#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kgj s SER 208 N 0.00 6.25 -0.01 1.62 0.01 -1.26 -4.82 113.70 115.49 1kgj s SER 208 Ca 0.00 -1.26 -0.25 0.00 1.31 0.00 0.00 55.95 55.74 1kgj s SER 208 Cb 0.00 -2.57 -0.19 0.00 0.21 0.00 0.00 66.02 63.47 1kgj s SER 208 CO 0.00 -1.74 1.28 0.11 0.41 0.00 0.00 173.24 173.30 1kgj h LYS 209 N 10.10 -0.08 -5.96 12.44 1.57 -2.01 -3.44 116.57 129.18 1kgj h LYS 209 Ca 0.16 0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 58.33 1kgj h LYS 209 Cb 1.01 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.30 1kgj h LYS 209 CO 1.39 0.32 -0.42 0.00 -0.57 0.00 0.00 179.45 180.17 1kgj h PRO 211 N 3.33 0.00 -5.02 0.00 0.11 -1.84 -3.45 132.00 125.14 1kgj h PRO 211 Ca -0.47 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.00 1kgj h PRO 211 Cb 1.17 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.94 1kgj h PRO 211 CO 0.72 0.00 -0.86 -1.17 -0.21 0.00 0.00 178.00 176.48 1kgj s LEU 212 N -5.49 1.97 -0.05 2.35 2.96 -1.26 0.16 118.68 119.32 1kgj s LEU 212 Ca 0.08 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 53.42 1kgj s LEU 212 Cb 0.08 -1.34 0.03 0.00 0.50 0.00 0.00 46.19 45.47 1kgj s LEU 212 CO 0.63 0.04 0.11 -0.32 -1.32 0.00 0.00 176.35 175.49 1kgj s MET 213 N 0.98 0.06 -0.20 1.98 -2.45 -0.95 -4.31 119.30 114.42 1kgj s MET 213 Ca -0.04 0.28 -0.02 0.00 -1.25 0.00 0.00 55.69 54.66 1kgj s MET 213 Cb -0.15 -0.16 0.00 0.00 1.25 0.00 0.00 34.83 35.78 1kgj s MET 213 CO -0.04 -0.14 -0.11 0.08 1.05 0.00 0.00 175.02 175.86 1kgj s VAL 214 N 0.95 2.88 -0.18 10.11 1.01 -0.49 -1.33 120.40 133.35 1kgj s VAL 214 Ca -0.07 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 1kgj s VAL 214 Cb -0.10 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1kgj s VAL 214 CO -0.04 0.47 -0.06 -0.75 0.00 0.00 0.00 175.10 174.72 1kgj s LYS 215 N 1.32 3.46 0.05 2.72 2.20 0.17 -0.64 119.74 129.02 1kgj s LYS 215 Ca 0.04 -0.61 0.09 0.00 -0.36 0.00 0.00 55.97 55.13 1kgj s LYS 215 Cb -0.14 -2.90 -0.03 0.00 -1.51 0.00 0.00 37.83 33.25 1kgj s LYS 215 CO -0.06 0.01 -0.24 0.08 -0.36 0.00 0.00 175.35 174.78 1kgj s VAL 216 N 0.93 1.97 0.23 4.02 1.01 -0.30 -0.36 120.40 127.90 1kgj s VAL 216 Ca -0.01 -1.33 0.02 0.00 0.00 0.00 0.00 61.98 60.66 1kgj s VAL 216 Cb -0.15 -1.69 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 1kgj s VAL 216 CO 0.01 0.30 0.04 -0.76 0.00 0.00 0.00 175.10 174.68 1kgj s LEU 217 N -1.25 1.98 -0.17 3.92 1.43 0.69 -2.72 118.68 122.57 1kgj s LEU 217 Ca 0.10 -1.27 0.01 0.00 -1.03 0.00 0.00 54.13 51.94 1kgj s LEU 217 Cb -0.10 -0.12 0.02 0.00 0.03 0.00 0.00 46.19 46.02 1kgj s LEU 217 CO 0.02 -0.61 -0.20 -0.62 0.23 0.00 0.00 176.35 175.17 1kgj s ASP 218 N -3.29 3.09 0.36 2.29 -1.08 -0.43 -1.15 116.67 116.47 1kgj s ASP 218 Ca 0.31 -0.63 0.24 0.00 -0.52 0.00 0.00 52.55 51.96 1kgj s ASP 218 Cb 0.07 -1.45 0.53 0.00 -1.46 0.00 0.00 42.92 40.61 1kgj s ASP 218 CO 0.10 0.02 1.68 0.00 0.52 0.00 0.00 175.17 177.48 1kgj h ALA 219 N 7.78 1.00 0.00 3.66 0.00 -0.79 -3.05 119.26 127.86 1kgj h ALA 219 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1kgj h ALA 219 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1kgj h ALA 219 CO 0.61 0.00 -0.88 1.33 0.00 0.00 0.00 179.25 180.32 1kgj n VAL 220 N -2.80 0.03 -0.09 0.00 0.24 -1.26 -4.48 118.33 109.96 1kgj n VAL 220 Ca 0.04 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 1kgj n VAL 220 Cb 0.49 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 1kgj n VAL 220 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1kgj n ARG 221 N -1.60 2.65 -3.34 7.34 1.74 -1.25 -5.03 116.66 117.18 1kgj n ARG 221 Ca 0.04 -0.18 -0.18 0.00 -0.77 0.00 0.00 57.85 56.76 1kgj n ARG 221 Cb 0.36 -0.62 0.07 0.00 -1.02 0.00 0.00 32.46 31.24 1kgj n ARG 221 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1kgj n GLY 222 N 0.43 -0.27 3.27 -0.13 0.00 -1.15 -5.01 105.19 102.33 1kgj n GLY 222 Ca 0.00 0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 1kgj n GLY 222 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kgj s SER 223 N -3.58 0.01 0.30 1.61 1.04 -1.24 -5.05 113.70 106.79 1kgj s SER 223 Ca 0.32 -0.61 -0.28 0.00 0.48 0.00 0.00 55.95 