#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dkd s GLY 192 N 0.00 1.42 -0.26 -1.84 0.00 -1.26 0.10 107.32 105.48 1dkd s GLY 192 Ca 0.00 -1.38 -0.20 0.00 0.00 0.00 0.00 44.72 43.13 1dkd s GLY 192 CO 0.00 -1.39 0.67 -0.29 0.00 0.00 0.00 173.10 172.09 1dkd s MET 193 N -2.12 0.75 -0.22 2.90 0.00 -0.71 -5.00 119.30 114.90 1dkd s MET 193 Ca 0.11 1.02 -0.14 0.00 0.00 0.00 0.00 55.69 56.69 1dkd s MET 193 Cb -0.09 0.29 0.07 0.00 0.00 0.00 0.00 34.83 35.09 1dkd s MET 193 CO 0.06 -0.11 0.55 -1.14 0.00 0.00 0.00 175.02 174.37 1dkd s GLN 194 N 0.81 0.57 0.13 4.11 0.74 -1.26 0.09 119.66 124.85 1dkd s GLN 194 Ca -0.04 0.95 0.02 0.00 0.05 0.00 0.00 55.36 56.34 1dkd s GLN 194 Cb -0.05 0.12 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 1dkd s GLN 194 CO -0.06 -0.14 -0.04 -0.59 -0.55 0.00 0.00 175.29 173.91 1dkd s PHE 195 N 1.22 1.03 -1.56 1.67 -0.71 -0.85 -4.99 117.98 113.79 1dkd s PHE 195 Ca -0.07 -0.94 -0.10 0.00 -1.04 0.00 0.00 56.93 54.78 1dkd s PHE 195 Cb -0.06 -0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 41.12 1dkd s PHE 195 CO -0.12 -0.15 2.81 -0.25 -1.34 0.00 0.00 175.22 176.16 1dkd n ASP 196 N -0.13 8.24 -3.89 1.98 8.00 -1.26 -1.89 116.55 127.60 1dkd n ASP 196 Ca -0.10 -2.69 -0.17 0.00 0.71 0.00 0.00 54.79 52.54 1dkd n ASP 196 Cb 0.62 -1.54 -0.16 0.00 -0.02 0.00 0.00 41.12 40.02 1dkd n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dkd s ARG 197 N 1.71 0.51 0.33 -1.24 1.81 -0.75 -4.84 118.95 116.49 1dkd s ARG 197 Ca 0.65 -0.08 0.04 0.00 -1.72 0.00 0.00 55.73 54.63 1dkd s ARG 197 Cb 0.18 -0.56 0.04 0.00 -0.45 0.00 0.00 34.95 34.16 1dkd s ARG 197 CO -0.07 -0.02 0.37 0.41 -0.68 0.00 0.00 175.30 175.31 1dkd n GLY 198 N 3.65 2.35 3.75 -3.53 0.00 -1.18 -1.97 105.19 108.27 1dkd n GLY 198 Ca -0.21 -2.21 -0.38 0.00 0.00 0.00 0.00 46.02 43.22 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 -1.31 2.44 -2.20 1.61 -0.85 -0.94 -4.43 117.35 111.67 1dkd s TYR 199 Ca 0.28 1.44 0.21 0.00 -0.52 0.00 0.00 57.07 58.49 1dkd s TYR 199 Cb -0.02 -3.64 0.96 0.00 0.38 0.00 0.00 41.96 39.64 1dkd s TYR 199 CO 0.18 -2.44 1.66 1.28 -1.52 0.00 0.00 175.55 174.71 1dkd n LEU 200 N -1.03 1.02 -3.64 -3.49 4.77 -0.30 -4.77 117.00 109.56 1dkd n LEU 200 Ca 0.10 -0.41 -0.04 0.00 -0.03 0.00 0.00 56.01 55.63 1dkd n LEU 200 Cb 0.47 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 1dkd n LEU 200 CO 0.50 0.21 0.56 -0.55 -1.33 0.00 0.00 177.39 176.77 1dkd s SER 201 N -1.64 -0.67 0.46 -1.43 0.15 -1.26 -5.02 113.70 104.29 1dkd s SER 201 Ca 0.32 1.07 0.32 0.00 0.70 0.00 0.00 55.95 58.36 1dkd s SER 201 Cb 0.17 1.28 1.63 0.00 -1.71 0.00 0.00 66.02 67.38 1dkd s SER 201 CO 0.26 -0.17 1.96 1.55 1.20 0.00 0.00 173.24 178.04 1dkd h PRO 202 N 6.41 0.00 0.00 5.44 0.13 -2.01 -2.13 132.00 139.85 1dkd h PRO 202 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1dkd h PRO 202 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 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 -2.65 0.00 0.69 1.56 4.01 -1.26 -1.98 117.16 117.53 1dkd n TYR 203 Ca -0.01 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.85 1dkd n TYR 203 Cb 0.10 -0.28 0.36 0.00 -0.31 0.00 0.00 39.34 39.21 1dkd n TYR 203 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1dkd n PHE 204 N -1.28 0.63 -1.72 -0.72 3.72 -0.80 -4.87 117.46 112.42 1dkd n PHE 204 Ca 0.10 0.18 -0.43 0.00 -0.05 0.00 0.00 57.45 57.26 1dkd n PHE 204 Cb 0.16 -0.75 -0.03 0.00 -0.94 0.00 0.00 39.48 37.93 1dkd n PHE 204 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1dkd n ILE 205 N -2.06 0.52 -0.34 4.37 5.41 -0.84 -4.73 119.36 121.68 1dkd n ILE 205 Ca 0.05 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.67 1dkd n ILE 205 Cb 0.41 -1.87 0.00 0.00 -0.71 0.00 0.00 39.64 37.48 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 2.98 1.30 -3.45 4.38 6.94 -0.91 -4.83 115.26 121.68 1dkd n ASN 206 Ca 0.13 -1.64 -0.27 0.00 -0.02 0.00 0.00 54.58 52.78 1dkd n ASN 206 Cb 0.34 0.00 -0.10 0.00 -2.36 0.00 0.00 39.78 37.67 1dkd n ASN 206 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1dkd n LYS 207 N -0.32 0.84 -0.18 -3.83 4.76 -0.85 -4.93 118.16 113.65 1dkd n LYS 207 Ca 0.00 -3.58 -0.00 0.00 -2.87 0.00 0.00 58.31 51.86 1dkd n LYS 207 Cb 0.33 -1.74 0.08 0.00 -1.84 0.00 0.00 35.03 31.86 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 5.08 0.12 -1.16 1.97 0.11 -1.88 0.42 132.00 136.66 1dkd h PRO 208 Ca 0.20 -0.01 0.34 0.00 0.11 0.00 0.00 66.00 66.63 1dkd h PRO 208 Cb 0.85 -0.03 -0.10 0.00 0.11 0.00 0.00 31.00 31.83 1dkd h PRO 208 CO 0.50 0.08 0.75 1.05 -0.21 0.00 0.00 178.00 180.17 1dkd h GLU 209 N 0.12 0.24 -0.00 1.05 9.09 -1.97 -1.44 114.58 121.67 1dkd h GLU 209 Ca 0.29 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.69 1dkd h GLU 209 Cb 0.45 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 1dkd h GLU 209 CO -0.48 0.16 -0.04 0.25 0.05 0.00 0.00 179.01 178.95 1dkd n THR 210 N -4.61 0.00 -3.42 -1.06 -2.24 -0.83 -5.02 114.28 97.09 1dkd n THR 210 Ca 0.30 -0.48 -0.18 0.00 -2.27 0.00 0.00 64.05 61.41 1dkd n THR 210 Cb 1.12 1.04 0.08 0.00 -2.10 0.00 0.00 70.33 70.47 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 0.45 -0.37 3.33 3.38 0.00 0.14 -5.02 105.19 107.10 1dkd n GLY 211 Ca 0.01 0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.34 1.78 -0.15 4.61 0.00 -0.99 -4.51 121.76 119.16 1dkd s ALA 212 Ca 0.16 -1.83 -0.02 0.00 0.00 0.00 0.00 51.96 50.27 1dkd s ALA 212 Cb -0.07 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1dkd s ALA 212 CO 0.70 -0.37 -0.08 0.08 0.00 0.00 0.00 175.76 176.09 1dkd s VAL 213 N -3.60 3.43 -0.20 0.00 1.01 0.19 -2.00 120.40 119.23 1dkd s VAL 213 Ca 0.33 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1dkd s VAL 213 Cb 0.07 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 34.03 1dkd s VAL 213 CO 0.11 0.50 -0.01 -1.61 0.00 0.00 0.00 175.10 174.09 1dkd s GLU 214 N 0.44 1.14 -0.09 2.72 2.02 -1.26 -0.55 118.70 