#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dkd n GLY 192 N 0.00 4.14 3.71 -1.84 0.00 -1.26 -4.86 105.19 105.07 1dkd n GLY 192 Ca 0.00 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 45.00 1dkd n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1dkd s MET 193 N 2.35 4.17 0.06 1.61 1.75 -0.96 -4.95 119.30 123.33 1dkd s MET 193 Ca 0.00 -0.18 -0.03 0.00 -1.25 0.00 0.00 55.69 54.22 1dkd s MET 193 Cb 0.00 -3.45 -0.03 0.00 2.84 0.00 0.00 34.83 34.19 1dkd s MET 193 CO 0.00 0.23 0.04 1.14 -0.65 0.00 0.00 175.02 175.78 1dkd s GLN 194 N 0.55 0.68 0.20 4.11 -2.07 -1.26 -0.68 119.66 121.20 1dkd s GLN 194 Ca 0.09 -1.14 0.02 0.00 -1.82 0.00 0.00 55.36 52.51 1dkd s GLN 194 Cb -0.12 0.25 -0.05 0.00 -1.09 0.00 0.00 33.01 32.00 1dkd s GLN 194 CO 0.00 -0.16 0.03 -0.59 -1.32 0.00 0.00 175.29 173.26 1dkd s PHE 195 N -3.90 1.33 -1.46 9.60 -0.71 -0.94 -5.00 117.98 116.90 1dkd s PHE 195 Ca 0.06 -1.07 -0.08 0.00 -1.04 0.00 0.00 56.93 54.81 1dkd s PHE 195 Cb 0.07 -0.76 -0.00 0.00 -1.21 0.00 0.00 43.02 41.12 1dkd s PHE 195 CO -0.10 -0.25 2.73 -0.25 -1.34 0.00 0.00 175.22 176.01 1dkd n ASP 196 N -0.32 8.39 -3.76 1.98 9.92 -1.26 -2.20 116.55 129.29 1dkd n ASP 196 Ca -0.04 -2.82 -0.14 0.00 -0.53 0.00 0.00 54.79 51.26 1dkd n ASP 196 Cb 0.64 -1.47 -0.15 0.00 -0.64 0.00 0.00 41.12 39.51 1dkd n ASP 196 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1dkd s ARG 197 N 0.67 0.06 0.00 -1.24 1.81 -0.53 -4.86 118.95 114.86 1dkd s ARG 197 Ca 0.63 0.30 0.00 0.00 -1.72 0.00 0.00 55.73 54.94 1dkd s ARG 197 Cb 0.19 -0.17 0.00 0.00 -0.45 0.00 0.00 34.95 34.51 1dkd s ARG 197 CO -0.08 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 174.80 1dkd n GLY 198 N 4.08 2.38 3.76 -3.53 0.00 -1.11 -2.16 105.19 108.61 1dkd n GLY 198 Ca -0.25 -2.13 -0.38 0.00 0.00 0.00 0.00 46.02 43.26 1dkd n GLY 198 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1dkd s TYR 199 N 0.82 2.73 -1.20 1.61 -0.85 -0.99 -4.41 117.35 115.06 1dkd s TYR 199 Ca 0.00 1.46 0.30 0.00 -0.52 0.00 0.00 57.07 58.31 1dkd s TYR 199 Cb 0.00 -3.56 1.36 0.00 0.38 0.00 0.00 41.96 40.14 1dkd s TYR 199 CO 0.00 -1.98 1.98 1.28 -1.52 0.00 0.00 175.55 175.31 1dkd n LEU 200 N -0.41 0.01 -3.68 -3.49 4.77 -0.02 -4.78 117.00 109.40 1dkd n LEU 200 Ca 0.07 0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 56.32 1dkd n LEU 200 Cb 0.46 -0.40 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 1dkd n LEU 200 CO 0.51 0.00 0.23 -0.55 -1.33 0.00 0.00 177.39 176.25 1dkd s SER 201 N -2.80 -0.64 0.43 -1.43 0.15 -1.26 -5.02 113.70 103.12 1dkd s SER 201 Ca 0.21 1.16 0.30 0.00 0.70 0.00 0.00 55.95 58.31 1dkd s SER 201 Cb 0.20 1.12 1.29 0.00 -1.71 0.00 0.00 66.02 66.92 1dkd s SER 201 CO 0.50 -0.20 1.89 1.55 1.20 0.00 0.00 173.24 178.18 1dkd h PRO 202 N 5.95 0.00 0.00 5.44 0.13 -2.01 -2.56 132.00 138.95 1dkd h PRO 202 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1dkd h PRO 202 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1dkd h PRO 202 CO 0.18 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.61 1dkd n TYR 203 N -2.71 0.00 0.20 1.56 4.01 -1.26 -2.10 117.16 116.86 1dkd n TYR 203 Ca 0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.87 1dkd n TYR 203 Cb 0.24 -0.30 0.14 0.00 -0.31 0.00 0.00 39.34 39.11 1dkd n TYR 203 CO 0.00 0.00 0.00 0.74 -0.46 0.00 0.00 176.86 177.14 1dkd h PHE 204 N 0.00 0.00 -2.08 -0.72 0.04 -1.79 -3.47 116.94 108.93 1dkd h PHE 204 Ca 0.00 0.00 -0.62 0.00 2.80 0.00 0.00 57.97 60.15 1dkd h PHE 204 Cb 0.18 0.00 0.05 0.00 2.20 0.00 0.00 35.95 38.38 1dkd h PHE 204 CO 0.00 0.00 0.78 -0.89 -0.60 0.00 0.00 178.31 177.60 1dkd n ILE 205 N -3.01 0.11 0.00 -0.55 5.41 -0.89 -4.82 119.36 115.61 1dkd n ILE 205 Ca 0.03 -0.02 0.01 0.00 1.00 0.00 0.00 62.75 63.77 1dkd n ILE 205 Cb 0.53 -1.43 0.01 0.00 -0.71 0.00 0.00 39.64 38.05 1dkd n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1dkd n ASN 206 N 3.86 1.79 -3.57 4.38 0.23 -0.84 -4.75 115.26 116.35 1dkd n ASN 206 Ca 0.19 -1.70 -0.27 0.00 -0.53 0.00 0.00 54.58 52.27 1dkd n ASN 206 Cb 0.26 -0.02 -0.10 0.00 -2.08 0.00 0.00 39.78 37.85 1dkd n ASN 206 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1dkd n LYS 207 N -0.23 1.70 -0.30 -3.83 4.76 -0.41 -4.95 118.16 114.89 1dkd n LYS 207 Ca 0.01 -4.20 -0.01 0.00 -2.87 0.00 0.00 58.31 51.24 1dkd n LYS 207 Cb 0.19 -2.05 0.05 0.00 -1.84 0.00 0.00 35.03 31.38 1dkd n LYS 207 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 1dkd h PRO 208 N 4.82 -0.05 -0.38 1.97 0.11 -1.85 0.66 132.00 137.27 1dkd h PRO 208 Ca 0.17 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.36 1dkd h PRO 208 Cb 0.76 0.01 -0.09 0.00 0.11 0.00 0.00 31.00 31.79 1dkd h PRO 208 CO 0.68 -0.03 -0.33 0.93 -0.21 0.00 0.00 178.00 179.03 1dkd h GLU 209 N -0.05 -0.26 -0.02 1.05 3.07 -1.97 -2.05 114.58 114.35 1dkd h GLU 209 Ca 0.33 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1dkd h GLU 209 Cb 0.59 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1dkd h GLU 209 CO -0.86 -0.17 -0.15 0.25 -1.40 0.00 0.00 179.01 176.68 1dkd n THR 210 N -5.42 0.00 -3.64 1.13 -2.24 -0.83 -4.96 114.28 98.32 1dkd n THR 210 Ca 0.01 -0.28 -0.24 0.00 -2.27 0.00 0.00 64.05 61.27 1dkd n THR 210 Cb 0.34 0.83 0.07 0.00 -2.10 0.00 0.00 70.33 69.46 1dkd n THR 210 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dkd n GLY 211 N 1.30 -0.49 3.44 3.38 0.00 0.22 -4.99 105.19 108.05 1dkd n GLY 211 Ca 0.14 0.21 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 1dkd n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dkd s ALA 212 N -3.35 2.39 -0.17 4.61 0.00 -1.00 -4.64 121.76 119.61 1dkd s ALA 212 Ca 0.46 -1.94 -0.02 0.00 0.00 0.00 0.00 51.96 50.46 1dkd s ALA 212 Cb -0.21 0.23 -0.02 0.00 0.00 0.00 0.00 23.12 23.12 1dkd s ALA 212 CO 0.75 -0.09 -0.07 0.08 0.00 0.00 0.00 175.76 176.43 1dkd s VAL 213 N -3.02 3.41 -0.09 0.00 1.01 0.12 -1.28 120.40 120.55 1dkd s VAL 213 Ca 0.30 -0.52 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 1dkd s VAL 213 Cb 0.04 -2.49 0.03 0.00 0.00 0.00 0.00 36.38 33.97 1dkd s VAL 213 CO 0.13 0.48 0.02 -1.61 0.00 0.00 0.00 175.10 174.12 1dkd s GLU 214 N 0.72 0.47 -0.05 2.72 2.02 -1.26 -0.37 118.70 122.95 1dkd s GLU 214 Ca -0.04 0.08 0.05 0.00 0.02 0.00 0.00 54.97 55.09 1dkd s GLU 214 Cb -0.15 -1.07 -0.02 0.00 0.10 0.00 0.00 34.13 32.99 1dkd s GLU 214 CO 0.02 -0.37 -0.19 -0.51 0.02 0.00 0.00 175.26 174.24 1dkd s LEU 215 N 2.00 2.46 -0.14 1.80 1.43 -0.46 -4.95 118.68 120.82 1dkd s LEU 215 Ca 0.04 -0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 52.77 1dkd s LEU 215 Cb -0.13 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 1dkd s LEU 215 CO -0.05 0.31 0.01 -1.61 0.23 0.00 0.00 176.35 175.24 1dkd s GLU 216 N -0.53 3.57 -1.27 1.70 0.41 -1.26 -1.92 118.70 119.41 1dkd s GLU 216 Ca 0.07 -0.41 -0.19 0.00 -0.41 0.00 0.00 54.97 54.03 1dkd s GLU 216 Cb -0.11 -2.99 0.01 0.00 -1.78 0.00 0.00 34.13 29.26 1dkd s GLU 216 CO 0.01 0.41 0.58 0.45 -0.49 0.00 0.00 175.26 176.22 1dkd n SER 217 N 3.07 -3.14 -4.94 -0.19 2.88 -0.10 -4.57 113.62 106.62 1dkd n SER 217 Ca -0.18 -1.14 -0.24 0.00 -1.33 0.00 0.00 58.87 55.98 1dkd n SER 217 Cb 0.53 -2.53 0.01 0.00 -0.75 0.00 0.00 64.21 61.47 1dkd n SER 217 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1dkd s PRO 218 N -6.76 3.14 0.38 -1.46 0.04 -1.19 -4.44 135.00 124.71 1dkd s PRO 218 Ca 0.33 -0.35 -0.04 0.00 0.04 0.00 0.00 61.00 60.98 1dkd s PRO 218 Cb -0.15 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.83 1dkd s PRO 218 CO 0.92 -0.27 0.65 -0.06 0.04 0.00 0.00 177.00 178.28 1dkd s PHE 219 N -2.60 3.51 -0.12 0.56 0.08 0.42 -3.28 117.98 116.55 1dkd s PHE 219 Ca 0.48 0.63 -0.02 0.00 0.12 0.00 0.00 56.93 58.14 1dkd s PHE 219 Cb -0.10 -2.13 0.04 0.00 -0.57 0.00 0.00 43.02 40.26 1dkd s PHE 219 CO 0.39 -0.02 0.01 0.42 -0.10 0.00 0.00 175.22 175.93 1dkd s ILE 220 N -2.41 0.44 -0.24 0.64 1.01 0.74 -1.21 121.20 120.17 1dkd s ILE 220 Ca 0.44 -0.15 -0.14 0.00 0.00 0.00 0.00 60.65 60.80 1dkd s ILE 220 Cb -0.10 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1dkd s ILE 220 CO 0.37 0.08 0.31 -0.22 0.00 0.00 0.00 174.94 175.48 1dkd s LEU 221 N 1.92 4.09 -0.24 2.97 2.96 -0.26 0.29 118.68 130.41 1dkd s LEU 221 Ca 0.03 0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 1dkd s LEU 221 Cb -0.14 -2.35 0.01 0.00 0.50 0.00 0.00 46.19 44.21 1dkd s LEU 221 CO -0.06 -0.08 -0.03 -0.76 -1.32 0.00 0.00 176.35 174.10 1dkd s LEU 222 N 1.56 3.15 -0.07 -0.68 1.43 -1.26 -0.88 118.68 121.93 1dkd s LEU 222 Ca 0.14 -0.63 0.01 0.00 -1.03 0.00 0.00 54.13 52.61 1dkd s LEU 222 Cb -0.15 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.36 1dkd s LEU 222 CO 0.08 -0.09 -0.06 0.00 0.23 0.00 0.00 176.35 176.51 1dkd s ALA 223 N 1.42 0.94 -1.23 4.21 0.00 -0.55 -1.04 121.76 125.51 1dkd s ALA 223 Ca 0.03 -0.25 -0.07 0.00 0.00 0.00 0.00 51.96 51.67 1dkd s ALA 223 Cb -0.16 -0.61 0.20 0.00 0.00 0.00 0.00 23.12 22.56 1dkd s ALA 223 CO -0.03 -0.14 1.85 -3.47 0.00 0.00 0.00 175.76 173.97 1dkd n ASP 224 N 4.36 5.87 -3.64 0.00 -0.08 -0.89 -2.89 116.55 119.28 1dkd n ASP 224 Ca -0.19 -3.21 -0.01 0.00 -1.51 0.00 0.00 54.79 49.86 1dkd n ASP 224 Cb 0.51 -1.40 -0.01 0.00 2.34 0.00 0.00 41.12 42.56 1dkd n ASP 224 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 1dkd s LYS 225 N -0.77 0.62 -0.05 -0.67 -2.85 -1.26 -4.58 119.74 110.18 1dkd s LYS 225 Ca 0.39 -0.32 -0.22 0.00 -1.00 0.00 0.00 55.97 54.82 1dkd s LYS 225 Cb 0.10 0.22 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 1dkd s LYS 225 CO 0.01 -0.28 0.66 0.15 0.10 0.00 0.00 175.35 175.99 1dkd s LYS 226 N -2.70 4.41 -0.34 1.78 1.02 -1.26 -2.00 119.74 120.65 1dkd s LYS 226 Ca 0.12 0.82 -0.09 0.00 0.02 0.00 0.00 55.97 56.84 1dkd s LYS 226 Cb 0.02 -3.42 0.02 0.00 -0.52 0.00 0.00 37.83 33.93 1dkd s LYS 226 CO -0.03 0.15 0.14 0.42 -0.92 0.00 0.00 175.35 175.12 1dkd s ILE 227 N 0.51 4.24 0.00 2.17 1.01 0.75 -4.89 121.20 124.98 1dkd s ILE 227 Ca 0.35 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.18 1dkd s ILE 227 Cb -0.18 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 38.99 1dkd s ILE 227 CO 0.17 -0.10 0.00 -1.54 0.00 0.00 0.00 174.94 173.48 1dkd n SER 228 N 4.92 3.09 -4.36 3.58 