55.85 1kgj s SER 223 Cb -0.14 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.28 1kgj s SER 223 CO 0.61 -0.80 1.09 -2.16 0.98 0.00 0.00 173.24 172.95 1kgj s PRO 224 N -3.87 4.56 -0.31 4.02 0.04 -1.26 -1.31 135.00 136.87 1kgj s PRO 224 Ca 0.07 1.75 -0.29 0.00 0.04 0.00 0.00 61.00 62.57 1kgj s PRO 224 Cb 0.04 -3.08 0.01 0.00 0.04 0.00 0.00 34.50 31.50 1kgj s PRO 224 CO -0.09 0.16 1.23 0.00 0.04 0.00 0.00 177.00 178.34 1kgj s ALA 225 N -1.25 3.39 0.05 8.56 0.00 -1.10 -4.68 121.76 126.73 1kgj s ALA 225 Ca 0.47 0.03 -0.04 0.00 0.00 0.00 0.00 51.96 52.42 1kgj s ALA 225 Cb -0.30 -3.75 -0.05 0.00 0.00 0.00 0.00 23.12 19.02 1kgj s ALA 225 CO 0.38 -1.71 0.27 0.14 0.00 0.00 0.00 175.76 174.84 1kgj s VAL 226 N 4.17 5.31 -1.44 0.00 -7.23 -1.26 -4.15 120.40 115.79 1kgj s VAL 226 Ca 0.53 -0.04 -0.07 0.00 -1.81 0.00 0.00 61.98 60.59 1kgj s VAL 226 Cb -0.15 -3.59 0.04 0.00 0.56 0.00 0.00 36.38 33.23 1kgj s VAL 226 CO 0.21 0.23 0.59 0.47 -0.31 0.00 0.00 175.10 176.29 1kgj n ASP 227 N 0.65 -5.12 -4.75 4.85 8.00 0.81 -4.92 116.55 116.07 1kgj n ASP 227 Ca -0.08 -0.35 -0.40 0.00 0.71 0.00 0.00 54.79 54.67 1kgj n ASP 227 Cb 0.52 -4.16 -0.06 0.00 -0.02 0.00 0.00 41.12 37.40 1kgj n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1kgj s VAL 228 N -3.09 4.14 -0.34 2.53 1.01 -1.26 -4.70 120.40 118.70 1kgj s VAL 228 Ca 0.36 2.08 -0.28 0.00 0.00 0.00 0.00 61.98 64.14 1kgj s VAL 228 Cb -0.18 -4.33 0.02 0.00 0.00 0.00 0.00 36.38 31.90 1kgj s VAL 228 CO 0.45 0.46 1.05 0.00 0.00 0.00 0.00 175.10 177.07 1kgj s ALA 229 N -0.96 3.45 -0.12 5.51 0.00 -1.26 -1.45 121.76 126.92 1kgj s ALA 229 Ca 0.42 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.23 1kgj s ALA 229 Cb -0.26 -3.67 -0.01 0.00 0.00 0.00 0.00 23.12 19.18 1kgj s ALA 229 CO 0.32 -1.59 -0.17 0.08 0.00 0.00 0.00 175.76 174.40 1kgj s VAL 230 N 3.71 2.72 -0.13 0.00 1.01 0.07 0.12 120.40 127.90 1kgj s VAL 230 Ca 0.44 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.60 1kgj s VAL 230 Cb -0.12 -2.11 0.05 0.00 0.00 0.00 0.00 36.38 34.20 1kgj s VAL 230 CO 0.18 0.54 0.08 -0.75 0.00 0.00 0.00 175.10 175.14 1kgj s LYS 231 N 0.33 0.02 0.02 2.72 2.20 0.13 -1.61 119.74 123.54 1kgj s LYS 231 Ca -0.13 0.07 -0.19 0.00 -0.36 0.00 0.00 55.97 55.35 1kgj s LYS 231 Cb -0.17 -1.41 -0.06 0.00 -1.51 0.00 0.00 37.83 34.68 1kgj s LYS 231 CO 0.07 -0.56 0.56 0.08 -0.36 0.00 0.00 175.35 175.13 1kgj s VAL 232 N 2.15 4.88 0.14 4.02 1.01 -0.87 -1.42 120.40 130.31 1kgj s VAL 232 Ca 0.03 1.17 0.10 0.00 0.00 0.00 0.00 61.98 63.28 1kgj s VAL 232 Cb -0.15 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1kgj s VAL 232 CO -0.07 0.48 -0.23 -0.36 0.00 0.00 0.00 175.10 174.92 1kgj s PHE 233 N -0.56 2.07 0.15 5.22 0.40 0.12 -1.08 117.98 124.29 1kgj s PHE 233 Ca 0.29 -0.40 0.10 0.00 -0.60 0.00 0.00 56.93 56.32 1kgj s PHE 233 Cb -0.18 -1.09 -0.04 0.00 0.51 0.00 0.00 43.02 42.22 1kgj s PHE 233 CO 0.17 0.33 -0.22 0.21 0.70 0.00 0.00 175.22 176.41 1kgj s LYS 234 N -2.26 1.31 -0.01 0.44 2.20 -0.21 -0.67 119.74 120.54 1kgj s LYS 234 Ca 0.13 -1.36 -0.24 0.00 -0.36 0.00 0.00 55.97 54.15 1kgj s LYS 234 Cb -0.09 -1.58 -0.05 0.00 -1.51 0.00 0.00 37.83 34.61 1kgj s LYS 234 CO 0.06 0.35 0.74 0.21 -0.36 0.00 0.00 175.35 176.35 1kgj s LYS 235 N -2.38 4.46 0.65 4.03 2.20 -0.10 -1.56 119.74 127.05 1kgj s LYS 235 Ca 0.14 0.98 -0.07 0.00 -0.36 0.00 0.00 55.97 56.66 1kgj s LYS 235 Cb -0.08 -3.40 0.03 0.00 -1.51 0.00 0.00 37.83 32.86 1kgj s LYS 235 CO 0.07 0.18 0.98 0.95 -0.36 0.00 0.00 175.35 177.16 1kgj s THR 236 N 0.37 3.10 0.51 3.43 -4.23 0.43 -4.75 115.64 114.51 1kgj s THR 236 Ca 0.38 -0.02 0.27 0.00 -1.18 0.00 0.00 61.69 61.15 1kgj s THR 236 Cb -0.19 -3.29 0.31 0.00 1.34 0.00 0.00 72.50 70.68 1kgj s THR 236 CO 0.21 -0.32 2.16 0.00 -0.54 0.00 0.00 174.62 176.14 1kgj h ALA 237 N -0.43 1.47 -0.02 3.99 0.00 -1.97 -1.65 119.26 120.66 1kgj h ALA 237 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1kgj h ALA 237 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1kgj h ALA 237 CO 0.61 0.07 -0.24 -0.40 0.00 0.00 0.00 179.25 179.30 1kgj n ASP 238 N -3.84 1.79 0.00 0.00 5.75 -1.26 -4.94 116.55 114.04 1kgj n ASP 