123.11 1dkd s GLU 214 Ca -0.07 -0.61 0.00 0.00 0.02 0.00 0.00 54.97 54.31 1dkd s GLU 214 Cb -0.15 -2.21 -0.03 0.00 0.10 0.00 0.00 34.13 31.85 1dkd s GLU 214 CO 0.04 -0.57 -0.08 -0.51 0.02 0.00 0.00 175.26 174.16 1dkd s LEU 215 N 1.66 3.05 -0.16 1.80 1.43 -0.43 -4.98 118.68 121.05 1dkd s LEU 215 Ca -0.02 -0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 52.91 1dkd s LEU 215 Cb -0.17 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 1dkd s LEU 215 CO -0.07 0.29 0.03 -1.61 0.23 0.00 0.00 176.35 175.21 1dkd s GLU 216 N -0.37 3.73 -1.40 1.70 0.41 -1.26 -1.59 118.70 119.92 1dkd s GLU 216 Ca 0.05 -0.39 -0.07 0.00 -0.41 0.00 0.00 54.97 54.15 1dkd s GLU 216 Cb -0.12 -3.07 0.01 0.00 -1.78 0.00 0.00 34.13 29.16 1dkd s GLU 216 CO 0.02 0.35 0.35 0.43 -0.49 0.00 0.00 175.26 175.93 1dkd n SER 217 N 3.26 -0.94 -4.86 -0.19 7.64 0.19 -4.59 113.62 114.14 1dkd n SER 217 Ca -0.17 -1.14 -0.31 0.00 1.01 0.00 0.00 58.87 58.26 1dkd n SER 217 Cb 0.53 -2.42 -0.04 0.00 -1.01 0.00 0.00 64.21 61.27 1dkd n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1dkd s PRO 218 N -6.89 3.86 0.49 1.43 0.04 -1.21 -4.47 135.00 128.25 1dkd s PRO 218 Ca 0.12 0.63 -0.09 0.00 0.04 0.00 0.00 61.00 61.70 1dkd s PRO 218 Cb -0.06 -2.33 -0.05 0.00 0.04 0.00 0.00 34.50 32.10 1dkd s PRO 218 CO 0.93 -0.07 0.85 -0.06 0.04 0.00 0.00 177.00 178.70 1dkd s PHE 219 N -2.37 3.53 -0.14 0.56 0.08 0.60 -3.23 117.98 117.02 1dkd s PHE 219 Ca 0.54 1.06 -0.01 0.00 0.12 0.00 0.00 56.93 58.64 1dkd s PHE 219 Cb -0.10 -2.49 0.04 0.00 -0.57 0.00 0.00 43.02 39.90 1dkd s PHE 219 CO 0.29 -0.32 -0.01 0.42 -0.10 0.00 0.00 175.22 175.50 1dkd s ILE 220 N -2.70 0.69 -0.19 0.64 1.01 -0.32 -1.21 121.20 119.12 1dkd s ILE 220 Ca 0.52 -0.32 -0.17 0.00 0.00 0.00 0.00 60.65 60.68 1dkd s ILE 220 Cb -0.10 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 1dkd s ILE 220 CO 0.41 0.11 0.45 -0.22 0.00 0.00 0.00 174.94 175.68 1dkd s LEU 221 N 1.82 4.17 -0.27 2.97 2.96 -0.52 -0.42 118.68 129.38 1dkd s LEU 221 Ca 0.02 0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 54.52 1dkd s LEU 221 Cb -0.14 -2.60 0.04 0.00 0.50 0.00 0.00 46.19 43.98 1dkd s LEU 221 CO -0.07 -0.10 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.05 1dkd s LEU 222 N 1.34 3.44 -0.12 -0.68 1.43 -1.26 -1.36 118.68 121.47 1dkd s LEU 222 Ca 0.22 -1.03 0.01 0.00 -1.03 0.00 0.00 54.13 52.30 1dkd s LEU 222 Cb -0.15 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.41 1dkd s LEU 222 CO 0.09 -0.18 -0.15 0.00 0.23 0.00 0.00 176.35 176.34 1dkd s ALA 223 N 1.29 1.76 -0.70 4.21 0.00 -0.58 -1.11 121.76 126.63 1dkd s ALA 223 Ca -0.02 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 51.08 1dkd s ALA 223 Cb -0.18 -0.90 -0.08 0.00 0.00 0.00 0.00 23.12 21.97 1dkd s ALA 223 CO -0.03 -0.15 3.05 -3.47 0.00 0.00 0.00 175.76 175.15 1dkd n ASP 224 N 4.34 6.82 -3.63 0.00 2.03 -0.54 -2.97 116.55 122.61 1dkd n ASP 224 Ca -0.18 -2.81 -0.01 0.00 0.52 0.00 0.00 