#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xiu n ASP 211 N 0.00 0.00 -3.79 1.20 2.03 -1.26 -4.91 116.55 109.82 1xiu n ASP 211 Ca 0.00 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.03 1xiu n ASP 211 Cb 0.00 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.29 1xiu n ASP 211 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 1xiu n MET 212 N -2.00 1.71 -2.82 -0.67 1.56 -1.26 -5.00 117.12 108.64 1xiu n MET 212 Ca 0.00 -4.35 -0.41 0.00 -0.27 0.00 0.00 57.70 52.67 1xiu n MET 212 Cb 0.00 -2.20 -0.04 0.00 2.15 0.00 0.00 33.22 33.13 1xiu n MET 212 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1xiu s PRO 213 N -1.40 4.57 0.48 2.12 0.04 -1.26 -4.74 135.00 134.81 1xiu s PRO 213 Ca 0.27 1.28 0.13 0.00 0.04 0.00 0.00 61.00 62.73 1xiu s PRO 213 Cb -0.01 -3.41 1.11 0.00 0.04 0.00 0.00 34.50 32.23 1xiu s PRO 213 CO -0.16 0.12 2.10 -0.39 0.04 0.00 0.00 177.00 178.71 1xiu h VAL 214 N 4.40 1.02 -0.90 -0.36 -1.51 -1.98 -2.25 116.25 114.66 1xiu h VAL 214 Ca -0.42 -0.08 0.06 0.00 -1.23 0.00 0.00 66.70 65.03 1xiu h VAL 214 Cb 1.21 0.77 -0.06 0.00 -2.13 0.00 0.00 31.29 31.08 1xiu h VAL 214 CO 0.73 0.04 0.59 1.05 -1.23 0.00 0.00 177.57 178.75 1xiu h GLU 215 N 0.23 1.01 0.00 5.19 9.09 -1.99 0.89 114.58 128.99 1xiu h GLU 215 Ca 0.09 -0.06 -0.14 0.00 0.05 0.00 0.00 59.36 59.30 1xiu h GLU 215 Cb 0.07 -0.23 -0.02 0.00 -1.65 0.00 0.00 28.75 26.92 1xiu h GLU 215 CO -0.02 0.67 -0.65 1.96 0.05 0.00 0.00 179.01 181.02 1xiu h GLN 216 N 1.04 0.00 -0.01 1.06 4.20 -1.82 0.12 115.11 119.71 1xiu h GLN 216 Ca 0.38 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.09 1xiu h GLN 216 Cb 0.17 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 1xiu h GLN 216 CO -0.14 0.65 -0.00 0.82 -0.67 0.00 0.00 178.83 179.49 1xiu h ILE 217 N 0.00 1.27 -0.64 2.54 2.04 -1.11 0.13 117.51 121.74 1xiu h ILE 217 Ca -0.01 -0.79 0.13 0.00 1.00 0.00 0.00 64.86 65.20 1xiu h ILE 217 Cb 1.43 1.78 -0.11 0.00 -0.74 0.00 0.00 36.82 39.18 1xiu h ILE 217 CO 0.09 0.21 -0.01 0.25 0.00 0.00 0.00 178.15 178.69 1xiu h LEU 218 N -0.31 -0.30 -0.85 1.44 6.46 -0.62 0.14 115.31 121.26 1xiu h LEU 218 Ca 0.00 0.16 0.13 0.00 -0.12 0.00 0.00 57.88 58.05 1xiu h LEU 218 Cb 0.34 0.29 -0.09 0.00 -0.73 0.00 0.00 40.66 40.47 1xiu h LEU 218 CO 0.00 -0.13 0.46 -0.33 -0.62 0.00 0.00 178.44 177.83 1xiu h GLU 219 N 0.11 0.68 -0.46 1.25 4.39 -0.12 -1.10 114.58 119.32 1xiu h GLU 219 Ca 0.33 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.94 1xiu h GLU 219 Cb 0.55 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 1xiu h GLU 219 CO -0.55 0.45 0.06 0.00 -1.16 0.00 0.00 179.01 177.81 1xiu h ALA 220 N 1.53 0.61 0.54 3.43 0.00 0.20 -0.17 119.26 125.40 1xiu h ALA 220 Ca 0.45 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1xiu h ALA 220 Cb 0.56 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1xiu h ALA 220 CO -0.32 0.35 -0.40 0.93 0.00 0.00 0.00 179.25 179.80 1xiu h GLU 221 N 0.63 -0.89 -0.88 0.00 4.39 -0.95 -2.94 114.58 113.95 1xiu h GLU 221 Ca 0.14 0.06 0.16 0.00 0.34 0.00 0.00 59.36 60.06 1xiu h GLU 221 Cb 0.41 0.20 -0.10 0.00 -0.10 0.00 0.00 28.75 29.16 1xiu h GLU 221 CO 0.01 -0.59 0.46 -0.07 -1.16 0.00 0.00 179.01 177.66 1xiu h LEU 222 N -0.92 0.55 -1.78 1.33 3.38 -1.02 0.45 115.31 117.31 1xiu h LEU 222 Ca -0.06 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xiu h LEU 222 Cb 0.78 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1xiu h LEU 222 CO 0.01 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.75 1xiu h ALA 223 N 1.59 1.00 -0.24 1.53 0.00 -0.85 -2.75 119.26 119.54 1xiu h ALA 223 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1xiu h ALA 223 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1xiu h ALA 223 CO -0.38 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.20 1xiu n VAL 224 N -2.75 0.81 -1.62 0.00 0.24 0.16 -4.99 118.33 110.17 1xiu n VAL 224 Ca -0.01 -0.90 -0.46 0.00 -2.04 0.00 0.00 64.34 60.93 1xiu n VAL 224 Cb 0.16 0.63 -0.02 0.00 -1.47 0.00 0.00 33.84 33.14 1xiu n VAL 224 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1xiu n ASP 225 N 0.38 1.88 -4.78 -1.34 8.00 -1.02 -4.94 116.55 114.74 1xiu n ASP 225 Ca 0.09 1.16 -0.34 0.00 0.71 0.00 0.00 54.79 56.41 1xiu n ASP 225 Cb 0.37 -1.33 0.01 0.00 -0.02 0.00 0.00 41.12 40.15 1xiu n ASP 225 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1xiu s PRO 226 N -0.93 3.21 -0.54 -0.24 0.04 -1.26 -4.93 135.00 130.36 1xiu s PRO 226 Ca 0.65 1.49 -0.24 0.00 0.04 0.00 0.00 61.00 62.94 1xiu s PRO 226 Cb -0.72 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 31.87 1xiu s PRO 226 CO 0.55 -0.94 0.94 0.15 0.04 0.00 0.00 177.00 177.74 1xiu s LYS 227 N -3.59 3.36 -0.26 4.56 1.02 -1.26 -4.96 119.74 118.61 1xiu s LYS 227 Ca 0.70 -0.20 -0.01 0.00 0.02 0.00 0.00 55.97 56.48 1xiu s LYS 227 Cb -0.22 -4.03 0.08 0.00 -0.52 0.00 0.00 37.83 33.14 1xiu s LYS 227 CO 0.32 -1.44 0.04 -1.50 -0.92 0.00 0.00 175.35 171.85 1xiu s ILE 228 N 3.90 0.99 0.00 2.17 -1.16 -1.26 -5.05 121.20 120.80 1xiu s ILE 228 Ca 0.31 -1.15 0.00 0.00 -0.51 0.00 0.00 60.65 59.30 1xiu s ILE 228 Cb -0.12 -1.56 0.00 0.00 0.61 0.00 0.00 42.46 41.39 1xiu s ILE 228 CO 0.20 -0.40 0.00 -0.67 -2.81 0.00 0.00 174.94 171.27 1xiu n ASP 229 N 4.84 0.00 0.09 4.50 4.64 -1.26 -4.96 116.55 124.40 1xiu n ASP 229 Ca -0.06 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.35 1xiu n ASP 229 Cb 0.44 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.52 1xiu n ASP 229 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 1xiu n THR 230 N 0.00 0.67 0.00 5.18 -1.04 -1.26 -5.13 114.28 112.71 1xiu n THR 230 Ca 0.00 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1xiu n THR 230 Cb 0.00 -1.10 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 1xiu n THR 230 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1xiu n TYR 231 N -3.48 0.00 -3.60 -1.42 4.01 -1.23 -5.04 117.16 106.39 1xiu n TYR 231 Ca 0.00 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.43 1xiu n TYR 231 Cb 0.01 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.99 1xiu n TYR 231 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 1xiu s ILE 232 N 0.00 5.12 1.02 -0.72 -4.36 -0.94 -4.83 121.20 116.49 1xiu s ILE 232 Ca 0.00 0.08 -0.17 0.00 -0.26 0.00 0.00 60.65 60.30 1xiu s ILE 232 Cb 0.00 -3.64 0.02 0.00 1.25 0.00 0.00 42.46 40.09 1xiu s ILE 232 CO 0.00 -0.03 -0.04 0.47 0.24 0.00 0.00 174.94 175.58 1xiu n ASP 233 N -0.10 -2.75 -4.20 4.36 8.00 -1.26 -0.52 116.55 120.09 1xiu n ASP 233 Ca -0.02 0.13 -0.17 0.00 0.71 0.00 0.00 54.79 55.43 1xiu n ASP 233 Cb 0.52 -1.01 -0.11 0.00 -0.02 0.00 0.00 41.12 40.50 1xiu n ASP 233 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xiu s ALA 234 N -2.26 1.28 0.00 2.24 0.00 -0.71 -4.53 121.76 117.78 1xiu s ALA 234 Ca 0.53 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1xiu s ALA 234 Cb -0.15 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1xiu s ALA 234 CO 0.69 0.10 0.33 1.04 0.00 0.00 0.00 175.76 177.91 1xiu n GLN 235 N 0.83 -0.49 -0.06 0.00 6.02 -1.26 -4.47 117.38 117.95 1xiu n GLN 235 Ca -0.18 -0.34 -0.03 0.00 -0.01 0.00 0.00 57.00 56.44 1xiu n GLN 235 Cb 0.56 -0.80 -0.01 0.00 1.02 0.00 0.00 30.24 31.01 1xiu n GLN 235 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1xiu h LYS 236 N 0.00 0.00 -2.38 -1.09 1.63 -1.99 -3.42 116.57 109.32 1xiu h LYS 236 Ca 0.00 0.00 -0.59 0.00 -0.85 0.00 0.00 60.65 59.21 1xiu h LYS 236 Cb 0.22 0.00 -0.39 0.00 -0.60 0.00 0.00 32.23 31.46 1xiu h LYS 236 CO 0.00 0.00 -0.91 -3.47 -3.45 0.00 0.00 179.45 171.62 1xiu n ASP 237 N -4.39 0.56 -0.29 4.20 4.64 -1.26 -4.96 116.55 115.05 1xiu n ASP 237 Ca -0.04 -2.66 -0.01 0.00 -1.38 0.00 0.00 54.79 50.69 1xiu n ASP 237 Cb 0.15 -0.61 0.11 0.00 -1.04 0.00 0.00 