238 Ca -0.03 -1.40 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 1kgj n ASP 238 Cb 0.15 0.20 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1kgj n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kgj n GLY 239 N 1.34 1.08 3.32 6.12 0.00 -0.62 -5.11 105.19 111.32 1kgj n GLY 239 Ca 0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1kgj n GLY 239 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kgj n SER 240 N 0.00 0.85 -3.69 1.61 7.64 -1.26 -4.78 113.62 113.99 1kgj n SER 240 Ca 0.00 -1.81 -0.30 0.00 1.01 0.00 0.00 58.87 57.77 1kgj n SER 240 Cb 0.00 -0.65 -0.14 0.00 -1.01 0.00 0.00 64.21 62.42 1kgj n SER 240 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1kgj s TRP 241 N -2.87 1.70 0.11 1.43 0.52 -1.26 -0.42 118.94 118.16 1kgj s TRP 241 Ca 0.59 -2.06 -0.22 0.00 0.02 0.00 0.00 56.10 54.43 1kgj s TRP 241 Cb -0.03 -1.69 -0.07 0.00 -1.15 0.00 0.00 33.47 30.53 1kgj s TRP 241 CO 0.40 -0.82 0.66 -1.83 0.02 0.00 0.00 176.95 175.37 1kgj s GLU 242 N 0.92 4.36 0.43 4.98 -1.05 -0.60 -4.78 118.70 122.96 1kgj s GLU 242 Ca 0.15 0.91 -0.24 0.00 -0.15 0.00 0.00 54.97 55.64 1kgj s GLU 242 Cb -0.22 -3.25 -0.10 0.00 -0.44 0.00 0.00 34.13 30.12 1kgj s GLU 242 CO -0.09 0.61 1.08 -2.30 0.95 0.00 0.00 175.26 175.51 1kgj n PRO 243 N 1.68 1.48 0.00 -4.83 -0.02 -1.26 -1.04 135.00 131.01 1kgj n PRO 243 Ca -0.08 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1kgj n PRO 243 Cb 0.50 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1kgj n PRO 243 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1kgj n PHE 244 N -0.49 0.00 -3.78 6.00 7.35 -0.24 -4.73 117.46 121.56 1kgj n PHE 244 Ca 0.09 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.72 1kgj n PHE 244 Cb 0.40 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.21 1kgj n PHE 244 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1kgj s ALA 245 N -1.96 -1.43 0.17 3.13 0.00 -1.09 -4.98 121.76 115.60 1kgj s ALA 245 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 51.96 51.71 1kgj s ALA 245 Cb 0.00 0.76 0.05 0.00 0.00 0.00 0.00 23.12 23.93 1kgj s ALA 245 CO 0.00 -1.01 0.54 -1.12 0.00 0.00 0.00 175.76 174.17 1kgj s SER 246 N -2.90 -0.39 0.00 0.00 0.01 -1.26 -2.04 113.70 107.11 1kgj s SER 246 Ca 0.11 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.14 1kgj s SER 246 Cb -0.04 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.77 1kgj s SER 246 CO 0.03 -0.99 0.00 0.61 0.41 0.00 0.00 173.24 173.31 1kgj n GLY 247 N -0.34 0.57 3.18 3.44 0.00 -0.63 -4.95 105.19 106.45 1kgj n GLY 247 Ca -0.14 -1.19 -0.20 0.00 0.00 0.00 0.00 46.02 44.49 1kgj n GLY 247 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kgj s LYS 248 N -2.00 0.90 0.40 1.61 -2.85 -1.26 -0.75 119.74 115.80 1kgj s LYS 248 Ca 0.00 -0.91 -0.26 0.00 -1.00 0.00 0.00 55.97 53.80 1kgj s LYS 248 Cb 0.00 -0.94 -0.09 0.00 -2.06 0.00 0.00 37.83 34.74 1kgj s LYS 248 CO 0.00 0.22 1.28 0.95 0.10 0.00 0.00 175.35 177.90 1kgj s THR 249 N -1.10 2.72 0.00 3.79 -4.23 -0.53 -4.81 115.64 111.48 1kgj s THR 249 Ca 0.00 0.64 0.00 0.00 -1.18 0.00 0.00 61.69 61.15 1kgj s THR 249 Cb -0.09 -3.38 0.00 0.00 1.34 0.00 0.00 72.50 70.37 1kgj s THR 249 CO 0.02 0.09 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 1kgj n ALA 250 N 0.15 0.00 0.40 3.99 0.00 -0.32 -0.14 120.51 124.60 1kgj n ALA 250 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1kgj n ALA 250 Cb 0.44 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.22 1kgj n ALA 250 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1kgj h GLU 251 N 0.00 0.00 -0.60 0.00 5.08 -1.93 -3.18 114.58 113.96 1kgj h GLU 251 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1kgj h GLU 251 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1kgj h GLU 251 CO 0.00 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.88 1kgj n SER 252 N -2.71 4.21 0.00 1.42 3.41 -1.26 -4.79 113.62 113.89 1kgj n SER 252 Ca 0.04 -2.30 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 1kgj n SER 252 Cb 0.45 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1kgj n SER 252 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1kgj n GLY 253 N 1.05 2.93 