54.79 52.31 1dkd n ASP 224 Cb 0.51 -1.39 -0.00 0.00 -0.72 0.00 0.00 41.12 39.52 1dkd n ASP 224 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1dkd s LYS 225 N 0.17 0.91 0.00 -0.67 -2.85 -1.26 -4.72 119.74 111.32 1dkd s LYS 225 Ca 0.63 -0.53 -0.23 0.00 -1.00 0.00 0.00 55.97 54.84 1dkd s LYS 225 Cb 0.28 0.29 -0.05 0.00 -2.06 0.00 0.00 37.83 36.29 1dkd s LYS 225 CO -0.09 -0.42 0.69 0.15 0.10 0.00 0.00 175.35 175.78 1dkd s LYS 226 N -2.65 4.42 -0.30 1.78 1.02 -1.26 -1.76 119.74 121.00 1dkd s LYS 226 Ca 0.17 0.91 -0.05 0.00 0.02 0.00 0.00 55.97 57.01 1dkd s LYS 226 Cb 0.00 -3.38 0.02 0.00 -0.52 0.00 0.00 37.83 33.96 1dkd s LYS 226 CO 0.01 0.26 0.05 0.42 -0.92 0.00 0.00 175.35 175.17 1dkd s ILE 227 N 0.10 3.67 0.00 2.17 1.01 0.10 -4.91 121.20 123.35 1dkd s ILE 227 Ca 0.36 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1dkd s ILE 227 Cb -0.19 -2.94 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1dkd s ILE 227 CO 0.20 0.04 0.00 -1.54 0.00 0.00 0.00 174.94 173.64 1dkd n SER 228 N 4.81 0.30 -4.23 3.58 3.41 -1.26 -1.37 113.62 118.86 1dkd n SER 228 Ca -0.14 -0.30 -0.34 0.00 -0.26 0.00 0.00 58.87 57.83 1dkd n SER 228 Cb 0.47 0.65 -0.15 0.00 -0.26 0.00 0.00 64.21 64.93 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 -0.71 4.09 0.24 4.04 3.84 -1.26 -1.91 114.94 123.26 1dkd s ASN 229 Ca 0.00 -0.65 -0.07 0.00 0.21 0.00 0.00 52.86 52.35 1dkd s ASN 229 Cb 0.00 -1.66 0.23 0.00 -0.55 0.00 0.00 41.25 39.27 1dkd s ASN 229 CO 0.00 -0.06 1.89 0.40 -2.79 0.00 0.00 177.10 176.54 1dkd h ILE 230 N 5.94 1.26 -1.03 -5.21 1.08 -1.90 -2.68 117.51 114.98 1dkd h ILE 230 Ca -0.38 -0.56 0.26 0.00 -0.39 0.00 0.00 64.86 63.79 1dkd h ILE 230 Cb 1.13 -0.09 -0.10 0.00 -3.07 0.00 0.00 36.82 34.70 1dkd h ILE 230 CO 0.60 0.27 0.66 0.03 -0.69 0.00 0.00 178.15 179.01 1dkd h ARG 231 N 1.31 0.42 0.00 2.37 -0.00 -1.99 1.01 114.38 117.50 1dkd h ARG 231 Ca 0.34 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.79 1dkd h ARG 231 Cb -0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 29.97 29.81 1dkd h ARG 231 CO -0.06 0.28 -0.03 1.49 0.00 0.00 0.00 179.97 181.65 1dkd h GLU 232 N 0.44 0.00 0.00 0.04 4.81 -1.90 -2.91 114.58 115.05 1dkd h GLU 232 Ca 0.60 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.83 1dkd h GLU 232 Cb 1.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.81 1dkd h GLU 232 CO -0.32 0.03 -1.44 -1.33 -0.73 0.00 0.00 179.01 175.21 1dkd n MET 233 N -3.18 0.51 -0.25 1.92 2.81 0.34 -3.80 117.12 115.48 1dkd n MET 233 Ca -0.01 -0.06 0.05 0.00 -1.81 0.00 0.00 57.70 55.88 1dkd n MET 233 Cb 0.22 -1.62 0.18 0.00 -0.71 0.00 0.00 33.22 31.30 1dkd n MET 233 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1dkd h LEU 234 N 0.00 0.04 0.01 4.03 4.07 -1.17 -1.30 115.31 120.98 1dkd h LEU 234 Ca 0.00 0.14 0.00 0.00 0.08 0.00 0.00 57.88 58.10 1dkd h LEU 234 Cb 0.90 0.18 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 1dkd h LEU 234 CO 0.00 -0.02 -0.01 -0.65 -1.08 0.00 0.00 178.44 176.67 1dkd h PRO 235 N 0.29 -0.03 -0.64 1.13 0.11 -1.81 -1.97 132.00 129.08 1dkd h PRO 235 Ca 0.41 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.45 1dkd h PRO 235 Cb 0.69 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.78 1dkd h PRO 235 CO -0.49 -0.02 0.13 0.28 -0.21 0.00 0.00 178.00 177.69 1dkd h VAL 236 N -0.03 1.26 -0.83 3.15 2.07 -1.69 -2.98 116.25 117.20 1dkd h VAL 236 Ca 0.00 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1dkd h VAL 236 Cb 0.03 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1dkd h VAL 236 CO -0.01 0.37 0.45 -0.07 0.02 0.00 0.00 177.57 178.32 1dkd h LEU 237 N 0.96 1.04 -0.57 2.57 3.38 -1.09 -1.53 115.31 120.06 1dkd h LEU 237 Ca 0.20 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1dkd h LEU 237 Cb 0.40 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1dkd h LEU 237 CO 0.01 0.84 0.11 -0.08 0.09 0.00 0.00 178.44 179.42 1dkd h GLU 238 N 1.15 0.93 -0.95 1.13 4.81 -1.33 0.77 114.58 121.10 1dkd h GLU 238 Ca 0.29 -0.24 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1dkd h GLU 238 Cb 0.04 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.26 1dkd h GLU 238 CO -0.05 0.88 0.62 0.00 -0.73 0.00 0.00 179.01 179.74 1dkd h ALA 239 N 1.01 1.21 -0.24 2.92 0.00 -1.31 -0.17 119.26 122.68 1dkd h ALA 239 Ca 0.18 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1dkd h ALA 239 Cb 0.38 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1dkd h ALA 239 CO 0.01 0.61 -0.24 0.28 0.00 0.00 0.00 179.25 179.91 1dkd h VAL 240 N 1.29 1.31 -0.42 0.00 2.07 -0.91 -2.50 116.25 117.10 1dkd h VAL 240 Ca 0.35 -1.40 0.03 0.00 0.82 0.00 0.00 66.70 66.50 1dkd h VAL 240 Cb -0.14 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 1dkd h VAL 240 CO -0.07 0.44 0.21 0.00 0.02 0.00 0.00 177.57 178.17 1dkd h ALA 241 N 0.68 0.53 0.00 1.67 0.00 -0.36 -0.13 119.26 121.64 1dkd h ALA 241 Ca 0.04 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dkd h ALA 241 Cb 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1dkd h ALA 241 CO 0.06 -0.15 0.00 1.57 0.00 0.00 0.00 179.25 180.73 1dkd h LYS 242 N 0.43 0.00 0.00 0.00 2.10 -1.00 -2.09 116.57 116.00 1dkd h LYS 242 Ca 0.18 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 1dkd h LYS 242 Cb 0.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1dkd h LYS 242 CO -0.13 0.00 -0.74 0.00 -2.00 0.00 0.00 179.45 176.58 1dkd h ALA 243 N 2.10 0.58 -1.83 0.07 0.00 -0.58 -3.48 119.26 116.12 1dkd h ALA 243 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1dkd h ALA 243 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1dkd h ALA 243 CO 0.00 0.00 -0.29 0.41 0.00 0.00 0.00 179.25 179.37 1dkd n GLY 244 N 1.24 -0.06 3.22 0.00 0.00 -0.76 -5.04 105.19 103.81 1dkd n GLY 244 Ca 0.02 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 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 -4.70 1.07 0.89 1.61 1.02 -1.24 -5.10 119.74 113.30 1dkd s LYS 245 Ca 