41.12 39.72 1xiu n ASP 237 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1xiu h PRO 238 N 5.10 0.94 -0.76 -0.67 0.13 -1.92 -1.93 132.00 132.89 1xiu h PRO 238 Ca 0.20 -0.06 0.04 0.00 -0.87 0.00 0.00 66.00 65.32 1xiu h PRO 238 Cb 0.86 -0.21 -0.05 0.00 0.13 0.00 0.00 31.00 31.73 1xiu h PRO 238 CO 0.48 0.62 0.47 0.28 -0.23 0.00 0.00 178.00 179.62 1xiu h VAL 239 N 0.96 1.07 -0.26 1.56 2.07 -1.94 0.14 116.25 119.85 1xiu h VAL 239 Ca 0.33 -0.31 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1xiu h VAL 239 Cb 0.06 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1xiu h VAL 239 CO -0.13 0.16 0.14 0.74 0.02 0.00 0.00 177.57 178.50 1xiu h THR 240 N 0.89 1.01 -0.99 2.57 2.02 -1.79 0.47 112.91 117.09 1xiu h THR 240 Ca 0.32 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.40 1xiu h THR 240 Cb 0.08 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 67.14 1xiu h THR 240 CO -0.14 0.05 0.65 0.78 0.37 0.00 0.00 175.52 177.23 1xiu h ASN 241 N 0.30 1.15 0.04 4.18 2.35 -0.88 0.34 115.58 123.06 1xiu h ASN 241 Ca 0.10 -0.04 -0.19 0.00 -0.55 0.00 0.00 56.30 55.63 1xiu h ASN 241 Cb 0.01 -0.29 -0.00 0.00 0.05 0.00 0.00 38.32 38.09 1xiu h ASN 241 CO -0.06 0.85 -0.68 0.40 -1.65 0.00 0.00 177.43 176.28 1xiu h ILE 242 N 1.35 1.33 -0.16 2.81 2.04 -0.46 -1.54 117.51 122.87 1xiu h ILE 242 Ca 0.36 -1.97 -0.12 0.00 1.00 0.00 0.00 64.86 64.13 1xiu h ILE 242 Cb -0.14 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1xiu h ILE 242 CO -0.08 0.61 -0.41 0.00 0.00 0.00 0.00 178.15 178.28 1xiu h GLN 244 N 0.31 0.99 -0.49 0.00 4.20 -0.34 -1.05 115.11 118.74 1xiu h GLN 244 Ca 0.03 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 1xiu h GLN 244 Cb 0.85 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 1xiu h GLN 244 CO 0.07 0.92 0.26 0.00 -0.67 0.00 0.00 178.83 179.41 1xiu h ALA 245 N 1.16 0.62 0.15 3.87 0.00 -0.92 -1.14 119.26 123.01 1xiu h ALA 245 Ca 0.19 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xiu h ALA 245 Cb 0.41 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1xiu h ALA 245 CO 0.01 0.16 -0.24 0.00 0.00 0.00 0.00 179.25 179.18 1xiu h ALA 246 N 1.10 -0.43 -0.18 0.00 0.00 -1.14 0.67 119.26 119.29 1xiu h ALA 246 Ca 0.17 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1xiu h ALA 246 Cb 0.07 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1xiu h ALA 246 CO -0.03 -0.78 -0.22 0.22 0.00 0.00 0.00 179.25 178.44 1xiu h ASP 247 N -0.46 -0.69 -0.54 0.00 3.58 -1.03 0.10 116.42 117.38 1xiu h ASP 247 Ca 0.02 0.12 0.11 0.00 0.42 0.00 0.00 57.03 57.70 1xiu h ASP 247 Cb 0.46 0.32 -0.10 0.00 1.72 0.00 0.00 39.33 41.73 1xiu h ASP 247 CO -0.11 -0.27 -0.12 0.50 -2.88 0.00 0.00 179.24 176.36 1xiu h LYS 248 N -0.26 0.01 0.00 0.28 3.11 -0.60 -1.35 116.57 117.77 1xiu h LYS 248 Ca 0.12 -0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.95 1xiu h LYS 248 Cb 0.43 -0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.66 1xiu h LYS 248 CO -0.32 0.01 -0.03 1.96 -2.81 0.00 0.00 179.45 178.26 1xiu h GLN 249 N 0.01 0.00 -0.76 1.90 1.08 0.16 -3.00 115.11 114.50 1xiu h GLN 249 Ca 0.26 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.50 1xiu h GLN 249 Cb 0.40 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.78 1xiu h GLN 249 CO -0.55 0.03 0.47 -0.07 -0.95 0.00 0.00 178.83 177.76 1xiu h LEU 250 N 0.00 0.77 -0.27 1.46 3.38 0.36 0.33 115.31 121.34 1xiu h LEU 250 Ca -0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1xiu h LEU 250 Cb 0.50 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 1xiu h LEU 250 CO 0.00 0.52 -0.01 -0.26 0.09 0.00 0.00 178.44 178.79 1xiu h PHE 251 N 0.91 -0.03 0.00 1.13 -1.00 -1.60 -1.43 116.94 114.93 1xiu h PHE 251 Ca 0.31 0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.11 1xiu h PHE 251 Cb 0.05 0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.66 1xiu h PHE 251 CO -0.04 -0.05 0.00 0.00 -1.61 0.00 0.00 178.31 176.61 1xiu h THR 252 N 0.07 0.00 -0.66 -1.55 1.03 -1.46 -2.55 112.91 107.79 1xiu h THR 252 Ca 0.13 -0.47 -0.08 0.00 -0.01 0.00 0.00 66.41 65.98 1xiu h THR 252 Cb 0.17 1.38 -0.03 0.00 -1.07 0.00 0.00 68.15 68.61 1xiu h THR 252 CO -0.22 0.00 0.10 0.25 -0.01 0.00 0.00 175.52 175.63 1xiu h LEU 253 N 0.00 1.06 -0.43 0.00 5.85 0.73 -1.09 115.31 121.42 1xiu h LEU 253 Ca 0.00 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 1xiu h LEU 253 Cb 0.53 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1xiu h LEU 253 CO 0.00 1.05 0.18 0.58 -0.34 0.00 0.00 178.44 179.92 1xiu h VAL 254 N 1.02 1.19 -0.79 1.05 2.07 -1.03 -0.96 116.25 118.80 1xiu h VAL 254 Ca 0.20 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 1xiu h VAL 254 Cb 0.46 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 1xiu h VAL 254 CO 0.02 0.21 0.46 -0.33 0.02 0.00 0.00 177.57 177.94 1xiu h GLU 255 N 0.55 1.08 -0.41 1.57 5.08 -1.45 0.92 114.58 121.92 1xiu h GLU 255 Ca 0.14 -0.11 0.07 0.00 -1.00 0.00 0.00 59.36 58.46 1xiu h GLU 255 Cb 0.16 -0.22 -0.06 0.00 0.50 0.00 0.00 28.75 29.14 1xiu h GLU 255 CO -0.01 0.78 0.07 2.35 -1.00 0.00 0.00 179.01 181.19 1xiu h TRP 256 N 1.08 0.11 -0.62 4.33 7.01 -0.78 -2.44 115.95 124.64 1xiu h TRP 256 Ca 0.28 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.26 1xiu h TRP 256 Cb -0.01 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.04 1xiu h TRP 256 CO -0.00 -0.01 0.21 0.00 -2.79 0.00 0.00 178.44 175.85 1xiu h ALA 257 N 1.32 0.81 0.00 2.65 0.00 -0.24 -1.65 119.26 122.14 1xiu h ALA 257 Ca 0.20 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xiu h ALA 257 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1xiu h ALA 257 CO -0.27 0.47 -0.00 0.87 0.00 0.00 0.00 179.25 180.31 1xiu h LYS 258 N 0.88 0.00 -0.02 0.00 1.57 -0.51 -0.75 116.57 117.75 1xiu h LYS 258 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1xiu h LYS 258 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1xiu h LYS 258 CO -0.01 0.00 -0.48 -2.13 -0.57 0.00 0.00 179.45 176.26 1xiu n ARG 259 N -3.17 1.22 -2.61 3.15 0.63 -0.65 -4.70 116.66 110.53 1xiu n ARG 259 Ca -0.03 -1.00 -0.42 0.00 -0.92 0.00 0.00 57.85 55.48 1xiu n ARG 259 Cb 0.08 -1.47 -0.03 0.00 0.45 0.00 0.00 32.46 31.49 1xiu n ARG 259 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1xiu s ILE 260 N -2.47 4.59 0.27 5.15 -1.09 -0.29 -4.76 121.20 122.60 1xiu s ILE 260 Ca 0.18 1.86 -0.31 0.00 -2.23 0.00 0.00 60.65 60.16 1xiu s ILE 260 Cb 0.18 -4.20 -0.13 0.00 -1.58 0.00 0.00 42.46 36.74 1xiu s ILE 260 CO 0.57 0.09 1.49 -2.65 -1.23 0.00 0.00 174.94 173.21 1xiu n PRO 261 N 4.40 2.35 0.00 2.79 -0.02 -1.26 -1.27 135.00 141.98 1xiu n PRO 261 Ca 0.08 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 1xiu n PRO 261 Cb 0.49 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1xiu n PRO 261 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1xiu n HIS 262 N 1.95 0.00 -0.14 6.00 8.25 -1.26 -4.88 115.22 125.15 1xiu n HIS 262 Ca 0.10 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.52 1xiu n HIS 262 Cb 0.34 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.48 1xiu n HIS 262 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1xiu h PHE 263 N 0.00 -0.16 0.00 4.41 3.57 -1.45 -0.91 116.94 122.40 1xiu h PHE 263 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1xiu h PHE 263 Cb 0.00 0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1xiu h PHE 263 CO 0.00 -0.16 0.00 0.25 -2.23 0.00 0.00 178.31 176.17 1xiu n THR 264 N -5.29 0.73 1.67 4.41 -2.24 -1.26 -1.71 114.28 110.59 1xiu n THR 264 Ca 0.03 0.14 0.15 0.00 -2.27 0.00 0.00 64.05 62.10 1xiu n THR 264 Cb 0.24 -0.91 0.71 0.00 -2.10 0.00 0.00 70.33 68.26 1xiu n THR 264 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xiu n GLU 265 N -1.80 1.18 -1.41 -0.78 1.02 -0.35 -4.85 120.64 113.64 