3.86 5.00 0.00 -1.20 -4.82 105.19 112.00 1kgj n GLY 253 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 1kgj n GLY 253 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1kgj s GLU 254 N -0.03 3.87 -0.15 1.61 2.02 -1.26 -1.15 118.70 123.61 1kgj s GLU 254 Ca 0.00 0.35 -0.03 0.00 0.02 0.00 0.00 54.97 55.31 1kgj s GLU 254 Cb 0.00 -2.84 0.05 0.00 0.10 0.00 0.00 34.13 31.44 1kgj s GLU 254 CO 0.00 0.44 0.04 -1.17 0.02 0.00 0.00 175.26 174.58 1kgj s LEU 255 N -2.26 0.81 0.30 1.80 2.96 0.19 -1.17 118.68 121.31 1kgj s LEU 255 Ca 0.40 -0.54 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 1kgj s LEU 255 Cb -0.13 -0.46 -0.06 0.00 0.50 0.00 0.00 46.19 46.04 1kgj s LEU 255 CO 0.20 -0.28 0.08 -1.38 -1.32 0.00 0.00 176.35 173.64 1kgj s HIS 256 N 1.96 1.80 -0.08 5.38 -3.43 -1.26 -1.39 115.29 118.27 1kgj s HIS 256 Ca 0.01 -1.05 0.00 0.00 -0.80 0.00 0.00 55.06 53.22 1kgj s HIS 256 Cb -0.15 -1.14 0.00 0.00 -1.43 0.00 0.00 32.58 29.86 1kgj s HIS 256 CO -0.07 -0.13 0.00 0.41 -2.00 0.00 0.00 174.74 172.95 1kgj n GLY 257 N -0.61 0.37 0.19 -1.38 0.00 -1.26 -4.94 105.19 97.56 1kgj n GLY 257 Ca -0.01 -0.92 -0.17 0.00 0.00 0.00 0.00 46.02 44.91 1kgj n GLY 257 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1kgj h LEU 258 N 0.00 0.78 0.00 0.99 3.38 -1.87 -3.48 115.31 115.11 1kgj h LEU 258 Ca -0.02 -0.59 -0.31 0.00 0.09 0.00 0.00 57.88 57.05 1kgj h LEU 258 Cb 0.68 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 41.11 1kgj h LEU 258 CO 0.02 1.39 -0.29 0.35 0.09 0.00 0.00 178.44 180.00 1kgj n THR 259 N -3.84 0.00 -3.83 0.22 -2.24 -1.26 -4.76 114.28 98.57 1kgj n THR 259 Ca -0.09 -1.53 -0.12 0.00 -2.27 0.00 0.00 64.05 60.05 1kgj n THR 259 Cb 0.83 0.71 -0.12 0.00 -2.10 0.00 0.00 70.33 69.65 1kgj n THR 259 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1kgj s THR 260 N -2.77 0.03 0.28 4.28 -1.32 -1.26 -4.62 115.64 110.26 1kgj s THR 260 Ca 0.22 -0.22 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 1kgj s THR 260 Cb 0.01 -0.31 0.44 0.00 -1.51 0.00 0.00 72.50 71.13 1kgj s THR 260 CO 0.16 -0.12 1.52 0.47 -2.21 0.00 0.00 174.62 174.43 1kgj n ASP 261 N 2.49 -0.30 -0.07 8.08 8.00 -1.26 0.16 116.55 133.65 1kgj n ASP 261 Ca -0.16 1.67 -0.07 0.00 0.71 0.00 0.00 54.79 56.94 1kgj n ASP 261 Cb 0.58 -0.53 -0.01 0.00 -0.02 0.00 0.00 41.12 41.15 1kgj n ASP 261 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1kgj h GLU 262 N 0.00 -0.07 0.16 -1.24 4.81 -1.97 -3.11 114.58 113.15 1kgj h GLU 262 Ca 0.49 0.01 -0.29 0.00 -0.13 0.00 0.00 59.36 59.44 1kgj h GLU 262 Cb 0.82 0.02 0.01 0.00 0.63 0.00 0.00 28.75 30.23 1kgj h GLU 262 CO -0.98 -0.05 -1.32 -0.22 -0.73 0.00 0.00 179.01 175.70 1kgj h LYS 263 N -0.08 0.34 -5.92 1.92 3.64 -1.09 -3.41 116.57 111.97 1kgj h LYS 263 Ca 0.15 -0.58 -0.65 0.00 -1.27 0.00 0.00 60.65 58.30 1kgj h LYS 263 Cb 0.30 0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 32.25 1kgj h LYS 263 CO -0.34 1.27 1.84 0.12 -2.27 0.00 0.00 179.45 180.07 1kgj s PHE 264 N -2.64 2.70 0.56 1.91 5.36 0.12 -4.94 117.98 121.05 1kgj s PHE 264 Ca -0.06 -1.29 0.08 0.00 -0.96 0.00 0.00 56.93 54.71 1kgj s PHE 264 Cb 0.06 -4.71 0.07 0.00 -0.34 0.00 0.00 43.02 38.10 1kgj s PHE 264 CO 0.90 -1.85 0.66 -0.08 -1.46 0.00 0.00 175.22 173.39 1kgj s THR 265 N 4.46 2.02 0.64 0.12 -1.32 -1.26 -4.81 115.64 115.50 1kgj s THR 265 Ca 0.50 -1.15 -0.17 0.00 -1.21 0.00 0.00 61.69 59.65 1kgj s THR 265 Cb 0.02 -2.18 -0.08 0.00 -1.51 0.00 0.00 72.50 68.75 1kgj s THR 265 CO -0.01 0.00 0.32 1.21 -2.21 0.00 0.00 174.62 173.93 1kgj n GLU 266 N -2.08 0.30 0.00 7.08 2.13 -1.26 -4.80 120.64 122.01 1kgj n GLU 266 Ca 0.10 0.13 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1kgj n GLU 266 Cb 0.62 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.76 1kgj n GLU 266 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1kgj n GLY 267 N 1.98 2.40 3.69 8.31 0.00 -1.02 -5.01 105.19 115.53 1kgj n GLY 267 Ca 0.09 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.03 1kgj n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kgj s VAL 268 N -1.75 5.15 0.27 1.61 1.01 -1.26 -0.42 120.40 125.01 1kgj s VAL 268 Ca 0.00 0.93 0.10 0.00 0.00 0.00 