 1y19 s LEU 266 Cb 0.00 0.41 0.04 0.00 0.03 0.00 0.00 46.19 46.67 1y19 s LEU 266 CO 0.00 -0.42 1.20 -2.84 0.23 0.00 0.00 176.35 174.52 1y19 s PRO 267 N -2.15 2.12 0.14 1.29 0.02 -1.26 -4.76 135.00 130.40 1y19 s PRO 267 Ca -0.09 1.75 -0.32 0.00 0.02 0.00 0.00 61.00 62.36 1y19 s PRO 267 Cb -0.04 -1.83 -0.08 0.00 0.02 0.00 0.00 34.50 32.57 1y19 s PRO 267 CO -0.03 -1.85 1.55 0.87 -0.33 0.00 0.00 177.00 177.21 1y19 h LYS 268 N -0.34 -0.31 0.00 5.54 1.57 -1.92 -0.80 116.57 120.32 1y19 h LYS 268 Ca -0.47 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1y19 h LYS 268 Cb 1.29 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.67 1y19 h LYS 268 CO 0.50 -0.20 0.36 -0.85 -0.57 0.00 0.00 179.45 178.68 1y19 n GLU 269 N -5.36 0.07 0.00 3.15 0.28 -1.26 -1.05 120.64 116.46 1y19 n GLU 269 Ca -0.02 0.51 0.05 0.00 -0.16 0.00 0.00 57.16 57.55 1y19 n GLU 269 Cb 0.33 -2.08 -0.00 0.00 1.43 0.00 0.00 31.44 31.13 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 -1.90 0.00 0.03 -1.84 0.53 -0.31 -4.72 117.16 108.94 1y19 n TYR 270 Ca -0.01 0.00 -0.10 0.00 -1.02 0.00 0.00 57.90 56.77 1y19 n TYR 270 Cb 0.37 0.00 -0.04 0.00 -1.03 0.00 0.00 39.34 38.64 1y19 n TYR 270 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1y19 h VAL 271 N 1.21 0.56 -0.11 -0.72 2.07 -0.99 -2.58 116.25 115.69 1y19 h VAL 271 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1y19 h VAL 271 Cb 0.37 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1y19 h VAL 271 CO 0.00 0.00 0.09 2.29 0.02 0.00 0.00 177.57 179.97 1y19 n LYS 272 N -5.31 1.17 -0.03 1.57 2.85 -1.26 -4.01 118.16 113.13 1y19 n LYS 272 Ca -0.04 -0.36 0.08 0.00 -1.05 0.00 0.00 58.31 56.94 1y19 n LYS 272 Cb 0.23 -1.14 0.09 0.00 -0.65 0.00 0.00 35.03 33.55 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 0.74 1.44 -3.75 -1.58 1.13 -0.97 -5.00 117.38 109.39 1y19 n GLN 273 Ca 0.07 -1.57 -0.25 0.00 -1.94 0.00 0.00 57.00 53.31 1y19 n GLN 273 Cb 0.58 -1.32 0.02 0.00 0.11 0.00 0.00 30.24 29.63 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 0.91 -3.32 -0.72 -1.09 4.76 -1.26 -4.89 118.16 112.56 1y19 n LYS 274 Ca 0.10 0.52 0.08 0.00 -2.87 0.00 0.00 58.31 56.14 1y19 n LYS 274 Cb 0.42 -4.74 0.35 0.00 -1.84 0.00 0.00 35.03 29.22 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 -1.71 3.45 0.23 0.72 0.00 -1.26 -4.50 105.19 102.12 1y19 n GLY 275 Ca -0.24 -0.98 0.05 0.00 0.00 0.00 0.00 46.02 44.85 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 3.08 0.06 -0.13 1.61 4.81 -1.96 -1.44 114.58 120.62 1y19 h GLU 276 Ca 0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1y19 h GLU 276 Cb 1.77 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.14 1y19 h GLU 276 CO 0.39 0.22 -0.02 0.00 -0.73 0.00 0.00 179.01 178.86 1y19 h ARG 277 N 0.06 0.24 -0.75 1.92 2.47 -1.99 -1.22 114.38 115.11 1y19 h ARG 277 Ca 0.01 -0.09 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1y19 h ARG 277 Cb 0.30 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.57 1y19 h ARG 277 CO 0.02 0.52 0.44 0.87 0.56 0.00 0.00 179.97 182.39 1y19 h LYS 278 N -0.06 1.02 -0.28 0.04 1.57 -1.76 0.25 116.57 117.35 1y19 h LYS 278 Ca 0.03 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1y19 h LYS 278 Cb 0.43 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1y19 h LYS 278 CO 0.01 0.72 0.01 0.82 -0.57 0.00 0.00 179.45 180.45 1y19 h ILE 279 N 1.04 1.25 0.00 1.86 2.04 -1.16 -1.29 117.51 121.25 1y19 h ILE 279 Ca 0.27 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 1y19 h ILE 279 Cb -0.03 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1y19 h ILE 279 CO -0.05 0.28 -0.24 -0.26 0.00 0.00 0.00 178.15 177.88 1y19 h PHE 280 N 0.27 0.00 -0.40 1.37 0.05 -0.76 0.13 116.94 117.60 1y19 h PHE 280 Ca 0.08 0.00 -0.14 0.00 3.82 0.00 0.00 57.97 61.73 1y19 h PHE 280 Cb 0.40 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.34 1y19 h PHE 280 CO 0.03 0.24 -0.29 0.37 -0.18 0.00 0.00 178.31 178.48 1y19 h GLN 281 N 0.00 0.87 -0.05 1.51 5.75 -0.55 0.12 115.11 122.77 1y19 h GLN 281 Ca -0.00 -0.40 -0.19 0.00 -0.15 0.00 0.00 58.65 57.91 1y19 h GLN 281 Cb 0.50 -0.02 0.01 0.00 1.07 0.00 0.00 27.48 29.04 1y19 h GLN 281 CO 0.03 1.04 -0.70 0.00 -2.65 0.00 0.00 178.83 176.55 1y19 h ALA 282 N 0.93 0.15 -0.08 3.38 0.00 -0.61 -2.53 119.26 120.49 1y19 h ALA 282 Ca 0.08 -0.59 0.03 0.00 0.00 0.00 0.00 54.91 54.43 1y19 h ALA 282 Cb 0.84 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1y19 h ALA 282 CO 0.07 0.48 -0.09 1.25 0.00 0.00 0.00 179.25 180.97 