3.41 -1.26 -1.12 113.62 121.87 1dkd n SER 228 Ca -0.13 -0.09 -0.37 0.00 -0.26 0.00 0.00 58.87 58.01 1dkd n SER 228 Cb 0.47 0.80 -0.12 0.00 -0.26 0.00 0.00 64.21 65.10 1dkd n SER 228 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1dkd s ASN 229 N -1.42 5.21 0.23 4.04 3.84 -1.26 -2.44 114.94 123.14 1dkd s ASN 229 Ca 0.00 -0.67 -0.04 0.00 0.21 0.00 0.00 52.86 52.36 1dkd s ASN 229 Cb 0.00 -1.90 0.24 0.00 -0.55 0.00 0.00 41.25 39.03 1dkd s ASN 229 CO 0.00 -0.19 1.68 -0.29 -2.79 0.00 0.00 177.10 175.51 1dkd h ILE 230 N 5.82 1.26 -0.48 -5.21 -0.00 -1.91 -2.93 117.51 114.06 1dkd h ILE 230 Ca -0.32 -1.19 0.14 0.00 -0.00 0.00 0.00 64.86 63.49 1dkd h ILE 230 Cb 1.13 1.05 -0.02 0.00 -0.00 0.00 0.00 36.82 38.98 1dkd h ILE 230 CO 0.61 0.41 0.57 0.03 -0.00 0.00 0.00 178.15 179.77 1dkd h ARG 231 N 0.72 0.00 0.00 2.19 3.08 -1.99 0.77 114.38 119.15 1dkd h ARG 231 Ca 0.12 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1dkd h ARG 231 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1dkd h ARG 231 CO 0.04 0.00 -0.35 1.49 -1.07 0.00 0.00 179.97 180.08 1dkd h GLU 232 N 0.00 0.00 0.00 0.04 4.81 -1.94 -3.26 114.58 114.23 1dkd h GLU 232 Ca 0.23 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.36 1dkd h GLU 232 Cb 1.37 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.73 1dkd h GLU 232 CO -0.00 0.35 -1.11 0.52 -0.73 0.00 0.00 179.01 178.04 1dkd h MET 233 N 0.00 0.00 -0.62 1.92 2.86 0.42 -3.31 114.93 116.20 1dkd h MET 233 Ca -0.00 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.75 1dkd h MET 233 Cb 1.14 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.68 1dkd h MET 233 CO 0.05 0.21 -0.26 -0.07 1.06 0.00 0.00 176.91 177.90 1dkd h LEU 234 N 0.00 -0.91 0.04 1.22 3.38 -1.48 0.17 115.31 117.73 1dkd h LEU 234 Ca -0.09 0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1dkd h LEU 234 Cb 1.35 0.50 -0.04 0.00 0.09 0.00 0.00 40.66 42.57 1dkd h LEU 234 CO 0.03 -0.27 -0.37 -0.65 0.09 0.00 0.00 178.44 177.27 1dkd h PRO 235 N -0.10 -0.48 0.00 1.13 0.11 -1.81 0.55 132.00 131.41 1dkd h PRO 235 Ca 0.27 0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.39 1dkd h PRO 235 Cb 0.53 0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.74 1dkd h PRO 235 CO -0.68 -0.32 -0.13 -0.24 -0.21 0.00 0.00 178.00 176.42 1dkd h VAL 236 N -0.50 0.72 -0.45 3.15 3.04 -1.71 -2.13 116.25 118.37 1dkd h VAL 236 Ca 0.00 -0.53 -0.12 0.00 -1.01 0.00 0.00 66.70 65.05 1dkd h VAL 236 Cb 0.51 1.32 -0.02 0.00 -2.01 0.00 0.00 31.29 31.10 1dkd h VAL 236 CO -0.22 0.13 -0.18 -0.07 -1.01 0.00 0.00 177.57 176.22 1dkd h LEU 237 N 0.00 0.89 -0.41 3.16 3.38 -0.14 -2.08 115.31 120.10 1dkd h LEU 237 Ca -0.00 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1dkd h LEU 237 Cb 0.31 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1dkd h LEU 237 CO 0.02 1.05 0.03 -0.08 0.09 0.00 0.00 178.44 179.55 1dkd h GLU 238 N 0.78 0.71 -0.51 1.13 4.81 -0.25 -1.23 114.58 120.02 1dkd h GLU 238 Ca 0.11 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1dkd h GLU 238 Cb 0.71 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.99 1dkd h GLU 238 CO 0.05 0.77 0.33 0.00 -0.73 0.00 0.00 179.01 179.43 1dkd h ALA 239 N 0.91 0.64 -0.59 2.92 0.00 -1.37 -1.81 119.26 119.96 1dkd h ALA 239 Ca 0.12 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1dkd h ALA 239 Cb 0.44 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1dkd h ALA 239 CO 0.02 0.06 0.22 0.28 0.00 0.00 0.00 179.25 179.82 1dkd h VAL 240 N 0.66 1.23 -0.57 0.00 2.07 -1.24 -2.01 116.25 116.39 1dkd h VAL 240 Ca 0.19 -0.76 0.03 0.00 0.82 0.00 0.00 66.70 66.98 1dkd h VAL 240 Cb -0.05 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1dkd h VAL 240 CO -0.06 0.29 0.34 0.00 0.02 0.00 0.00 177.57 178.17 1dkd h ALA 241 N 1.07 0.74 -0.59 1.67 0.00 -0.85 -2.15 119.26 119.16 1dkd h ALA 241 Ca 0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1dkd h ALA 241 Cb 0.24 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1dkd h ALA 241 CO -0.01 0.07 0.30 1.57 0.00 0.00 0.00 179.25 181.17 1dkd h LYS 242 N 0.68 0.83 0.00 0.00 2.10 -1.12 -1.83 116.57 117.23 1dkd h LYS 242 Ca 0.23 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.77 1dkd h LYS 242 Cb 0.03 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.21 1dkd h LYS 242 CO -0.11 0.66 0.00 0.00 -2.00 0.00 0.00 179.45 178.00 1dkd n ALA 243 N -2.32 1.28 -2.58 0.07 0.00 -0.77 -4.87 120.51 111.32 1dkd n ALA 243 Ca 0.04 0.11 -0.17 0.00 0.00 0.00 0.00 53.44 53.41 1dkd n ALA 243 Cb 0.11 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.29 1dkd n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dkd n GLY 244 N -0.82 -0.29 3.37 0.00 0.00 -0.69 -5.02 105.19 101.73 1dkd n GLY 244 Ca 0.00 -0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1dkd n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dkd s LYS 245 N -5.13 1.36 0.69 1.61 1.02 -1.24 -5.09 119.74 112.97 1dkd s LYS 245 Ca 0.12 -1.43 -0.13 0.00 0.02 0.00 0.00 55.97 54.54 1dkd s LYS 245 Cb -0.05 -1.55 0.02 0.00 -0.52 0.00 0.00 37.83 35.72 1dkd s LYS 245 CO 0.14 0.33 1.09 -2.14 -0.92 0.00 0.00 175.35 173.85 1dkd s PRO 246 N -2.66 2.70 -0.08 -1.68 0.02 -1.26 -4.71 135.00 127.33 1dkd s PRO 246 Ca 0.17 1.24 0.01 0.00 0.02 0.00 0.00 61.00 62.44 1dkd s PRO 246 Cb -0.07 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.52 1dkd s PRO 246 CO 0.08 -1.31 -0.09 -1.17 -0.33 0.00 0.00 177.00 174.18 1dkd s LEU 247 N -5.26 1.40 -0.22 -5.54 2.96 0.49 -0.44 118.68 112.08 1dkd s LEU 247 Ca 0.63 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 54.20 1dkd s LEU 247 Cb -0.18 -0.75 -0.04 0.00 0.50 0.00 0.00 46.19 45.71 1dkd s LEU 247 CO 0.47 -0.04 0.10 -0.22 -1.32 0.00 0.00 176.35 175.35 1dkd s LEU 248 N 1.09 3.84 -0.21 -0.68 2.96 -0.35 -1.46 118.68 123.87 1dkd s LEU 248 Ca -0.07 0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 53.81 1dkd s LEU 248 Cb -0.14 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1dkd s LEU 248 CO -0.01 0.09 0.03 -0.63 -1.32 0.00 0.00 176.35 174.50 1dkd s ILE 249 N 0.91 4.15 -0.31 6.68 1.01 0.08 -1.11 121.20 132.62 1dkd s ILE 249 Ca 0.05 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.48 1dkd s ILE 249 Cb -0.13 -2.89 0.08 0.00 0.01 0.00 0.00 42.46 39.52 1dkd s ILE 249 CO 0.03 0.41 -0.00 -0.63 0.00 0.00 0.00 174.94 174.74 1dkd s ILE 250 N 1.10 2.40 0.16 2.92 1.01 -0.06 -1.05 121.20 127.67 1dkd s ILE 250 Ca 0.03 -1.95 0.02 0.00 0.00 0.00 0.00 60.65 58.75 1dkd s ILE 250 Cb -0.14 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 1dkd s ILE 250 CO 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 174.94 174.60 1dkd s ALA 251 N 1.04 1.31 0.37 9.38 0.00 -1.09 -1.49 121.76 131.28 1dkd s ALA 251 Ca 0.01 -1.54 0.15 0.00 0.00 0.00 0.00 51.96 50.59 1dkd s ALA 251 Cb -0.20 0.40 1.01 0.00 0.00 0.00 0.00 23.12 24.33 1dkd s ALA 251 CO -0.06 -0.27 1.76 1.49 0.00 0.00 0.00 175.76 178.69 1dkd h GLU 252 N 2.75 0.47 -1.62 0.00 4.81 -1.27 0.53 114.58 120.25 1dkd h GLU 252 Ca -0.36 -0.03 0.21 0.00 -0.13 0.00 0.00 59.36 59.05 1dkd h GLU 252 Cb 1.20 -0.11 -0.19 0.00 0.63 0.00 0.00 28.75 30.28 1dkd h GLU 252 CO 0.63 0.31 0.74 0.34 -0.73 0.00 0.00 179.01 180.30 1dkd s ASP 253 N -5.28 -0.19 -0.11 1.04 -1.08 -1.22 -4.42 116.67 105.42 1dkd s ASP 253 Ca -0.09 0.03 -0.02 0.00 -0.52 0.00 0.00 52.55 51.94 1dkd s ASP 253 Cb 0.26 0.20 0.04 0.00 -1.46 0.00 0.00 42.92 41.95 1dkd s ASP 253 CO 0.80 -0.31 0.04 -0.69 0.52 0.00 0.00 175.17 175.53 1dkd s VAL 254 N -2.38 0.20 0.11 1.11 1.01 -1.26 -0.18 120.40 119.01 1dkd s VAL 254 Ca 0.08 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1dkd s VAL 254 Cb -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.83 1dkd s VAL 254 CO -0.05 0.05 0.15 -1.84 0.00 0.00 0.00 175.10 173.40 1dkd n GLU 255 N 5.19 0.21 0.00 2.72 0.28 -0.27 -4.69 120.64 124.08 1dkd n GLU 255 Ca -0.06 -0.94 0.00 0.00 -0.16 0.00 0.00 57.16 56.00 1dkd n GLU 255 Cb 0.49 0.88 0.00 0.00 1.43 0.00 0.00 31.44 34.24 1dkd n GLU 255 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1dkd n GLY 256 N -0.19 1.95 0.32 -1.84 0.00 -1.26 -2.57 105.19 101.60 1dkd n GLY 256 Ca 0.01 -0.46 0.06 0.00 0.00 0.00 0.00 46.02 45.62 1dkd n GLY 256 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dkd h GLU 257 N 0.00 0.56 0.03 1.61 4.11 -1.95 -2.64 114.58 116.29 1dkd h GLU 257 Ca 0.00 -0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.42 1dkd h GLU 257 Cb 0.00 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 1dkd h GLU 257 CO 0.00 0.37 -0.23 0.00 0.07 0.00 0.00 179.01 179.22 1dkd h ALA 258 N 1.71 -0.32 -0.22 1.06 0.00 -1.20 0.42 119.26 120.70 1dkd h ALA 258 Ca 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1dkd h ALA 258 Cb 0.08 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1dkd h ALA 258 CO -0.05 -0.74 0.09 1.25 0.00 0.00 0.00 179.25 179.80 1dkd h LEU 259 N -0.38 0.30 -0.42 0.00 5.85 -1.34 -1.37 115.31 117.95 1dkd h LEU 259 Ca 0.05 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1dkd h LEU 259 Cb 0.44 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1dkd h LEU 259 CO -0.19 0.38 0.25 0.00 -0.34 0.00 0.00 178.44 178.54 1dkd h ALA 260 N 0.94 0.54 -0.69 1.25 0.00 -1.27 -1.52 119.26 118.49 1dkd h ALA 260 Ca 0.07 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1dkd h ALA 260 Cb 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1dkd h ALA 260 CO -0.01 0.03 0.18 1.15 0.00 0.00 0.00 179.25 180.61 1dkd h THR 261 N 0.55 1.26 -0.53 0.00 2.02 -0.07 -0.18 112.91 115.96 1dkd h THR 261 Ca 0.15 -0.93 -0.02 0.00 0.77 0.00 0.00 66.41 66.38 1dkd h THR 261 Cb 0.01 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1dkd h THR 261 CO -0.03 0.36 0.25 -0.07 0.37 0.00 0.00 175.52 176.40 1dkd h LEU 262 N 1.04 0.70 0.22 2.58 3.38 -1.03 -1.63 115.31 120.57 1dkd h LEU 262 Ca 0.22 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1dkd h LEU 262 Cb 0.34 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1dkd h LEU 262 CO -0.00 0.64 -0.12 0.58 0.09 0.00 0.00 178.44 179.62 1dkd h VAL 263 N 0.72 0.74 -0.27 1.22 2.07 -0.84 -0.82 116.25 119.06 1dkd h VAL 263 Ca 0.18 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.77 1dkd h VAL 263 Cb 0.13 