1xiu n GLU 265 Ca 0.04 -0.42 -0.32 0.00 -0.02 0.00 0.00 57.16 56.44 1xiu n GLU 265 Cb 0.25 -1.49 0.08 0.00 -0.02 0.00 0.00 31.44 30.25 1xiu n GLU 265 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1xiu s LEU 266 N -2.11 3.14 0.69 -4.62 1.43 -0.69 -5.00 118.68 111.51 1xiu s LEU 266 Ca 0.40 1.88 -0.17 0.00 -1.03 0.00 0.00 54.13 55.21 1xiu s LEU 266 Cb 0.21 -4.53 0.01 0.00 0.03 0.00 0.00 46.19 41.91 1xiu s LEU 266 CO 0.38 -1.92 1.13 -2.65 0.23 0.00 0.00 176.35 173.53 1xiu n PRO 267 N -3.19 0.74 -0.13 1.29 -0.02 -1.26 -4.77 135.00 127.66 1xiu n PRO 267 Ca 0.09 0.31 -0.05 0.00 -2.02 0.00 0.00 63.50 61.83 1xiu n PRO 267 Cb 0.53 -2.37 0.03 0.00 -0.02 0.00 0.00 33.50 31.67 1xiu n PRO 267 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1xiu h LEU 268 N 0.04 0.18 -0.86 2.45 5.85 -1.94 0.04 115.31 121.07 1xiu h LEU 268 Ca -0.49 0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.41 1xiu h LEU 268 Cb 1.34 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.29 1xiu h LEU 268 CO 0.50 0.14 0.46 -0.08 -0.34 0.00 0.00 178.44 179.12 1xiu h GLU 269 N 0.33 0.67 -0.16 1.25 4.57 -2.01 -1.11 114.58 118.12 1xiu h GLU 269 Ca 0.19 -0.04 -0.17 0.00 -1.18 0.00 0.00 59.36 58.15 1xiu h GLU 269 Cb 0.16 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1xiu h GLU 269 CO -0.18 0.44 -0.62 -0.44 -1.18 0.00 0.00 179.01 177.04 1xiu h ASP 270 N 0.69 0.63 -0.74 1.04 3.32 -1.40 -2.01 116.42 117.94 1xiu h ASP 270 Ca 0.45 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 57.19 1xiu h ASP 270 Cb 0.58 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1xiu h ASP 270 CO -0.33 1.09 0.49 1.56 -1.72 0.00 0.00 179.24 180.33 1xiu h GLN 271 N 0.41 0.82 -0.05 3.56 4.20 0.10 -0.52 115.11 123.63 1xiu h GLN 271 Ca -0.01 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.45 1xiu h GLN 271 Cb 1.18 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.77 1xiu h GLN 271 CO 0.12 0.54 -0.83 -0.24 -0.67 0.00 0.00 178.83 177.75 1xiu h VAL 272 N 0.85 1.38 -0.37 -0.54 3.04 -1.26 -3.02 116.25 116.32 1xiu h VAL 272 Ca 0.31 -2.27 -0.01 0.00 -1.01 0.00 0.00 66.70 63.71 1xiu h VAL 272 Cb 0.14 2.25 -0.02 0.00 -2.01 0.00 0.00 31.29 31.65 1xiu h VAL 272 CO -0.10 0.68 0.20 0.40 -1.01 0.00 0.00 177.57 177.75 1xiu h ILE 273 N 0.27 1.14 -0.90 3.17 2.04 -0.55 0.17 117.51 122.86 1xiu h ILE 273 Ca -0.05 -0.37 0.04 0.00 1.00 0.00 0.00 64.86 65.47 1xiu h ILE 273 Cb 1.44 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 38.18 1xiu h ILE 273 CO 0.14 0.15 0.59 -0.07 0.00 0.00 0.00 178.15 178.96 1xiu h LEU 274 N 0.47 0.96 0.11 1.44 3.38 -1.17 0.21 115.31 120.71 1xiu h LEU 274 Ca 0.13 -0.01 -0.31 0.00 0.09 0.00 0.00 57.88 57.78 1xiu h LEU 274 Cb 0.06 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1xiu h LEU 274 CO -0.02 0.65 -1.58 -0.07 0.09 0.00 0.00 178.44 177.51 1xiu h LEU 275 N 1.11 0.36 -0.89 1.67 3.38 -1.37 0.84 115.31 120.41 1xiu h LEU 275 Ca 0.36 -0.53 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1xiu h LEU 275 Cb 0.05 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1xiu h LEU 275 CO -0.11 1.45 0.01 0.03 0.09 0.00 0.00 178.44 179.91 1xiu h ARG 276 N 0.06 0.83 0.00 1.13 3.08 -0.41 -2.32 114.38 116.75 1xiu h ARG 276 Ca -0.26 -0.22 -0.12 0.00 0.07 0.00 0.00 59.98 59.44 1xiu h ARG 276 Cb 2.01 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.95 1xiu h ARG 276 CO 0.15 0.83 -0.58 0.00 -1.07 0.00 0.00 179.97 179.30 1xiu h ALA 277 N 1.23 0.81 0.00 0.04 0.00 -0.48 -3.37 119.26 117.50 1xiu h ALA 277 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1xiu h ALA 277 Cb 0.45 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1xiu h ALA 277 CO 0.02 0.72 -0.86 0.41 0.00 0.00 0.00 179.25 179.54 1xiu n GLY 278 N 0.62 -0.35 0.21 0.00 0.00 0.28 -4.73 105.19 101.21 1xiu n GLY 278 Ca -0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1xiu n GLY 278 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1xiu h TRP 279 N 0.00 0.68 -0.85 1.61 5.08 -1.59 0.09 115.95 120.97 1xiu h TRP 279 Ca 0.00 -0.06 -0.00 0.00 1.08 0.00 0.00 58.89 59.90 1xiu h TRP 279 Cb 0.39 -0.20 -0.04 0.00 -3.00 0.00 0.00 29.16 26.31 1xiu h TRP 279 CO 0.00 0.61 0.52 -2.95 -1.28 0.00 0.00 178.44 175.34 1xiu h ASN 280 N 0.56 1.02 -0.08 0.11 -1.07 -1.87 0.33 115.58 114.58 1xiu h ASN 280 Ca 0.14 -0.06 -0.19 0.00 0.07 0.00 0.00 56.30 56.26 1xiu h ASN 280 Cb 0.23 -0.26 0.00 0.00 -2.07 0.00 0.00 38.32 36.23 1xiu h ASN 280 CO -0.01 0.78 -0.64 -0.33 0.07 0.00 0.00 177.43 177.30 1xiu h GLU 281 N 1.17 0.70 -0.81 4.14 5.08 -1.66 -0.92 114.58 122.28 1xiu h GLU 281 Ca 0.31 -0.50 0.11 0.00 -1.00 0.00 0.00 59.36 58.28 1xiu h GLU 281 Cb -0.05 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.20 1xiu h GLU 281 CO -0.06 1.12 0.44 -0.07 -1.00 0.00 0.00 179.01 179.44 1xiu h LEU 282 N 0.51 0.58 -0.03 1.33 4.07 -0.17 -0.64 115.31 120.96 1xiu h LEU 282 Ca -0.01 0.07 -0.23 0.00 0.08 0.00 0.00 57.88 57.78 1xiu h LEU 282 Cb 1.24 -0.04 0.02 0.00 1.08 0.00 0.00 40.66 42.95 1xiu h LEU 282 CO 0.13 0.31 -0.87 -0.07 -1.08 0.00 0.00 178.44 176.85 1xiu h LEU 283 N 0.70 0.82 -0.60 1.67 3.38 -0.09 -2.20 115.31 118.99 1xiu h LEU 283 Ca 0.41 -0.72 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1xiu h LEU 283 Cb 0.47 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1xiu h LEU 283 CO -0.29 1.43 0.33 0.40 0.09 0.00 0.00 178.44 180.40 1xiu h ILE 284 N 0.30 1.19 -0.76 1.22 2.04 -0.97 -1.33 117.51 119.20 1xiu h ILE 284 Ca -0.10 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1xiu h ILE 284 Cb 1.53 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 1xiu h ILE 284 CO 0.17 0.21 0.39 0.00 0.00 0.00 0.00 178.15 178.92 1xiu h ALA 285 N 1.16 1.26 0.05 1.87 0.00 -1.09 0.27 119.26 122.77 1xiu h ALA 285 Ca 0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1xiu h ALA 285 Cb 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1xiu h ALA 285 CO -0.03 0.59 -0.02 0.78 0.00 0.00 0.00 179.25 180.56 1xiu h GLY 286 N 1.11 -0.07 2.00 0.00 0.00 -0.64 -1.26 103.07 104.21 1xiu h GLY 286 Ca 0.27 0.02 -0.13 0.00 0.00 0.00 0.00 47.33 47.49 1xiu h GLY 286 CO -0.04 -0.02 -0.60 0.27 0.00 0.00 0.00 176.54 176.15 1xiu h PHE 287 N -0.34 0.00 -0.26 5.60 -5.15 -1.01 -1.78 116.94 114.01 1xiu h PHE 287 Ca -0.01 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.75 1xiu h PHE 287 Cb 0.30 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.46 1xiu h PHE 287 CO 0.02 0.60 0.13 0.77 -2.00 0.00 0.00 178.31 177.83 1xiu h SER 288 N 0.00 0.34 -0.57 -0.68 0.02 -0.75 -1.69 113.55 110.22 1xiu h SER 288 Ca -0.01 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.74 1xiu h SER 288 Cb 1.16 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 1xiu h SER 288 CO 0.08 0.36 0.04 -0.74 -1.14 0.00 0.00 176.83 175.43 1xiu h HIS 289 N 0.29 1.06 -0.45 3.45 -0.00 -0.91 -0.99 115.15 117.60 1xiu h HIS 289 Ca 0.09 -0.17 0.13 0.00 -0.00 0.00 0.00 60.37 60.42 1xiu h HIS 289 Cb 0.11 -0.28 -0.02 0.00 -0.00 0.00 0.00 27.41 27.22 1xiu h HIS 289 CO -0.02 0.94 0.33 -0.09 -0.00 0.00 0.00 177.93 179.09 1xiu h ARG 290 N 0.87 0.00 -0.14 5.26 2.43 -1.05 -2.92 114.38 118.84 1xiu h ARG 290 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1xiu h ARG 290 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1xiu h ARG 290 CO 0.02 0.00 0.00 0.43 -1.51 0.00 0.00 179.97 178.91 1xiu n SER 291 N -4.35 1.94 -0.25 -3.80 7.64 -0.38 -3.86 113.62 110.57 1xiu n SER 291 Ca 0.08 -1.70 0.12 0.00 1.01 0.00 0.00 58.87 58.37 1xiu n SER 291 Cb 0.53 -0.08 0.40 0.00 -1.01 0.00 0.00 64.21 64.05 1xiu n SER 291 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1xiu h ILE 292 N 2.74 0.84 0.00 0.44 2.04 -1.50 -1.35 117.51 120.71 1xiu h ILE 292 Ca 0.00 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1xiu h ILE 292 Cb 0.59 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1xiu h ILE 292 CO 0.00 0.12 0.00 1.15 0.00 0.00 0.00 178.15 179.42 1xiu n MET 293 N -4.54 0.13 -1.83 2.37 0.00 -1.25 -4.77 117.12 107.23 1xiu n MET 293 Ca 0.16 0.14 -0.31 0.00 0.00 0.00 0.00 57.70 57.69 1xiu n MET 293 Cb 0.46 -1.66 0.03 0.00 0.00 0.00 0.00 33.22 32.05 1xiu n MET 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1xiu s ALA 294 N -3.06 2.96 -0.20 3.17 0.00 -0.51 -5.07 121.76 119.05 1xiu s ALA 294 Ca 0.12 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.90 1xiu s ALA 294 Cb 0.15 -3.