1y19 h HIS 283 N 0.15 -0.21 -0.99 0.00 -0.00 -0.66 -2.41 115.15 111.03 1y19 h HIS 283 Ca -0.08 0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.36 1y19 h HIS 283 Cb 1.38 0.11 -0.06 0.00 -0.00 0.00 0.00 27.41 28.83 1y19 h HIS 283 CO 0.12 -0.13 0.65 -0.22 -0.00 0.00 0.00 177.93 178.35 1y19 h LYS 284 N -0.11 1.19 0.00 5.26 3.64 -0.79 -0.85 116.57 124.90 1y19 h LYS 284 Ca 0.06 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1y19 h LYS 284 Cb 0.20 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1y19 h LYS 284 CO -0.15 0.79 0.00 -0.91 -2.27 0.00 0.00 179.45 176.91 1y19 h ASN 285 N 1.22 0.00 0.69 4.20 2.35 -0.98 -2.45 115.58 120.61 1y19 h ASN 285 Ca 0.41 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.16 1y19 h ASN 285 Cb 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1y19 h ASN 285 CO -0.14 0.00 -0.01 0.00 -1.65 0.00 0.00 177.43 175.62 1y19 n GLY 287 N -0.32 2.88 1.74 0.00 0.00 -0.93 -2.02 105.19 106.54 1y19 n GLY 287 Ca -0.01 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.78 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 13.58 3.94 -1.61 1.61 1.13 -1.26 -4.39 117.38 130.38 1y19 n GLN 288 Ca 0.00 -3.09 -0.48 0.00 -1.94 0.00 0.00 57.00 51.49 1y19 n GLN 288 Cb 0.00 -2.16 -0.04 0.00 0.11 0.00 0.00 30.24 28.15 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 0.01 1.49 -1.66 -1.09 1.56 -0.86 -4.95 117.12 111.62 1y19 n MET 289 Ca 0.33 0.53 -0.30 0.00 -0.27 0.00 0.00 57.70 57.99 1y19 n MET 289 Cb 1.23 -2.11 0.09 0.00 2.15 0.00 0.00 33.22 34.58 1y19 n MET 289 CO 0.00 0.00 0.00 -1.54 -0.73 0.00 0.00 175.97 173.70 1y19 s SER 290 N 0.20 4.50 0.17 6.12 1.04 -1.26 -4.73 113.70 119.73 1y19 s SER 290 Ca 0.73 1.13 -0.13 0.00 0.48 0.00 0.00 55.95 58.16 1y19 s SER 290 Cb -0.79 -1.82 0.07 0.00 0.10 0.00 0.00 66.02 63.58 1y19 s SER 290 CO 0.50 -1.95 1.76 -0.08 0.98 0.00 0.00 173.24 174.46 1y19 h GLU 291 N -1.08 0.80 -0.76 4.02 4.81 -1.91 0.25 114.58 120.71 1y19 h GLU 291 Ca -0.47 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 58.66 1y19 h GLU 291 Cb 1.29 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.48 1y19 h GLU 291 CO 0.62 0.64 0.50 0.82 -0.73 0.00 0.00 179.01 180.86 1y19 h ILE 292 N 0.76 1.18 -0.25 2.32 1.08 -1.98 0.62 117.51 121.24 1y19 h ILE 292 Ca 0.20 -0.35 -0.12 0.00 -0.39 0.00 0.00 64.86 64.20 1y19 h ILE 292 Cb 0.09 0.08 -0.00 0.00 -3.07 0.00 0.00 36.82 33.92 1y19 h ILE 292 CO -0.03 0.18 -0.32 -0.08 -0.69 0.00 0.00 178.15 177.22 1y19 h GLU 293 N 1.01 0.66 -0.95 2.37 4.81 -1.86 -1.64 114.58 118.99 1y19 h GLU 293 Ca 0.29 -0.38 0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1y19 h GLU 293 Cb -0.09 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.26 1y19 h GLU 293 CO -0.07 0.99 0.61 0.00 -0.73 0.00 0.00 179.01 179.81 1y19 h ALA 294 N 0.66 1.27 -0.53 2.92 0.00 -0.55 -1.30 119.26 121.74 1y19 h ALA 294 Ca 0.03 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1y19 h ALA 294 Cb 0.90 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1y19 h ALA 294 CO 0.08 0.46 -0.10 0.87 0.00 0.00 0.00 179.25 180.56 1y19 h LYS 295 N 1.16 0.98 0.06 0.00 1.57 -0.75 -2.10 116.57 117.50 1y19 h LYS 295 Ca 0.39 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1y19 h LYS 295 Cb 0.05 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1y19 h LYS 295 CO -0.14 1.02 -0.03 0.28 -0.57 0.00 0.00 179.45 180.02 1y19 h VAL 296 N 0.88 0.96 -0.34 0.50 2.07 -0.49 -2.57 116.25 117.26 1y19 h VAL 296 Ca 0.14 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.57 1y19 h VAL 296 Cb 0.65 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1y19 h VAL 296 CO 0.04 0.02 0.07 0.03 0.02 0.00 0.00 177.57 177.75 1y19 h ARG 297 N -0.11 0.49 0.33 1.57 3.08 -1.23 -1.72 114.38 116.80 1y19 h ARG 297 Ca -0.01 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1y19 h ARG 297 Cb 0.09 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1y19 h ARG 297 CO 0.01 0.47 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.30 1y19 h TYR 298 N 0.49 -0.41 -0.48 3.04 3.20 -1.16 0.18 116.97 121.82 1y19 h TYR 298 Ca 0.11 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1y19 h TYR 298 Cb 0.21 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1y19 h TYR 298 CO 0.01 -0.21 0.28 0.28 -1.64 0.00 0.00 178.16 176.88 1y19 h VAL 299 N -0.51 1.15 -0.69 1.81 2.07 -1.24 -0.35 116.25 118.49 1y19 h VAL 299 Ca -0.05 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 1y19 h VAL 299 Cb 0.39 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 