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 30.56 1dkd h VAL 263 CO -0.02 0.00 -0.29 0.58 0.02 0.00 0.00 177.57 177.85 1dkd h VAL 264 N -0.33 0.30 0.00 2.57 2.07 -0.79 0.98 116.25 121.05 1dkd h VAL 264 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1dkd h VAL 264 Cb 0.27 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1dkd h VAL 264 CO 0.03 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.40 1dkd h ASN 265 N -0.29 0.00 -0.02 0.57 4.21 -1.21 -1.19 115.58 117.66 1dkd h ASN 265 Ca 0.14 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 57.54 1dkd h ASN 265 Cb 0.51 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.72 1dkd h ASN 265 CO -0.43 0.00 -0.41 0.74 -1.29 0.00 0.00 177.43 176.04 1dkd h THR 266 N 0.00 1.47 -0.39 2.81 2.02 0.05 -0.56 112.91 118.31 1dkd h THR 266 Ca 0.00 -1.96 -0.02 0.00 0.77 0.00 0.00 66.41 65.21 1dkd h THR 266 Cb 0.53 2.61 -0.02 0.00 -1.74 0.00 0.00 68.15 69.52 1dkd h THR 266 CO 0.00 0.56 0.17 0.24 0.37 0.00 0.00 175.52 176.86 1dkd h MET 267 N -0.27 0.54 0.00 6.66 2.86 -0.39 -1.65 114.93 122.69 1dkd h MET 267 Ca -0.05 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1dkd h MET 267 Cb 1.13 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1dkd h MET 267 CO 0.08 0.44 -0.01 0.54 1.06 0.00 0.00 176.91 179.02 1dkd n ARG 268 N -4.40 0.13 -0.79 1.72 1.74 -0.49 -4.94 116.66 109.63 1dkd n ARG 268 Ca 0.03 0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1dkd n ARG 268 Cb 0.13 -1.65 0.00 0.00 -1.02 0.00 0.00 32.46 29.92 1dkd n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dkd n GLY 269 N 1.41 0.52 0.12 -0.13 0.00 -0.62 -4.97 105.19 101.52 1dkd n GLY 269 Ca 0.06 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 45.16 1dkd n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1dkd h ILE 270 N 0.00 1.49 -2.87 -0.61 1.08 -1.35 -3.46 117.51 111.80 1dkd h ILE 270 Ca 0.00 -2.45 -0.20 0.00 -0.39 0.00 0.00 64.86 61.82 1dkd h ILE 270 Cb 0.00 3.09 -0.31 0.00 -3.07 0.00 0.00 36.82 36.52 1dkd h ILE 270 CO 0.00 0.70 -0.50 -0.69 -0.69 0.00 0.00 178.15 176.97 1dkd s VAL 271 N -2.59 -0.31 -0.49 1.67 1.01 -1.17 -4.87 120.40 113.65 1dkd s VAL 271 Ca -0.13 0.23 -0.26 0.00 0.00 0.00 0.00 61.98 61.82 1dkd s VAL 271 Cb 0.01 -0.45 0.03 0.00 0.00 0.00 0.00 36.38 35.98 1dkd s VAL 271 CO 0.83 0.10 0.98 -0.75 0.00 0.00 0.00 175.10 176.26 1dkd s LYS 272 N 2.08 3.53 0.13 2.72 2.20 -1.26 -3.80 119.74 125.33 1dkd s LYS 272 Ca -0.02 0.16 0.04 0.00 -0.36 0.00 0.00 55.97 55.79 1dkd s LYS 272 Cb -0.11 -3.95 -0.04 0.00 -1.51 0.00 0.00 37.83 32.21 1dkd s LYS 272 CO -0.09 -1.33 -0.10 0.14 -0.36 0.00 0.00 175.35 173.61 1dkd s VAL 273 N 4.00 1.03 -0.00 4.02 -7.23 -1.26 -0.38 120.40 120.58 1dkd s VAL 273 Ca 0.38 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.62 1dkd s VAL 273 Cb -0.10 -1.69 -0.00 0.00 0.56 0.00 0.00 36.38 35.15 1dkd s VAL 273 CO 0.26 -0.72 0.01 0.00 -0.31 0.00 0.00 175.10 174.34 1dkd s ALA 274 N -3.15 -0.01 -0.01 1.32 0.00 -0.54 -4.86 121.76 114.51 1dkd s ALA 274 Ca 0.13 -0.08 0.05 0.00 0.00 0.00 0.00 51.96 52.06 1dkd s ALA 274 Cb 0.02 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1dkd s ALA 274 CO -0.01 -0.04 -0.16 0.00 0.00 0.00 0.00 175.76 175.56 1dkd s ALA 275 N -0.28 1.30 0.03 0.00 0.00 -1.26 -0.74 121.76 120.80 1dkd s ALA 275 Ca -0.03 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 51.23 1dkd s ALA 275 Cb -0.02 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 1dkd s ALA 275 CO -0.00 0.32 0.03 0.14 0.00 0.00 0.00 175.76 176.25 1dkd s VAL 276 N -0.37 0.13 0.34 0.00 -7.23 -0.22 -0.84 120.40 112.21 1dkd s VAL 276 Ca 0.06 -1.05 -0.26 0.00 -1.81 0.00 0.00 61.98 58.92 1dkd s VAL 276 Cb -0.06 -0.63 -0.09 0.00 0.56 0.00 0.00 36.38 36.15 1dkd s VAL 276 CO -0.01 -0.58 1.04 -0.54 -0.31 0.00 0.00 175.10 174.70 1dkd s LYS 277 N -2.10 4.43 0.33 4.82 1.02 -1.26 -2.66 119.74 124.32 1dkd s LYS 277 Ca -0.10 1.57 -0.28 0.00 0.02 0.00 0.00 55.97 57.18 1dkd s LYS 277 Cb -0.05 -2.83 -0.10 0.00 -0.52 0.00 0.00 37.83 34.33 1dkd s LYS 277 CO -0.03 0.08 1.23 0.00 -0.92 0.00 0.00 175.35 175.71 1dkd s ALA 278 N -1.47 3.42 0.58 5.17 0.00 0.18 -4.80 121.76 124.83 1dkd s ALA 278 Ca 0.51 1.11 -0.17 0.00 0.00 0.00 0.00 51.96 53.42 1dkd s ALA 278 Cb -0.25 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 1dkd s ALA 278 CO 0.31 -0.49 1.06 -1.25 0.00 0.00 0.00 175.76 175.39 1dkd s PRO 279 N -1.78 3.36 0.29 0.00 0.04 -1.26 -4.90 135.00 130.75 1dkd s PRO 279 Ca 0.49 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1dkd s PRO 279 Cb -0.36 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.14 1dkd s PRO 279 CO 0.47 -0.78 0.00 0.41 0.04 0.00 0.00 177.00 177.14 1dkd n GLY 280 N -0.75 -2.23 3.09 0.56 0.00 -1.26 -4.27 105.19 100.33 1dkd n GLY 280 Ca 0.09 -1.