#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jua n MET 209 N 0.00 0.00 -0.03 -1.46 0.00 -1.12 -4.65 117.12 109.86 3jua n MET 209 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 57.70 57.68 3jua n MET 209 Cb 0.00 -3.67 -0.13 0.00 0.00 0.00 0.00 33.22 29.41 3jua n MET 209 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 175.97 173.84 3jua n ARG 210 N -2.00 0.65 -0.25 0.03 0.63 -1.26 -0.70 116.66 113.77 3jua n ARG 210 Ca 0.00 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 3jua n ARG 210 Cb 0.00 -1.64 0.00 0.00 0.45 0.00 0.00 32.46 31.27 3jua n ARG 210 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3jua n SER 211 N -2.71 0.00 -2.37 6.15 3.41 -1.26 -4.52 113.62 112.32 3jua n SER 211 Ca -0.17 -0.15 -0.21 0.00 -0.26 0.00 0.00 58.87 58.08 3jua n SER 211 Cb 0.91 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.75 3jua n SER 211 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3jua n ILE 212 N 0.00 3.37 -4.43 -1.33 3.06 -1.26 -4.67 119.36 114.10 3jua n ILE 212 Ca 0.00 -2.21 -0.23 0.00 -2.50 0.00 0.00 62.75 57.80 3jua n ILE 212 Cb 0.00 -1.96 -0.10 0.00 0.54 0.00 0.00 39.64 38.12 3jua n ILE 212 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3jua s ALA 213 N 0.22 2.53 0.00 1.51 0.00 -1.26 -2.37 121.76 122.39 3jua s ALA 213 Ca 0.64 -1.77 0.00 0.00 0.00 0.00 0.00 51.96 50.83 3jua s ALA 213 Cb 0.32 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.20 3jua s ALA 213 CO -0.08 0.27 0.00 -1.13 0.00 0.00 0.00 175.76 174.82 3jua n SER 214 N -0.35 1.89 0.25 0.00 3.41 -0.58 -2.79 113.62 115.46 3jua n SER 214 Ca -0.07 -0.55 0.13 0.00 -0.26 0.00 0.00 58.87 58.12 3jua n SER 214 Cb 0.59 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.17 3jua n SER 214 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3jua h SER 215 N 0.00 0.00 0.00 4.04 0.02 -1.88 -3.37 113.55 112.36 3jua h SER 215 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3jua h SER 215 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3jua h SER 215 CO 0.00 0.14 -0.49 0.29 -1.14 0.00 0.00 176.83 175.63 3jua n LYS 216 N -3.40 3.30 -3.79 3.45 5.02 -1.26 -4.88 118.16 116.61 3jua n LYS 216 Ca -0.01 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 3jua n LYS 216 Cb 0.32 -0.73 -0.13 0.00 -0.02 0.00 0.00 35.03 34.48 3jua n LYS 216 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3jua s LEU 217 N -2.35 1.07 -0.18 -0.35 0.20 -1.26 -4.25 118.68 111.56 3jua s LEU 217 Ca 0.00 0.36 0.00 0.00 0.69 0.00 0.00 54.13 55.18 3jua s LEU 217 Cb 0.00 0.55 0.02 0.00 -0.43 0.00 0.00 46.19 46.33 3jua s LEU 217 CO 0.00 -0.10 -0.18 0.86 -0.29 0.00 0.00 176.35 176.65 3jua s TRP 218 N 0.52 2.80 -0.66 5.38 -0.00 -0.44 -1.52 118.94 125.01 3jua s TRP 218 Ca -0.04 -1.52 -0.28 0.00 -0.00 0.00 0.00 56.10 54.26 3jua s TRP 218 Cb -0.05 -1.94 0.03 0.00 -0.00 0.00 0.00 33.47 31.51 3jua s TRP 218 CO -0.03 -0.76 1.27 1.41 -0.00 0.00 0.00 176.95 178.85 3jua s MET 219 N 1.28 3.32 0.34 5.86 -2.45 -1.00 -1.14 119.30 125.51 3jua s MET 219 Ca 0.04 0.03 0.03 0.00 -1.25 0.00 0.00 55.69 54.55 3jua s MET 219 Cb -0.13 -4.11 0.60 0.00 1.25 0.00 0.00 34.83 32.44 3jua s MET 219 CO -0.11 -1.96 1.92 -0.07 1.05 0.00 0.00 175.02 175.86 3jua h LEU 220 N 12.67 0.61 -7.00 4.11 3.38 -1.47 -3.45 115.31 124.16 3jua h LEU 220 Ca -0.27 -0.07 0.12 0.00 0.09 0.00 0.00 57.88 57.75 3jua h LEU 220 Cb 1.06 -0.16 -0.28 0.00 0.09 0.00 0.00 40.66 41.37 3jua h LEU 220 CO 1.23 0.56 0.65 -0.70 0.09 0.00 0.00 178.44 180.27 3jua s GLU 221 N -5.28 0.33 -0.03 1.13 2.12 -1.21 -2.86 118.70 112.90 3jua s GLU 221 Ca -0.09 0.33 -0.00 0.00 0.36 0.00 0.00 54.97 55.57 3jua s GLU 221 Cb 0.16 0.16 0.03 0.00 0.26 0.00 0.00 34.13 34.74 3jua s GLU 221 CO 0.77 -0.05 0.04 0.12 -0.54 0.00 0.00 175.26 175.60 3jua s PHE 222 N -0.05 0.01 -0.10 5.30 5.36 -1.26 -1.89 117.98 125.35 3jua s PHE 222 Ca 0.05 0.18 -0.04 0.00 -0.96 0.00 0.00 56.93 56.15 3jua s PHE 222 Cb -0.04 -0.24 0.05 0.00 -0.34 0.00 0.00 43.02 42.44 3jua s PHE 222 CO -0.09 -0.11 0.22 0.45 -1.46 0.00 0.00 175.22 174.23 3jua s SER 223 N 1.17 -0.04 -0.08 6.13 0.15 0.45 0.61 113.70 122.09 3jua s SER 223 Ca -0.08 0.46 0.03 0.00 0.70 0.00 0.00 55.95 57.07 3jua s SER 223 Cb -0.13 0.39 -0.02 0.00 -1.71 0.00 0.00 66.02 64.55 3jua s SER 223 CO -0.03 -0.18 -0.18 0.00 1.20 0.00 0.00 173.24 174.04 3jua s ALA 224 N 1.51 2.45 0.22 5.45 0.00 -0.91 -0.29 121.76 130.19 3jua s ALA 224 Ca -0.07 -0.98 -0.20 0.00 0.00 0.00 0.00 51.96 50.72 3jua s ALA 224 Cb -0.11 -0.93 0.04 0.00 0.00 0.00 0.00 23.12 22.11 3jua s ALA 224 CO -0.08 0.40 0.62 -0.59 0.00 0.00 0.00 175.76 176.11 3jua s PHE 225 N -0.14 -0.25 -0.02 0.00 -0.12 0.34 -1.53 117.98 116.25 3jua s PHE 225 Ca -0.02 -0.10 0.01 0.00 -0.05 0.00 0.00 56.93 56.76 3jua s PHE 225 Cb -0.14 0.56 0.01 0.00 -0.63 0.00 0.00 43.02 42.82 3jua s PHE 225 CO 0.04 -1.03 -0.02 -1.17 -0.05 0.00 0.00 175.22 172.99 3jua s LEU 226 N -2.86 1.52 -0.11 -1.99 2.96 0.15 -0.83 118.68 117.51 3jua s LEU 226 Ca 0.08 -0.06 -0.14 0.00 -0.22 0.00 0.00 54.13 53.79 3jua s LEU 226 Cb -0.03 -0.25 0.03 0.00 0.50 0.00 0.00 46.19 46.45 3jua s LEU 226 CO -0.01 -0.03 0.37 -1.83 -1.32 0.00 0.00 176.35 173.52 3jua s GLU 227 N 0.57 0.51 0.29 1.98 -1.05 -0.63 0.65 118.70 121.01 3jua s GLU 227 Ca -0.06 0.36 0.07 0.00 -0.15 0.00 0.00 54.97 55.20 3jua s GLU 227 Cb -0.09 0.24 -0.06 0.00 -0.44 0.00 0.00 34.13 33.78 3jua s GLU 227 CO -0.01 -0.09 -0.07 -0.98 0.95 0.00 0.00 175.26 175.07 3jua s ARG 228 N -0.17 1.58 0.19 -4.83 1.70 -0.78 -1.25 118.95 115.39 3jua s ARG 228 Ca -0.03 -1.80 -0.23 0.00 -0.47 0.00 0.00 55.73 53.19 3jua s ARG 228 Cb -0.03 -1.24 -0.08 0.00 -0.57 0.00 0.00 34.95 33.03 3jua s ARG 228 CO 0.02 0.06 0.76 -0.65 -1.08 0.00 0.00 175.30 174.41 3jua s GLN 229 N -3.70 4.45 0.07 3.89 -0.21 -1.26 -2.66 119.66 120.23 3jua s GLN 229 Ca 0.30 1.06 -0.03 0.00 0.02 0.00 0.00 55.36 56.70 3jua s GLN 229 Cb 0.03 -3.11 -0.03 0.00 1.00 0.00 0.00 33.01 30.91 3jua s GLN 229 CO 0.12 0.50 0.04 -0.65 -2.12 0.00 0.00 175.29 173.18 3jua s GLN 230 N -1.47 0.71 -1.16 2.91 -0.21 -1.26 -4.84 119.66 114.34 3jua s GLN 230 Ca 0.39 -1.18 -0.08 0.00 0.02 0.00 0.00 55.36 54.51 3jua s GLN 230 Cb -0.21 0.25 0.25 0.00 1.00 0.00 0.00 33.01 34.30 3jua s GLN 230 CO 0.24 -0.17 1.50 -0.25 -2.12 0.00 0.00 175.29 174.49 3jua n ASP 231 N 0.04 5.75 -4.42 5.90 9.92 -1.26 -2.65 116.55 129.83 3jua n ASP 231 Ca -0.13 -3.20 -0.20 0.00 -0.53 0.00 0.00 54.79 50.72 3jua n ASP 231 Cb 0.62 -1.39 -0.10 0.00 -0.64 0.00 0.00 41.12 39.61 3jua n ASP 231 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 3jua s PRO 232 N -1.10 1.55 0.00 -0.24 0.05 -1.26 -5.21 135.00 128.79 3jua s PRO 232 Ca 0.35 -1.82 0.00 0.00 0.05 0.00 0.00 61.00 59.57 3jua s PRO 232 Cb 0.02 -0.89 0.00 0.00 0.05 0.00 0.00 34.50 33.68 3jua s PRO 232 CO 0.03 -0.11 0.00 -3.47 0.05 0.00 0.00 177.00 173.50 3jua n ASP 233 N -0.60 0.00 -4.24 6.66 2.03 -1.09 -5.20 116.55 114.12 3jua n ASP 233 Ca -0.04 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 54.99 3jua n ASP 233 Cb 0.65 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.89 3jua n ASP 233 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3jua s THR 234 N -0.53 1.73 -0.28 5.18 2.01 -1.09 -4.87 115.64 117.78 3jua s THR 234 Ca 0.00 -0.93 0.01 0.00 0.31 0.00 0.00 61.69 61.08 3jua s THR 234 Cb 0.00 -1.44 0.16 0.00 0.01 0.00 0.00 72.50 71.23 3jua s THR 234 CO 0.00 0.49 0.42 -0.47 -0.69 0.00 0.00 174.62 174.37 