1y19 h VAL 299 CO 0.07 0.15 0.24 0.11 0.02 0.00 0.00 177.57 178.17 1y19 h LYS 300 N 0.64 1.03 -0.29 1.57 1.57 -1.25 0.74 116.57 120.58 1y19 h LYS 300 Ca 0.17 -0.19 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1y19 h LYS 300 Cb -0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1y19 h LYS 300 CO -0.03 0.86 0.01 1.25 -0.57 0.00 0.00 179.45 180.97 1y19 h LEU 301 N 1.00 0.48 -1.08 2.94 5.85 -0.59 -1.19 115.31 122.72 1y19 h LEU 301 Ca 0.23 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.59 1y19 h LEU 301 Cb 0.24 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1y19 h LEU 301 CO -0.01 0.66 0.02 0.00 -0.34 0.00 0.00 178.44 178.77 1y19 h ALA 302 N 0.84 1.25 0.00 1.25 0.00 -0.72 -2.86 119.26 119.02 1y19 h ALA 302 Ca 0.08 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1y19 h ALA 302 Cb 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1y19 h ALA 302 CO 0.01 0.51 -0.42 0.00 0.00 0.00 0.00 179.25 179.35 1y19 h ARG 303 N 0.64 0.00 0.00 0.00 3.08 -0.71 -3.20 114.38 114.20 1y19 h ARG 303 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1y19 h ARG 303 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1y19 h ARG 303 CO 0.01 0.42 0.00 -1.13 -1.07 0.00 0.00 179.97 178.20 1y19 n SER 304 N -3.29 0.00 -4.81 7.04 3.41 -0.46 -4.85 113.62 110.66 1y19 n SER 304 Ca 0.01 -0.22 -0.34 0.00 -0.26 0.00 0.00 58.87 58.06 1y19 n SER 304 Cb 0.64 -0.25 -0.07 0.00 -0.26 0.00 0.00 64.21 64.27 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 -2.51 4.08 0.42 1.04 1.43 -1.21 -4.96 118.68 116.98 1y19 s LEU 305 Ca 0.30 1.70 0.17 0.00 -1.03 0.00 0.00 54.13 55.27 1y19 s LEU 305 Cb 0.20 -4.32 0.92 0.00 0.03 0.00 0.00 46.19 43.02 1y19 s LEU 305 CO 0.43 -0.25 1.89 0.50 0.23 0.00 0.00 176.35 179.16 1y19 h LYS 306 N 2.36 0.00 -0.01 1.70 1.63 -1.91 -2.57 116.57 117.77 1y19 h LYS 306 Ca -0.48 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.32 1y19 h LYS 306 Cb 1.18 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.81 1y19 h LYS 306 CO 0.63 0.29 -0.05 0.25 -3.45 0.00 0.00 179.45 177.12 1y19 n THR 307 N -3.92 0.00 -2.15 1.00 -2.24 -1.26 -4.84 114.28 100.86 1y19 n THR 307 Ca -0.02 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.22 1y19 n THR 307 Cb 0.36 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 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 -2.15 3.14 -1.72 4.78 5.04 -0.97 -3.13 117.35 122.34 1y19 s TYR 308 Ca 0.37 1.33 0.00 0.00 -2.44 0.00 0.00 57.07 56.33 1y19 s TYR 308 Cb 0.21 -3.65 0.00 0.00 0.35 0.00 0.00 41.96 38.87 1y19 s TYR 308 CO 0.39 -1.88 0.00 0.41 -1.34 0.00 0.00 175.55 173.13 1y19 n GLY 309 N 1.43 0.37 3.49 8.97 0.00 -1.26 -4.97 105.19 113.22 1y19 n GLY 309 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.78 3.90 -0.28 1.61 1.01 -1.18 -4.94 120.40 117.73 1y19 s VAL 310 Ca 0.00 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1y19 s VAL 310 Cb 0.00 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.67 1y19 s VAL 310 CO 0.00 0.49 1.18 -0.44 0.00 0.00 0.00 175.10 176.33 1y19 s SER 311 N 0.43 6.86 0.06 3.32 0.01 -0.99 -4.84 113.70 118.53 1y19 s SER 311 Ca -0.04 1.24 0.03 0.00 1.31 0.00 0.00 55.95 58.49 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 0.03 -0.91 0.04 -0.36 0.41 0.00 0.00 173.24 172.44 1y19 s PHE 312 N 3.85 3.11 -0.03 2.43 0.40 -1.26 -0.20 117.98 126.28 1y19 s PHE 312 Ca 0.51 0.06 0.01 0.00 -0.60 0.00 0.00 56.93 56.91 1y19 s PHE 312 Cb -0.16 -1.61 0.01 0.00 0.51 0.00 0.00 43.02 41.77 1y19 s PHE 312 CO 0.17 0.50 -0.05 -0.06 0.70 0.00 0.00 175.22 176.48 1y19 s PHE 313 N -1.29 0.67 -0.46 0.36 0.40 0.10 -4.95 117.98 112.81 1y19 s PHE 313 Ca 0.26 -0.16 -0.26 0.00 -0.60 0.00 0.00 56.93 56.17 1y19 s PHE 313 Cb -0.12 -0.56 0.03 0.00 0.51 0.00 0.00 43.02 42.88 1y19 s PHE 313 CO 0.18 -0.12 0.93 -1.17 0.70 0.00 0.00 175.22 175.74 1y19 s LEU 314 N 0.56 3.99 0.00 -0.37 2.96 -1.26 -0.88 118.68 123.67 1y19 s LEU 314 Ca -0.07 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1y19 s LEU 314 Cb -0.11 -3.21 0.01 0.00 0.50 0.00 0.00 46.19 43.38 1y19 s LEU 314 CO 0.00 -1.05 0.04 1.33 -1.32 0.00 0.00 176.35 175.35 1y19 n VAL 315 N 6.42 0.00 -3.97 1.68 0.24 -0.17 -4.92 118.33 117.60 1y19 n VAL 315 Ca 0.06 -0.92 -0.16 0.00 -2.04 0.00 0.00 64.34 61.28 1y19 n VAL 315 Cb 0.48 0.05 -0.16 0.00 -1.47 0.00 0.00 33.84 32.75 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 -2.77 0.32 -0.16 7.34 1.02 -1.06 -0.82 119.74 123.62 1y19 s LYS 316 Ca 0.03 0.02 -0.06 0.00 0.02 0.00 