0.04 -0.99 -0.11 0.00 0.02 0.00 0.00 55.97 54.93 1dkd s LYS 245 Cb -0.02 -1.20 0.13 0.00 -0.52 0.00 0.00 37.83 36.22 1dkd s LYS 245 CO 0.05 0.29 1.11 -2.14 -0.92 0.00 0.00 175.35 173.73 1dkd s PRO 246 N -1.56 1.26 -0.04 -1.68 0.02 -1.26 -4.78 135.00 126.96 1dkd s PRO 246 Ca 0.04 1.25 0.01 0.00 0.02 0.00 0.00 61.00 62.32 1dkd s PRO 246 Cb -0.09 -1.78 0.02 0.00 0.02 0.00 0.00 34.50 32.67 1dkd s PRO 246 CO 0.03 -2.36 -0.04 -1.17 -0.33 0.00 0.00 177.00 173.12 1dkd s LEU 247 N -6.39 1.34 -0.17 -5.54 2.96 -0.24 -0.29 118.68 110.36 1dkd s LEU 247 Ca 0.65 -0.11 -0.04 0.00 -0.22 0.00 0.00 54.13 54.40 1dkd s LEU 247 Cb -0.20 -0.41 -0.03 0.00 0.50 0.00 0.00 46.19 46.05 1dkd s LEU 247 CO 0.58 -0.05 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.32 1dkd s LEU 248 N 0.87 3.33 -0.19 -0.68 2.96 -0.35 -1.83 118.68 122.79 1dkd s LEU 248 Ca -0.11 -0.11 -0.05 0.00 -0.22 0.00 0.00 54.13 53.64 1dkd s LEU 248 Cb -0.14 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 1dkd s LEU 248 CO 0.00 0.15 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.54 1dkd s ILE 249 N 0.49 3.87 -0.30 6.68 1.01 0.26 -1.44 121.20 131.76 1dkd s ILE 249 Ca -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.31 1dkd s ILE 249 Cb -0.14 -2.74 0.08 0.00 0.01 0.00 0.00 42.46 39.67 1dkd s ILE 249 CO 0.02 0.44 -0.01 -0.63 0.00 0.00 0.00 174.94 174.77 1dkd s ILE 250 N 0.91 2.06 0.24 2.92 1.01 -0.47 -0.49 121.20 127.39 1dkd s ILE 250 Ca 0.01 -1.93 0.01 0.00 0.00 0.00 0.00 60.65 58.74 1dkd s ILE 250 Cb -0.14 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 1dkd s ILE 250 CO 0.02 -0.37 0.11 0.00 0.00 0.00 0.00 174.94 174.69 1dkd s ALA 251 N 1.07 1.59 0.48 9.38 0.00 -1.09 -1.52 121.76 131.67 1dkd s ALA 251 Ca 0.03 -1.82 0.22 0.00 0.00 0.00 0.00 51.96 50.39 1dkd s ALA 251 Cb -0.19 1.14 1.26 0.00 0.00 0.00 0.00 23.12 25.32 1dkd s ALA 251 CO -0.08 -0.49 1.93 1.49 0.00 0.00 0.00 175.76 178.60 1dkd h GLU 252 N 2.44 0.19 -1.13 0.00 4.81 -1.23 0.21 114.58 119.87 1dkd h GLU 252 Ca -0.38 -0.01 0.26 0.00 -0.13 0.00 0.00 59.36 59.10 1dkd h GLU 252 Cb 1.25 -0.04 -0.25 0.00 0.63 0.00 0.00 28.75 30.34 1dkd h GLU 252 CO 0.59 0.13 0.92 0.34 -0.73 0.00 0.00 179.01 180.25 1dkd s ASP 253 N -5.91 -0.06 -0.15 1.04 -1.08 -1.25 -4.43 116.67 104.83 1dkd s ASP 253 Ca -0.06 0.05 -0.02 0.00 -0.52 0.00 0.00 52.55 52.00 1dkd s ASP 253 Cb 0.21 0.06 0.05 0.00 -1.46 0.00 0.00 42.92 41.77 1dkd s ASP 253 CO 0.76 -0.07 -0.01 -0.69 0.52 0.00 0.00 175.17 175.68 1dkd s VAL 254 N -1.42 0.71 0.26 1.11 1.01 -1.26 -0.72 120.40 120.09 1dkd s VAL 254 Ca 0.09 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.68 1dkd s VAL 254 Cb -0.01 -1.01 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 1dkd s VAL 254 CO -0.06 0.03 0.28 -1.84 0.00 0.00 0.00 175.10 173.52 1dkd n GLU 255 N 5.01 0.41 0.00 2.72 0.28 -0.47 -4.72 120.64 123.86 1dkd n GLU 255 Ca -0.10 -2.34 0.00 0.00 -0.16 0.00 0.00 57.16 54.57 1dkd n GLU 255 Cb 0.48 2.05 