0.00 61.98 63.01 1kgj s VAL 268 Cb 0.00 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1kgj s VAL 268 CO 0.00 0.25 -0.03 -0.31 0.00 0.00 0.00 175.10 175.01 1kgj s TYR 269 N 1.17 2.63 -0.25 5.22 1.51 0.17 -0.93 117.35 126.87 1kgj s TYR 269 Ca 0.24 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 56.02 1kgj s TYR 269 Cb -0.15 -1.19 0.11 0.00 -0.11 0.00 0.00 41.96 40.61 1kgj s TYR 269 CO 0.10 0.62 0.21 0.50 -1.11 0.00 0.00 175.55 175.86 1kgj s ARG 270 N -3.66 0.22 -0.08 -0.62 3.52 0.15 -1.16 118.95 117.33 1kgj s ARG 270 Ca 0.32 -0.15 -0.19 0.00 -0.13 0.00 0.00 55.73 55.57 1kgj s ARG 270 Cb -0.06 -1.06 -0.04 0.00 -1.56 0.00 0.00 34.95 32.22 1kgj s ARG 270 CO 0.19 -0.89 0.54 0.08 -0.81 0.00 0.00 175.30 174.41 1kgj s VAL 271 N 2.26 5.09 -0.08 7.11 1.01 -0.09 -0.71 120.40 135.00 1kgj s VAL 271 Ca 0.08 1.09 0.03 0.00 0.00 0.00 0.00 61.98 63.18 1kgj s VAL 271 Cb -0.15 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1kgj s VAL 271 CO -0.26 0.35 -0.16 -0.70 0.00 0.00 0.00 175.10 174.33 1kgj s GLU 272 N 0.36 2.18 -0.16 2.72 2.12 -0.51 -1.45 118.70 123.97 1kgj s GLU 272 Ca 0.29 -0.58 -0.02 0.00 0.36 0.00 0.00 54.97 55.02 1kgj s GLU 272 Cb -0.16 -1.73 -0.02 0.00 0.26 0.00 0.00 34.13 32.48 1kgj s GLU 272 CO 0.13 0.07 -0.07 -0.51 -0.54 0.00 0.00 175.26 174.34 1kgj s LEU 273 N 0.58 3.00 -1.16 2.70 1.43 -0.49 0.19 118.68 124.92 1kgj s LEU 273 Ca -0.16 -0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 52.52 1kgj s LEU 273 Cb -0.16 -1.71 0.11 0.00 0.03 0.00 0.00 46.19 44.45 1kgj s LEU 273 CO 0.05 0.14 1.49 -0.62 0.23 0.00 0.00 176.35 177.64 1kgj s ASP 274 N 0.54 6.83 0.27 2.29 2.15 0.32 -2.40 116.67 126.67 1kgj s ASP 274 Ca -0.05 -2.41 0.13 0.00 0.43 0.00 0.00 52.55 50.64 1kgj s ASP 274 Cb -0.15 -2.49 0.26 0.00 -0.30 0.00 0.00 42.92 40.25 1kgj s ASP 274 CO 0.03 -1.06 1.54 0.71 -0.17 0.00 0.00 175.17 176.22 1kgj h THR 275 N 5.50 1.26 0.64 1.71 1.35 -1.85 -3.28 112.91 118.23 1kgj h THR 275 Ca 0.32 -2.29 -0.03 0.00 -0.55 0.00 0.00 66.41 63.86 1kgj h THR 275 Cb 0.92 2.30 0.01 0.00 -1.73 0.00 0.00 68.15 69.64 1kgj h THR 275 CO 1.32 0.61 -0.31 0.50 -0.25 0.00 0.00 175.52 177.40 1kgj h LYS 276 N 0.00 -0.82 0.00 4.72 3.64 -1.78 -2.55 116.57 119.78 1kgj h LYS 276 Ca -0.01 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1kgj h LYS 276 Cb 1.25 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1kgj h LYS 276 CO 0.08 -0.50 0.00 -1.13 -2.27 0.00 0.00 179.45 175.63 1kgj n SER 277 N -5.39 0.00 0.00 4.20 3.41 -1.26 -1.93 113.62 112.66 1kgj n SER 277 Ca -0.12 0.50 -0.09 0.00 -0.26 0.00 0.00 58.87 58.90 1kgj n SER 277 Cb 0.36 -0.50 -0.07 0.00 -0.26 0.00 0.00 64.21 63.75 1kgj n SER 277 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1kgj h TYR 278 N 0.00 -0.12 -0.73 7.33 3.20 -1.56 -3.22 116.97 121.87 1kgj h TYR 278 Ca 0.00 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1kgj h TYR 278 Cb 0.12 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 1kgj h TYR 278 CO 0.00 0.33 0.45 -1.49 -1.64 0.00 0.00 178.16 175.81 1kgj h TRP 279 N -0.95 0.94 0.00 -3.82 -0.00 -1.02 -2.69 115.95 108.42 1kgj h TRP 279 Ca -0.01 0.01 -0.06 0.00 -0.00 0.00 0.00 58.89 58.82 1kgj h TRP 279 Cb 0.50 -0.31 -0.01 0.00 -0.00 0.00 0.00 29.16 29.33 1kgj h TRP 279 CO 0.11 0.62 -0.29 0.87 -0.00 0.00 0.00 178.44 179.75 1kgj h LYS 280 N 1.00 0.00 0.00 0.49 1.57 -1.21 -1.55 116.57 116.86 1kgj h LYS 280 Ca 0.26 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1kgj h LYS 280 Cb -0.06 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1kgj h LYS 280 CO -0.05 0.29 -0.00 0.00 -0.57 0.00 0.00 179.45 179.11 1kgj h ALA 281 N 1.71 1.01 -0.40 3.86 0.00 -1.48 -0.15 119.26 123.82 1kgj h ALA 281 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1kgj h ALA 281 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1kgj h ALA 281 CO 0.04 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.57 1kgj n LEU 282 N -3.10 3.11 -0.27 0.00 4.77 -0.66 -4.93 117.00 115.93 1kgj n LEU 282 Ca -0.01 -1.38 -0.04 0.00 -0.03 0.00 0.00 56.01 54.55 1kgj n LEU 282 Cb 0.20 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1kgj n LEU 282 CO 0.24 0.69 -0.03 