0.00 55.97 55.98 1y19 s LYS 316 Cb -0.00 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 1y19 s LYS 316 CO 0.02 -0.08 0.03 -1.21 -0.92 0.00 0.00 175.35 173.20 1y19 s GLU 317 N 0.73 3.77 -0.38 1.68 2.02 0.40 -1.29 118.70 125.63 1y19 s GLU 317 Ca -0.07 -0.39 -0.11 0.00 0.02 0.00 0.00 54.97 54.42 1y19 s GLU 317 Cb -0.11 -3.09 0.03 0.00 0.10 0.00 0.00 34.13 31.06 1y19 s GLU 317 CO -0.01 0.34 0.22 0.21 0.02 0.00 0.00 175.26 176.04 1y19 s LYS 318 N 0.17 2.82 0.00 1.61 2.47 -1.26 0.13 119.74 125.67 1y19 s LYS 318 Ca 0.03 -1.11 0.00 0.00 -1.56 0.00 0.00 55.97 53.33 1y19 s LYS 318 Cb -0.13 -3.77 0.00 0.00 -1.46 0.00 0.00 37.83 32.47 1y19 s LYS 318 CO 0.01 -0.73 0.00 -1.33 0.16 0.00 0.00 175.35 173.46 1y19 n MET 319 N 5.02 1.46 -0.66 4.03 2.81 -1.26 -5.06 117.12 123.46 1y19 n MET 319 Ca -0.12 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.68 1y19 n MET 319 Cb 0.46 0.00 0.07 0.00 -0.71 0.00 0.00 33.22 33.03 1y19 n MET 319 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1y19 n LYS 320 N 0.00 -0.39 0.00 0.03 4.01 -1.26 -4.30 118.16 116.24 1y19 n LYS 320 Ca 0.00 -0.69 0.00 0.00 -0.51 0.00 0.00 58.31 57.11 1y19 n LYS 320 Cb 0.00 -0.44 0.00 0.00 -0.51 0.00 0.00 35.03 34.08 1y19 n LYS 320 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1y19 n GLY 321 N 2.13 2.71 1.65 0.72 0.00 -1.26 -4.88 105.19 106.27 1y19 n GLY 321 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.29 0.27 0.00 1.61 2.85 -1.26 -5.02 118.16 116.32 1y19 n LYS 322 Ca 0.00 -0.62 0.07 0.00 -1.05 0.00 0.00 58.31 56.71 1y19 n LYS 322 Cb 0.00 0.84 -0.01 0.00 -0.65 0.00 0.00 35.03 35.21 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 -0.87 1.35 -4.81 -5.58 0.23 -1.26 -4.74 115.26 99.59 1y19 n ASN 323 Ca -0.01 -1.18 -0.35 0.00 -0.53 0.00 0.00 54.58 52.51 1y19 n ASN 323 Cb 0.25 0.53 -0.06 0.00 -2.08 0.00 0.00 39.78 38.42 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 -1.74 4.33 0.03 -3.83 2.20 -1.26 -5.00 119.74 114.47 1y19 s LYS 324 Ca 0.10 1.06 -0.21 0.00 -0.36 0.00 0.00 55.97 56.56 1y19 s LYS 324 Cb 0.11 -2.66 -0.06 0.00 -1.51 0.00 0.00 37.83 33.71 1y19 s LYS 324 CO 0.36 0.24 0.63 -0.51 -0.36 0.00 0.00 175.35 175.71 1y19 s LEU 325 N -2.37 4.45 -0.38 5.43 1.02 -1.26 -4.61 118.68 120.96 1y19 s LEU 325 Ca 0.51 1.25 -0.18 0.00 0.02 0.00 0.00 54.13 55.72 1y19 s LEU 325 Cb -0.15 -2.99 0.00 0.00 0.02 0.00 0.00 46.19 43.08 1y19 s LEU 325 CO 0.20 0.12 0.52 -0.69 0.02 0.00 0.00 176.35 176.52 1y19 s VAL 326 N -0.37 5.00 0.30 -1.59 1.01 0.12 -4.81 120.40 120.05 1y19 s VAL 326 Ca 0.32 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 1y19 s VAL 326 Cb -0.19 -4.01 -0.12 0.00 0.00 0.00 0.00 36.38 32.06 1y19 s VAL 326 CO 0.19 -0.31 1.54 -2.65 0.00 0.00 0.00 175.10 173.87 1y19 n PRO 327 N 5.80 2.58 -4.11 2.72 -0.02 -1.26 -0.45 135.00 140.25 1y19 n PRO 327 Ca -0.05 0.91 -0.09 0.00 -2.02 0.00 0.00 63.50 62.25 1y19 n PRO 327 Cb 0.48 -2.66 -0.10 0.00 -0.02 0.00 0.00 33.50 31.20 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 -0.74 0.67 -0.26 -0.52 6.06 0.00 -4.44 118.95 119.72 1y19 s ARG 328 Ca 0.63 -1.16 -0.09 0.00 -2.50 0.00 0.00 55.73 52.61 1y19 s ARG 328 Cb -0.52 -0.03 -0.04 0.00 0.06 0.00 0.00 34.95 34.42 1y19 s ARG 328 CO 0.51 -0.05 0.13 -0.51 -2.50 0.00 0.00 175.30 172.88 1y19 s LEU 329 N -2.69 3.76 -0.35 -0.88 1.43 -0.57 -1.00 118.68 118.38 1y19 s LEU 329 Ca 0.05 -0.08 -0.10 0.00 -1.03 0.00 0.00 54.13 52.98 1y19 s LEU 329 Cb 0.03 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.25 1y19 s LEU 329 CO -0.06 -0.02 0.17 -0.22 0.23 0.00 0.00 176.35 176.46 1y19 s LEU 330 N 1.52 4.49 -0.12 1.79 2.96 -0.06 -0.33 118.68 128.94 1y19 s LEU 330 Ca 0.06 -0.92 -0.05 0.00 -0.22 0.00 0.00 54.13 53.00 1y19 s LEU 330 Cb -0.15 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 1y19 s LEU 330 CO 0.06 -0.33 0.08 -0.83 -1.32 0.00 0.00 176.35 174.01 1y19 s GLY 331 N 1.53 2.00 -0.07 7.98 0.00 -0.68 -0.73 107.32 117.36 1y19 s GLY 331 Ca 0.02 -0.72 0.04 0.00 0.00 0.00 0.00 44.72 44.06 1y19 s GLY 331 CO 0.06 -0.37 -0.20 -0.42 0.00 0.00 0.00 173.10 172.17 1y19 s ILE 332 N -0.72 1.71 0.40 0.90 -1.09 0.72 -0.46 121.20 122.65 1y19 s ILE 332 Ca 0.12 -0.84 0.04 0.00 -2.23 0.00 0.00 60.65 57.74 1y19 s ILE 332 Cb -0.12 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 39.24 1y19 s ILE 332 CO 0.03 0.48 0.05 0.42 -1.23 0.00 0.00 174.94 174.69 1y19 s THR 333 N 0.25 1.21 -1.94 2.92 -4.23 0.11 -2.36 115.64 111.59 1y19 s THR 333 Ca -0.12 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 