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.13 1dkd n GLY 280 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1dkd s PHE 281 N -0.22 0.79 0.00 1.61 5.36 -1.26 -4.72 117.98 119.54 1dkd s PHE 281 Ca 0.00 -0.52 0.00 0.00 -0.96 0.00 0.00 56.93 55.45 1dkd s PHE 281 Cb 0.00 -0.46 0.00 0.00 -0.34 0.00 0.00 43.02 42.22 1dkd s PHE 281 CO 0.00 -0.06 0.00 0.41 -1.46 0.00 0.00 175.22 174.11 1dkd n GLY 282 N 1.33 2.38 0.36 13.12 0.00 -1.26 -1.60 105.19 119.52 1dkd n GLY 282 Ca -0.22 0.01 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1dkd n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1dkd h ASP 283 N 0.00 0.43 -0.72 1.61 3.45 -1.99 -1.11 116.42 118.09 1dkd h ASP 283 Ca 0.00 0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.40 1dkd h ASP 283 Cb 0.00 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 38.66 1dkd h ASP 283 CO 0.00 0.25 0.18 0.03 -1.57 0.00 0.00 179.24 178.13 1dkd h ARG 284 N 0.47 1.14 -0.70 3.56 2.47 -1.70 -0.64 114.38 118.98 1dkd h ARG 284 Ca 0.31 -0.27 -0.01 0.00 -1.26 0.00 0.00 59.98 58.75 1dkd h ARG 284 Cb 0.57 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.71 1dkd h ARG 284 CO -0.10 1.00 0.41 -0.09 0.56 0.00 0.00 179.97 181.75 1dkd h ARG 285 N 1.08 0.96 -0.67 0.04 2.43 -0.39 -0.25 114.38 117.58 1dkd h ARG 285 Ca 0.23 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1dkd h ARG 285 Cb 0.37 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1dkd h ARG 285 CO 0.00 0.70 0.17 -0.22 -1.51 0.00 0.00 179.97 179.11 1dkd h LYS 286 N 0.96 1.08 -0.33 0.20 3.11 -1.06 -0.98 116.57 119.56 1dkd h LYS 286 Ca 0.25 -0.26 -0.08 0.00 -2.81 0.00 0.00 60.65 57.75 1dkd h LYS 286 Cb 0.00 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.08 1dkd h LYS 286 CO -0.04 0.96 -0.12 0.00 -2.81 0.00 0.00 179.45 177.43 1dkd h ALA 287 N 1.07 0.45 -0.53 5.00 0.00 -0.77 -1.82 119.26 122.67 1dkd h ALA 287 Ca 0.21 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1dkd h ALA 287 Cb 0.36 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1dkd h ALA 287 CO 0.00 0.33 0.06 0.52 0.00 0.00 0.00 179.25 180.16 1dkd h MET 288 N 0.43 0.90 -0.99 0.00 2.86 -0.93 -0.85 114.93 116.35 1dkd h MET 288 Ca 0.08 -0.26 0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1dkd h MET 288 Cb 0.64 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 32.15 1dkd h MET 288 CO 0.04 0.89 0.65 1.25 1.06 0.00 0.00 176.91 180.80 1dkd h LEU 289 N 0.78 1.09 -1.02 1.22 5.85 -1.14 -1.24 115.31 120.84 1dkd h LEU 289 Ca 0.16 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1dkd h LEU 289 Cb 0.45 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1dkd h LEU 289 CO 0.02 0.75 0.02 -0.61 -0.34 0.00 0.00 178.44 178.28 1dkd h GLN 290 N 1.26 0.73 -0.18 1.25 4.15 -0.66 -1.35 115.11 120.30 1dkd h GLN 290 Ca 0.39 -0.18 -0.14 0.00 0.77 0.00 0.00 58.65 59.49 1dkd h GLN 290 Cb -0.03 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1dkd h GLN 290 CO -0.11 0.73 -0.49 -0.44 -1.93 0.00 0.00 178.83 176.58 1dkd h ASP 291 N 0.69 0.53 -0.39 -0.69 3.45 -0.25 -2.23 116.42 117.54 1dkd h ASP 291 Ca 0.14 -0.27 -0.15 0.00 0.43 0.00 0.00 57.03 57.19 1dkd h ASP 291 Cb 0.39 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.00 1dkd h ASP 291 CO 0.01 0.94 -0.32 0.40 -1.57 0.00 0.00 179.24 178.70 1dkd h ILE 292 N 0.39 1.27 -0.64 0.35 2.04 -0.86 -2.09 117.51 117.98 1dkd h ILE 292 Ca 0.02 -1.49 0.04 0.00 1.00 0.00 0.00 64.86 64.43 1dkd h ILE 292 Cb 1.00 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 1dkd h ILE 292 CO 0.09 0.50 0.38 0.00 0.00 0.00 0.00 178.15 179.12 1dkd h ALA 293 N 0.85 0.84 -0.38 1.87 0.00 -1.06 -0.67 119.26 120.71 1dkd h ALA 293 Ca 0.08 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1dkd h ALA 293 Cb 0.90 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1dkd h ALA 293 CO 0.08 0.09 0.03 1.15 0.00 0.00 0.00 179.25 180.60 1dkd h THR 294 N 0.72 1.25 -0.84 0.00 2.02 -1.26 0.38 112.91 115.19 1dkd h THR 294 Ca 0.27 -0.93 0.06 0.00 0.77 0.00 0.00 66.41 66.57 1dkd h THR 294 Cb 0.09 1.11 -0.05 0.00 -1.74 0.00 0.00 68.15 67.57 1dkd h THR 294 CO -0.14 0.31 0.55 0.25 0.37 0.00 0.00 175.52 176.86 1dkd h LEU 295 N 0.48 0.84 -2.19 2.58 5.85 -0.86 -2.90 115.31 119.11 1dkd h LEU 295 Ca 0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1dkd h LEU 295 Cb 0.42 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1dkd h LEU 295 CO 0.01 0.55 0.00 0.35 -0.34 0.00 0.00 178.44 179.01 1dkd n THR 296 N -4.47 0.43 -1.33 1.05 -2.24 -0.31 -3.21 114.28 104.20 1dkd n THR 296 Ca 0.12 -0.71 -0.11 0.00 -2.27 0.00 0.00 64.05 61.07 1dkd n THR 296 Cb 0.18 1.01 -0.05 0.00 -2.10 0.00 0.00 70.33 69.37 1dkd n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1dkd n GLY 297 N 1.12 1.26 3.10 3.38 0.00 0.11 -0.02 105.19 114.14 1dkd n GLY 297 Ca 0.15 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 1dkd n GLY 297 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dkd n GLY 298 N -1.52 1.96 2.99 -0.02 0.00 0.36 -4.65 105.19 104.31 1dkd n GLY 298 Ca -0.11 -2.21 -0.23 0.00 0.00 0.00 0.00 46.02 43.47 1dkd n GLY 298 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1dkd s THR 299 N -1.86 0.92 0.12 2.61 -4.23 0.33 -4.47 115.64 109.06 1dkd s THR 299 Ca 0.48 -0.38 -0.31 0.00 -1.18 0.00 0.00 61.69 60.30 1dkd s THR 299 Cb -0.04 -0.85 -0.08 0.00 1.34 0.00 0.00 72.50 72.87 1dkd s THR 299 CO 0.31 0.30 1.45 -0.69 -0.54 0.00 