0.61 -1.33 0.00 0.00 177.39 177.57 1kgj n GLY 283 N 1.44 0.66 3.54 -0.72 0.00 -0.07 -5.03 105.19 105.01 1kgj n GLY 283 Ca 0.19 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 1kgj n GLY 283 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kgj s ILE 284 N -2.13 3.89 -0.63 -0.61 1.01 -0.77 -4.99 121.20 116.98 1kgj s ILE 284 Ca 0.00 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.10 1kgj s ILE 284 Cb 0.00 -2.67 0.13 0.00 0.01 0.00 0.00 42.46 39.93 1kgj s ILE 284 CO 0.00 0.54 0.68 -0.55 0.00 0.00 0.00 174.94 175.61 1kgj s SER 285 N -0.12 6.28 0.73 3.58 0.15 -1.26 -2.80 113.70 120.26 1kgj s SER 285 Ca 0.02 -1.71 -0.11 0.00 0.70 0.00 0.00 55.95 54.85 1kgj s SER 285 Cb -0.13 -2.27 0.03 0.00 -1.71 0.00 0.00 66.02 61.93 1kgj s SER 285 CO 0.03 -0.98 1.08 -2.16 1.20 0.00 0.00 173.24 172.40 1kgj s PRO 286 N 2.11 2.68 -0.11 5.44 0.04 -1.26 -5.02 135.00 138.88 1kgj s PRO 286 Ca 0.11 0.64 -0.27 0.00 0.04 0.00 0.00 61.00 61.53 1kgj s PRO 286 Cb -0.23 -1.99 -0.23 0.00 0.04 0.00 0.00 34.50 32.09 1kgj s PRO 286 CO 0.03 -1.20 0.83 0.35 0.04 0.00 0.00 177.00 177.04 1kgj h PHE 287 N -0.78 -0.01 -4.04 0.56 3.57 -1.59 -3.47 116.94 111.18 1kgj h PHE 287 Ca -0.45 -0.00 -0.46 0.00 3.53 0.00 0.00 57.97 60.59 1kgj h PHE 287 Cb 1.24 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1kgj h PHE 287 CO 0.53 0.83 0.36 -1.01 -2.23 0.00 0.00 178.31 176.79 1kgj s HIS 288 N -2.61 3.23 0.06 0.41 3.76 -1.26 -4.96 115.29 113.92 1kgj s HIS 288 Ca -0.17 1.62 -0.05 0.00 -0.15 0.00 0.00 55.06 56.30 1kgj s HIS 288 Cb -0.02 -2.96 -0.29 0.00 1.11 0.00 0.00 32.58 30.42 1kgj s HIS 288 CO 0.64 -0.39 1.08 0.93 -0.85 0.00 0.00 174.74 176.15 1kgj h GLU 289 N 1.95 0.29 -2.17 1.40 4.39 -1.98 -3.40 114.58 115.07 1kgj h GLU 289 Ca -0.49 -0.50 0.21 0.00 0.34 0.00 0.00 59.36 58.92 1kgj h GLU 289 Cb 1.20 0.19 -0.09 0.00 -0.10 0.00 0.00 28.75 29.95 1kgj h GLU 289 CO 0.61 1.22 0.56 1.52 -1.16 0.00 0.00 179.01 181.75 1kgj s TYR 290 N -2.64 -0.11 -0.05 4.33 1.13 -1.26 -3.71 117.35 115.04 1kgj s TYR 290 Ca -0.05 -0.16 0.02 0.00 -1.41 0.00 0.00 57.07 55.47 1kgj s TYR 290 Cb 0.07 0.62 -0.03 0.00 -1.10 0.00 0.00 41.96 41.52 1kgj s TYR 290 CO 0.88 -0.72 -0.10 0.00 -2.51 0.00 0.00 175.55 173.11 1kgj s ALA 291 N -3.09 2.87 -0.02 9.51 0.00 -1.01 -4.93 121.76 125.09 1kgj s ALA 291 Ca 0.13 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 1kgj s ALA 291 Cb -0.00 -1.11 0.03 0.00 0.00 0.00 0.00 23.12 22.04 1kgj s ALA 291 CO 0.01 0.57 0.03 -2.00 0.00 0.00 0.00 175.76 174.38 1kgj s GLU 292 N -0.89 -0.03 -0.14 0.00 2.12 -1.26 -1.40 118.70 117.09 1kgj s GLU 292 Ca 0.13 0.19 0.02 0.00 0.36 0.00 0.00 54.97 55.67 1kgj s GLU 292 Cb -0.11 -0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.03 1kgj s GLU 292 CO 0.02 -0.17 -0.19 0.14 -0.54 0.00 0.00 175.26 174.51 1kgj s VAL 293 N 1.11 1.89 -0.14 3.70 -7.23 -0.52 -5.01 120.40 114.20 1kgj s VAL 293 Ca -0.09 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.22 1kgj s VAL 293 Cb -0.13 -1.70 -0.01 0.00 0.56 0.00 0.00 36.38 35.10 1kgj s VAL 293 CO -0.03 0.52 -0.14 -0.69 -0.31 0.00 0.00 175.10 174.45 1kgj s VAL 294 N 1.01 2.95 0.09 1.32 1.01 -1.26 -0.91 120.40 124.61 1kgj s VAL 294 Ca -0.03 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 1kgj s VAL 294 Cb -0.15 -2.24 0.01 0.00 0.00 0.00 0.00 36.38 34.01 1kgj s VAL 294 CO -0.05 0.52 0.27 0.72 0.00 0.00 0.00 175.10 176.56 1kgj s PHE 295 N 0.46 0.00 -0.59 5.22 -0.71 -0.31 -4.99 117.98 117.07 1kgj s PHE 295 Ca -0.10 -0.35 -0.19 0.00 -1.04 0.00 0.00 56.93 55.24 1kgj s PHE 295 Cb -0.16 0.06 0.10 0.00 -1.21 0.00 0.00 43.02 41.81 1kgj s PHE 295 CO 0.05 -0.58 0.73 0.99 -1.34 0.00 0.00 175.22 175.06 1kgj s THR 296 N -3.63 4.77 0.30 -4.49 2.01 -1.26 0.46 115.64 113.79 1kgj s THR 296 Ca 0.03 -0.87 -0.14 0.00 0.31 0.00 0.00 61.69 61.01 1kgj s THR 296 Cb 0.03 -4.50 -0.09 0.00 0.01 0.00 0.00 72.50 67.96 1kgj s THR 296 CO -0.10 -1.14 0.70 0.00 -0.69 0.00 0.00 174.62 173.39 1kgj s ALA 297 N 2.84 3.37 -1.54 7.40 0.00 0.45 -4.47 121.76 129.81 1kgj s ALA 297 Ca 0.13 -0.01 -0.12 0.00 0.00 0.00 0.00 51.96 51.95 1kgj s ALA 297 Cb -0.23 -2.71 0.12 0.00 0.00 0.00 0.00 23.12 20.31 