58.58 1y19 s THR 333 Cb -0.15 -2.59 0.50 0.00 1.34 0.00 0.00 72.50 71.60 1y19 s THR 333 CO 0.05 0.00 1.50 2.29 -0.54 0.00 0.00 174.62 177.92 1y19 n LYS 334 N -0.93 0.54 0.00 3.99 2.85 -1.26 -3.22 118.16 120.13 1y19 n LYS 334 Ca -0.07 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 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 -1.03 0.00 -3.55 -1.58 0.28 -1.26 -4.84 120.64 108.65 1y19 n GLU 335 Ca 0.13 -0.15 -0.07 0.00 -0.16 0.00 0.00 57.16 56.92 1y19 n GLU 335 Cb 0.07 -0.41 -0.02 0.00 1.43 0.00 0.00 31.44 32.52 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 -2.92 2.35 0.11 0.00 1.01 0.51 0.05 120.40 121.51 1y19 s VAL 337 Ca 0.07 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.16 1y19 s VAL 337 Cb -0.01 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1y19 s VAL 337 CO -0.07 0.56 -0.12 0.00 0.00 0.00 0.00 175.10 175.47 1y19 s MET 338 N 0.00 0.95 -0.27 2.72 0.23 0.39 0.62 119.30 123.94 1y19 s MET 338 Ca -0.07 -1.21 -0.07 0.00 -1.03 0.00 0.00 55.69 53.31 1y19 s MET 338 Cb -0.15 -0.74 -0.00 0.00 -1.53 0.00 0.00 34.83 32.40 1y19 s MET 338 CO 0.05 0.13 0.06 1.03 -2.03 0.00 0.00 175.02 174.27 1y19 s ARG 339 N -2.75 3.30 -0.07 3.16 0.52 0.12 -1.68 118.95 121.55 1y19 s ARG 339 Ca 0.08 -0.71 0.05 0.00 -0.52 0.00 0.00 55.73 54.62 1y19 s ARG 339 Cb -0.04 -3.32 -0.01 0.00 0.52 0.00 0.00 34.95 32.10 1y19 s ARG 339 CO 0.02 -0.34 -0.21 0.08 0.02 0.00 0.00 175.30 174.87 1y19 s VAL 340 N 1.53 2.39 0.10 3.52 1.01 0.56 0.47 120.40 129.99 1y19 s VAL 340 Ca 0.04 -0.94 -0.33 0.00 0.00 0.00 0.00 61.98 60.75 1y19 s VAL 340 Cb -0.16 -1.91 -0.12 0.00 0.00 0.00 0.00 36.38 34.19 1y19 s VAL 340 CO 0.02 0.57 1.75 -0.67 0.00 0.00 0.00 175.10 176.77 1y19 n ASP 341 N 2.94 3.60 0.30 3.32 -0.08 0.88 -1.51 116.55 126.00 1y19 n ASP 341 Ca -0.18 1.02 0.16 0.00 -1.51 0.00 0.00 54.79 54.29 1y19 n ASP 341 Cb 0.52 -1.47 0.92 0.00 2.34 0.00 0.00 41.12 43.43 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 7.67 0.00 0.00 -0.67 4.22 -1.91 -1.23 114.58 122.66 1y19 h GLU 342 Ca -0.46 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.98 1y19 h GLU 342 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1y19 h GLU 342 CO 0.93 0.03 -0.38 1.17 -2.18 0.00 0.00 179.01 178.58 1y19 n LYS 343 N -3.64 0.20 0.13 1.92 4.81 -1.26 -4.67 118.16 115.66 1y19 n LYS 343 Ca -0.03 0.08 0.12 0.00 -0.87 0.00 0.00 58.31 57.61 1y19 n LYS 343 Cb 0.12 -0.78 0.49 0.00 0.02 0.00 0.00 35.03 34.89 1y19 n LYS 343 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1y19 n THR 344 N -3.47 0.81 -1.57 3.15 -2.24 -1.26 -4.72 114.28 104.97 1y19 n THR 344 Ca -0.05 0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.74 1y19 n THR 344 Cb 0.20 -1.13 -0.07 0.00 -2.10 0.00 0.00 70.33 67.23 1y19 n THR 344 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1y19 n LYS 345 N -2.26 -1.25 -3.04 -0.78 4.76 -0.46 -4.39 118.16 110.73 1y19 n LYS 345 Ca 0.02 1.11 -0.36 0.00 -2.87 0.00 0.00 58.31 56.22 1y19 n LYS 345 Cb 0.24 -5.38 -0.06 0.00 -1.84 0.00 0.00 35.03 27.99 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 -3.61 4.26 -0.59 1.97 0.41 -1.26 -4.62 118.70 115.27 1y19 s GLU 346 Ca 0.00 0.92 -0.28 0.00 -0.41 0.00 0.00 54.97 55.20 1y19 s GLU 346 Cb 0.00 -2.76 0.03 0.00 -1.78 0.00 0.00 34.13 29.62 1y19 s GLU 346 CO 0.00 0.32 1.21 0.08 -0.49 0.00 0.00 175.26 176.37 1y19 s VAL 347 N -1.64 3.99 0.02 2.63 1.01 -1.26 -0.08 120.40 125.07 1y19 s VAL 347 Ca 0.47 0.87 -0.22 0.00 0.00 0.00 0.00 61.98 63.10 1y19 s VAL 347 Cb -0.16 -4.73 -0.16 0.00 0.00 0.00 0.00 36.38 31.33 1y19 s VAL 347 CO 0.20 -1.37 1.33 0.40 0.00 0.00 0.00 175.10 175.66 1y19 h ILE 348 N 6.16 1.35 -2.82 2.22 2.04 -0.34 -3.46 117.51 122.66 1y19 h ILE 348 Ca -0.25 -1.24 -0.12 0.00 1.00 0.00 0.00 64.86 64.25 1y19 h ILE 348 Cb 1.06 1.94 -0.23 0.00 -0.74 0.00 0.00 36.82 38.85 1y19 h ILE 348 CO 1.19 0.35 -0.25 -1.58 0.00 0.00 0.00 178.15 177.86 1y19 s GLN 349 N -4.32 0.51 -0.05 2.37 0.74 -1.20 -5.00 119.66 112.72 1y19 s GLN 349 Ca -0.15 0.38 0.03 0.00 0.05 0.00 0.00 55.36 55.67 1y19 s GLN 349 Cb 0.04 0.24 0.01 0.00 1.10 0.00 0.00 33.01 34.40 1y19 s GLN 349 CO 0.73 -0.09 -0.12 -2.00 -0.55 0.00 0.00 175.29 173.26 1y19 s GLU 350 N -0.15 1.51 0.05 1.67 2.12 -1.26 0.13 118.70 122.77 1y19 s GLU 350 Ca -0.03 -0.42 0.07 0.00 0.36 0.00 0.00 54.97 54.95 1y19 s GLU 350 Cb -0.03 -1.29 -0.03 0.00 0.26 0.00 0.00 34.13 33.03 1y19 s GLU 350 CO 0.02 0.09 -0.17 -1.58 -0.54 0.00 0.00 175.26 173.08 1y19 s TRP 351 N 