0.00 174.62 175.45 1dkd s VAL 300 N 0.57 3.14 -0.52 2.29 1.01 -1.26 -4.61 120.40 121.02 1dkd s VAL 300 Ca -0.11 0.80 -0.24 0.00 0.00 0.00 0.00 61.98 62.44 1dkd s VAL 300 Cb -0.14 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.77 1dkd s VAL 300 CO 0.02 0.05 0.89 -0.63 0.00 0.00 0.00 175.10 175.43 1dkd s ILE 301 N 1.28 4.48 -0.24 2.22 1.09 -0.21 -4.96 121.20 124.85 1dkd s ILE 301 Ca 0.66 0.27 -0.03 0.00 -1.10 0.00 0.00 60.65 60.45 1dkd s ILE 301 Cb -0.38 -4.48 0.02 0.00 -1.06 0.00 0.00 42.46 36.56 1dkd s ILE 301 CO 0.30 -1.00 -0.05 -0.44 -0.10 0.00 0.00 174.94 173.65 1dkd s SER 302 N 2.68 4.35 0.15 3.58 0.01 -1.26 -2.09 113.70 121.12 1dkd s SER 302 Ca 0.29 -0.73 -0.13 0.00 1.31 0.00 0.00 55.95 56.69 1dkd s SER 302 Cb -0.13 -1.70 0.04 0.00 0.21 0.00 0.00 66.02 64.44 1dkd s SER 302 CO 0.20 -0.11 1.68 -0.33 0.41 0.00 0.00 173.24 175.09 1dkd h GLU 303 N 8.06 0.80 -0.86 12.44 5.08 -1.81 -0.30 114.58 137.99 1dkd h GLU 303 Ca -0.35 -0.17 0.19 0.00 -1.00 0.00 0.00 59.36 58.02 1dkd h GLU 303 Cb 1.12 -0.12 -0.16 0.00 0.50 0.00 0.00 28.75 30.09 1dkd h GLU 303 CO 0.59 0.74 -0.17 0.39 -1.00 0.00 0.00 179.01 179.56 1dkd n GLU 304 N -4.49 -0.08 -0.89 2.33 -0.58 -1.26 0.11 120.64 115.79 1dkd n GLU 304 Ca 0.02 1.33 -0.04 0.00 -0.42 0.00 0.00 57.16 58.05 1dkd n GLU 304 Cb 0.19 -2.02 0.28 0.00 -0.57 0.00 0.00 31.44 29.33 1dkd n GLU 304 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 1dkd n ILE 305 N -5.37 2.60 -0.24 -3.67 -5.35 -1.14 -4.91 119.36 101.28 1dkd n ILE 305 Ca 0.15 -1.38 0.00 0.00 -0.27 0.00 0.00 62.75 61.25 1dkd n ILE 305 Cb 0.48 -0.39 0.00 0.00 -1.74 0.00 0.00 39.64 37.99 1dkd n ILE 305 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dkd n GLY 306 N 0.01 1.01 3.78 3.28 0.00 0.31 -5.06 105.19 108.51 1dkd n GLY 306 Ca 0.34 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.02 1dkd n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dkd s MET 307 N -0.56 3.44 -0.09 1.61 -1.94 -0.13 -4.94 119.30 116.68 1dkd s MET 307 Ca 0.00 1.55 0.02 0.00 -1.71 0.00 0.00 55.69 55.55 1dkd s MET 307 Cb 0.00 -2.02 0.02 0.00 2.01 0.00 0.00 34.83 34.83 1dkd s MET 307 CO 0.00 -0.77 -0.13 -1.21 -0.01 0.00 0.00 175.02 172.90 1dkd s GLU 308 N -3.30 1.92 0.46 2.03 2.02 -1.26 -3.79 118.70 116.79 1dkd s GLU 308 Ca 0.71 -0.46 0.17 0.00 0.02 0.00 0.00 54.97 55.41 1dkd s GLU 308 Cb -0.22 -1.66 1.14 0.00 0.10 0.00 0.00 34.13 33.48 1dkd s GLU 308 CO 0.26 -0.06 1.99 1.25 0.02 0.00 0.00 175.26 178.71 1dkd h LEU 309 N 7.36 0.26 -1.41 1.80 5.85 -1.94 0.69 115.31 127.92 1dkd h LEU 309 Ca -0.31 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1dkd h LEU 309 Cb 1.17 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1dkd h LEU 309 CO 0.47 0.15 0.00 -0.08 -0.34 0.00 0.00 178.44 178.64 1dkd h GLU 310 N 0.29 0.00 -0.02 1.25 4.81 -1.96 -2.64 114.58 116.31 1dkd h GLU 310 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1dkd h GLU 310 Cb 0.67 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.05 1dkd h GLU 310 CO -0.06 0.00 -0.06 1.63 -0.73 0.00 0.00 179.01 179.79 1dkd n LYS 311 N -2.60 1.64 -2.11 1.92 5.02 0.23 -4.81 118.16 117.44 1dkd n LYS 311 Ca 0.00 -1.52 -0.38 0.00 -2.02 0.00 0.00 58.31 54.40 1dkd n LYS 311 Cb 0.18 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 1dkd n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1dkd s ALA 312 N -1.67 3.01 0.38 7.82 0.00 -1.00 -5.03 121.76 125.27 1dkd s ALA 312 Ca 0.21 1.08 0.04 0.00 0.00 0.00 0.00 51.96 53.29 1dkd s ALA 312 Cb 0.16 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1dkd s ALA 312 CO 0.27 -0.84 0.13 0.95 0.00 0.00 0.00 175.76 176.27 1dkd s THR 313 N -1.42 0.62 0.64 0.00 -4.23 -1.26 -4.30 115.64 105.68 1dkd s THR 313 Ca 0.64 -2.00 0.36 0.00 -1.18 0.00 0.00 61.69 59.50 1dkd s THR 313 Cb -0.33 -2.44 0.39 0.00 1.34 0.00 0.00 72.50 71.45 1dkd s THR 313 CO 0.41 0.00 2.21 -0.07 -0.54 0.00 0.00 174.62 176.62 1dkd h LEU 314 N 1.91 0.00 -1.01 4.79 3.38 -1.96 -0.48 115.31 121.94 1dkd h LEU 314 Ca -0.35 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.51 1dkd h LEU 314 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1dkd h LEU 314 CO 0.57 0.00 -0.47 -0.33 0.09 0.00 0.00 178.44 178.30 1dkd h GLU 315 N 0.00 0.06 0.00 1.13 4.39 -2.00 -2.91 114.58 115.24 1dkd h GLU 315 Ca 0.02 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1dkd h GLU 315 Cb 0.