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 1xiu s ALA 294 CO 0.54 -0.91 -0.05 0.15 0.00 0.00 0.00 175.76 175.48 1xiu s LYS 295 N -5.21 3.41 -1.48 0.00 3.01 -1.26 -4.72 119.74 113.49 1xiu s LYS 295 Ca 0.56 -0.62 -0.12 0.00 -1.01 0.00 0.00 55.97 54.79 1xiu s LYS 295 Cb -0.11 -2.95 0.06 0.00 -1.01 0.00 0.00 37.83 33.82 1xiu s LYS 295 CO 0.54 -0.09 1.01 -0.25 0.51 0.00 0.00 175.35 177.06 1xiu n ASP 296 N 4.48 -4.87 -3.85 2.83 10.43 -1.26 -4.91 116.55 119.40 1xiu n ASP 296 Ca -0.18 -0.73 -0.07 0.00 2.57 0.00 0.00 54.79 56.38 1xiu n ASP 296 Cb 0.51 -4.15 -0.02 0.00 1.84 0.00 0.00 41.12 39.30 1xiu n ASP 296 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1xiu s GLY 297 N -3.40 -0.07 0.09 0.44 0.00 -1.26 -1.03 107.32 102.09 1xiu s GLY 297 Ca 0.60 -0.32 0.08 0.00 0.00 0.00 0.00 44.72 45.08 1xiu s GLY 297 CO 0.81 -0.11 -0.22 -0.26 0.00 0.00 0.00 173.10 173.32 1xiu s ILE 298 N -3.92 1.79 -0.33 0.90 -4.36 -0.04 -4.82 121.20 110.41 1xiu s ILE 298 Ca 0.11 -1.48 -0.09 0.00 -0.26 0.00 0.00 60.65 58.93 1xiu s ILE 298 Cb -0.06 -1.60 0.01 0.00 1.25 0.00 0.00 42.46 42.07 1xiu s ILE 298 CO 0.06 0.04 0.15 -0.76 0.24 0.00 0.00 174.94 174.68 1xiu s LEU 299 N -1.73 4.28 0.52 0.37 1.43 -1.26 -0.34 118.68 121.95 1xiu s LEU 299 Ca 0.08 -0.77 -0.13 0.00 -1.03 0.00 0.00 54.13 52.27 1xiu s LEU 299 Cb -0.10 -1.97 -0.06 0.00 0.03 0.00 0.00 46.19 44.08 1xiu s LEU 299 CO 0.04 -0.27 0.94 -0.76 0.23 0.00 0.00 176.35 176.53 1xiu s LEU 300 N 1.55 3.57 0.45 1.79 1.02 0.35 -4.79 118.68 122.63 1xiu s LEU 300 Ca 0.03 1.42 0.31 0.00 0.02 0.00 0.00 54.13 55.90 1xiu s LEU 300 Cb -0.18 -4.37 1.44 0.00 0.02 0.00 0.00 46.19 43.10 1xiu s LEU 300 CO 0.05 -0.61 1.93 0.00 0.02 0.00 0.00 176.35 177.74 1xiu h ALA 301 N 0.66 1.00 -0.03 4.21 0.00 -1.91 0.17 119.26 123.37 1xiu h ALA 301 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1xiu h ALA 301 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xiu h ALA 301 CO 0.62 0.00 0.00 0.25 0.00 0.00 0.00 179.25 180.12 1xiu n THR 302 N -2.68 0.03 -1.32 0.00 -2.24 -1.26 -4.86 114.28 101.95 1xiu n THR 302 Ca -0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1xiu n THR 302 Cb 0.18 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1xiu n THR 302 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xiu n GLY 303 N 0.85 0.40 3.79 3.38 0.00 0.04 -5.03 105.19 108.63 1xiu n GLY 303 Ca 0.15 -1.00 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 1xiu n GLY 303 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xiu s LEU 304 N 0.00 3.81 -0.10 0.99 1.43 -1.22 -2.22 118.68 121.37 1xiu s LEU 304 Ca 0.00 -0.06 0.03 0.00 -1.03 0.00 0.00 54.13 53.07 1xiu s LEU 304 Cb 0.00 -2.46 -0.01 0.00 0.03 0.00 0.00 46.19 43.75 1xiu s LEU 304 CO 0.00 0.13 -0.20 -2.28 0.23 0.00 0.00 176.35 174.23 1xiu s HIS 305 N -1.54 2.63 -0.18 0.29 5.65 0.33 -0.50 115.29 121.96 1xiu s HIS 305 Ca 0.30 -0.83 -0.01 0.00 0.25 0.00 0.00 55.06 54.77 1xiu s HIS 305 Cb -0.11 -1.73 0.00 0.00 -1.18 0.00 0.00 32.58 29.56 1xiu s HIS 305 CO 0.23 -0.29 -0.12 0.08 -0.65 0.00 0.00 174.74 173.98 1xiu s VAL 306 N 0.21 2.81 0.21 0.89 1.01 0.54 -1.74 120.40 124.32 1xiu s VAL 306 Ca -0.13 -0.70 -0.24 0.00 0.00 0.00 0.00 61.98 60.91 1xiu s VAL 306 Cb -0.16 -2.22 -0.08 0.00 0.00 0.00 0.00 36.38 33.91 1xiu s VAL 306 CO 0.07 0.49 0.80 -2.28 0.00 0.00 0.00 175.10 174.17 1xiu s HIS 307 N 1.14 3.82 0.33 5.22 2.46 -1.26 -0.87 115.29 126.14 1xiu s HIS 307 Ca 0.01 1.61 0.12 0.00 0.47 0.00 0.00 55.06 57.27 1xiu s HIS 307 Cb -0.14 -2.76 1.03 0.00 -0.13 0.00 0.00 32.58 30.58 1xiu s HIS 307 CO -0.04 0.42 1.61 -0.09 -2.47 0.00 0.00 174.74 174.18 1xiu h ARG 308 N 3.91 0.13 -0.50 2.88 2.43 -1.43 0.88 114.38 122.67 1xiu h ARG 308 Ca -0.47 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.62 1xiu h ARG 308 Cb 1.20 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1xiu h ARG 308 CO 0.66 0.09 0.02 0.66 -1.51 0.00 0.00 179.97 179.88 1xiu h SER 309 N 0.13 0.79 -0.57 -3.80 4.64 -1.93 -2.02 113.55 110.81 1xiu h SER 309 Ca 0.71 -0.19 -0.08 0.00 -0.47 0.00 0.00 61.79 61.77 1xiu h SER 309 Cb 1.66 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.52 1xiu h SER 309 CO -0.73 0.85 0.07 0.28 -0.87 0.00 0.00 176.83 176.43 1xiu h SER 310 N 0.77 0.94 -0.29 4.97 0.02 -1.24 -1.75 113.55 116.96 1xiu h SER 310 Ca 0.15 -0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 60.84 1xiu h SER 310 Cb 0.44 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1xiu h SER 310 CO 0.02 0.96 0.08 0.00 -1.14 0.00 0.00 176.83 176.75 1xiu h ALA 311 N 1.15 1.45 0.11 3.77 0.00 -0.74 0.80 119.26 125.80 1xiu h ALA 311 Ca 0.18 -0.15 -0.28 0.00 0.00 0.00 0.00 54.91 54.66 1xiu h ALA 311 Cb 0.44 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.09 1xiu h ALA 311 CO 0.01 0.40 -1.20 0.45 0.00 0.00 0.00 179.25 178.91 1xiu h HIS 312 N 0.54 0.79 -0.16 0.00 3.86 -1.12 -1.18 115.15 117.87 1xiu h HIS 312 Ca 0.13 -0.51 -0.01 0.00 -1.16 0.00 0.00 60.37 58.82 1xiu h HIS 312 Cb 0.22 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1xiu h HIS 312 CO 0.01 1.36 0.06 0.37 0.86 0.00 0.00 177.93 180.59 1xiu h GLN 313 N 0.20 0.22 -0.31 2.45 4.15 -0.66 -1.05 115.11 120.12 1xiu h GLN 313 Ca -0.16 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.24 1xiu h GLN 313 Cb 1.88 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.53 1xiu h GLN 313 CO 0.22 0.19 0.00 0.00 -1.93 0.00 0.00 178.83 177.31 1xiu n ALA 314 N -2.51 2.46 -0.97 3.38 0.00 0.22 -4.92 120.51 118.17 1xiu n ALA 314 Ca -0.01 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1xiu n ALA 314 Cb 0.12 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1xiu n ALA 314 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xiu n GLY 315 N 1.04 0.64 0.94 0.00 0.00 -0.40 -4.89 105.19 102.52 1xiu n GLY 315 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.18 1xiu n GLY 315 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1xiu n VAL 316 N -2.44 2.36 -0.29 1.61 0.24 -0.50 -4.72 118.33 114.58 1xiu n VAL 316 Ca 0.00 -2.17 0.21 0.00 -2.04 0.00 0.00 64.34 60.34 1xiu n VAL 316 Cb 0.03 -0.28 0.50 0.00 -1.47 0.00 0.00 33.84 32.62 1xiu n VAL 316 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1xiu h GLY 317 N 1.43 1.09 1.46 7.63 0.00 -1.66 -2.30 103.07 110.72 1xiu h GLY 317 Ca 0.08 -0.21 -0.30 0.00 0.00 0.00 0.00 47.33 46.90 1xiu h GLY 317 CO 0.27 -0.07 -1.33 0.00 0.00 0.00 0.00 176.54 175.41 1xiu h THR 318 N 0.42 1.40 -0.13 4.70 1.03 -1.89 -0.43 112.91 118.01 1xiu h THR 318 Ca 0.54 -2.87 -0.23 0.00 -0.01 0.00 0.00 66.41 63.85 1xiu h THR 318 Cb 1.34 2.96 0.01 0.00 -1.07 0.00 0.00 68.15 71.38 1xiu h THR 318 CO -0.25 0.85 -0.82 -0.29 -0.01 0.00 0.00 175.52 175.00 1xiu h ILE 319 N 0.12 1.28 -0.66 0.00 6.09 -1.88 -3.00 117.51 119.46 1xiu h ILE 319 Ca -0.19 -2.03 0.14 0.00 -1.37 0.00 0.00 64.86 61.41 1xiu h ILE 319 Cb 2.04 2.05 -0.10 0.00 0.47 0.00 0.00 36.82 41.28 1xiu h ILE 319 CO 0.23 0.64 0.11 0.15 -3.07 0.00 0.00 178.15 176.21 1xiu h PHE 320 N 0.51 0.16 -0.45 2.19 3.57 -1.44 -1.09 116.94 120.39 1xiu h PHE 320 Ca -0.07 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 1xiu h PHE 320 Cb 1.46 