1kgj s ALA 297 CO 0.07 0.37 0.31 0.09 0.00 0.00 0.00 175.76 176.60 1kgj n ASN 298 N -0.25 -0.59 0.01 0.00 3.02 -1.26 -2.44 115.26 113.75 1kgj n ASN 298 Ca 0.03 -1.11 -0.07 0.00 -0.03 0.00 0.00 54.58 53.40 1kgj n ASN 298 Cb 0.53 -1.40 -0.12 0.00 -0.61 0.00 0.00 39.78 38.17 1kgj n ASN 298 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1kgj h ASP 299 N -1.05 0.00 -0.38 6.41 2.03 -1.91 -3.30 116.42 118.23 1kgj h ASP 299 Ca -0.55 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.75 1kgj h ASP 299 Cb 1.23 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.73 1kgj h ASP 299 CO 0.72 0.94 0.00 -1.20 -1.03 0.00 0.00 179.24 178.67 1kgj n SER 300 N -3.12 2.30 0.00 4.15 7.64 -1.26 -5.01 113.62 118.32 1kgj n SER 300 Ca -0.11 -2.07 0.00 0.00 1.01 0.00 0.00 58.87 57.70 1kgj n SER 300 Cb 0.99 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.88 1kgj n SER 300 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kgj n GLY 301 N 1.00 2.37 3.69 0.23 0.00 -1.24 -5.03 105.19 106.20 1kgj n GLY 301 Ca 0.13 -2.08 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 1kgj n GLY 301 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1kgj s HIS 302 N -2.20 2.40 0.00 1.61 2.46 -1.26 -4.50 115.29 113.80 1kgj s HIS 302 Ca 0.00 0.30 0.00 0.00 0.47 0.00 0.00 55.06 55.83 1kgj s HIS 302 Cb 0.00 -3.97 0.00 0.00 -0.13 0.00 0.00 32.58 28.48 1kgj s HIS 302 CO 0.00 -3.90 0.00 0.54 -2.47 0.00 0.00 174.74 168.91 1kgj n ARG 303 N 5.64 0.26 -4.33 2.88 5.12 -1.26 -4.63 116.66 120.35 1kgj n ARG 303 Ca 0.16 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.84 1kgj n ARG 303 Cb 0.40 0.00 -0.17 0.00 -1.16 0.00 0.00 32.46 31.54 1kgj n ARG 303 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 1kgj s HIS 304 N -1.86 1.23 -0.03 -1.55 3.76 -0.96 -4.71 115.29 111.17 1kgj s HIS 304 Ca 0.00 -0.46 0.07 0.00 -0.15 0.00 0.00 55.06 54.52 1kgj s HIS 304 Cb 0.00 -0.97 -0.02 0.00 1.11 0.00 0.00 32.58 32.70 1kgj s HIS 304 CO 0.00 -0.29 -0.25 0.71 -0.85 0.00 0.00 174.74 174.06 1kgj s TYR 305 N 0.95 2.39 -0.14 1.40 1.51 0.41 -0.92 117.35 122.95 1kgj s TYR 305 Ca -0.10 -0.52 0.02 0.00 -1.01 0.00 0.00 57.07 55.46 1kgj s TYR 305 Cb -0.15 -1.54 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1kgj s TYR 305 CO 0.00 -0.08 -0.18 0.99 -1.11 0.00 0.00 175.55 175.16 1kgj s THR 306 N -0.47 1.84 -0.23 -0.71 2.01 -0.88 -2.24 115.64 114.96 1kgj s THR 306 Ca 0.06 -0.83 -0.09 0.00 0.31 0.00 0.00 61.69 61.14 1kgj s THR 306 Cb -0.11 -1.66 -0.05 0.00 0.01 0.00 0.00 72.50 70.69 1kgj s THR 306 CO 0.01 0.51 0.13 -0.63 -0.69 0.00 0.00 174.62 173.94 1kgj s ILE 307 N 1.09 5.11 -0.12 1.82 -1.09 -0.44 -1.84 121.20 125.71 1kgj s ILE 307 Ca -0.02 0.09 0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1kgj s ILE 307 Cb -0.14 -3.36 0.01 0.00 -1.58 0.00 0.00 42.46 37.38 1kgj s ILE 307 CO -0.06 0.38 -0.21 0.00 -1.23 0.00 0.00 174.94 173.82 1kgj s ALA 308 N 0.93 2.07 -0.01 9.38 0.00 -0.33 -0.65 121.76 133.15 1kgj s ALA 308 Ca 0.06 -0.96 0.07 0.00 0.00 0.00 0.00 51.96 51.13 1kgj s ALA 308 Cb -0.13 -0.90 -0.02 0.00 0.00 0.00 0.00 23.12 22.06 1kgj s ALA 308 CO 0.03 0.03 -0.23 0.00 0.00 0.00 0.00 175.76 175.60 1kgj s ALA 309 N 0.75 2.34 -0.27 0.00 0.00 0.51 -0.67 121.76 124.42 1kgj s ALA 309 Ca -0.10 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.75 1kgj s ALA 309 Cb -0.16 -0.65 0.08 0.00 0.00 0.00 0.00 23.12 22.39 1kgj s ALA 309 CO 0.01 0.54 -0.00 -1.17 0.00 0.00 0.00 175.76 175.14 1kgj s LEU 310 N -0.84 2.87 0.18 0.00 2.96 -0.86 -0.22 118.68 122.76 1kgj s LEU 310 Ca 0.11 -1.44 -0.05 0.00 -0.22 0.00 0.00 54.13 52.53 1kgj s LEU 310 Cb -0.10 -1.18 -0.06 0.00 0.50 0.00 0.00 46.19 45.35 1kgj s LEU 310 CO 0.01 -0.30 0.43 -0.76 -1.32 0.00 0.00 176.35 174.40 1kgj s LEU 311 N 1.36 4.22 -0.08 -0.68 1.43 -0.30 -2.70 118.68 121.93 1kgj s LEU 311 Ca 0.01 0.63 -0.27 0.00 -1.03 0.00 0.00 54.13 53.47 1kgj s LEU 311 Cb -0.18 -3.38 0.06 0.00 0.03 0.00 0.00 46.19 42.72 1kgj s LEU 311 CO -0.10 -0.01 0.62 -0.44 0.23 0.00 0.00 176.35 176.64 1kgj s SER 312 N -2.59 -0.59 0.54 2.29 0.01 -0.58 -0.08 113.70 112.71 1kgj s SER 312 Ca 0.42 0.73 0.39 0.00 1.31 0.00 0.00 55.95 58.81 