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1dkd h GLU 315 CO -0.00 0.51 0.00 -0.44 -1.16 0.00 0.00 179.01 177.92 1dkd h ASP 316 N 0.05 0.00 -3.93 1.42 3.32 -1.45 -3.44 116.42 112.39 1dkd h ASP 316 Ca -0.00 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.56 1dkd h ASP 316 Cb 0.85 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.41 1dkd h ASP 316 CO 0.06 0.00 0.42 -0.76 -1.72 0.00 0.00 179.24 177.24 1dkd s LEU 317 N -5.94 4.22 0.63 1.55 1.43 -1.10 -0.51 118.68 118.95 1dkd s LEU 317 Ca 0.04 2.06 -0.03 0.00 -1.03 0.00 0.00 54.13 55.17 1dkd s LEU 317 Cb 0.08 -4.08 0.04 0.00 0.03 0.00 0.00 46.19 42.26 1dkd s LEU 317 CO 0.58 -0.41 0.90 -0.83 0.23 0.00 0.00 176.35 176.82 1dkd s GLY 318 N -1.46 1.73 -0.01 -3.19 0.00 0.14 -4.21 107.32 100.33 1dkd s GLY 318 Ca 0.55 -1.07 -0.02 0.00 0.00 0.00 0.00 44.72 44.18 1dkd s GLY 318 CO 0.29 -0.73 0.05 1.20 0.00 0.00 0.00 173.10 173.92 1dkd s GLN 319 N -5.01 0.19 0.10 2.90 -0.21 0.98 -0.19 119.66 118.42 1dkd s GLN 319 Ca 0.58 -0.15 -0.08 0.00 0.02 0.00 0.00 55.36 55.73 1dkd s GLN 319 Cb -0.11 0.08 -0.01 0.00 1.00 0.00 0.00 33.01 33.97 1dkd s GLN 319 CO 0.42 -0.03 0.18 0.00 -2.12 0.00 0.00 175.29 173.74 1dkd s ALA 320 N -0.53 -0.04 0.15 6.09 0.00 -1.21 -1.18 121.76 125.03 1dkd s ALA 320 Ca -0.06 -0.78 0.05 0.00 0.00 0.00 0.00 51.96 51.17 1dkd s ALA 320 Cb -0.04 0.57 -0.09 0.00 0.00 0.00 0.00 23.12 23.57 1dkd s ALA 320 CO 0.00 -0.52 1.33 0.87 0.00 0.00 0.00 175.76 177.44 1dkd h LYS 321 N 2.75 0.09 -2.00 0.00 1.57 -0.96 -3.15 116.57 114.87 1dkd h LYS 321 Ca -0.34 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.28 1dkd h LYS 321 Cb 1.20 0.04 -0.20 0.00 0.08 0.00 0.00 32.23 33.35 1dkd h LYS 321 CO 0.56 0.96 0.16 0.50 -0.57 0.00 0.00 179.45 181.06 1dkd s ARG 322 N -2.96 0.93 -0.03 3.15 3.52 -0.89 -0.93 118.95 121.73 1dkd s ARG 322 Ca -0.01 0.70 0.03 0.00 -0.13 0.00 0.00 55.73 56.32 1dkd s ARG 322 Cb 0.10 0.45 0.00 0.00 -1.56 0.00 0.00 34.95 33.94 1dkd s ARG 322 CO 0.82 -0.19 -0.11 0.08 -0.81 0.00 0.00 175.30 175.09 1dkd s VAL 323 N -0.25 0.94 -0.11 7.11 1.01 -0.81 -0.36 120.40 127.94 1dkd s VAL 323 Ca -0.04 -0.43 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1dkd s VAL 323 Cb -0.03 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.54 1dkd s VAL 323 CO 0.05 0.29 -0.09 -0.69 0.00 0.00 0.00 175.10 174.65 1dkd s VAL 324 N 0.25 1.12 -0.03 2.92 1.01 -0.26 -1.35 120.40 124.07 1dkd s VAL 324 Ca -0.05 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.61 1dkd s VAL 324 Cb -0.10 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1dkd s VAL 324 CO 0.01 0.38 -0.19 -0.63 0.00 0.00 0.00 175.10 174.67 1dkd s ILE 325 N 1.45 1.53 0.00 2.22 1.01 0.50 0.04 121.20 127.96 1dkd s ILE 325 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1dkd s ILE 325 Cb -0.13 -1.29 0.00 0.00 0.01 0.00 0.00 42.46 41.05 1dkd s ILE 325 CO -0.06 0.44 0.00 -0.46 0.00 0.00 0.00 174.94 174.86 1dkd n ASN 326 N 2.77 1.19 0.20 3.58 0.23 -0.72 0.15 115.26 122.67 1dkd n ASN 326 Ca -0.16 -0.73 0.06 0.00 -0.53 0.00 0.00 54.58 53.22 1dkd n ASN 326 Cb 0.53 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.77 1dkd n ASN 326 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1dkd h LYS 327 N 0.00 0.09 0.00 -3.83 3.64 -1.94 -2.64 116.57 111.90 1dkd h LYS 327 Ca 0.00 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 1dkd h LYS 327 Cb 0.00 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1dkd h LYS 327 CO 0.00 0.15 -1.51 -0.25 -2.27 0.00 0.00 179.45 175.57 1dkd n ASP 328 N -4.43 2.95 -4.39 4.20 8.00 -1.26 -3.73 116.55 117.89 1dkd n ASP 328 Ca -0.02 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.29 1dkd n ASP 328 Cb 0.16 0.97 -0.10 0.00 -0.02 0.00 0.00 41.12 42.12 1dkd n ASP 328 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1dkd s THR 329 N -2.36 1.02 -0.04 -3.53 -4.23 -1.24 -1.45 115.64 103.81 1dkd s THR 329 Ca -0.04 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.48 1dkd s THR 329 Cb 0.04 -2.66 0.01 0.00 1.34 0.00 0.00 72.50 71.23 1dkd s THR 329 CO 0.35 -0.07 -0.07 -0.89 -0.54 0.00 0.00 174.62 173.40 1dkd s THR 330 N -3.43 0.69 -0.10 3.99 2.01 -0.92 -1.75 115.64 116.14 1dkd s THR 330 Ca 0.35 -0.25 0.03 0.00 0.31 0.00 0.00 61.69 62.12 1dkd s THR 330 Cb 0.08 -0.66 0.01 0.00 0.01 0.00 0.00 72.50 71.94 1dkd s THR 330 CO 0.14 0.24 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.25 1dkd s THR 331 N 0.58 1.57 -0.22 -0.82 2.01 0.11 -2.21 115.64 116.66 1dkd s THR 331 Ca -0.09 -0.71 -0.04 0.00 0.31 0.00 0.00 61.69 61.15 1dkd s THR 331 Cb -0.12 -1.41 -0.01 0.00 0.01 0.00 0.00 72.50 70.97 1dkd s THR 331 CO 0.01 0.45 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.74 1dkd s ILE 332 N 0.71 3.54 -0.13 1.82 1.01 0.15 -1.10 121.20 127.20 1dkd s ILE 332 Ca -0.12 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.10 1dkd s ILE 332 Cb -0.16 -2.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1dkd s ILE 332 CO 0.03 0.41 -0.17 -0.63 0.00 0.00 0.00 174.94 174.58 1dkd s ILE 333 N 1.44 2.59 -0.75 2.92 1.01 0.51 -2.26 121.20 126.66 1dkd s ILE 333 Ca 0.05 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 1dkd s ILE 333 Cb -0.14 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 1dkd s ILE 333 CO -0.02 0.53 0.65 0.47 0.00 0.00 0.00 174.94 176.58 1dkd n ASP 334 N 3.72 -4.54 -4.75 3.58 10.43 -1.26 -1.92 116.55 121.82 1dkd n ASP 334 Ca -0.19 -0.48 -0.41 0.00 2.57 0.00 0.00 54.79 56.28 1dkd n ASP 334 Cb 0.52 -3.76 -0.04 0.00 1.84 0.00 0.00 41.12 39.69 1dkd n ASP 334 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1dkd s GLY 335 N -3.42 2.83 0.00 0.44 0.00 -1.26 -2.30 107.32 103.61 1dkd s GLY 335 Ca 0.25 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.95 1dkd s GLY 335 CO 0.51 1.76 0.49 3.33 0.00 0.00 0.00 173.10 179.19