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 40.21 1xiu h PHE 320 CO 0.09 -0.09 0.09 -0.44 -2.23 0.00 0.00 178.31 175.73 1xiu h ASP 321 N 0.22 0.63 -0.87 0.41 3.45 -1.00 -2.07 116.42 117.19 1xiu h ASP 321 Ca 0.36 -0.10 -0.02 0.00 0.43 0.00 0.00 57.03 57.70 1xiu h ASP 321 Cb 0.58 -0.16 -0.04 0.00 -0.56 0.00 0.00 39.33 39.14 1xiu h ASP 321 CO -0.48 0.64 0.48 0.03 -1.57 0.00 0.00 179.24 178.34 1xiu h ARG 322 N 0.65 1.21 0.17 3.56 3.08 -1.20 0.16 114.38 122.01 1xiu h ARG 322 Ca 0.15 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1xiu h ARG 322 Cb 0.27 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1xiu h ARG 322 CO 0.00 0.88 -0.08 0.28 -1.07 0.00 0.00 179.97 179.98 1xiu h VAL 323 N 1.21 0.84 -0.89 2.04 2.07 -0.66 -0.83 116.25 120.03 1xiu h VAL 323 Ca 0.31 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.91 1xiu h VAL 323 Cb 0.02 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 1xiu h VAL 323 CO -0.05 0.00 0.53 -0.07 0.02 0.00 0.00 177.57 178.01 1xiu h LEU 324 N -0.23 0.80 0.18 2.57 3.38 -1.07 -1.06 115.31 119.88 1xiu h LEU 324 Ca -0.02 0.04 -0.35 0.00 0.09 0.00 0.00 57.88 57.64 1xiu h LEU 324 Cb 0.17 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.81 1xiu h LEU 324 CO 0.04 0.46 -1.74 0.74 0.09 0.00 0.00 178.44 178.03 1xiu h THR 325 N 0.91 0.92 0.00 0.22 2.02 -0.51 0.27 112.91 116.73 1xiu h THR 325 Ca 0.42 -2.48 0.00 0.00 0.77 0.00 0.00 66.41 65.11 1xiu h THR 325 Cb 0.33 2.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.48 1xiu h THR 325 CO -0.23 0.85 -1.59 -0.62 0.37 0.00 0.00 175.52 174.30 1xiu n GLU 326 N -3.62 0.57 0.01 6.66 1.02 -0.33 -4.21 120.64 120.73 1xiu n GLU 326 Ca -0.25 -0.09 -0.00 0.00 -0.02 0.00 0.00 57.16 56.79 1xiu n GLU 326 Cb 1.06 -1.60 -0.00 0.00 -0.02 0.00 0.00 31.44 30.87 1xiu n GLU 326 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1xiu n LEU 327 N -2.29 0.46 0.13 -4.62 4.32 -0.55 -4.64 117.00 109.81 1xiu n LEU 327 Ca -0.02 0.06 -0.14 0.00 -0.02 0.00 0.00 56.01 55.90 1xiu n LEU 327 Cb 0.54 -0.19 -0.08 0.00 -1.62 0.00 0.00 43.42 42.07 1xiu n LEU 327 CO 0.44 -0.57 0.81 0.58 -1.22 0.00 0.00 177.39 177.42 1xiu h VAL 328 N -0.05 0.82 -0.06 4.08 2.07 -1.30 0.76 116.25 122.57 1xiu h VAL 328 Ca 0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1xiu h VAL 328 Cb 0.05 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1xiu h VAL 328 CO 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.50 1xiu h ALA 329 N 0.56 1.73 0.00 1.67 0.00 -0.62 0.16 119.26 122.77 1xiu h ALA 329 Ca -0.03 -0.13 -0.24 0.00 0.00 0.00 0.00 54.91 54.52 1xiu h ALA 329 Cb 0.20 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1xiu h ALA 329 CO 0.04 0.20 -1.42 0.87 0.00 0.00 0.00 179.25 178.94 1xiu h LYS 330 N 0.09 0.00 -0.54 0.00 1.57 -1.60 0.16 116.57 116.25 1xiu h LYS 330 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1xiu h LYS 330 Cb 0.23 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1xiu h LYS 330 CO 0.01 0.57 -0.02 0.52 -0.57 0.00 0.00 179.45 179.96 1xiu h MET 331 N 0.00 0.93 0.03 3.15 2.86 -0.13 -2.66 114.93 119.10 1xiu h MET 331 Ca -0.18 -0.28 -0.00 0.00 -2.06 0.00 0.00 59.70 57.17 1xiu h MET 331 Cb 1.84 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 33.41 1xiu h MET 331 CO 0.08 0.93 -0.01 -0.09 1.06 0.00 0.00 176.91 178.88 1xiu h ARG 332 N 0.85 -0.03 -0.93 1.72 2.43 -0.37 -1.04 114.38 117.00 1xiu h ARG 332 Ca 0.16 0.00 0.13 0.00 -0.81 0.00 0.00 59.98 59.46 1xiu h ARG 332 Cb 0.53 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.01 1xiu h ARG 332 CO 0.03 0.55 0.60 -0.44 -1.51 0.00 0.00 179.97 179.20 1xiu h ASP 333 N -0.65 0.78 -0.12 -3.80 3.32 -0.65 -0.09 116.42 115.22 1xiu h ASP 333 Ca -0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xiu h ASP 333 Cb 0.60 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1xiu h ASP 333 CO 0.01 0.41 0.00 1.15 -1.72 0.00 0.00 179.24 179.09 1xiu n MET 334 N -4.58 2.07 -3.69 3.56 0.00 -1.01 -4.96 117.12 108.52 1xiu n MET 334 Ca 0.18 -1.58 -0.26 0.00 0.00 0.00 0.00 57.70 56.04 1xiu n MET 334 Cb 0.40 -1.46 0.03 0.00 0.00 0.00 0.00 33.22 32.19 1xiu n MET 334 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1xiu n LYS 335 N 0.87 -2.82 -1.69 3.17 5.02 -0.05 -4.86 118.16 117.80 1xiu n LYS 335 Ca 0.17 0.54 -0.43 0.00 -2.02 0.00 0.00 58.31 56.57 1xiu n LYS 335 Cb 0.48 -4.70 -0.03 0.00 -0.02 0.00 0.00 35.03 30.76 1xiu n LYS 335 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 1xiu n MET 336 N -4.15 2.62 -2.58 1.97 1.56 -0.49 -5.00 117.12 111.05 1xiu n MET 336 Ca -0.19 0.95 -0.22 0.00 -0.27 0.00 0.00 57.70 57.96 1xiu n MET 336 Cb 0.64 -2.80 0.04 0.00 2.15 0.00 0.00 33.22 33.24 1xiu n MET 336 CO 0.00 0.00 0.00 0.16 -0.73 0.00 0.00 175.97 175.40 1xiu s ASP 337 N 2.08 5.27 0.51 6.12 3.84 -1.26 -4.90 116.67 128.33 1xiu s ASP 337 Ca 0.80 0.15 0.16 0.00 -0.00 0.00 0.00 52.55 53.67 1xiu s ASP 337 Cb -0.54 -1.04 1.24 0.00 -1.38 0.00 0.00 42.92 41.20 1xiu s ASP 337 CO 0.37 -1.17 2.12 0.11 -0.00 0.00 0.00 175.17 176.59 1xiu h LYS 338 N -0.03 0.06 -0.19 2.11 1.57 -1.99 -0.52 116.57 117.59 1xiu h LYS 338 Ca -0.43 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.29 1xiu h LYS 338 Cb 1.29 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.58 1xiu h LYS 338 CO 0.55 0.04 -0.10 1.15 -0.57 0.00 0.00 179.45 180.52 1xiu h THR 339 N 0.07 1.31 -0.64 -0.16 2.02 -1.95 -0.60 112.91 112.96 1xiu h THR 339 Ca 0.06 -1.18 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 1xiu h THR 339 Cb 0.14 1.69 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 1xiu h THR 339 CO -0.01 0.35 0.17 -0.33 0.37 0.00 0.00 175.52 176.08 1xiu h GLU 340 N 0.09 1.00 -0.33 6.66 5.08 -1.66 -1.27 114.58 124.14 1xiu h GLU 340 Ca 0.04 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1xiu h GLU 340 Cb 0.60 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1xiu h GLU 340 CO 0.03 0.88 0.05 1.25 -1.00 0.00 0.00 179.01 180.21 1xiu h LEU 341 N 0.96 0.53 -0.81 1.33 5.85 -0.99 0.97 115.31 123.15 1xiu h LEU 341 Ca 0.21 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1xiu h LEU 341 Cb 0.32 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1xiu h LEU 341 CO -0.00 0.66 0.45 1.23 -0.34 0.00 0.00 178.44 180.44 1xiu h GLY 342 N 0.38 1.19 0.93 3.75 0.00 -0.68 0.18 103.07 108.81 1xiu h GLY 342 Ca 0.10 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.89 1xiu h GLY 342 CO 0.01 0.51 -0.06 0.00 0.00 0.00 0.00 176.54 177.00 1xiu h LEU 344 N -0.24 0.71 -1.14 0.00 3.38 -0.18 0.19 115.31 118.03 1xiu h LEU 344 Ca -0.02 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1xiu h LEU 344 Cb 0.19 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1xiu h LEU 344 CO 0.03 0.42 -0.29 0.03 0.09 0.00 0.00 178.44 178.72 1xiu h ARG 345 N 0.83 0.23 -0.32 1.13 3.08 -0.22 -1.38 114.38 117.74 1xiu h ARG 345 Ca 0.39 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 60.26 1xiu h ARG 345 Cb 0.31 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1xiu h ARG 345 CO -0.23 0.51 -0.20 0.00 -1.07 0.00 0.00 179.97 178.98 1xiu h ALA 346 N 1.50 0.45 -0.70 0.04 0.00 0.12 0.24 119.26 120.91 1xiu h ALA 346 Ca 0.03 -0.36 0.09 0.00 0.00 0.00 0.00 54.91 54.67 1xiu h ALA 346 Cb 0.63 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1xiu h ALA 346 CO 0.05 0.40 0.35 0.28 0.00 0.00 0.00 179.25 180.32 1xiu h VAL 347 N 0.45 0.85 -0.49 0.00 2.07 -0.32 0.24 116.25 119.05 1xiu h VAL 347 Ca 0.06 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.28 1xiu h VAL 347 Cb 0.75 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1xiu h VAL 347 CO 0.06 0.11 -0.09 0.58 0.02 0.00 0.00 177.57 178.25 1xiu h VAL 348 N 0.59 1.26 -0.69 2.57 2.07 -0.71 -2.57 116.25 118.77 1xiu h VAL 348 Ca 0.34 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 