3jua s TYR 235 N -0.46 -1.07 -0.11 4.92 5.04 -1.26 -1.87 117.35 122.54 3jua s TYR 235 Ca 0.07 0.52 -0.03 0.00 -2.44 0.00 0.00 57.07 55.19 3jua s TYR 235 Cb -0.09 -0.06 -0.03 0.00 0.35 0.00 0.00 41.96 42.13 3jua s TYR 235 CO -0.00 -0.94 0.00 1.21 -1.34 0.00 0.00 175.55 174.48 3jua s ASN 236 N 2.58 5.22 -0.25 4.32 3.84 0.21 -4.94 114.94 125.92 3jua s ASN 236 Ca 0.11 0.09 -0.05 0.00 0.21 0.00 0.00 52.86 53.21 3jua s ASN 236 Cb -0.13 -1.61 -0.00 0.00 -0.55 0.00 0.00 41.25 38.96 3jua s ASN 236 CO -0.27 0.31 0.02 -0.54 -2.79 0.00 0.00 177.10 173.83 3jua s LYS 237 N -0.48 3.31 0.01 0.43 1.02 -1.26 0.30 119.74 123.08 3jua s LYS 237 Ca 0.09 -0.69 -0.26 0.00 0.02 0.00 0.00 55.97 55.12 3jua s LYS 237 Cb -0.12 -3.20 -0.16 0.00 -0.52 0.00 0.00 37.83 33.84 3jua s LYS 237 CO 0.02 -0.29 1.19 0.45 -0.92 0.00 0.00 175.35 175.80 3jua h HIS 238 N 8.17 -0.68 -1.96 3.18 3.86 -1.42 -3.41 115.15 122.91 3jua h HIS 238 Ca -0.37 -0.02 -0.61 0.00 -1.16 0.00 0.00 60.37 58.22 3jua h HIS 238 Cb 1.15 0.22 -0.13 0.00 1.06 0.00 0.00 27.41 29.71 3jua h HIS 238 CO 0.61 -0.35 -0.66 -0.51 0.86 0.00 0.00 177.93 177.89 3jua s LEU 239 N -9.57 2.73 -0.30 2.43 2.01 -1.23 -1.18 118.68 113.58 3jua s LEU 239 Ca -0.14 -1.24 -0.13 0.00 0.01 0.00 0.00 54.13 52.62 3jua s LEU 239 Cb 0.02 -0.93 0.18 0.00 0.01 0.00 0.00 46.19 45.47 3jua s LEU 239 CO 0.48 -0.28 1.11 0.12 1.01 0.00 0.00 176.35 178.79 3jua s PHE 240 N -2.68 -0.28 0.80 0.29 5.36 -1.25 -2.14 117.98 118.07 3jua s PHE 240 Ca 0.33 0.16 -0.12 0.00 -0.96 0.00 0.00 56.93 56.33 3jua s PHE 240 Cb 0.04 0.05 0.08 0.00 -0.34 0.00 0.00 43.02 42.85 3jua s PHE 240 CO 0.16 -0.17 1.15 0.08 -1.46 0.00 0.00 175.22 174.99 3jua s VAL 241 N 2.91 2.55 0.01 3.12 1.01 0.20 -4.85 120.40 125.35 3jua s VAL 241 Ca 0.29 0.21 -0.10 0.00 0.00 0.00 0.00 61.98 62.39 3jua s VAL 241 Cb -0.00 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 3jua s VAL 241 CO -0.22 -0.20 0.26 1.41 0.00 0.00 0.00 175.10 176.35 3jua n HIS 242 N -3.41 0.12 -0.24 5.22 8.25 -1.26 -4.18 115.22 119.71 3jua n HIS 242 Ca 0.12 0.28 -0.28 0.00 -0.26 0.00 0.00 57.72 57.58 3jua n HIS 242 Cb 0.52 -0.55 0.27 0.00 1.12 0.00 0.00 29.99 31.34 3jua n HIS 242 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 3jua n ILE 243 N 0.33 0.00 -1.33 1.59 -5.35 -1.26 -4.23 119.36 109.11 3jua n ILE 243 Ca 0.05 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.44 3jua n ILE 243 Cb 0.03 -0.89 -0.07 0.00 -1.74 0.00 0.00 39.64 36.97 3jua n ILE 243 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3jua n SER 244 N -5.20 -0.01 -0.37 7.28 7.64 -1.13 -3.69 113.62 118.13 3jua n SER 244 Ca 0.12 -2.05 0.04 0.00 1.01 0.00 0.00 58.87 57.99 3jua n SER 244 Cb 0.54 -1.26 0.07 0.00 -1.01 0.00 0.00 64.21 62.55 3jua n SER 244 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 3jua n GLN 245 N 6.66 1.60 -3.10 1.43 0.00 -1.26 -4.89 117.38 117.81 3jua n GLN 245 Ca 0.25 -1.45 -0.41 0.00 -0.00 0.00 0.00 57.00 55.39 3jua n GLN 245 Cb 0.48 -1.16 -0.06 0.00 0.00 0.00 0.00 30.24 29.49 3jua n GLN 245 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3jua s SER 246 N -0.83 6.47 -0.81 1.69 1.04 -1.24 -4.79 113.70 115.24 3jua s SER 246 Ca 0.12 0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.88 3jua s SER 246 Cb 0.07 -2.33 0.26 0.00 0.10 0.00 0.00 66.02 64.12 3jua s SER 246 CO 0.10 -0.55 0.96 -0.24 0.98 0.00 0.00 173.24 174.49 3jua n SER 247 N 5.99 4.58 -4.38 7.02 2.88 -1.26 -5.02 113.62 123.43 3jua n SER 247 Ca -0.01 -3.38 -0.30 0.00 -1.33 0.00 0.00 58.87 53.85 3jua n SER 247 Cb 0.49 -0.91 0.23 0.00 -0.75 0.00 0.00 64.21 63.27 3jua n SER 247 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3jua n PRO 248 N 1.25 -2.22 -3.50 -1.46 -0.02 -1.26 -5.00 135.00 122.79 3jua n PRO 248 Ca 0.27 -0.62 -0.10 0.00 -2.02 0.00 0.00 63.50 61.02 3jua n PRO 248 Cb 0.38 -1.97 -0.02 0.00 -0.02 0.00 0.00 33.50 31.87 3jua n PRO 248 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3jua s SER 249 N -2.16 -0.48 0.00 2.55 1.04 -1.26 -5.03 113.70 108.36 3jua s SER 249 Ca 0.64 -0.09 0.20 0.00 0.48 0.00 0.00 55.95 57.18 3jua s SER 249 Cb -0.20 0.58 1.07 0.00 0.10 0.00 0.00 66.02 67.56 3jua s SER 249 CO 0.66 -0.96 1.63 -1.22 0.98 0.00 0.00 173.24 174.34 3jua n TYR 250 N -0.37 0.00 -0.03 5.02 4.01 -1.26 -2.24 117.16 122.29 3jua n TYR 250 Ca -0.14 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.47 3jua n TYR 250 Cb 0.64 -0.22 -0.14 0.00 -0.31 0.00 0.00 39.34 39.30 3jua n TYR 250 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3jua n SER 251 N -1.22 1.25 -4.46 7.72 3.41 -1.26 -5.00 113.62 114.05 3jua n SER 251 Ca 0.11 0.26 -0.35 0.00 -0.26 0.00 0.00 58.87 58.63 3jua n SER 251 Cb 0.14 -0.22 0.08 0.00 -0.26 0.00 0.00 64.21 63.96 3jua n SER 251 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3jua n ASP 252 N -3.16 -1.35 -4.76 4.04 8.00 -0.95 -4.95 116.55 113.42 3jua n ASP 252 Ca -0.26 0.52 -0.33 0.00 0.71 0.00 0.00 54.79 55.44 3jua n ASP 252 Cb 1.06 -1.22 0.06 0.00 -0.02 0.00 0.00 41.12 41.00 3jua n ASP 252 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3jua s PRO 253 N -3.03 2.61 0.61 -0.24 0.04 -1.26 -4.98 135.00 128.75 3jua s PRO 253 Ca 0.63 1.42 -0.18 0.00 0.04 0.00 0.00 61.00 62.92 3jua s PRO 253 Cb -0.31 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 3jua s PRO 253 CO 0.60 -1.40 1.18 0.71 0.04 0.00 0.00 177.00 178.13 3jua s TYR 254 N -2.36 2.44 0.87 0.56 2.02 -1.26 -4.59 117.35 115.03 3jua s TYR 254 Ca 0.67 1.54 -0.10 0.00 -0.37 0.00 0.00 57.07 58.80 3jua s TYR 254 Cb -0.21 -3.40 0.12 0.00 -0.40 0.00 0.00 41.96 38.06 3jua s TYR 254 CO 0.44 -2.05 1.12 -0.51 -1.57 0.00 0.00 175.55 172.97 3jua s LEU 255 N -4.23 2.83 0.44 -1.29 1.43 0.12 -4.96 118.68 113.02 3jua s LEU 255 Ca 0.75 2.01 -0.22 0.00 -1.03 0.00 0.00 54.13 55.63 3jua s LEU 255 Cb -0.28 -4.49 -0.09 0.00 0.03 0.00 0.00 46.19 41.37 3jua s LEU 255 CO 0.34 -2.73 1.06 -0.70 0.23 0.00 0.00 176.35 174.55 3jua s GLU 256 N -4.75 3.97 0.28 1.70 2.12 -1.26 -4.73 118.70 116.03 3jua s GLU 256 Ca 0.65 1.48 -0.09 0.00 0.36 0.00 0.00 54.97 57.37 3jua s GLU 256 Cb -0.21 -2.35 -0.07 0.00 0.26 0.00 0.00 34.13 31.77 3jua s GLU 256 CO 0.57 -0.30 0.60 0.95 -0.54 0.00 0.00 175.26 176.53 3jua s THR 257 N -1.77 4.91 0.01 -1.70 -4.23 -1.26 -1.71 115.64 109.89 3jua s THR 257 Ca 0.62 0.42 0.04 0.00 -1.18 0.00 0.00 61.69 61.60 3jua s THR 257 Cb -0.21 -3.66 -0.01 0.00 1.34 0.00 0.00 72.50 69.96 3jua s THR 257 CO 0.25 -0.20 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.31 3jua s VAL 258 N -1.97 1.04 -0.48 2.29 1.01 0.01 -4.89 120.40 117.41 3jua s VAL 258 Ca 0.48 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 3jua s VAL 258 Cb -0.11 -0.90 0.03 0.00 0.00 0.00 0.00 36.38 35.40 3jua s VAL 258 CO 0.24 0.17 1.13 -0.62 0.00 0.00 0.00 175.10 176.03 3jua s ASP 259 N -0.63 6.62 0.34 3.32 3.68 -1.26 -1.29 116.67 127.46 3jua s ASP 259 Ca 0.03 0.44 0.08 0.00 2.13 0.00 0.00 52.55 55.24 3jua s ASP 259 Cb -0.06 -2.55 0.80 0.00 -1.45 0.00 0.00 42.92 39.66 3jua s ASP 259 CO 0.00 -1.25 1.85 -0.29 0.13 0.00 0.00 175.17 175.61 3jua h ILE 260 N 6.23 0.81 -0.44 4.11 2.10 -1.56 0.17 117.51 128.92 3jua h ILE 260 Ca -0.23 -0.25 0.13 0.00 1.08 0.00 0.00 64.86 65.59 3jua h ILE 260 Cb 1.06 0.03 -0.02 0.00 -1.09 0.00 0.00 36.82 36.80 3jua h ILE 260 CO 1.13 0.13 0.32 0.03 -1.08 0.00 0.00 178.15 178.68 3jua h ARG 261 N 0.71 0.01 0.00 2.19 3.08 -1.87 -0.22 114.38 118.28 3jua h ARG 261 Ca 0.48 