1kgj s SER 312 Cb -0.12 0.66 1.58 0.00 0.21 0.00 0.00 66.02 68.35 1kgj s SER 312 CO 0.25 -0.51 1.74 -0.65 0.41 0.00 0.00 173.24 174.48 1kgj h PRO 313 N 3.55 0.02 0.00 12.44 0.11 -1.99 -2.45 132.00 143.68 1kgj h PRO 313 Ca -0.28 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.81 1kgj h PRO 313 Cb 1.15 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 1kgj h PRO 313 CO 0.33 0.01 -0.39 0.66 -0.21 0.00 0.00 178.00 178.40 1kgj n TYR 314 N -4.15 0.00 -3.59 0.65 4.02 -1.26 -1.39 117.16 111.43 1kgj n TYR 314 Ca 0.31 -0.55 -0.06 0.00 -0.01 0.00 0.00 57.90 57.59 1kgj n TYR 314 Cb 1.44 -0.12 -0.02 0.00 -0.02 0.00 0.00 39.34 40.63 1kgj n TYR 314 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1kgj s SER 315 N -1.98 -0.25 -0.20 7.72 0.15 -0.92 -4.99 113.70 113.22 1kgj s SER 315 Ca 0.19 -0.11 -0.30 0.00 0.70 0.00 0.00 55.95 56.43 1kgj s SER 315 Cb 0.18 0.35 0.14 0.00 -1.71 0.00 0.00 66.02 64.99 1kgj s SER 315 CO -0.02 -0.60 1.10 -0.72 1.20 0.00 0.00 173.24 174.20 1kgj s TYR 316 N -2.99 -0.28 0.04 3.44 -0.85 -1.26 -1.52 117.35 113.93 1kgj s TYR 316 Ca 0.08 0.49 0.06 0.00 -0.52 0.00 0.00 57.07 57.18 1kgj s TYR 316 Cb -0.01 0.46 -0.02 0.00 0.38 0.00 0.00 41.96 42.77 1kgj s TYR 316 CO -0.05 -0.26 -0.17 -1.54 -1.52 0.00 0.00 175.55 172.01 1kgj s SER 317 N -1.05 1.99 0.18 -0.18 1.04 -1.10 -4.99 113.70 109.59 1kgj s SER 317 Ca 0.01 -0.49 0.09 0.00 0.48 0.00 0.00 55.95 56.04 1kgj s SER 317 Cb -0.01 -0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.93 1kgj s SER 317 CO -0.01 0.08 -0.19 0.28 0.98 0.00 0.00 173.24 174.38 1kgj s THR 318 N -0.85 1.94 -0.05 2.02 -1.32 -1.26 -2.03 115.64 114.09 1kgj s THR 318 Ca 0.04 -2.00 -0.15 0.00 -1.21 0.00 0.00 61.69 58.37 1kgj s THR 318 Cb -0.08 -1.94 0.03 0.00 -1.51 0.00 0.00 72.50 69.00 1kgj s THR 318 CO 0.02 -0.32 0.34 -0.89 -2.21 0.00 0.00 174.62 171.55 1kgj s THR 319 N -2.12 0.04 -0.13 5.08 2.01 0.15 -4.95 115.64 115.72 1kgj s THR 319 Ca 0.18 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 61.83 1kgj s THR 319 Cb -0.05 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 1kgj s THR 319 CO 0.08 -0.18 -0.05 0.00 -0.69 0.00 0.00 174.62 173.78 1kgj s ALA 320 N -0.92 2.98 -0.36 7.40 0.00 -1.26 -1.19 121.76 128.40 1kgj s ALA 320 Ca -0.10 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1kgj s ALA 320 Cb -0.04 -1.46 0.11 0.00 0.00 0.00 0.00 23.12 21.73 1kgj s ALA 320 CO 0.04 0.31 0.12 0.08 0.00 0.00 0.00 175.76 176.30 1kgj s VAL 321 N 0.08 1.61 -0.76 0.00 1.01 -0.77 -4.99 120.40 116.58 1kgj s VAL 321 Ca -0.01 -2.12 -0.21 0.00 0.00 0.00 0.00 61.98 59.64 1kgj s VAL 321 Cb -0.14 -2.18 0.09 0.00 0.00 0.00 0.00 36.38 34.16 1kgj s VAL 321 CO 0.03 -0.70 1.01 0.68 0.00 0.00 0.00 175.10 176.12 1kgj s VAL 322 N 0.96 4.49 0.15 2.92 -7.23 -1.26 -2.07 120.40 118.35 1kgj s VAL 322 Ca 0.12 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.16 1kgj s VAL 322 Cb -0.20 -4.71 -0.07 0.00 0.56 0.00 0.00 36.38 31.96 1kgj s VAL 322 CO -0.12 -1.46 1.01 -0.55 -0.31 0.00 0.00 175.10 173.66 1kgj s SER 323 N 3.70 7.43 -0.05 4.85 0.15 -0.09 -4.95 113.70 124.72 1kgj s SER 323 Ca 0.26 1.92 -0.16 0.00 0.70 0.00 0.00 55.95 58.67 1kgj s SER 323 Cb -0.13 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.53 1kgj s SER 323 CO 0.03 -0.10 0.42 0.21 1.20 0.00 0.00 173.24 175.00 1kgj s ASN 324 N -0.16 6.74 0.65 5.45 3.84 -1.26 -2.27 114.94 127.93 1kgj s ASN 324 Ca 0.47 0.88 -0.17 0.00 0.21 0.00 0.00 52.86 54.25 1kgj s ASN 324 Cb -0.26 -2.26 -0.00 0.00 -0.55 0.00 0.00 41.25 38.18 1kgj s ASN 324 CO 0.32 0.19 1.19 -2.16 -2.79 0.00 0.00 177.10 173.85 1kgj s PRO 325 N -0.35 2.63 0.14 0.43 0.04 -1.26 -4.98 135.00 131.66 1kgj s PRO 325 Ca 0.24 1.73 -0.30 0.00 0.04 0.00 0.00 61.00 62.71 1kgj s PRO 325 Cb -0.16 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 1kgj s PRO 325 CO 0.11 -1.45 0.96 -1.14 0.04 0.00 0.00 177.00 175.53 1kgj s GLN 326 N -3.67 4.73 0.00 4.56 -0.44 -1.26 -5.16 119.66 118.42 1kgj s GLN 326 Ca 0.75 1.47 0.00 0.00 -2.50 0.00 0.00 55.36 55.08 1kgj s GLN 326 Cb -0.28 -3.35 0.00 0.00 -1.64 0.00 0.00 33.01 27.74 1kgj s GLN 326 CO 0.39 0.28 0.00 0.09 0.50 0.00 0.00 175.29 176.55