1xiu h VAL 348 Cb 0.35 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1xiu h VAL 348 CO -0.26 0.41 0.16 0.25 0.02 0.00 0.00 177.57 178.15 1xiu h LEU 349 N 0.80 1.04 -5.71 2.57 5.85 0.11 -3.18 115.31 116.80 1xiu h LEU 349 Ca 0.13 -0.22 -0.72 0.00 0.84 0.00 0.00 57.88 57.92 1xiu h LEU 349 Cb 0.60 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 1xiu h LEU 349 CO 0.04 1.00 2.92 0.49 -0.34 0.00 0.00 178.44 182.55 1xiu n PHE 350 N -4.23 2.82 -2.98 1.25 0.99 0.68 -4.84 117.46 111.14 1xiu n PHE 350 Ca 0.05 -2.93 -0.44 0.00 -0.00 0.00 0.00 57.45 54.13 1xiu n PHE 350 Cb 0.26 -2.22 -0.04 0.00 -1.00 0.00 0.00 39.48 36.48 1xiu n PHE 350 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1xiu s ASN 351 N 1.63 6.20 0.00 4.37 2.47 -1.20 -4.61 114.94 123.79 1xiu s ASN 351 Ca 0.54 -1.08 0.22 0.00 0.42 0.00 0.00 52.86 52.96 1xiu s ASN 351 Cb 0.15 -2.36 1.21 0.00 -1.45 0.00 0.00 41.25 38.80 1xiu s ASN 351 CO -0.06 -1.24 1.68 -0.81 -3.72 0.00 0.00 177.10 172.95 1xiu n PRO 352 N 7.01 0.53 -0.03 0.43 -0.04 -1.26 -2.09 135.00 139.56 1xiu n PRO 352 Ca -0.06 0.04 0.13 0.00 -0.04 0.00 0.00 63.50 63.56 1xiu n PRO 352 Cb 0.45 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.94 1xiu n PRO 352 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1xiu n ASP 353 N -1.11 1.19 -4.76 3.54 8.00 -1.26 -4.96 116.55 117.18 1xiu n ASP 353 Ca 0.14 -1.49 -0.39 0.00 0.71 0.00 0.00 54.79 53.76 1xiu n ASP 353 Cb 0.11 -0.03 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 1xiu n ASP 353 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xiu s ALA 354 N -1.93 3.33 0.33 2.24 0.00 -0.89 -4.93 121.76 119.91 1xiu s ALA 354 Ca 0.36 0.87 -0.29 0.00 0.00 0.00 0.00 51.96 52.91 1xiu s ALA 354 Cb 0.19 -3.32 -0.10 0.00 0.00 0.00 0.00 23.12 19.89 1xiu s ALA 354 CO 0.30 -0.20 1.29 0.15 0.00 0.00 0.00 175.76 177.30 1xiu s LYS 355 N -1.72 4.36 0.00 0.00 -0.14 -1.26 -3.49 119.74 117.49 1xiu s LYS 355 Ca 0.48 2.18 0.00 0.00 -1.36 0.00 0.00 55.97 57.27 1xiu s LYS 355 Cb -0.30 -3.07 0.00 0.00 -1.68 0.00 0.00 37.83 32.78 1xiu s LYS 355 CO 0.38 -0.17 0.00 0.41 -0.76 0.00 0.00 175.35 175.21 1xiu n GLY 356 N 0.82 0.78 3.74 -3.33 0.00 -1.26 -4.99 105.19 100.94 1xiu n GLY 356 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1xiu n GLY 356 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xiu n LEU 357 N 0.00 4.30 -0.07 0.99 4.77 -1.23 -4.96 117.00 120.81 1xiu n LEU 357 Ca 0.00 1.21 -0.07 0.00 -0.03 0.00 0.00 56.01 57.12 1xiu n LEU 357 Cb 0.00 -1.57 -0.05 0.00 -2.33 0.00 0.00 43.42 39.47 1xiu n LEU 357 CO 0.00 -0.07 -0.06 0.74 -1.33 0.00 0.00 177.39 176.66 1xiu h THR 358 N 2.85 0.52 -0.64 -5.08 2.02 -1.94 -3.40 112.91 107.24 1xiu h THR 358 Ca -0.49 -1.46 -0.37 0.00 0.77 0.00 0.00 66.41 64.87 1xiu h THR 358 Cb 1.26 1.05 -0.13 0.00 -1.74 0.00 0.00 68.15 68.58 1xiu h THR 358 CO 0.65 0.18 0.11 0.00 0.37 0.00 0.00 175.52 176.83 1xiu n ALA 359 N -3.03 6.30 -0.32 6.16 0.00 -1.26 -4.65 120.51 123.72 1xiu n ALA 359 Ca -0.08 -2.48 0.06 0.00 0.00 0.00 0.00 53.44 50.94 1xiu n ALA 359 Cb 0.26 -2.14 0.13 0.00 0.00 0.00 0.00 19.45 17.70 1xiu n ALA 359 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1xiu n VAL 360 N 1.43 -0.37 0.08 0.00 0.31 -1.26 -0.65 118.33 117.86 1xiu n VAL 360 Ca 0.45 2.02 -0.03 0.00 -0.01 0.00 0.00 64.34 66.76 1xiu n VAL 360 Cb 0.68 -2.81 -0.07 0.00 -0.91 0.00 0.00 33.84 30.74 1xiu n VAL 360 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1xiu h GLN 361 N 0.00 0.00 -0.03 5.55 4.15 -1.97 -0.37 115.11 122.44 1xiu h GLN 361 Ca 0.43 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.85 1xiu h GLN 361 Cb 0.67 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 1xiu h GLN 361 CO -0.91 0.76 0.02 1.49 -1.93 0.00 0.00 178.83 178.26 1xiu h GLU 362 N 0.00 0.04 -0.85 1.69 4.81 -1.26 -0.51 114.58 118.51 1xiu h GLU 362 Ca -0.03 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1xiu h GLU 362 Cb 1.64 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.97 1xiu h GLU 362 CO 0.10 0.11 0.44 0.28 -0.73 0.00 0.00 179.01 179.21 1xiu h VAL 363 N -0.03 1.25 -1.00 0.32 2.07 -0.91 -0.64 116.25 117.30 1xiu h VAL 363 Ca 0.01 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 66.88 1xiu h VAL 363 Cb 0.08 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 29.93 1xiu h VAL 363 CO -0.00 0.29 0.66 -0.33 0.02 0.00 0.00 177.57 178.21 1xiu h GLU 364 N 1.20 1.31 -0.19 1.57 5.08 -0.73 0.86 114.58 123.67 1xiu h GLU 364 Ca 0.30 -0.08 -0.18 0.00 -1.00 0.00 0.00 59.36 58.39 1xiu h GLU 364 Cb 0.06 -0.30 -0.00 0.00 0.50 0.00 0.00 28.75 29.02 1xiu h GLU 364 CO -0.04 0.87 -0.62 1.96 -1.00 0.00 0.00 179.01 180.17 1xiu h GLN 365 N 1.35 0.66 -0.78 2.33 4.20 0.32 -1.78 115.11 121.40 1xiu h GLN 365 Ca 0.37 -0.46 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1xiu h GLN 365 Cb -0.14 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 1xiu h GLN 365 CO -0.09 1.08 0.34 -0.07 -0.67 0.00 0.00 178.83 179.42 1xiu h LEU 366 N 0.49 1.05 -0.53 1.46 3.38 -0.77 -0.58 115.31 119.80 1xiu h LEU 366 Ca -0.01 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.68 1xiu h LEU 366 Cb 1.20 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1xiu h LEU 366 CO 0.12 0.91 -0.34 -0.09 0.09 0.00 0.00 178.44 179.13 1xiu h ARG 367 N 1.13 0.82 -0.77 1.13 2.43 -0.57 -1.82 114.38 116.72 1xiu h ARG 367 Ca 0.27 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1xiu h ARG 367 Cb 0.16 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 1xiu h ARG 367 CO -0.03 1.03 0.44 0.93 -1.51 0.00 0.00 179.97 180.83 1xiu h GLU 368 N 0.69 1.05 0.52 0.20 5.08 -0.96 -1.36 114.58 119.80 1xiu h GLU 368 Ca 0.07 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1xiu h GLU 368 Cb 0.89 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.93 1xiu h GLU 368 CO 0.08 0.76 -0.25 0.87 -1.00 0.00 0.00 179.01 179.47 1xiu h LYS 369 N 1.06 -0.67 -0.40 2.33 1.79 -0.82 -1.20 116.57 118.66 1xiu h LYS 369 Ca 0.27 0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.87 1xiu h LYS 369 Cb -0.01 0.15 -0.08 0.00 -1.58 0.00 0.00 32.23 30.71 1xiu h LYS 369 CO -0.05 -0.40 -0.16 0.28 -1.08 0.00 0.00 179.45 178.04 1xiu h VAL 370 N -0.80 0.48 0.00 0.50 2.07 -0.96 0.55 116.25 118.09 1xiu h VAL 370 Ca -0.07 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 1xiu h VAL 370 Cb 0.58 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1xiu h VAL 370 CO 0.12 0.00 -0.45 0.10 0.02 0.00 0.00 177.57 177.36 1xiu h TYR 371 N -0.08 0.00 -0.47 1.57 -0.00 -1.16 -0.04 116.97 116.79 1xiu h TYR 371 Ca 0.20 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.90 1xiu h TYR 371 Cb 0.39 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.10 1xiu h TYR 371 CO -0.41 0.45 0.16 0.00 -0.00 0.00 0.00 178.16 178.36 1xiu h ALA 372 N 1.55 0.61 -0.54 0.10 0.00 0.12 0.70 119.26 121.81 1xiu h ALA 372 Ca -0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.64 1xiu h ALA 372 Cb 1.