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.53 3jua h ARG 261 Cb 0.77 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 3jua h ARG 261 CO -0.24 0.01 0.00 0.94 -1.07 0.00 0.00 179.97 179.61 3jua n GLN 262 N -4.41 0.94 0.00 0.04 -0.06 0.59 -3.62 117.38 110.86 3jua n GLN 262 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 3jua n GLN 262 Cb 0.52 -1.19 0.00 0.00 -4.06 0.00 0.00 30.24 25.50 3jua n GLN 262 CO 0.00 0.00 0.00 1.51 -0.20 0.00 0.00 177.06 178.37 3jua n ILE 263 N -0.69 0.00 -0.25 1.69 0.13 -0.12 -4.86 119.36 115.25 3jua n ILE 263 Ca 0.09 -0.06 0.10 0.00 -1.10 0.00 0.00 62.75 61.78 3jua n ILE 263 Cb 0.04 1.10 0.36 0.00 -0.84 0.00 0.00 39.64 40.30 3jua n ILE 263 CO 0.00 0.00 0.00 1.88 2.80 0.00 0.00 176.55 181.23 3jua h TYR 264 N 0.00 0.82 0.00 9.51 0.05 -1.55 -1.19 116.97 124.61 3jua h TYR 264 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3jua h TYR 264 Cb 0.05 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.53 3jua h TYR 264 CO 0.00 0.35 0.00 0.38 -1.05 0.00 0.00 178.16 177.84 3jua h ASP 265 N 0.73 0.00 0.00 3.88 3.04 -1.89 -1.69 116.42 120.49 3jua h ASP 265 Ca 0.40 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.19 3jua h ASP 265 Cb 0.55 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.84 3jua h ASP 265 CO -0.17 0.00 0.00 0.29 -2.04 0.00 0.00 179.24 177.32 3jua n LYS 266 N -3.05 0.95 -4.15 4.15 4.76 -0.45 -4.18 118.16 116.18 3jua n LYS 266 Ca 0.01 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.35 3jua n LYS 266 Cb 0.30 -1.34 -0.10 0.00 -1.84 0.00 0.00 35.03 32.06 3jua n LYS 266 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3jua s PHE 267 N -2.00 0.89 0.22 2.13 0.08 -0.64 -4.15 117.98 114.51 3jua s PHE 267 Ca 0.30 -1.25 -0.32 0.00 0.12 0.00 0.00 56.93 55.79 3jua s PHE 267 Cb 0.14 -0.49 -0.14 0.00 -0.57 0.00 0.00 43.02 41.96 3jua s PHE 267 CO 0.23 -0.53 1.41 -2.30 -0.10 0.00 0.00 175.22 173.93 3jua n PRO 268 N -0.11 1.96 -0.00 0.24 -0.02 -0.89 -4.78 135.00 131.39 3jua n PRO 268 Ca -0.05 0.70 0.02 0.00 -2.02 0.00 0.00 63.50 62.15 3jua n PRO 268 Cb 0.64 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 3jua n PRO 268 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3jua n GLU 269 N 2.22 2.93 0.00 -0.52 1.02 -1.26 -1.71 120.64 123.33 3jua n GLU 269 Ca 0.13 -0.02 -0.01 0.00 -0.02 0.00 0.00 57.16 57.24 3jua n GLU 269 Cb 0.30 -0.89 -0.00 0.00 -0.02 0.00 0.00 31.44 30.83 3jua n GLU 269 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3jua n LYS 270 N -1.37 0.05 -0.10 3.49 5.02 -1.26 -4.74 118.16 119.26 3jua n LYS 270 Ca 0.00 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.07 3jua n LYS 270 Cb 0.09 -0.35 -0.12 0.00 -0.02 0.00 0.00 35.03 34.63 3jua n LYS 270 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 3jua n LYS 271 N -2.93 0.62 -1.86 1.97 0.00 -1.26 -4.30 118.16 110.40 3jua n LYS 271 Ca -0.01 0.37 -0.29 0.00 0.00 0.00 0.00 58.31 58.38 3jua n LYS 271 Cb 0.05 -1.64 0.04 0.00 0.00 0.00 0.00 35.03 33.48 3jua n LYS 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3jua n GLY 272 N 1.59 6.11 3.98 3.14 0.00 -1.26 -4.91 105.19 113.84 3jua n GLY 272 Ca -0.40 -2.56 -0.23 0.00 0.00 0.00 0.00 46.02 42.83 3jua n GLY 272 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3jua s GLY 273 N -2.82 1.77 0.10 -0.02 0.00 -1.26 -4.89 107.32 100.20 3jua s GLY 273 Ca 0.55 -1.47 -0.20 0.00 0.00 0.00 0.00 44.72 43.60 3jua s GLY 273 CO -0.05 -1.01 1.69 -2.00 0.00 0.00 0.00 173.10 171.72 3jua h LEU 274 N -0.39 0.26 -1.38 0.66 6.46 -1.64 -0.05 115.31 119.23 3jua h LEU 274 Ca -0.40 -0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.23 3jua h LEU 274 Cb 1.28 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 41.12 3jua h LEU 274 CO 0.47 0.30 0.16 0.50 -0.62 0.00 0.00 178.44 179.24 3jua h LYS 275 N 0.21 0.58 0.49 1.25 3.11 -1.87 0.60 116.57 120.93 3jua h LYS 275 Ca 0.07 -0.08 -0.02 0.00 -2.81 0.00 0.00 60.65 57.81 3jua h LYS 275 Cb 0.10 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.22 3jua h LYS 275 CO -0.01 0.48 -0.24 1.49 -2.81 0.00 0.00 179.45 178.37 3jua h GLU 276 N 0.58 -0.63 -0.67 1.90 4.81 -1.79 -1.88 114.58 116.90 3jua h GLU 276 Ca 0.14 0.04 0.13 0.00 -0.13 0.00 0.00 59.36 59.55 3jua h GLU 276 Cb 0.13 0.14 -0.13 0.00 0.63 0.00 0.00 28.75 29.53 3jua h GLU 276 CO -0.01 -0.33 -0.16 -0.07 -0.73 0.00 0.00 179.01 177.71 3jua h LEU 277 N -0.98 -0.61 -0.27 1.64 3.38 -0.17 -2.25 115.31 116.05 3jua h LEU 277 Ca -0.07 0.20 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 3jua h LEU 277 Cb 0.60 0.41 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3jua h LEU 277 CO 0.11 -0.22 -0.10 0.15 0.09 0.00 0.00 178.44 178.47 3jua h PHE 278 N 0.00 0.62 0.00 1.13 3.04 0.23 0.53 116.94 122.50 3jua h PHE 278 Ca 0.32 -0.14 0.00 0.00 3.98 0.00 0.00 57.97 62.13 3jua h PHE 278 Cb 0.49 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.85 3jua h PHE 278 CO -0.54 0.77 0.00 0.39 -2.02 0.00 0.00 178.31 176.92 3jua n GLU 279 N -4.48 0.04 -0.11 1.11 1.02 -0.71 -3.76 120.64 113.74 3jua n GLU 279 Ca -0.04 0.34 -0.23 0.00 -0.02 0.00 0.00 57.16 57.21 3jua n GLU 279 Cb 0.33 -1.58 -0.08 0.00 -0.02 0.00 0.00 31.44 30.09 3jua n GLU 279 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3jua n ARG 280 N -1.65 0.48 -2.35 3.49 0.63 -0.52 -5.03 116.66 111.71 3jua n ARG 280 Ca 0.02 0.20 -0.25 0.00 -0.92 0.00 0.00 57.85 56.91 3jua n ARG 280 Cb 0.14 -1.31 0.05 0.00 0.45 0.00 0.00 32.46 31.79 3jua n ARG 280 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3jua s GLY 281 N -5.48 1.71 0.31 5.14 0.00 0.06 -4.98 107.32 104.09 3jua s GLY 281 Ca -0.31 -0.99 -0.29 0.00 0.00 0.00 0.00 44.72 43.12 3jua s GLY 281 CO 0.41 -0.64 1.51 2.56 0.00 0.00 0.00 173.10 176.93 3jua s PRO 282 N -5.08 4.16 0.41 2.90 0.04 -1.26 -4.85 135.00 131.32 3jua s PRO 282 Ca 0.58 2.50 0.16 0.00 0.04 0.00 0.00 61.00 64.28 3jua s PRO 282 Cb -0.11 -3.02 0.90 0.00 0.04 0.00 0.00 34.50 32.31 3jua s PRO 282 CO 0.43 -0.52 1.89 0.66 0.04 0.00 0.00 177.00 179.50 3jua h SER 283 N 4.17 0.00 0.00 6.66 4.64 -1.94 -1.66 113.55 125.42 3jua h SER 283 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3jua h SER 283 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3jua h SER 283 CO 0.73 0.29 0.00 -0.46 -0.87 0.00 0.00 176.83 176.52 3jua n ASN 284 N -3.98 0.00 0.00 4.97 6.94 -1.26 -2.19 115.26 119.74 3jua n ASN 284 Ca -0.02 -1.20 0.11 0.00 -0.02 0.00 0.00 54.58 53.45 3jua n ASN 284 Cb 0.36 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.77 3jua n ASN 284 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3jua n ALA 285 N -0.61 4.08 -2.67 -2.53 0.00 -0.62 -4.14 120.51 114.01 3jua n ALA 285 Ca 0.04 -0.50 -0.37 0.00 0.00 0.00 0.00 53.44 52.61 3jua n ALA 285 Cb 0.02 -0.89 -0.09 0.00 0.00 0.00 0.00 19.45 18.49 3jua n ALA 285 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3jua s PHE 286 N -3.08 3.34 0.07 0.00 0.40 -0.93 -1.76 117.98 116.03 3jua s PHE 286 Ca 0.07 0.37 0.04 0.00 -0.60 0.00 0.00 56.93 56.81 3jua s PHE 286 Cb 0.16 -2.35 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 3jua s PHE 286 CO 0.82 0.06 -0.11 -0.06 0.70 0.00 0.00 175.22 176.63 3jua s PHE 287 N 1.08 1.02 -0.08 0.36 0.08 0.45 -1.71 117.98 119.19 3jua s PHE 287 Ca 0.12 -0.54 0.02 0.00 0.12 0.00 0.00 56.93 56.65 3jua s PHE 287 Cb -0.14 -0.57 0.01 0.00 -0.57 0.00 0.00 43.02 41.75 3jua s PHE 287 CO 0.05 0.00 -0.14 -1.17 -0.10 0.00 0.00 175.22 173.86 3jua s LEU 288 N -1.95 1.70 -0.13 -0.37 2.96 0.78 0.31 118.68 121.99 3jua s LEU 288 Ca -0.01 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 3jua s LEU 288 Cb -0.07 -0.93 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 3jua s LEU 288 CO 0.01 0.05 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.23 3jua s VAL 289 N 0.68 2.70 -0.34 1.68 1.01 0.91 0.05 120.40 127.09 3jua s VAL 289 Ca -0.14 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 60.93 3jua s VAL 289 Cb -0.16 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 3jua s VAL 289 CO 0.04 0.53 0.24 -0.75 0.00 0.00 0.00 175.10 175.15 3jua s LYS 290 N 0.47 3.46 -0.15 2.72 2.47 -0.72 -1.09 119.74 126.90 3jua s LYS 290 Ca -0.11 -0.67 -0.08 0.00 -1.56 0.00 0.00 55.97 53.55 3jua s LYS 290 Cb -0.16 -3.79 -0.04 0.00 -1.46 0.00 0.00 37.83 32.37 3jua s LYS 290 CO 0.05 -0.46 0.13 -0.06 0.16 0.00 0.00 175.35 175.18 3jua s PHE 291 N 1.71 3.51 -0.69 4.03 2.99 0.01 -1.58 117.98 127.96 3jua s PHE 291 Ca 0.06 0.43 -0.09 0.00 0.00 0.00 0.00 56.93 57.33 3jua s PHE 291 Cb -0.17 -2.03 0.18 0.00 0.00 0.00 0.00 43.02 41.00 3jua s PHE 291 CO 0.10 0.54 0.57 -1.58 -0.00 0.00 0.00 175.22 174.85 3jua s TRP 292 N -0.44 3.56 0.39 0.36 0.51 0.10 -1.06 118.94 122.36 3jua s TRP 292 Ca 0.12 -2.24 -0.26 0.00 -2.12 0.00 0.00 56.10 51.60 3jua s TRP 292 Cb -0.12 -3.53 -0.09 0.00 -0.81 0.00 0.00 33.47 28.92 3jua s TRP 292 CO 0.01 -0.93 1.22 0.00 -0.51 0.00 0.00 176.95 176.74 3jua s ALA 293 N 0.29 3.24 -0.52 0.98 0.00 0.40 -1.37 121.76 124.77 3jua s ALA 293 Ca 0.15 1.08 -0.13 0.00 0.00 0.00 0.00 51.96 53.07 3jua s ALA 293 Cb -0.17 -3.42 0.13 0.00 0.00 0.00 0.00 23.12 19.66 3jua s ALA 293 CO -0.05 -0.61 0.44 0.34 0.00 0.00 0.00 175.76 175.87 3jua s ASP 294 N -0.92 5.97 -0.35 0.00 -1.08 -0.32 -2.21 116.67 117.76 3jua s ASP 294 Ca 0.55 -1.90 0.08 0.00 -0.52 0.00 0.00 52.55 50.76 3jua s ASP 294 Cb -0.34 -2.11 0.65 0.00 -1.46 0.00 0.00 42.92 39.65 3jua s ASP 294 CO 0.43 -0.76 1.74 0.00 0.52 0.00 0.00 175.17 177.10 3jua n LEU 295 N 5.01 5.68 -4.01 -1.34 -0.00 -1.26 -4.04 117.00 117.04 3jua n LEU 295 Ca -0.10 -3.47 -0.43 0.00 -0.00 0.00 0.00 56.01 52.01 3jua n LEU 295 Cb 0.41 -0.74 0.00 0.00 -0.00 0.00 0.00 43.42 43.09 3jua n LEU 295 CO 0.48 0.99 1.97 -3.20 -0.00 0.00 0.00 177.39 177.62 3jua n ASN 296 N -0.76 4.91 -3.69 1.45 5.15 -1.26 -4.85 115.26 116.21 3jua n ASN 296 Ca 0.44 -3.03 -0.10 0.00 -0.60 0.00 0.00 54.58 51.29 3jua n ASN 296 Cb 1.37 -1.54 -0.10 0.00 -0.53 0.00 0.00 39.78 38.97 3jua n ASN 296 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3jua s THR 297 N 1.33 -0.14 -0.55 -0.44 -1.32 -1.26 -5.06 115.64 108.20 3jua s THR 297 Ca 0.42 0.10 0.05 0.00 -1.21 0.00 0.00 61.69 61.06 3jua s THR 297 Cb 0.08 -0.64 0.35 0.00 -1.51 0.00 0.00 72.50 70.78 3jua s THR 297 CO -0.01 0.04 0.97 -0.46 -2.21 0.00 0.00 174.62 172.96 3jua n ASN 298 N 4.48 4.44 -0.46 8.08 2.04 -1.26 -4.70 115.26 127.87 3jua n ASN 298 Ca -0.20 -3.68 0.13 0.00 -0.44 0.00 0.00 54.58 50.39 3jua n ASN 298 Cb 0.54 -0.54 0.28 0.00 -2.53 0.00 0.00 39.78 37.53 3jua n ASN 298 CO 0.00 0.00 0.00 2.30 -0.44 0.00 0.00 177.26 179.12 3jua n ILE 299 N -0.28 0.00 0.09 1.53 -6.64 -1.26 -3.53 119.36 109.26 3jua n ILE 299 Ca 0.32 -0.24 0.10 0.00 -1.77 0.00 0.00 62.75 61.16 3jua n ILE 299 Cb 0.45 0.79 0.27 0.00 -1.44 0.00 0.00 39.64 39.71 3jua n ILE 299 CO 0.00 0.00 0.00 -0.67 -1.77 0.00 0.00 176.55 174.11 3jua n ASP 300 N -0.02 3.29 -4.77 7.28 2.03 -1.26 -4.69 116.55 118.41 3jua n ASP 300 Ca 0.13 -1.99 -0.41 0.00 0.52 0.00 0.00 54.79 53.04 3jua n ASP 300 Cb 0.42 -0.39 -0.01 0.00 -0.72 0.00 0.00 41.12 40.42 3jua n ASP 300 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 3jua s ASP 301 N -1.07 6.42 0.00 1.67 1.01 -1.23 -0.02 116.67 123.45 3jua s ASP 301 Ca 0.41 2.95 0.00 0.00 0.71 0.00 0.00 52.55 56.62 3jua s ASP 301 Cb 0.22 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.49 3jua s ASP 301 CO 0.29 -0.83 0.00 -0.62 0.21 0.00 0.00 175.17 174.21 3jua n GLU 302 N 1.16 0.00 -3.96 8.23 -0.58 -1.26 -4.58 120.64 119.65 3jua n GLU 302 Ca 0.03 0.00 -0.34 0.00 -0.42 0.00 0.00 57.16 56.43 3jua n GLU 302 Cb 0.39 -1.09 -0.00 0.00 -0.57 0.00 0.00 31.44 30.17 3jua n GLU 302 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3jua n GLY 303 N -2.00 -0.60 0.18 0.62 0.00 0.97 -4.88 105.19 99.47 3jua n GLY 303 Ca 0.00 0.30 0.02 0.00 0.00 0.00 0.00 46.02 46.34 3jua n GLY 303 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3jua n SER 304 N -2.65 0.82 -3.51 1.61 2.88 -1.26 -5.10 113.62 106.41 3jua n SER 304 Ca -0.19 -1.91 -0.14 0.00 -1.33 0.00 0.00 58.87 55.29 3jua n SER 304 Cb 0.63 -0.15 0.07 0.00 -0.75 0.00 0.00 64.21 64.01 3jua n SER 304 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3jua n ALA 305 N -0.37 0.06 -3.82 -1.46 0.00 -1.26 -4.90 120.51 108.76 3jua n ALA 305 Ca 0.03 -1.17 -0.28 0.00 0.00 0.00 0.00 53.44 52.02 3jua n ALA 305 Cb 0.55 0.18 -0.16 0.00 0.00 0.00 0.00 19.45 20.02 3jua n ALA 305 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3jua s PHE 306 N -1.81 1.48 -0.02 0.00 2.19 -0.38 -4.98 117.98 114.45 3jua s PHE 306 Ca 0.40 -1.06 -0.19 0.00 0.33 0.00 0.00 56.93 56.41 3jua s PHE 306 Cb -0.02 -1.21 -0.05 0.00 -1.31 0.00 0.00 43.02 40.43 3jua s PHE 306 CO 0.27 -0.63 0.52 0.71 1.83 0.00 0.00 175.22 177.92 3jua s TYR 307 N 1.71 3.66 0.16 10.12 1.51 -1.26 -1.61 117.35 131.64 3jua s TYR 307 Ca -0.01 1.09 -0.17 0.00 -1.01 0.00 0.00 57.07 56.97 3jua s TYR 307 Cb -0.17 -2.51 0.03 0.00 -0.11 0.00 0.00 41.96 39.20 3jua s TYR 307 CO -0.07 0.39 0.46 0.20 -1.11 0.00 0.00 175.55 175.42 3jua s GLY 308 N -0.28 -0.19 -0.02 0.71 0.00 -0.01 -2.50 107.32 105.04 3jua s GLY 308 Ca 0.28 -0.12 0.02 0.00 0.00 0.00 0.00 44.72 44.90 3jua s GLY 308 CO 0.15 -0.28 -0.07 0.54 0.00 0.00 0.00 173.10 173.43 3jua s VAL 309 N -3.84 0.63 -0.01 1.40 0.11 -0.32 -0.51 120.40 117.87 3jua s VAL 309 Ca 0.06 -0.30 0.04 0.00 -2.93 0.00 0.00 61.98 58.85 3jua s VAL 309 Cb 0.01 -0.56 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3jua s VAL 309 CO -0.08 0.20 -0.14 -0.44 -3.33 0.00 0.00 175.10 171.31 3jua s SER 310 N 0.08 1.68 -0.00 3.54 0.01 0.60 -1.84 113.70 117.77 3jua s SER 310 Ca -0.01 -0.27 -0.14 0.00 1.31 0.00 0.00 55.95 56.84 3jua s SER 310 Cb -0.06 -0.18 0.02 0.00 0.21 0.00 0.00 66.02 66.01 3jua s SER 310 CO -0.00 0.17 0.30 -0.94 0.41 0.00 0.00 173.24 173.18 3jua s SER 311 N -0.38 -0.16 0.30 2.44 1.04 -0.55 -0.41 113.70 115.98 3jua s SER 311 Ca 0.05 0.01 0.04 0.00 0.48 0.00 0.00 55.95 56.53 3jua s SER 311 Cb -0.06 0.32 -0.06 0.00 0.10 0.00 0.00 66.02 66.32 3jua s SER 311 CO -0.00 -0.48 0.05 0.00 0.98 0.00 0.00 173.24 173.79 3jua s GLN 312 N -1.61 1.58 0.07 4.02 -2.07 -0.79 0.12 119.66 120.98 3jua s GLN 312 Ca -0.12 -1.86 -0.12 0.00 -1.82 0.00 0.00 55.36 51.44 3jua s GLN 312 Cb -0.04 -0.77 0.01 0.00 -1.09 0.00 0.00 33.01 31.12 3jua s GLN 312 CO 0.02 -0.18 0.27 0.71 -1.32 0.00 0.00 175.29 174.79 3jua s TYR 313 N -3.36 -0.02 0.13 9.60 2.02 0.19 -1.15 117.35 124.76 3jua s TYR 313 Ca 0.36 -0.26 0.08 0.00 -0.37 0.00 0.00 57.07 56.87 3jua s TYR 313 Cb 0.08 0.06 -0.04 0.00 -0.40 0.00 0.00 41.96 41.66 3jua s TYR 313 CO 0.14 -0.54 -0.18 -2.00 -1.57 0.00 0.00 175.55 171.40 3jua s GLU 314 N -3.23 1.13 -0.07 -0.62 2.12 -0.29 -0.86 118.70 116.90 3jua s GLU 314 Ca -0.00 -1.26 -0.19 0.00 0.36 0.00 0.00 54.97 53.88 3jua s GLU 314 Cb 0.02 -1.20 0.04 0.00 0.26 0.00 0.00 34.13 33.24 3jua s GLU 314 CO -0.08 0.25 