0.42 2.59 -0.10 5.30 0.51 0.20 -4.99 118.94 122.88 1y19 s TRP 351 Ca -0.09 -0.23 -0.19 0.00 -2.12 0.00 0.00 56.10 53.46 1y19 s TRP 351 Cb -0.13 -1.46 -0.04 0.00 -0.81 0.00 0.00 33.47 31.03 1y19 s TRP 351 CO 0.02 0.29 0.52 0.45 -0.51 0.00 0.00 176.95 177.72 1y19 s SER 352 N -1.59 6.76 0.58 2.95 0.15 -1.26 -0.36 113.70 120.92 1y19 s SER 352 Ca 0.16 0.90 0.31 0.00 0.70 0.00 0.00 55.95 58.02 1y19 s SER 352 Cb -0.11 -2.31 1.40 0.00 -1.71 0.00 0.00 66.02 63.30 1y19 s SER 352 CO 0.07 0.00 1.77 -0.07 1.20 0.00 0.00 173.24 176.21 1y19 h LEU 353 N 6.57 0.00 -0.05 3.45 3.38 -1.84 0.45 115.31 127.26 1y19 h LEU 353 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1y19 h LEU 353 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1y19 h LEU 353 CO 0.75 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.63 1y19 n THR 354 N -3.76 0.63 1.14 0.22 -2.24 -1.26 -2.53 114.28 106.48 1y19 n THR 354 Ca 0.16 0.14 0.13 0.00 -2.27 0.00 0.00 64.05 62.20 1y19 n THR 354 Cb 0.99 -0.82 0.29 0.00 -2.10 0.00 0.00 70.33 68.68 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 -1.58 2.38 -4.66 3.42 3.02 0.16 -4.88 115.26 113.11 1y19 n ASN 355 Ca 0.05 -1.79 -0.42 0.00 -0.03 0.00 0.00 54.58 52.39 1y19 n ASN 355 Cb 0.24 -0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.35 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 -1.94 4.84 -0.19 2.41 1.01 -1.05 -4.32 121.20 121.97 1y19 s ILE 356 Ca 0.33 1.69 -0.21 0.00 0.00 0.00 0.00 60.65 62.46 1y19 s ILE 356 Cb 0.20 -4.16 -0.21 0.00 0.01 0.00 0.00 42.46 38.30 1y19 s ILE 356 CO 0.31 -0.02 0.30 0.50 0.00 0.00 0.00 174.94 176.03 1y19 h LYS 357 N 7.41 0.04 -3.05 2.79 3.64 -0.27 -3.49 116.57 123.64 1y19 h LYS 357 Ca -0.27 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.09 1y19 h LYS 357 Cb 1.11 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 1y19 h LYS 357 CO 0.86 1.03 0.21 -0.98 -2.27 0.00 0.00 179.45 178.30 1y19 s ARG 358 N -2.37 1.82 -0.11 1.90 1.70 -0.84 -5.03 118.95 116.02 1y19 s ARG 358 Ca -0.27 -1.06 -0.14 0.00 -0.47 0.00 0.00 55.73 53.78 1y19 s ARG 358 Cb 0.05 0.60 0.03 0.00 -0.57 0.00 0.00 34.95 35.07 1y19 s ARG 358 CO 0.63 -0.83 0.38 1.67 -1.08 0.00 0.00 175.30 176.06 1y19 s TRP 359 N -3.74 -0.37 -0.08 5.89 -2.14 -1.26 -0.93 118.94 116.31 1y19 s TRP 359 Ca 0.12 0.84 0.05 0.00 2.66 0.00 0.00 56.10 59.78 1y19 s TRP 359 Cb -0.05 0.14 -0.01 0.00 -3.10 0.00 0.00 33.47 30.45 1y19 s TRP 359 CO 0.08 -0.27 -0.24 0.00 -2.66 0.00 0.00 176.95 173.86 1y19 s ALA 360 N -0.23 2.14 -0.23 2.67 0.00 -0.74 -5.00 121.76 120.37 1y19 s ALA 360 Ca -0.04 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.94 1y19 s ALA 360 Cb -0.03 -0.73 0.04 0.00 0.00 0.00 0.00 23.12 22.40 1y19 s ALA 360 CO 0.02 0.35 -0.13 0.00 0.00 0.00 0.00 175.76 176.00 1y19 s ALA 361 N 0.08 2.50 0.20 0.00 0.00 -1.26 -1.43 121.76 121.85 1y19 s ALA 361 Ca -0.11 -1.53 0.08 0.00 0.00 0.00 0.00 51.96 50.40 1y19 s ALA 361 Cb -0.16 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 1y19 s ALA 361 CO 0.06 -0.84 -0.03 -1.54 0.00 0.00 0.00 175.76 173.40 1y19 s SER 362 N 1.20 4.53 0.00 0.00 1.04 -0.54 -4.87 113.70 115.06 1y19 s SER 362 Ca -0.03 -0.53 0.03 0.00 0.48 0.00 0.00 55.95 55.90 1y19 s SER 362 Cb -0.17 -0.87 0.16 0.00 0.10 0.00 0.00 66.02 65.24 1y19 s SER 362 CO -0.08 0.07 0.52 -0.81 0.98 0.00 0.00 173.24 173.92 1y19 n PRO 363 N -0.28 0.33 0.00 4.02 -0.04 -1.26 -2.11 135.00 135.65 1y19 n PRO 363 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1y19 n PRO 363 Cb 0.56 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 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 -0.62 3.05 -3.92 0.54 4.81 -1.23 -4.56 118.16 116.23 1y19 n LYS 364 Ca 0.02 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.35 1y19 n LYS 364 Cb 0.01 -0.37 0.00 0.00 0.02 0.00 0.00 35.03 34.69 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 -0.39 0.40 -0.13 3.14 1.04 -0.90 -1.58 113.70 115.29 1y19 s SER 365 Ca 0.00 -1.31 -0.09 0.00 0.48 0.00 0.00 55.95 55.03 1y19 s SER 365 Cb 0.00 0.79 0.04 0.00 0.10 0.00 0.00 66.02 66.95 1y19 s SER 365 CO 0.00 -1.56 0.32 0.12 0.98 0.00 0.00 173.24 173.10 1y19 s PHE 366 N -2.51 -0.41 0.01 5.02 5.36 -0.93 -1.47 117.98 123.06 1y19 s PHE 366 Ca 0.21 0.94 0.04 0.00 -0.96 0.00 0.00 56.93 57.17 1y19 s PHE 366 Cb -0.03 0.13 -0.01 0.00 -0.34 0.00 0.00 43.02 42.77 1y19 s PHE 366 CO 0.15 -0.24 -0.14 0.99 -1.46 0.00 0.00 175.22 174.53 1y19 s THR 367 N 0.86 1.09 -0.10 0.12 2.01 -0.52 -1.78 115.64 117.32 1y19 s THR 367 Ca -0.06 -0.73 0.04 0.00 0.31 0.00 0.00 61.69 61.25 1y19 s THR 367 Cb -0.07 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.51 1y19 s THR 367 CO -0.06 0.19 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.07 1y19 s LEU 368 N -0.62 2.08 -0.30 4.42 1.43 -0.96 -1.80 118.68 122.93 1y19 s LEU 368 Ca 0.04 -0.56 -0.03 0.00 -1.03 0.00 0.00 54.13 52.56 1y19 s LEU 368 Cb -0.06 -1.40 0.04 0.00 0.03 0.00 0.00 46.19 44.80 1y19 s LEU 368 CO 0.00 0.15 0.01 -0.62 0.23 0.00 0.00 176.35 176.12 1y19 s ASP 369 N 0.39 4.90 0.00 2.29 2.15 -0.11 -2.60 116.67 123.69 1y19 s ASP 369 Ca -0.18 -1.18 0.21 0.00 0.43 0.00 0.00 52.55 51.83 1y19 s ASP 369 Cb -0.18 -1.74 0.58 0.00 -0.30 0.00 0.00 42.92 41.28 1y19 s ASP 369 CO 0.08 -0.25 1.46 0.49 -0.17 0.00 0.00 175.17 176.78 1y19 n PHE 370 N 4.67 0.38 0.00 -5.34 3.72 -1.26 0.42 117.46 120.05 1y19 n PHE 370 Ca -0.14 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 1y19 n PHE 370 Cb 0.44 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.98 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 1.28 0.40 0.15 1.37 0.00 -1.26 -2.42 105.19 104.71 1y19 n GLY 371 Ca 0.17 0.67 -0.08 0.00 0.00 0.00 0.00 46.02 46.78 1y19 n GLY 371 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1y19 h ASP 372 N 0.00 0.30 0.00 1.61 5.19 -1.94 -3.39 116.42 118.18 1y19 h ASP 372 Ca 0.00 -0.21 0.00 0.00 -0.62 0.00 0.00 57.03 56.20 1y19 h ASP 372 Cb 0.00 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.42 1y19 h ASP 372 CO 0.00 0.95 0.00 0.00 -3.12 0.00 0.00 179.24 177.07 1y19 n TYR 373 N -3.76 0.00 -4.53 4.55 9.36 -1.02 -4.86 117.16 116.91 1y19 n TYR 373 Ca -0.03 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.94 1y19 n TYR 373 Cb 0.73 -0.45 -0.10 0.00 -0.63 0.00 0.00 39.34 38.90 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 -2.79 1.83 0.26 2.98 -2.07 -1.26 -5.15 119.66 113.47 1y19 s GLN 374 Ca 0.00 -2.07 -0.08 0.00 -1.82 0.00 0.00 55.36 51.38 1y19 s GLN 374 Cb 0.00 -0.95 -0.06 0.00 -1.09 0.00 0.00 33.01 30.90 1y19 s GLN 374 CO 0.00 -0.28 0.57 -0.51 -1.32 0.00 0.00 175.29 173.75 1y19 s ASP 375 N -3.59 6.56 0.45 12.60 1.11 -1.26 -4.69 116.67 127.85 1y19 s ASP 375 Ca 0.29 0.88 0.00 0.00 0.18 0.00 0.00 52.55 53.89 1y19 s ASP 375 Cb 0.06 -2.21 0.00 0.00 1.07 0.00 0.00 42.92 41.84 1y19 s ASP 375 CO 0.14 -0.14 0.00 0.61 1.18 0.00 0.00 175.17 176.96 1y19 n GLY 376 N -0.49 -3.15 0.00 0.21 0.00 -1.26 -5.00 105.19 95.50 1y19 n GLY 376 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.71 0.00 -3.37 1.61 4.01 -1.26 -4.81 117.16 109.63 1y19 n TYR 377 Ca -0.07 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.51 1y19 n TYR 377 Cb 0.50 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.45 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 1.50 -0.38 -0.10 -0.72 5.04 -1.07 -4.97 117.35 116.63 1y19 s TYR 378 Ca 0.00 -0.59 -0.03 0.00 -2.44 0.00 0.00 57.07 54.01 1y19 s TYR 378 Cb 0.00 -0.41 -0.03 0.00 0.35 0.00 0.00 41.96 41.87 1y19 s TYR 378 CO 0.00 -0.96 0.01 0.45 -1.34 0.00 0.00 175.55 173.71 1y19 s SER 379 N 1.73 5.27 0.14 4.32 0.15 -1.26 -2.27 113.70 121.79 1y19 s SER 379 Ca 0.15 0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.93 1y19 s SER 379 Cb -0.15 -1.58 -0.04 0.00 -1.71 0.00 0.00 66.02 62.54 1y19 s SER 379 CO -0.13 0.33 -0.03 0.68 1.20 0.00 0.00 173.24 175.30 1y19 s VAL 380 N -0.62 0.72 -0.25 4.45 -7.23 -0.73 -4.59 120.40 112.15 1y19 s VAL 380 Ca 0.10 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.18 1y19 s VAL 380 Cb -0.12 -1.92 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 1y19 s VAL 380 CO 0.02 -0.66 0.26 -1.58 -0.31 0.00 0.00 175.10 172.83 1y19 s GLN 381 N -3.87 4.05 -0.02 4.82 0.74 -0.41 -2.19 119.66 122.79 1y19 s GLN 381 Ca 0.18 -0.12 -0.29 0.00 0.05 0.00 0.00 55.36 55.18 1y19 s GLN 381 Cb 0.05 -3.59 0.08 0.00 1.10 0.00 0.00 33.01 30.65 1y19 s GLN 381 CO 0.00 -0.08 0.72 -0.08 -0.55 0.00 0.00 175.29 175.30 1y19 s THR 382 N 1.47 0.00 -2.51 -0.34 -1.32 -0.61 -2.56 115.64 109.76 1y19 s THR 382 Ca 0.11 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.82 1y19 s THR 382 Cb -0.15 -1.00 0.41 0.00 -1.51 0.00 0.00 72.50 70.25 1y19 s THR 382 CO 0.08 0.00 1.42 0.35 -2.21 0.00 0.00 174.62 174.26 1y19 n THR 383 N 0.59 0.38 -0.66 5.08 -2.24 -1.26 -2.67 114.28 113.49 1y19 n THR 383 Ca -0.17 -0.63 0.07 0.00 -2.27 0.00 0.00 64.05 61.05 1y19 n THR 383 Cb 0.59 0.92 0.21 0.00 -2.10 0.00 0.00 70.33 69.94 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 1.24 2.83 -0.32 -0.78 1.02 -1.26 -4.72 120.64 118.65 1y19 n GLU 384 Ca 0.18 -2.49 0.29 0.00 -0.02 0.00 0.00 57.16 55.12 1y19 n GLU 384 Cb 0.55 -1.59 0.64 0.00 -0.02 0.00 0.00 31.44 31.02 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 1.72 0.60 0.65 0.62 0.00 -1.75 -0.71 103.07 104.21 1y19 h GLY 385 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 1y19 h GLY 385 CO 0.12 -0.08 -0.10 -2.09 0.00 0.00 0.00 176.54 174.39 1y19 h GLU 386 N 0.18 0.23 0.04 4.80 4.57 -1.84 -1.46 114.58 121.10 1y19 h GLU 386 Ca 0.58 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.63 1y19 h GLU 386 Cb 1.90 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.50 1y19 h GLU 386 CO -0.16 0.67 -0.02 1.96 -1.18 0.00 0.00 179.01 180.29 1y19 h GLN 387 N -0.19 -0.05 -0.29 1.92 7.50 -1.54 -1.33 115.11 121.13 1y19 h GLN 387 Ca 0.01 0.00 0.05 0.00 0.50 0.00 0.00 58.65 59.22 1y19 h GLN 387 Cb 0.63 0.01 -0.05 0.00 0.05 0.00 0.00 27.48 28.13 1y19 h GLN 387 CO 0.03 0.01 -0.00 0.82 -1.50 0.00 0.00 178.83 178.18 1y19 h ILE 388 N -0.09 0.79 -0.39 2.54 2.04 -1.31 -1.12 117.51 119.97 1y19 h ILE 388 Ca -0.01 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 65.85 1y19 h ILE 388 Cb 0.08 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1y19 h ILE 388 CO 0.01 0.02 0.19 0.00 0.00 0.00 0.00 178.15 178.37 1y19 h ALA 389 N 1.25 0.48 -0.48 1.87 0.00 -1.09 -2.19 119.26 119.09 1y19 h ALA 389 Ca 0.14 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1y19 h ALA 389 Cb 0.18 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1y19 h ALA 389 CO -0.23 -0.17 0.11 0.37 0.00 0.00 0.00 179.25 179.33 1y19 h GLN 390 N 0.39 0.73 0.55 0.00 4.15 -0.87 -0.87 115.11 119.19 1y19 h GLN 390 Ca 0.16 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 1y19 h GLN 390 Cb 0.07 -0.11 0.01 0.00 0.21 0.00 0.00 27.48 27.65 1y19 h GLN 390 CO -0.12 0.67 -0.26 1.25 -1.93 0.00 0.00 178.83 178.44 1y19 h LEU 391 N 0.71 -0.62 -0.60 -2.39 5.85 -0.77 -1.81 115.31 115.68 1y19 h LEU 391 Ca 0.16 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.94 1y19 h LEU 391 Cb 0.28 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 1y19 h LEU 391 CO -0.00 -0.41 0.29 0.40 -0.34 0.00 0.00 178.44 178.38 1y19 h ILE 392 N -0.79 0.90 -0.26 4.05 2.04 -1.23 -2.17 117.51 120.05 1y19 h ILE 392 Ca -0.08 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.64 1y19 h ILE 392 Cb 0.59 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 1y19 h ILE 392 CO 0.12 0.10 0.04 0.00 0.00 0.00 0.00 178.15 178.41 1y19 h ALA 393 N 1.34 0.26 0.10 1.87 0.00 -1.04 -1.23 119.26 120.57 1y19 h ALA 393 Ca 0.28 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.25 1y19 h ALA 393 Cb 0.23 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1y19 h ALA 393 CO -0.21 -0.38 -0.13 0.78 0.00 0.00 0.00 179.25 179.31 1y19 h GLY 394 N 0.13 -0.24 0.57 0.00 0.00 -0.91 -1.75 103.07 100.86 1y19 h GLY 394 Ca 0.12 0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.66 1y19 h GLY 394 CO -0.17 -0.13 0.13 -0.97 0.00 0.00 0.00 176.54 175.40 1y19 h TYR 395 N -0.27 0.22 -0.41 5.60 0.99 -1.20 -2.16 116.97 119.76 1y19 h TYR 395 Ca 0.01 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1y19 h TYR 395 Cb 0.27 -0.04 -0.02 0.00 1.00 0.00 0.00 36.73 37.94 1y19 h TYR 395 CO -0.14 0.07 0.17 0.82 -0.00 0.00 0.00 178.16 179.08 1y19 h ILE 396 N 0.28 1.15 -0.79 -2.88 2.04 -1.06 -2.65 117.51 113.61 1y19 h ILE 396 Ca 0.20 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 1y19 h ILE 396 Cb 0.21 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 1y19 h ILE 396 CO -0.23 0.18 0.39 0.44 0.00 0.00 0.00 178.15 178.94 1y19 h ASP 397 N 0.57 1.01 0.31 1.72 3.32 -0.65 -2.91 116.42 119.79 1y19 h ASP 397 Ca 0.14 -0.11 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1y19 h ASP 397 Cb 0.11 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1y19 h ASP 397 CO -0.02 0.85 -0.49 0.40 -1.72 0.00 0.00 179.24 178.26 1y19 h ILE 398 N 1.12 1.34 -0.12 0.35 2.04 -1.29 -3.30 117.51 117.65 1y19 h ILE 398 Ca 0.27 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.43 1y19 h ILE 398 Cb 0.09 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 1y19 h ILE 398 CO -0.04 0.50 0.07 0.40 0.00 0.00 0.00 178.15 179.09 1y19 h ILE 399 N 0.17 1.07 0.00 -0.67 2.04 -1.39 -3.52 117.51 115.21 1y19 h ILE 399 Ca 0.01 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1y19 h ILE 399 Cb 0.92 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1y19 h ILE 399 CO 0.07 0.06 0.00 -0.11 0.00 0.00 0.00 178.15 178.17