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1xiu h ALA 372 CO 0.06 0.24 -0.05 0.77 0.00 0.00 0.00 179.25 180.27 1xiu h SER 373 N 0.61 0.94 -0.58 0.00 0.02 -0.48 -0.94 113.55 113.13 1xiu h SER 373 Ca 0.15 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1xiu h SER 373 Cb 0.24 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1xiu h SER 373 CO -0.01 1.02 0.37 0.25 -1.14 0.00 0.00 176.83 177.33 1xiu h LEU 374 N 0.87 0.68 -0.77 5.07 5.85 -0.83 0.22 115.31 126.41 1xiu h LEU 374 Ca 0.15 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1xiu h LEU 374 Cb 0.58 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1xiu h LEU 374 CO 0.03 0.51 0.33 -0.08 -0.34 0.00 0.00 178.44 178.89 1xiu h GLU 375 N 0.78 1.13 0.47 1.25 4.81 -0.19 -0.56 114.58 122.28 1xiu h GLU 375 Ca 0.21 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1xiu h GLU 375 Cb -0.06 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.11 1xiu h GLU 375 CO -0.04 0.91 -0.36 1.49 -0.73 0.00 0.00 179.01 180.28 1xiu h GLU 376 N 1.10 -0.79 -0.52 1.92 4.22 -0.86 0.25 114.58 119.90 1xiu h GLU 376 Ca 0.26 0.05 0.10 0.00 0.08 0.00 0.00 59.36 59.86 1xiu h GLU 376 Cb 0.19 0.18 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 1xiu h GLU 376 CO -0.02 -0.53 -0.05 -0.92 -2.18 0.00 0.00 179.01 175.31 1xiu h TYR 377 N -0.82 -0.12 -0.37 0.92 3.20 -0.11 -2.55 116.97 117.12 1xiu h TYR 377 Ca -0.05 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.88 1xiu h TYR 377 Cb 0.70 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 1xiu h TYR 377 CO -0.15 -0.16 0.22 1.15 -1.64 0.00 0.00 178.16 177.58 1xiu h THR 378 N 0.07 1.05 -0.52 1.81 2.02 -0.96 0.29 112.91 116.67 1xiu h THR 378 Ca 0.26 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.28 1xiu h THR 378 Cb 0.40 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1xiu h THR 378 CO -0.47 0.08 0.31 0.11 0.37 0.00 0.00 175.52 175.92 1xiu h LYS 379 N 0.45 0.70 0.01 6.66 1.79 -0.70 -1.95 116.57 123.53 1xiu h LYS 379 Ca 0.14 -0.06 -0.26 0.00 -2.18 0.00 0.00 60.65 58.30 1xiu h LYS 379 Cb -0.01 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 30.45 1xiu h LYS 379 CO -0.06 0.50 -1.39 -1.13 -1.08 0.00 0.00 179.45 176.29 1xiu n SER 380 N -4.43 1.89 0.03 0.86 3.41 -0.92 -3.15 113.62 111.31 1xiu n SER 380 Ca 0.05 0.40 0.07 0.00 -0.26 0.00 0.00 58.87 59.13 1xiu n SER 380 Cb 0.08 -0.95 0.32 0.00 -0.26 0.00 0.00 64.21 63.40 1xiu n SER 380 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xiu n ARG 381 N -4.33 0.04 -2.71 4.33 3.00 0.96 -4.10 116.66 113.85 1xiu n ARG 381 Ca -0.33 0.32 -0.06 0.00 -0.01 0.00 0.00 57.85 57.77 1xiu n ARG 381 Cb 0.73 -1.59 0.06 0.00 0.00 0.00 0.00 32.46 31.66 1xiu n ARG 381 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1xiu n TYR 382 N -1.67 0.07 0.74 -1.55 4.02 -0.73 -4.95 117.16 113.09 1xiu n TYR 382 Ca 0.03 -2.34 0.07 0.00 -0.01 0.00 0.00 57.90 55.65 1xiu n TYR 382 Cb 0.16 0.28 0.39 0.00 -0.02 0.00 0.00 39.34 40.14 1xiu n TYR 382 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1xiu n PRO 383 N -0.46 0.26 0.00 -0.72 -0.04 -1.19 -0.20 135.00 132.64 1xiu n PRO 383 Ca 0.03 0.12 0.09 0.00 -0.04 0.00 0.00 63.50 63.70 1xiu n PRO 383 Cb 0.83 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 33.18 1xiu n PRO 383 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1xiu n GLU 384 N -1.24 0.02 -3.83 0.54 4.71 -1.26 -4.59 120.64 114.99 1xiu n GLU 384 Ca 0.08 0.19 -0.28 0.00 -0.01 0.00 0.00 57.16 57.13 1xiu n GLU 384 Cb 0.11 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 28.92 1xiu n GLU 384 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 1xiu s GLU 385 N -2.97 2.13 0.50 3.49 2.02 0.72 -4.95 118.70 119.63 1xiu s GLU 385 Ca 0.09 -3.02 0.14 0.00 0.02 0.00 0.00 54.97 52.21 1xiu s GLU 385 Cb 0.12 -3.08 1.18 0.00 0.10 0.00 0.00 34.13 32.45 1xiu s GLU 385 CO 0.33 -1.27 2.12 -1.00 0.02 0.00 0.00 175.26 175.46 1xiu h PRO 386 N 5.64 0.09 0.00 0.39 0.13 -1.82 -1.94 132.00 134.49 1xiu h PRO 386 Ca 0.13 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1xiu h PRO 386 Cb 0.80 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1xiu h PRO 386 CO 0.65 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.91 1xiu n GLY 387 N -1.49 -0.89 0.31 1.56 0.00 -1.26 -4.32 105.19 99.11 1xiu n GLY 387 Ca -0.02 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 1xiu n GLY 387 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1xiu h ARG 388 N 0.00 1.07 0.38 1.61 2.43 -1.73 -1.95 114.38 116.19 1xiu h ARG 388 Ca 0.00 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 58.85 1xiu h ARG 388 Cb 0.00 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1xiu h ARG 388 CO 0.00 1.00 -0.18 0.35 -1.51 0.00 0.00 179.97 179.63 1xiu h PHE 389 N 0.99 -0.47 -0.76 2.20 3.57 -1.83 -0.28 116.94 120.36 1xiu h PHE 389 Ca 0.19 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.84 1xiu h PHE 389 Cb 0.48 0.16 -0.14 0.00 2.79 0.00 0.00 35.95 39.23 1xiu h PHE 389 CO 0.03 -0.16 -0.15 0.00 -2.23 0.00 0.00 178.31 175.80 1xiu h ALA 390 N -0.29 0.56 -0.87 2.41 0.00 -1.83 -0.87 119.26 118.38 1xiu h ALA 390 Ca -0.05 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1xiu h ALA 390 Cb 0.52 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1xiu h ALA 390 CO 0.09 -0.42 0.47 -0.22 0.00 0.00 0.00 179.25 179.17 1xiu h LYS 391 N 0.02 1.21 -0.31 0.00 3.64 -0.83 0.71 116.57 121.01 1xiu h LYS 391 Ca 0.38 -0.14 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 1xiu h LYS 391 Cb 0.60 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1xiu h LYS 391 CO -0.77 0.89 0.02 -0.07 -2.27 0.00 0.00 179.45 177.25 1xiu h LEU 392 N 1.22 0.51 -0.68 5.20 3.38 0.31 -3.12 115.31 122.13 1xiu h LEU 392 Ca 0.31 -0.29 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1xiu h LEU 392 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1xiu h LEU 392 CO -0.05 0.68 -0.20 -0.07 0.09 0.00 0.00 178.44 178.89 1xiu h LEU 393 N 0.33 0.83 0.00 1.67 3.38 -0.05 -2.03 115.31 119.45 1xiu h LEU 393 Ca 0.09 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xiu h LEU 393 Cb 0.40 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1xiu h LEU 393 CO 0.01 1.01 0.00 0.18 0.09 0.00 0.00 178.44 179.73 1xiu n LEU 394 N -4.12 0.00 0.04 1.67 4.32 0.23 -1.03 117.00 118.10 1xiu n LEU 394 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 56.01 56.11 1xiu n LEU 394 Cb 0.42 0.00 0.10 0.00 -1.62 0.00 0.00 43.42 42.32 1xiu n LEU 394 CO 0.45 0.00 0.17 -1.14 -1.22 0.00 0.00 177.39 175.65 1xiu n ARG 395 N -0.73 0.26 -0.11 3.23 3.00 -0.76 -4.39 116.66 117.16 1xiu n ARG 395 Ca 0.03 0.03 -0.08 0.00 -0.00 0.00 0.00 57.85 57.83 1xiu n ARG 395 Cb 0.02 -1.62 0.07 0.00 0.00 0.00 0.00 32.46 30.93 1xiu n ARG 395 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 1xiu h LEU 396 N 0.00 0.84 -0.62 6.15 3.38 -1.25 -1.97 115.31 121.85 1xiu h LEU 396 Ca 0.00 -0.30 0.05 0.00 0.09 0.00 0.00 57.88 57.72 1xiu h LEU 396 Cb 0.71 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1xiu h LEU 396 CO 0.00 1.03 0.35 -0.65 0.09 0.00 0.00 178.44 179.25 1xiu h PRO 397 N 0.73 0.63 -0.98 1.13 0.11 -1.77 0.25 132.00 132.10 1xiu h PRO 397 Ca 0.10 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.19 1xiu h PRO 397 Cb 0.73 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 31.64 1xiu h PRO 397 CO 0.06 0.42 0.65 0.00 -0.21 0.00 0.00 178.00 178.92 1xiu h ALA 398 N 1.32 1.32 -0.57 -0.75 0.00 -1.68 -0.19 119.26 118.71 1xiu h ALA 398 Ca 0.27 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1xiu h ALA 398 Cb 0.14 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1xiu h ALA 398 CO -0.16 0.62 0.24 1.25 0.00 0.00 0.00 179.25 181.20 1xiu h LEU 399 N 1.31 0.77 0.31 0.00 5.85 -0.98 0.11 115.31 122.68 1xiu h LEU 399 Ca 0.37 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 1xiu h LEU 399 Cb -0.11 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.72 1xiu h LEU 399 CO -0.09 0.72 -0.18 -0.09 -0.34 0.00 0.00 178.44 178.46 1xiu h ARG 400 N 0.77 -0.45 -0.32 1.25 9.65 -0.25 0.22 114.38 125.27 1xiu h ARG 400 Ca 0.19 0.03 0.03 0.00 -1.10 0.00 0.00 59.98 59.13 1xiu h ARG 400 Cb 0.18 0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.83 1xiu h ARG 400 CO -0.02 -0.30 0.12 1.03 2.80 0.00 0.00 179.97 183.60 1xiu h SER 401 N -0.46 0.14 0.25 -3.80 0.87 -0.59 -1.84 113.55 108.11 1xiu h SER 401 Ca -0.03 0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 1xiu h SER 401 Cb 0.38 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1xiu h SER 401 CO 0.04 0.12 -0.39 0.40 -0.53 0.00 0.00 176.83 176.47 1xiu h ILE 402 N 0.26 1.30 -0.44 2.23 2.04 -0.63 -1.75 117.51 120.52 1xiu h ILE 402 Ca 0.14 -1.45 0.02 0.00 1.00 0.00 0.00 64.86 64.57 1xiu h ILE 402 Cb 0.10 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1xiu h ILE 402 CO -0.14 0.43 0.26 1.23 0.00 0.00 0.00 178.15 179.93 1xiu h GLY 403 N 1.19 0.61 1.01 5.37 0.00 -0.43 0.41 103.07 111.24 1xiu h GLY 403 Ca 0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 1xiu h GLY 403 CO 0.06 0.17 0.24 1.41 0.00 0.00 0.00 176.54 178.41 1xiu h LEU 404 N 0.52 0.91 -0.99 3.11 3.38 -0.92 -2.52 115.31 118.80 1xiu h LEU 404 Ca 0.17 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1xiu h LEU 404 Cb 0.01 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1xiu h LEU 404 CO -0.08 0.85 -0.09 0.50 0.09 0.00 0.00 178.44 179.70 1xiu h LYS 405 N 0.91 0.63 -0.80 1.13 1.63 -0.87 -1.97 116.57 117.23 1xiu h LYS 405 Ca 0.21 -0.18 -0.01 0.00 -0.85 0.00 0.00 60.65 59.82 1xiu h LYS 405 Cb 0.24 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.76 1xiu h LYS 405 CO -0.01 0.72 0.48 0.00 -3.45 0.00 0.00 179.45 177.18 1xiu h LEU 407 N 1.10 0.96 -0.59 0.00 3.38 -1.00 0.97 115.31 120.13 1xiu h LEU 407 Ca 0.29 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 58.10 1xiu h LEU 407 Cb -0.03 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.40 1xiu h LEU 407 CO -0.05 0.99 0.24 -0.33 0.09 0.00 0.00 178.44 179.38 1xiu h GLU 408 N 0.92 0.43 -0.63 1.13 5.08 -1.05 -0.17 114.58 120.28 1xiu h GLU 408 Ca 0.18 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1xiu h GLU 408 Cb 0.48 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1xiu h GLU 408 CO 0.02 0.28 0.41 0.45 -1.00 0.00 0.00 179.01 179.17 1xiu h HIS 409 N 0.44 0.77 -0.38 4.33 3.86 -0.15 -2.25 115.15 121.77 1xiu h HIS 409 Ca 0.29 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.38 1xiu h HIS 409 Cb 0.32 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 1xiu h HIS 409 CO -0.15 0.47 -0.30 -0.07 0.86 0.00 0.00 177.93 178.74 1xiu h LEU 410 N 0.83 0.87 -1.35 2.43 3.38 -0.37 -0.67 115.31 120.43 1xiu h LEU 410 Ca 0.24 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1xiu h LEU 410 Cb -0.05 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1xiu h LEU 410 CO -0.07 1.11 0.03 -0.26 0.09 0.00 0.00 178.44 179.33 1xiu h PHE 411 N 0.71 0.47 -0.07 1.13 -1.00 -0.79 -0.32 116.94 117.06 1xiu h PHE 411 Ca 0.08 -0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.76 1xiu h PHE 411 Cb 0.85 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.27 1xiu h PHE 411 CO 0.05 0.45 -0.20 0.35 -1.61 0.00 0.00 178.31 177.35 1xiu h PHE 412 N 0.45 0.35 -0.66 -0.55 3.57 -0.79 -2.19 116.94 117.11 1xiu h PHE 412 Ca 0.10 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 1xiu h PHE 412 Cb 0.25 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 1xiu h PHE 412 CO 0.01 0.81 0.26 0.74 -2.23 0.00 0.00 178.31 177.90 1xiu h PHE 413 N -0.22 0.98 0.00 0.41 0.05 -0.96 -0.79 116.94 116.41 1xiu h PHE 413 Ca -0.00 -0.06 -0.02 0.00 3.82 0.00 0.00 57.97 61.70 1xiu h PHE 413 Cb 0.81 -0.30 -0.00 0.00 2.00 0.00 0.00 35.95 38.46 1xiu h PHE 413 CO 0.12 0.75 -0.11 -0.22 -0.18 0.00 0.00 178.31 178.67 1xiu h LYS 414 N 0.95 0.00 0.19 1.51 3.64 -0.93 -1.96 116.57 119.97 1xiu h LYS 414 Ca 0.22 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.27 1xiu h LYS 414 Cb 0.19 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1xiu h LYS 414 CO -0.02 0.11 -1.60 1.25 -2.27 0.00 0.00 179.45 176.93 1xiu h LEU 415 N 0.00 0.63 -0.75 5.20 5.85 -0.96 -3.03 115.31 122.24 1xiu h LEU 415 Ca -0.00 -0.81 0.15 0.00 0.84 0.00 0.00 57.88 58.06 1xiu h LEU 415 Cb 0.21 -0.20 -0.14 0.00 0.37 0.00 0.00 40.66 40.89 1xiu h LEU 415 CO 0.01 1.67 -0.17 0.40 -0.34 0.00 0.00 178.44 180.01 1xiu h ILE 416 N 0.11 0.26 0.00 4.05 1.08 -0.81 -2.42 117.51 119.77 1xiu h ILE 416 Ca -0.29 -0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 1xiu h ILE 416 Cb 2.10 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.10 1xiu h ILE 416 CO 0.21 0.00 -0.11 1.23 -0.69 0.00 0.00 178.15 178.79 1xiu h GLY 417 N 0.01 0.00 0.11 5.37 0.00 -1.40 -2.88 103.07 104.27 1xiu h GLY 417 Ca 0.37 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.76 1xiu h GLY 417 CO -0.76 0.00 0.88 -1.80 0.00 0.00 0.00 176.54 174.86 1xiu h ASP 418 N 0.00 0.00 -1.72 0.19 3.58 -1.30 -3.43 116.42 113.74 1xiu h ASP 418 Ca 0.00 0.00 0.11 0.00 0.42 0.00 0.00 57.03 57.56 1xiu h ASP 418 Cb 0.81 0.00 -0.21 0.00 1.72 0.00 0.00 39.33 41.65 1xiu h ASP 418 CO 0.00 0.00 -0.02 -1.58 -2.88 0.00 0.00 179.24 174.76 1xiu s GLN 419 N -4.14 0.49 1.04 0.28 2.00 -1.09 -5.12 119.66 113.13 1xiu s GLN 419 Ca -0.01 1.24 -0.15 0.00 -2.00 0.00 0.00 55.36 54.43 1xiu s GLN 419 Cb 0.05 0.74 0.21 0.00 0.80 0.00 0.00 33.01 34.81 1xiu s GLN 419 CO 0.18 -0.17 1.14 -1.25 -0.50 0.00 0.00 175.29 174.69 1xiu s PRO 420 N 2.75 0.05 0.15 1.67 0.04 -1.26 -4.98 135.00 133.42 1xiu s PRO 420 Ca -0.05 0.12 -0.30 0.00 0.04 0.00 0.00 61.00 60.81 1xiu s PRO 420 Cb -0.10 -1.73 -0.07 0.00 0.04 0.00 0.00 34.50 32.64 1xiu s PRO 420 CO -0.19 -2.90 1.05 0.42 0.04 0.00 0.00 177.00 175.42 1xiu s ILE 421 N -3.19 4.10 1.09 0.56 1.01 -1.26 -5.06 121.20 118.46 1xiu s ILE 421 Ca 0.68 1.79 -0.12 0.00 0.00 0.00 0.00 60.65 62.99 1xiu s ILE 421 Cb -0.13 -4.14 0.24 0.00 0.01 0.00 0.00 42.46 38.45 1xiu s ILE 421 CO 0.55 0.29 1.06 -1.81 0.00 0.00 0.00 174.94 175.03 1xiu s ASP 422 N -0.06 1.61 0.24 3.58 -0.00 -1.26 -4.59 116.67 116.20 1xiu s ASP 422 Ca 0.49 1.55 0.15 0.00 -0.00 0.00 0.00 52.55 54.74 1xiu s ASP 422 Cb -0.27 -2.27 0.02 0.00 -0.00 0.00 0.00 42.92 40.41 1xiu s ASP 422 CO 0.33 -3.81 1.33 0.71 -0.00 0.00 0.00 175.17 173.72 1xiu h THR 423 N -2.36 0.81 0.05 -1.27 1.35 -1.98 0.49 112.91 109.99 1xiu h THR 423 Ca -0.57 -2.19 -0.28 0.00 -0.55 0.00 0.00 66.41 62.82 1xiu h THR 423 Cb 1.32 2.35 0.02 0.00 -1.73 0.00 0.00 68.15 70.12 1xiu h THR 423 CO 0.51 0.46 -1.12 0.15 -0.25 0.00 0.00 175.52 175.26 1xiu h PHE 424 N 0.00 0.98 -0.87 4.73 3.57 -1.99 -1.57 116.94 121.79 1xiu h PHE 424 Ca -0.03 -0.57 -0.02 0.00 3.53 0.00 0.00 57.97 60.88 1xiu h PHE 424 Cb 1.42 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 40.02 1xiu h PHE 424 CO 0.00 1.41 0.48 1.25 -2.23 0.00 0.00 178.31 179.22 1xiu h LEU 425 N 0.32 1.09 -0.90 0.59 5.85 -1.85 -0.42 115.31 120.00 1xiu h LEU 425 Ca -0.15 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 1xiu h LEU 425 Cb 1.78 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.50 1xiu h LEU 425 CO 0.21 0.88 0.39 -0.03 -0.34 0.00 0.00 178.44 179.55 1xiu h MET 426 N 1.22 1.17 -0.09 1.25 4.05 -0.79 -2.04 114.93 119.70 1xiu h MET 426 Ca 0.31 -0.17 -0.07 0.00 -0.28 0.00 0.00 59.70 59.49 1xiu h MET 426 Cb 0.03 -0.21 -0.01 0.00 -0.80 0.00 0.00 31.60 30.60 1xiu h MET 426 CO -0.05 0.91 -0.25 1.49 0.23 0.00 0.00 176.91 179.24 1xiu h GLU 427 N 1.16 0.15 -0.01 0.39 4.81 -0.08 -1.47 114.58 119.53 1xiu h GLU 427 Ca 0.28 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.33 1xiu h GLU 427 Cb 0.12 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1xiu h GLU 427 CO -0.03 0.40 -0.62 0.52 -0.73 0.00 0.00 179.01 178.54 1xiu h MET 428 N 0.14 0.05 0.00 1.92 2.86 -0.49 -0.81 114.93 118.60 1xiu h MET 428 Ca 0.02 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1xiu h MET 428 Cb 0.52 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1xiu h MET 428 CO 0.04 0.65 0.00 1.28 1.06 0.00 0.00 176.91 179.94 1xiu n LEU 429 N -3.82 0.00 0.00 1.22 4.32 -0.87 -5.12 117.00 112.73 1xiu n LEU 429 Ca -0.01 0.01 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1xiu n LEU 429 Cb 0.62 -0.01 0.00 0.00 -1.62 0.00 0.00 43.42 42.40 1xiu n LEU 429 CO 0.43 -0.00 0.00 -0.62 -1.22 0.00 0.00 177.39 175.98