0.43 0.45 -0.54 0.00 0.00 175.26 175.78 3jua s SER 315 N -2.32 -0.38 0.47 -1.70 0.15 0.52 -1.33 113.70 109.11 3jua s SER 315 Ca 0.10 0.46 0.27 0.00 0.70 0.00 0.00 55.95 57.48 3jua s SER 315 Cb -0.07 0.54 0.76 0.00 -1.71 0.00 0.00 66.02 65.54 3jua s SER 315 CO 0.05 -0.40 1.76 -0.65 1.20 0.00 0.00 173.24 175.19 3jua h PRO 316 N 4.10 0.00 -6.35 5.44 0.11 -1.87 0.35 132.00 133.78 3jua h PRO 316 Ca -0.28 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.17 3jua h PRO 316 Cb 1.17 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.15 3jua h PRO 316 CO 0.35 0.00 -0.67 -1.21 -0.21 0.00 0.00 178.00 176.26 3jua s GLU 317 N -3.39 2.52 -0.57 1.05 2.02 -1.26 -4.71 118.70 114.36 3jua s GLU 317 Ca 0.05 -0.84 -0.22 0.00 0.02 0.00 0.00 54.97 53.98 3jua s GLU 317 Cb 0.07 -2.52 0.06 0.00 0.10 0.00 0.00 34.13 31.83 3jua s GLU 317 CO 0.61 0.54 0.85 1.21 0.02 0.00 0.00 175.26 178.50 3jua s ASN 318 N -2.22 6.25 0.42 -0.19 3.84 -1.26 -4.61 114.94 117.16 3jua s ASN 318 Ca 0.25 -0.74 0.03 0.00 0.21 0.00 0.00 52.86 52.61 3jua s ASN 318 Cb -0.12 -2.39 -0.01 0.00 -0.55 0.00 0.00 41.25 38.19 3jua s ASN 318 CO 0.17 -1.19 0.11 1.15 -2.79 0.00 0.00 177.10 174.55 3jua n MET 319 N 7.13 0.65 -3.91 0.43 0.00 -1.26 -5.08 117.12 115.07 3jua n MET 319 Ca -0.03 -3.38 -0.35 0.00 0.00 0.00 0.00 57.70 53.95 3jua n MET 319 Cb 0.46 1.61 -0.14 0.00 0.00 0.00 0.00 33.22 35.15 3jua n MET 319 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 3jua s ILE 320 N -2.96 3.04 0.08 3.17 1.01 -1.26 -4.17 121.20 120.10 3jua s ILE 320 Ca 0.15 -1.25 0.02 0.00 0.00 0.00 0.00 60.65 59.57 3jua s ILE 320 Cb 0.01 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.75 3jua s ILE 320 CO 0.11 -0.03 0.13 0.27 0.00 0.00 0.00 174.94 175.42 3jua s ILE 321 N 1.29 4.85 -0.25 2.92 -4.36 -0.69 -0.51 121.20 124.45 3jua s ILE 321 Ca -0.03 -0.65 -0.01 0.00 -0.26 0.00 0.00 60.65 59.70 3jua s ILE 321 Cb -0.19 -3.36 0.03 0.00 1.25 0.00 0.00 42.46 40.19 3jua s ILE 321 CO -0.02 0.11 -0.08 -0.89 0.24 0.00 0.00 174.94 174.31 3jua s THR 322 N -1.46 2.71 -0.26 8.37 2.01 -0.30 -0.79 115.64 125.93 3jua s THR 322 Ca 0.31 -1.10 -0.11 0.00 0.31 0.00 0.00 61.69 61.10 3jua s THR 322 Cb -0.12 -2.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.95 3jua s THR 322 CO 0.24 0.19 0.19 0.00 -0.69 0.00 0.00 174.62 174.56 3jua s SER 324 N 1.37 3.36 -0.02 0.00 0.15 -0.71 -1.15 113.70 116.69 3jua s SER 324 Ca 0.08 -0.66 0.04 0.00 0.70 0.00 0.00 55.95 56.11 3jua s SER 324 Cb -0.15 -1.52 -0.03 0.00 -1.71 0.00 0.00 66.02 62.62 3jua s SER 324 CO 0.07 -0.01 -0.12 0.42 1.20 0.00 0.00 173.24 174.80 3jua s THR 325 N 1.31 3.24 -0.06 6.45 -4.23 -0.46 -1.01 115.64 120.87 3jua s THR 325 Ca 0.04 -0.80 0.03 0.00 -1.18 0.00 0.00 61.69 59.79 3jua s THR 325 Cb -0.14 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.38 3jua s THR 325 CO -0.11 0.49 -0.17 -0.54 -0.54 0.00 0.00 174.62 173.75 3jua s LYS 326 N -1.06 2.04 -0.18 3.99 1.02 0.57 -0.55 119.74 125.57 3jua s LYS 326 Ca 0.14 -0.59 -0.13 0.00 0.02 0.00 0.00 55.97 55.40 3jua s LYS 326 Cb -0.11 -1.66 -0.05 0.00 -0.52 0.00 0.00 37.83 35.49 3jua s LYS 326 CO 0.03 0.15 0.28 0.08 -0.92 0.00 0.00 175.35 174.97 3jua s VAL 327 N 0.35 5.31 -0.00 3.17 1.01 0.70 -1.53 120.40 129.40 3jua s VAL 327 Ca -0.11 0.49 0.06 0.00 0.00 0.00 0.00 61.98 62.41 3jua s VAL 327 Cb -0.15 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 3jua s VAL 327 CO 0.04 0.36 -0.18 0.00 0.00 0.00 0.00 175.10 175.33 3jua n SER 329 N 2.48 3.34 -2.59 0.00 3.41 -0.55 -1.24 113.62 118.46 3jua n SER 329 Ca -0.15 -0.04 -0.12 0.00 -0.26 0.00 0.00 58.87 58.30 3jua n SER 329 Cb 0.54 0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.54 3jua n SER 329 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3jua n PHE 330 N -2.65 1.83 -0.38 7.33 3.01 -1.25 -4.23 117.46 121.12 3jua n PHE 330 Ca -0.14 -2.65 0.00 0.00 1.01 0.00 0.00 57.45 55.67 3jua n PHE 330 Cb 0.67 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.86 3jua n PHE 330 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3jua n GLY 331 N -0.34 1.40 3.71 1.37 0.00 -1.26 -4.89 105.19 105.17 3jua n GLY 331 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3jua n GLY 331 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jua s LYS 332 N -0.31 4.22 0.07 1.61 -0.14 -1.26 -2.10 119.74 121.83 3jua s LYS 332 Ca 0.00 0.06 -0.31 0.00 -1.36 0.00 0.00 55.97 54.36 3jua s LYS 332 Cb 0.00 -3.46 -0.09 0.00 -1.68 0.00 0.00 37.83 32.60 3jua s LYS 332 CO 0.00 0.16 1.70 -1.14 -0.76 0.00 0.00 175.35 175.31 3jua s GLN 333 N 0.71 4.18 -0.19 1.68 0.74 -1.26 -1.49 119.66 124.04 3jua s GLN 333 Ca 0.15 2.39 0.13 0.00 0.05 0.00 0.00 55.36 58.08 3jua s GLN 333 Cb -0.13 -3.63 -0.21 0.00 1.10 0.00 0.00 33.01 30.14 3jua s GLN 333 CO 0.04 -0.77 -0.00 1.33 -0.55 0.00 0.00 175.29 175.34 3jua n VAL 334 N 4.78 1.27 -3.55 1.34 0.24 0.15 -4.94 118.33 117.60 3jua n VAL 334 Ca 0.16 -0.70 -0.16 0.00 -2.04 0.00 0.00 64.34 61.60 3jua n VAL 334 Cb 0.40 -0.72 -0.06 0.00 -1.47 0.00 0.00 33.84 31.99 3jua n VAL 334 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3jua s VAL 335 N -2.44 0.01 0.02 3.34 0.11 -1.21 -5.00 120.40 115.22 3jua s VAL 335 Ca -0.15 -0.10 0.02 0.00 -2.93 0.00 0.00 61.98 58.82 3jua s VAL 335 Cb 0.06 -0.95 -0.01 0.00 -1.53 0.00 0.00 36.38 33.95 3jua s VAL 335 CO 0.69 -0.06 -0.08 -1.83 -3.33 0.00 0.00 175.10 170.49 3jua s GLU 336 N -1.62 0.58 -0.12 1.54 -1.05 -1.26 -0.22 118.70 116.55 3jua s GLU 336 Ca -0.09 -0.47 0.03 0.00 -0.15 0.00 0.00 54.97 54.29 3jua s GLU 336 Cb -0.01 -0.50 0.00 0.00 -0.44 0.00 0.00 34.13 33.18 3jua s GLU 336 CO 0.05 0.13 -0.21 0.21 0.95 0.00 0.00 175.26 176.39 3jua s LYS 337 N -0.73 3.09 -0.21 -4.83 2.20 0.29 -4.97 119.74 114.59 3jua s LYS 337 Ca -0.01 -0.84 -0.02 0.00 -0.36 0.00 0.00 55.97 54.74 3jua s LYS 337 Cb -0.06 -2.41 0.00 0.00 -1.51 0.00 0.00 37.83 33.86 3jua s LYS 337 CO 0.00 0.11 -0.10 0.08 -0.36 0.00 0.00 175.35 175.08 3jua s VAL 338 N 0.54 2.87 0.17 4.02 1.01 -1.26 -1.36 120.40 126.39 3jua s VAL 338 Ca -0.13 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.24 3jua s VAL 338 Cb -0.17 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 3jua s VAL 338 CO 0.04 0.46 -0.13 -1.83 0.00 0.00 0.00 175.10 173.65 3jua s GLU 339 N 1.41 1.17 -0.09 2.72 -1.05 -0.30 -5.00 118.70 117.56 3jua s GLU 339 Ca 0.05 -1.48 0.04 0.00 -0.15 0.00 0.00 54.97 53.44 3jua s GLU 339 Cb -0.14 -0.88 -0.01 0.00 -0.44 0.00 0.00 34.13 32.66 3jua s GLU 339 CO -0.07 0.14 -0.23 0.95 0.95 0.00 0.00 175.26 177.00 3jua s THR 340 N -2.98 2.19 0.11 1.83 -4.23 -1.26 -0.11 115.64 111.19 3jua s THR 340 Ca 0.18 -0.99 0.08 0.00 -1.18 0.00 0.00 61.69 59.78 3jua s THR 340 Cb -0.00 -1.83 -0.04 0.00 1.34 0.00 0.00 72.50 71.97 3jua s THR 340 CO 0.04 0.56 -0.11 -1.61 -0.54 0.00 0.00 174.62 172.96 3jua s GLU 341 N 0.18 2.07 0.49 3.99 0.41 0.03 -4.98 118.70 120.89 3jua s GLU 341 Ca -0.13 -1.07 0.03 0.00 -0.41 0.00 0.00 54.97 53.39 3jua s GLU 341 Cb -0.16 -2.27 -0.03 0.00 -1.78 0.00 0.00 34.13 29.89 3jua s GLU 341 CO 0.07 0.50 0.04 0.71 -0.49 0.00 0.00 175.26 176.09 3jua s TYR 342 N -1.25 2.03 0.04 1.61 2.02 -1.26 -1.71 117.35 118.83 3jua s TYR 342 Ca 0.21 -0.87 0.03 0.00 -0.37 0.00 0.00 57.07 56.07 3jua s TYR 342 Cb -0.11 -1.69 -0.04 0.00 -0.40 0.00 0.00 41.96 39.73 3jua s TYR 342 CO 0.13 0.23 0.01 0.00 -1.57 0.00 0.00 175.55 174.35 3jua s ALA 343 N -2.82 3.31 -0.05 3.71 0.00 -1.26 -4.62 121.76 120.03 3jua s ALA 343 Ca 0.16 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.16 3jua s ALA 343 Cb 0.03 -1.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 3jua s ALA 343 CO 0.08 0.68 -0.21 0.50 0.00 0.00 0.00 175.76 176.82 3jua s ARG 344 N -1.90 2.50 0.18 0.00 3.52 -0.55 -4.90 118.95 117.81 3jua s ARG 344 Ca 0.23 -0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 54.71 3jua s ARG 344 Cb -0.12 -2.25 -0.08 0.00 -1.56 0.00 0.00 34.95 30.95 3jua s ARG 344 CO 0.14 0.49 1.06 -0.47 -0.81 0.00 0.00 175.30 175.72 3jua s TYR 345 N -0.42 3.66 0.51 5.12 6.14 -1.26 0.49 117.35 131.59 3jua s TYR 345 Ca 0.04 1.67 0.03 0.00 0.64 0.00 0.00 57.07 59.45 3jua s TYR 345 Cb -0.12 -3.22 0.03 0.00 0.42 0.00 0.00 41.96 39.07 3jua s TYR 345 CO 0.02 -0.38 0.23 -1.91 0.64 0.00 0.00 175.55 174.14 3jua n GLU 346 N 2.23 0.76 -1.59 4.97 2.13 0.33 -4.87 120.64 124.60 3jua n GLU 346 Ca 0.02 -3.41 -0.41 0.00 0.66 0.00 0.00 57.16 54.02 3jua n GLU 346 Cb 0.47 0.61 -0.03 0.00 0.27 0.00 0.00 31.44 32.75 3jua n GLU 346 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3jua s ASN 347 N -3.92 5.13 0.00 4.31 2.20 -1.26 -2.64 114.94 118.76 3jua s ASN 347 Ca 0.17 1.65 0.00 0.00 -0.94 0.00 0.00 52.86 53.74 3jua s ASN 347 Cb -0.01 -2.51 0.00 0.00 -2.00 0.00 0.00 41.25 36.73 3jua s ASN 347 CO 0.11 -2.25 0.00 0.61 -2.94 0.00 0.00 177.10 172.63 3jua n GLY 348 N 5.85 0.90 3.37 0.45 0.00 -1.26 -4.97 105.19 109.53 3jua n GLY 348 Ca 0.32 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.18 3jua n GLY 348 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3jua s HIS 349 N -2.84 1.31 -0.04 1.61 -3.43 -1.08 -4.88 115.29 105.93 3jua s HIS 349 Ca 0.00 -1.42 0.07 0.00 -0.80 0.00 0.00 55.06 52.91 3jua s HIS 349 Cb 0.00 -0.39 -0.02 0.00 -1.43 0.00 0.00 32.58 30.75 3jua s HIS 349 CO 0.00 -0.95 -0.25 0.71 -2.00 0.00 0.00 174.74 172.25 3jua s TYR 350 N -3.44 2.37 -0.17 0.38 2.02 0.12 0.12 117.35 118.75 3jua s TYR 350 Ca 0.35 -0.57 -0.03 0.00 -0.37 0.00 0.00 57.07 56.45 3jua s TYR 350 Cb 0.02 -1.54 -0.02 0.00 -0.40 0.00 0.00 41.96 40.02 3jua s TYR 350 CO 0.21 -0.12 -0.05 -0.51 -1.57 0.00 0.00 175.55 173.51 3jua s LEU 351 N -0.40 3.10 0.27 -1.29 1.43 0.18 -0.36 118.68 121.60 3jua s LEU 351 Ca 0.04 -0.23 0.11 0.00 -1.03 0.00 0.00 54.13 53.02 3jua s LEU 351 Cb -0.12 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.30 3jua s LEU 351 CO 0.01 0.11 -0.12 -0.31 0.23 0.00 0.00 176.35 176.27 3jua s TYR 352 N 0.70 2.46 -0.09 0.29 2.02 -0.04 -1.48 117.35 121.21 3jua s TYR 352 Ca -0.02 -0.29 -0.26 0.00 -0.37 0.00 0.00 57.07 56.13 3jua s TYR 352 Cb -0.15 -1.08 0.06 0.00 -0.40 0.00 0.00 41.96 40.39 3jua s TYR 352 CO 0.02 0.67 0.60 -0.98 -1.57 0.00 0.00 175.55 174.29 3jua s ARG 353 N -3.51 0.91 -0.27 -0.62 1.04 -1.26 0.56 118.95 115.79 3jua s ARG 353 Ca 0.30 0.34 -0.05 0.00 -1.04 0.00 0.00 55.73 55.28 3jua s ARG 353 Cb -0.06 0.43 0.01 0.00 -2.04 0.00 0.00 34.95 33.29 3jua s ARG 353 CO 0.17 -0.24 0.02 0.42 -0.04 0.00 0.00 175.30 175.63 3jua s ILE 354 N -0.82 3.57 -0.39 4.99 1.01 0.31 -4.94 121.20 124.94 3jua s ILE 354 Ca -0.09 -0.77 -0.08 0.00 0.00 0.00 0.00 60.65 59.71 3jua s ILE 354 Cb -0.02 -2.81 0.06 0.00 0.01 0.00 0.00 42.46 39.70 3jua s ILE 354 CO 0.07 0.16 0.20 -2.28 0.00 0.00 0.00 174.94 173.08 3jua s HIS 355 N 1.44 3.30 -1.29 3.97 2.46 -1.26 -1.49 115.29 122.43 3jua s HIS 355 Ca 0.02 -1.42 -0.04 0.00 0.47 0.00 0.00 55.06 54.09 3jua s HIS 355 Cb -0.17 -2.67 0.01 0.00 -0.13 0.00 0.00 32.58 29.62 3jua s HIS 355 CO -0.00 -0.78 1.02 0.54 -2.47 0.00 0.00 174.74 173.05 3jua n ARG 356 N 4.89 -6.79 -1.91 2.88 1.74 -1.23 -4.90 116.66 111.34 3jua n ARG 356 Ca -0.11 0.80 -0.42 0.00 -0.77 0.00 0.00 57.85 57.35 3jua n ARG 356 Cb 0.44 -5.77 -0.03 0.00 -1.02 0.00 0.00 32.46 26.08 3jua n ARG 356 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3jua s SER 357 N -3.95 6.60 0.10 0.55 0.15 -0.77 -4.79 113.70 111.59 3jua s SER 357 Ca 0.24 2.42 -0.31 0.00 0.70 0.00 0.00 55.95 58.99 3jua s SER 357 Cb -0.11 -2.54 -0.09 0.00 -1.71 0.00 0.00 66.02 61.57 3jua s SER 357 CO 0.75 -0.94 1.67 -2.16 1.20 0.00 0.00 173.24 173.76 3jua s PRO 358 N 3.63 4.19 0.26 5.44 0.04 -1.26 -1.17 135.00 146.12 3jua s PRO 358 Ca 0.77 2.39 -0.31 0.00 0.04 0.00 0.00 61.00 63.89 3jua s PRO 358 Cb -0.38 -3.50 -0.11 0.00 0.04 0.00 0.00 34.50 30.55 3jua s PRO 358 CO 0.33 -0.73 1.61 -1.17 0.04 0.00 0.00 177.00 177.08 3jua s LEU 359 N 2.34 4.36 0.62 -3.56 2.96 -1.04 -4.90 118.68 119.46 3jua s LEU 359 Ca 0.74 2.88 -0.18 0.00 -0.22 0.00 0.00 54.13 57.36 3jua s LEU 359 Cb -0.42 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 42.63 3jua s LEU 359 CO 0.33 -0.90 1.25 0.00 -1.32 0.00 0.00 176.35 175.70 3jua h GLU 361 N 0.71 0.07 -0.55 0.00 4.39 -2.00 -1.32 114.58 115.88 3jua h GLU 361 Ca -0.51 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.28 3jua h GLU 361 Cb 1.31 -0.02 -0.11 0.00 -0.10 0.00 0.00 28.75 29.84 3jua h GLU 361 CO 0.54 0.04 -0.39 -0.92 -1.16 0.00 0.00 179.01 177.13 3jua h TYR 362 N 0.07 -1.10 -0.87 4.33 3.20 -2.00 -1.24 116.97 119.35 3jua h TYR 362 Ca 0.28 0.07 0.00 0.00 3.14 0.00 0.00 58.73 62.23 3jua h TYR 362 Cb 0.44 0.56 -0.04 0.00 1.54 0.00 0.00 36.73 39.23 3jua h TYR 362 CO -0.39 -0.41 0.56 0.52 -1.64 0.00 0.00 178.16 176.81 3jua h MET 363 N -0.22 1.16 0.20 1.82 2.86 -1.62 -2.00 114.93 117.13 3jua h MET 363 Ca 0.20 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 3jua h MET 363 Cb 0.56 -0.26 0.00 0.00 0.06 0.00 0.00 31.60 31.97 3jua h MET 363 CO -0.66 0.78 -0.10 0.82 1.06 0.00 0.00 176.91 178.81 3jua h ILE 364 N 1.19 0.84 -0.95 -1.22 2.04 -0.63 -2.58 117.51 116.20 3jua h ILE 364 Ca 0.32 -0.16 0.13 0.00 1.00 0.00 0.00 64.86 66.14 3jua h ILE 364 Cb -0.11 0.93 -0.09 0.00 -0.74 0.00 0.00 36.82 36.81 3jua h ILE 364 CO -0.07 0.04 0.57 0.78 0.00 0.00 0.00 178.15 179.48 3jua h ASN 365 N -0.35 0.81 -0.69 1.72 -0.26 -0.93 -0.64 115.58 115.24 3jua h ASN 365 Ca -0.03 0.06 0.09 0.00 -0.56 0.00 0.00 56.30 55.87 3jua h ASN 365 Cb 0.27 -0.09 -0.07 0.00 -1.06 0.00 0.00 38.32 37.36 3jua h ASN 365 CO 0.05 0.40 0.33 0.15 -1.06 0.00 0.00 177.43 177.30 3jua h PHE 366 N 0.88 0.59 -0.35 1.19 3.57 -1.09 0.44 116.94 122.17 3jua h PHE 366 Ca 0.49 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.90 3jua h PHE 366 Cb 0.55 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 3jua h PHE 366 CO -0.03 0.21 -0.27 0.82 -2.23 0.00 0.00 178.31 176.81 3jua h ILE 367 N 0.57 1.28 -0.13 1.41 2.04 -0.75 -0.70 117.51 121.22 3jua h ILE 367 Ca 0.34 -1.39 -0.02 0.00 1.00 0.00 0.00 64.86 64.80 3jua h ILE 367 Cb 0.37 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 3jua h ILE 367 CO -0.27 0.46 0.01 0.45 0.00 0.00 0.00 178.15 178.80 3jua h HIS 368 N 0.62 0.23 -0.97 1.37 3.86 -0.67 -2.00 115.15 117.60 3jua h HIS 368 Ca 0.08 -0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.28 3jua h HIS 368 Cb 0.77 -0.06 -0.05 0.00 1.06 0.00 0.00 27.41 29.13 3jua h HIS 368 CO 0.04 0.42 0.64 0.87 0.86 0.00 0.00 177.93 180.76 3jua h LYS 369 N -0.02 1.21 0.34 2.45 1.57 -0.83 -2.00 116.57 119.29 3jua h LYS 369 Ca 0.04 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3jua h LYS 369 Cb 0.32 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3jua h LYS 369 CO 0.00 0.80 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.45 3jua h LEU 370 N 1.25 -0.38 -1.72 2.94 4.07 -0.98 -2.92 115.31 117.58 3jua h LEU 370 Ca 0.38 -0.04 0.08 0.00 0.08 0.00 0.00 57.88 58.38 3jua h LEU 370 Cb -0.03 0.10 -0.03 0.00 1.08 0.00 0.00 40.66 41.78 3jua h LEU 370 CO -0.11 -0.21 0.33 0.11 -1.08 0.00 0.00 178.44 177.48 3jua h LYS 371 N -0.53 0.33 0.00 1.13 1.57 -1.14 -1.97 116.57 115.97 3jua h LYS 371 Ca -0.05 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3jua h LYS 371 Cb 0.39 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3jua h LYS 371 CO 0.08 0.22 0.00 0.45 -0.57 0.00 0.00 179.45 179.62 3jua h HIS 372 N 0.34 0.00 -3.76 -1.35 3.86 -1.16 -3.43 115.15 109.64 3jua h HIS 372 Ca 0.22 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.90 3jua h HIS 372 Cb 0.42 0.00 0.06 0.00 1.06 0.00 0.00 27.41 28.95 3jua h HIS 372 CO -0.00 0.00 0.67 -0.51 0.86 0.00 0.00 177.93 178.95 3jua s LEU 373 N -4.68 4.42 0.46 2.43 1.43 -0.74 -4.92 118.68 117.07 3jua s LEU 373 Ca 0.03 2.68 0.26 0.00 -1.03 0.00 0.00 54.13 56.07 3jua s LEU 373 Cb 0.09 -3.64 0.84 0.00 0.03 0.00 0.00 46.19 43.50 3jua s LEU 373 CO 0.39 -0.58 1.79 1.55 0.23 0.00 0.00 176.35 179.73 3jua h PRO 374 N 3.80 0.00 -6.59 1.29 0.13 -1.89 -3.46 132.00 125.29 3jua h PRO 374 Ca -0.48 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.98 3jua h PRO 374 Cb 1.22 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.09 3jua h PRO 374 CO 0.68 0.13 -0.87 -1.21 -0.23 0.00 0.00 178.00 176.50 3jua s GLU 375 N -3.48 1.75 0.02 0.86 0.41 -1.26 -5.04 118.70 111.96 3jua s GLU 375 Ca 0.03 -1.06 -0.19 0.00 -0.41 0.00 0.00 54.97 53.34 3jua s GLU 375 Cb 0.08 -1.89 -0.20 0.00 -1.78 0.00 0.00 34.13 30.35 3jua s GLU 375 CO 0.63 0.49 1.19 0.87 -0.49 0.00 0.00 175.26 177.94 3jua h LYS 376 N 4.89 0.44 -0.12 1.61 1.57 -1.98 -1.87 116.57 121.09 3jua h LYS 376 Ca -0.45 -0.38 0.04 0.00 -1.87 0.00 0.00 60.65 57.99 3jua h LYS 376 Cb 1.14 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.53 3jua h LYS 376 CO 0.44 1.02 0.23 0.10 -0.57 0.00 0.00 179.45 180.67 3jua h TYR 377 N -0.02 0.00 0.18 -1.35 -0.00 -1.99 0.23 116.97 114.02 3jua h TYR 377 Ca -0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 58.73 58.38 3jua h TYR 377 Cb 1.12 0.00 0.03 0.00 -0.00 0.00 0.00 36.73 37.89 3jua h TYR 377 CO 0.13 0.00 -1.35 1.98 -0.00 0.00 0.00 178.16 178.91 3jua h MET 378 N 0.00 0.57 -0.72 0.10 4.05 -1.89 -2.38 114.93 114.65 3jua h MET 378 Ca 0.06 -0.85 0.05 0.00 -0.28 0.00 0.00 59.70 58.68 3jua h MET 378 Cb 0.52 0.30 -0.05 0.00 -0.80 0.00 0.00 31.60 31.57 3jua h MET 378 CO -0.00 1.40 0.43 0.52 0.23 0.00 0.00 176.91 179.48 3jua h MET 379 N 0.21 0.77 0.00 0.39 2.86 0.15 -2.67 114.93 116.65 3jua h MET 379 Ca -0.22 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.30 3jua h MET 379 Cb 2.03 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 33.51 3jua h MET 379 CO 0.25 0.51 -0.36 -0.91 1.06 0.00 0.00 176.91 177.46 3jua h ASN 380 N 0.80 0.00 -0.15 1.22 2.35 -0.90 -2.29 115.58 116.61 3jua h ASN 380 Ca 0.32 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.85 3jua h ASN 380 Cb 0.15 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.52 3jua h ASN 380 CO -0.16 0.36 -0.72 -1.28 -1.65 0.00 0.00 177.43 173.98 3jua h SER 381 N 0.00 0.91 -0.04 5.81 0.87 -1.10 -0.71 113.55 119.29 3jua h SER 381 Ca -0.00 -0.57 -0.01 0.00 -1.23 0.00 0.00 61.79 59.98 3jua h SER 381 Cb 0.68 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 3jua h SER 381 CO 0.05 1.36 0.01 0.58 -0.53 0.00 0.00 176.83 178.30 3jua h VAL 382 N 0.55 1.22 -0.02 2.23 2.07 -1.34 -3.20 116.25 117.76 3jua h VAL 382 Ca -0.03 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.82 3jua h VAL 382 Cb 1.34 1.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.70 3jua h VAL 382 CO 0.15 0.18 0.03 -0.07 0.02 0.00 0.00 177.57 177.88 3jua h LEU 383 N -0.19 0.00 -1.94 2.57 3.38 -1.12 -2.09 115.31 115.92 3jua h LEU 383 Ca 0.01 0.00 0.39 0.00 0.09 0.00 0.00 57.88 58.37 3jua h LEU 383 Cb 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 3jua h LEU 383 CO 0.00 0.00 1.00 -0.33 0.09 0.00 0.00 178.44 179.20 3jua h GLU 384 N 0.00 0.00 -0.05 1.13 4.39 -1.12 -2.05 114.58 116.87 3jua h GLU 384 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3jua h GLU 384 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3jua h GLU 384 CO -0.00 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 177.94 3jua n ASN 385 N -4.04 1.92 -4.68 1.42 4.13 -0.78 -4.96 115.26 108.27 3jua n ASN 385 Ca 0.29 -1.76 -0.38 0.00 1.68 0.00 0.00 54.58 54.41 3jua n ASN 385 Cb 1.42 -0.03 -0.07 0.00 -1.54 0.00 0.00 39.78 39.55 3jua n ASN 385 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3jua s PHE 386 N -0.79 3.39 0.13 3.10 5.36 -0.77 -3.94 117.98 124.46 3jua s PHE 386 Ca 0.04 0.59 -0.01 0.00 -0.96 0.00 0.00 56.93 56.59 3jua s PHE 386 Cb 0.02 -2.47 -0.04 0.00 -0.34 0.00 0.00 43.02 40.20 3jua s PHE 386 CO 0.03 0.06 0.06 0.95 -1.46 0.00 0.00 175.22 174.85 3jua s THR 387 N 1.08 0.11 -0.02 0.12 -4.23 -0.38 -4.42 115.64 107.90 3jua s THR 387 Ca 0.18 -1.90 0.01 0.00 -1.18 0.00 0.00 61.69 58.80 3jua s THR 387 Cb -0.14 -2.02 0.01 0.00 1.34 0.00 0.00 72.50 71.69 3jua s THR 387 CO 0.07 -0.48 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.01 3jua s ILE 388 N -4.04 0.30 -0.16 2.99 1.01 -0.96 -0.34 121.20 120.00 3jua s ILE 388 Ca 0.23 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.83 3jua s ILE 388 Cb 0.07 -0.32 0.01 0.00 0.01 0.00 0.00 42.46 42.24 3jua s ILE 388 CO 0.01 0.13 -0.20 -0.22 0.00 0.00 0.00 174.94 174.66 3jua s LEU 389 N 0.46 2.16 -0.14 2.97 0.20 -0.58 0.46 118.68 124.20 3jua s LEU 389 Ca -0.05 -0.61 0.00 0.00 0.69 0.00 0.00 54.13 54.16 3jua s LEU 389 Cb -0.08 -1.47 -0.01 0.00 -0.43 0.00 0.00 46.19 44.20 3jua s LEU 389 CO -0.01 0.04 -0.15 -1.58 -0.29 0.00 0.00 176.35 174.37 3jua s GLN 390 N 1.04 3.29 -0.21 1.98 0.74 -0.10 -0.31 119.66 126.08 3jua s GLN 390 Ca -0.01 -0.73 -0.01 0.00 0.05 0.00 0.00 55.36 54.66 3jua s GLN 390 Cb -0.14 -2.60 0.06 0.00 1.10 0.00 0.00 33.01 31.42 3jua s GLN 390 CO -0.07 0.13 -0.01 0.08 -0.55 0.00 0.00 175.29 174.87 3jua s VAL 391 N 0.54 1.04 -0.17 1.34 1.01 -0.18 -1.00 120.40 122.98 3jua s VAL 391 Ca -0.09 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 3jua s VAL 391 Cb -0.16 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 3jua s VAL 391 CO 0.04 -0.13 0.20 -0.69 0.00 0.00 0.00 175.10 174.52 3jua s VAL 392 N 1.62 5.37 0.05 2.92 1.01 -0.60 -1.74 120.40 129.03 3jua s VAL 392 Ca -0.03 0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.32 3jua s VAL 392 Cb -0.18 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3jua s VAL 392 CO -0.07 0.44 -0.09 0.42 0.00 0.00 0.00 175.10 175.80 3jua s THR 393 N 0.21 0.64 -0.03 3.92 -4.23 -0.68 -0.39 115.64 115.09 3jua s THR 393 Ca 0.12 -1.12 -0.30 0.00 -1.18 0.00 0.00 61.69 59.22 3jua s THR 393 Cb -0.12 -0.69 -0.06 0.00 1.34 0.00 0.00 72.50 72.97 3jua s THR 393 CO 0.01 -0.35 1.69 0.21 -0.54 0.00 0.00 174.62 175.64 3jua s ASN 394 N -1.60 6.63 0.11 3.99 3.84 0.36 -1.15 114.94 127.12 3jua s ASN 394 Ca -0.09 2.32 -0.16 0.00 0.21 0.00 0.00 52.86 55.15 3jua s ASN 394 Cb -0.10 -2.54 -0.04 0.00 -0.55 0.00 0.00 41.25 38.02 3jua s ASN 394 CO 0.01 -0.94 1.54 -0.09 -2.79 0.00 0.00 177.10 174.83 3jua h ARG 395 N 9.54 0.64 0.45 0.43 2.43 -1.12 -3.29 114.38 123.45 3jua h ARG 395 Ca -0.41 -0.22 -0.02 0.00 -0.81 0.00 0.00 59.98 58.52 3jua h ARG 395 Cb 1.19 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 3jua h ARG 395 CO 0.95 0.77 -0.21 -0.44 -1.51 0.00 0.00 179.97 179.53 3jua h ASP 396 N 0.44 -0.51 -3.44 -3.80 3.32 -1.92 -3.42 116.42 107.09 3jua h ASP 396 Ca 0.09 -0.07 -0.36 0.00 0.02 0.00 0.00 57.03 56.71 3jua h ASP 396 Cb 0.51 0.13 0.16 0.00 0.22 0.00 0.00 39.33 40.35 3jua h ASP 396 CO 0.02 -0.09 0.28 0.35 -1.72 0.00 0.00 179.24 178.08 3jua n THR 397 N -5.19 0.00 -1.97 0.35 -2.24 -1.25 -4.99 114.28 98.99 3jua n THR 397 Ca -0.09 -0.71 -0.25 0.00 -2.27 0.00 0.00 64.05 60.73 3jua n THR 397 Cb 0.28 -1.45 0.02 0.00 -2.10 0.00 0.00 70.33 67.08 3jua n THR 397 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3jua n GLN 398 N -3.76 3.55 -2.83 -0.78 -0.06 -1.24 -4.58 117.38 107.69 3jua n GLN 398 Ca 0.14 -4.11 -0.41 0.00 -2.00 0.00 0.00 57.00 50.62 3jua n GLN 398 Cb 0.50 -2.28 -0.04 0.00 -4.06 0.00 0.00 30.24 24.36 3jua n GLN 398 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 3jua s GLU 399 N -3.62 4.57 -0.41 3.69 2.12 -1.24 -4.79 118.70 119.02 3jua s GLU 399 Ca 0.52 1.27 -0.28 0.00 0.36 0.00 0.00 54.97 56.84 3jua s GLU 399 Cb 0.42 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 31.38 3jua s GLU 399 CO 0.04 0.13 1.85 0.99 -0.54 0.00 0.00 175.26 177.72 3jua s THR 400 N 0.42 3.42 0.02 -1.70 2.01 -1.26 -0.48 115.64 118.06 3jua s THR 400 Ca 0.45 0.38 -0.19 0.00 0.31 0.00 0.00 61.69 62.64 3jua s THR 400 Cb -0.21 -3.68 -0.20 0.00 0.01 0.00 0.00 72.50 68.42 3jua s THR 400 CO 0.26 -0.51 1.18 -0.07 -0.69 0.00 0.00 174.62 174.79 3jua h LEU 401 N 14.69 0.55 -7.45 4.42 4.07 -1.05 -3.42 115.31 127.11 3jua h LEU 401 Ca -0.31 -0.68 -0.07 0.00 0.08 0.00 0.00 57.88 56.89 3jua h LEU 401 Cb 1.17 -0.16 -0.15 0.00 1.08 0.00 0.00 40.66 42.60 3jua h LEU 401 CO 1.08 1.14 -0.14 -0.76 -1.08 0.00 0.00 178.44 178.68 3jua s LEU 402 N -8.53 0.58 -0.29 1.67 1.43 -0.81 -4.44 118.68 108.30 3jua s LEU 402 Ca -0.13 -0.19 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 3jua s LEU 402 Cb 0.05 1.64 0.18 0.00 0.03 0.00 0.00 46.19 48.08 3jua s LEU 402 CO 0.81 -0.72 0.48 0.00 0.23 0.00 0.00 176.35 177.15 3jua s ILE 404 N 2.66 5.01 -0.13 0.00 1.09 -0.17 -0.41 121.20 129.25 3jua s ILE 404 Ca 0.10 0.05 -0.10 0.00 -1.10 0.00 0.00 60.65 59.60 3jua s ILE 404 Cb -0.12 -3.27 -0.05 0.00 -1.06 0.00 0.00 42.46 37.96 3jua s ILE 404 CO -0.28 0.45 0.20 0.00 -0.10 0.00 0.00 174.94 175.21 3jua s ALA 405 N 0.41 3.76 -0.08 9.38 0.00 0.15 -0.92 121.76 134.45 3jua s ALA 405 Ca 0.05 -0.57 0.04 0.00 0.00 0.00 0.00 51.96 51.48 3jua s ALA 405 Cb -0.12 -2.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.85 3jua s ALA 405 CO -0.00 0.40 -0.21 0.71 0.00 0.00 0.00 175.76 176.66 3jua s TYR 406 N -0.43 2.58 0.08 0.00 1.51 0.17 -0.06 117.35 121.20 3jua s TYR 406 Ca 0.15 -0.71 0.06 0.00 -1.01 0.00 0.00 57.07 55.56 3jua s TYR 406 Cb -0.12 -1.68 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 3jua s TYR 406 CO 0.04 -0.21 -0.17 0.08 -1.11 0.00 0.00 175.55 174.18 3jua s VAL 407 N -0.00 1.32 -0.02 0.71 1.01 -0.25 -2.26 120.40 120.91 3jua s VAL 407 Ca -0.07 -1.34 0.03 0.00 0.00 0.00 0.00 61.98 60.61 3jua s VAL 407 Cb -0.15 -1.23 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 3jua s VAL 407 CO 0.05 -0.13 -0.12 -0.36 0.00 0.00 0.00 175.10 174.55 3jua s PHE 408 N -1.16 1.12 0.40 5.22 0.40 -1.26 -0.81 117.98 121.88 3jua s PHE 408 Ca 0.01 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.13 3jua s PHE 408 Cb -0.10 -0.75 -0.05 0.00 0.51 0.00 0.00 43.02 42.63 3jua s PHE 408 CO 0.03 -0.07 0.05 -1.21 0.70 0.00 0.00 175.22 174.72 3jua s GLU 409 N -0.05 1.88 0.38 0.44 2.02 -0.22 -4.51 118.70 118.64 3jua s GLU 409 Ca 0.00 -2.10 0.01 0.00 0.02 0.00 0.00 54.97 52.90 3jua s GLU 409 Cb -0.07 -1.10 -0.02 0.00 0.10 0.00 0.00 34.13 33.03 3jua s GLU 409 CO 0.00 -0.25 0.59 0.08 0.02 0.00 0.00 175.26 175.70 3jua s VAL 410 N -3.07 4.69 0.44 2.63 1.01 -1.26 -0.45 120.40 124.39 3jua s VAL 410 Ca 0.28 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 61.85 3jua s VAL 410 Cb 0.06 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.73 3jua s VAL 410 CO 0.14 -0.47 0.50 -0.94 0.00 0.00 0.00 175.10 174.32 3jua s SER 411 N -4.10 5.27 0.00 3.32 1.04 -0.94 -4.65 113.70 113.64 3jua s SER 411 Ca 0.43 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.20 3jua s SER 411 Cb -0.10 -0.46 0.00 0.00 0.10 0.00 0.00 66.02 65.56 3jua s SER 411 CO 0.37 -0.79 0.09 0.00 0.98 0.00 0.00 173.24 173.88 3jua n ALA 412 N -1.75 0.00 0.00 5.32 0.00 -1.26 -5.00 120.51 117.82 3jua n ALA 412 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3jua n ALA 412 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 3jua n ALA 412 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3jua n SER 413 N -0.33 0.00 -4.60 0.00 3.41 -1.26 -5.11 113.62 105.74 3jua n SER 413 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 3jua n SER 413 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 3jua n SER 413 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3jua s ALA 417 N 0.00 3.13 0.29 7.33 0.00 -1.26 -5.14 121.76 126.11 3jua s ALA 417 Ca 0.00 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 3jua s ALA 417 Cb 0.00 -1.47 -0.02 0.00 0.00 0.00 0.00 23.12 21.64 3jua s ALA 417 CO 0.00 0.45 0.35 -0.65 0.00 0.00 0.00 175.76 175.91 3jua s GLN 418 N -0.41 1.66 0.04 0.00 1.11 -0.47 -4.98 119.66 116.62 3jua s GLN 418 Ca 0.07 -1.72 -0.27 0.00 0.01 0.00 0.00 55.36 53.45 3jua s GLN 418 Cb -0.12 0.38 0.07 0.00 -1.01 0.00 0.00 33.01 32.33 3jua s GLN 418 CO 0.02 -0.65 0.63 -3.38 0.01 0.00 0.00 175.29 171.93 3jua s HIS 419 N -3.54 -0.59 -0.05 0.91 -3.43 -1.26 0.00 115.29 107.34 3jua s HIS 419 Ca 0.34 0.76 0.03 0.00 -0.80 0.00 0.00 55.06 55.38 3jua s HIS 419 Cb 0.02 0.46 0.00 0.00 -1.43 0.00 0.00 32.58 31.64 3jua s HIS 419 CO 0.18 -0.71 -0.13 -1.58 -2.00 0.00 0.00 174.74 170.51 3jua s HIS 420 N -2.31 1.38 -0.16 0.38 2.46 -0.61 -5.01 115.29 111.44 3jua s HIS 420 Ca -0.06 -0.42 -0.07 0.00 0.47 0.00 0.00 55.06 54.98 3jua s HIS 420 Cb -0.00 -0.98 -0.04 0.00 -0.13 0.00 0.00 32.58 31.43 3jua s HIS 420 CO -0.00 -0.18 0.07 0.42 -2.47 0.00 0.00 174.74 172.58 3jua s ILE 421 N 0.31 4.89 0.08 0.89 1.01 -1.26 -1.76 121.20 125.35 3jua s ILE 421 Ca -0.07 -0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.63 3jua s ILE 421 Cb -0.12 -3.17 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 3jua s ILE 421 CO 0.02 0.51 -0.17 -0.31 0.00 0.00 0.00 174.94 175.00 3jua s TYR 422 N -0.11 1.44 -0.01 3.97 2.02 0.11 -4.34 117.35 120.42 3jua s TYR 422 Ca 0.07 -0.44 -0.12 0.00 -0.37 0.00 0.00 57.07 56.21 3jua s TYR 422 Cb -0.12 -0.80 -0.05 0.00 -0.40 0.00 0.00 41.96 40.59 3jua s TYR 422 CO 0.01 0.11 0.35 -0.98 -1.57 0.00 0.00 175.55 173.47 3jua s ARG 423 N -1.76 3.79 0.07 -0.62 1.70 -0.69 -0.15 118.95 121.28 3jua s ARG 423 Ca 0.01 0.26 -0.15 0.00 -0.47 0.00 0.00 55.73 55.39 3jua s ARG 423 Cb -0.10 -3.18 -0.06 0.00 -0.57 0.00 0.00 34.95 31.04 3jua s ARG 423 CO 0.03 0.69 0.48 -0.51 -1.08 0.00 0.00 175.30 174.91 3jua s LEU 424 N -1.21 4.43 0.00 -1.89 1.43 -0.69 -0.81 118.68 119.95 3jua s LEU 424 Ca 0.23 1.03 -0.01 0.00 -1.03 0.00 0.00 54.13 54.35 3jua s LEU 424 Cb -0.15 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.18 3jua s LEU 424 CO 0.12 0.23 0.43 1.33 0.23 0.00 0.00 176.35 178.70 3jua n VAL 425 N 1.38 0.00 -0.69 -1.59 0.24 -0.41 -4.85 118.33 112.41 3jua n VAL 425 Ca -0.10 -1.71 0.00 0.00 -2.04 0.00 0.00 64.34 60.49 3jua n VAL 425 Cb 0.52 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.92 3jua n VAL 425 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98