0.00 0.00 1.43 0.00 0.00 31.44 35.40 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 -0.46 2.92 0.23 -1.84 0.00 -1.26 -2.49 105.19 102.30 1dkd n GLY 256 Ca 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 1dkd n GLY 256 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1dkd h GLU 257 N 0.00 0.59 -0.23 1.61 4.81 -1.95 -2.03 114.58 117.38 1dkd h GLU 257 Ca 0.00 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1dkd h GLU 257 Cb 0.00 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 1dkd h GLU 257 CO 0.00 0.39 0.12 0.00 -0.73 0.00 0.00 179.01 178.79 1dkd h ALA 258 N 1.31 0.28 0.21 2.92 0.00 -1.16 -0.62 119.26 122.20 1dkd h ALA 258 Ca 0.26 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1dkd h ALA 258 Cb 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1dkd h ALA 258 CO -0.17 -0.29 -0.10 1.25 0.00 0.00 0.00 179.25 179.94 1dkd h LEU 259 N 0.25 -0.24 -0.78 0.00 5.85 -1.22 -1.29 115.31 117.87 1dkd h LEU 259 Ca 0.10 -0.06 0.07 0.00 0.84 0.00 0.00 57.88 58.82 1dkd h LEU 259 Cb 0.02 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.05 1dkd h LEU 259 CO -0.06 -0.09 0.46 0.00 -0.34 0.00 0.00 178.44 178.40 1dkd h ALA 260 N 0.40 1.08 -0.39 1.25 0.00 -1.30 -1.93 119.26 118.36 1dkd h ALA 260 Ca -0.03 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1dkd h ALA 260 Cb 0.29 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1dkd h ALA 260 CO 0.05 0.14 -0.27 1.15 0.00 0.00 0.00 179.25 180.32 1dkd h THR 261 N 0.82 1.27 -0.79 0.00 2.02 -0.98 -1.92 112.91 113.32 1dkd h THR 261 Ca 0.35 -1.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.11 1dkd h THR 261 Cb 0.23 1.26 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 1dkd h THR 261 CO -0.20 0.47 0.42 -0.07 0.37 0.00 0.00 175.52 176.51 1dkd h LEU 262 N 0.70 1.00 0.07 2.58 3.38 -0.75 -2.54 115.31 119.76 1dkd h LEU 262 Ca 0.09 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1dkd h LEU 262 Cb 0.80 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1dkd h LEU 262 CO 0.07 0.83 -0.03 0.58 0.09 0.00 0.00 178.44 179.97 1dkd h VAL 263 N 1.10 0.97 -0.46 1.22 2.07 -1.16 -1.95 116.25 118.03 1dkd h VAL 263 Ca 0.28 -0.11 0.09 0.00 0.82 0.00 0.00 66.70 67.77 1dkd h VAL 263 Cb 0.06 1.04 -0.08 0.00 -1.52 0.00 0.00 31.29 30.80 1dkd h VAL 263 CO -0.04 0.03 0.00 0.58 0.02 0.00 0.00 177.57 178.16 1dkd h VAL 264 N -0.14 0.64 0.00 2.57 2.07 -1.18 0.23 116.25 120.44 1dkd h VAL 264 Ca -0.01 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1dkd h VAL 264 Cb 0.12 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1dkd h VAL 264 CO 0.02 0.02 0.00 0.59 0.02 0.00 0.00 177.57 178.22 1dkd n ASN 265 N -5.22 0.20 -0.07 0.57 3.02 -0.97 -1.72 115.26 111.07 1dkd n ASN 265 Ca 0.04 0.53 -0.16 0.00 -0.03 0.00 0.00 54.58 54.96 1dkd n ASN 265 Cb 0.25 -0.58 -0.13 0.00 -0.61 0.00 0.00 39.78 38.71 1dkd n ASN 265 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1dkd h THR 266 N 0.00 1.55 -0.36 3.41 2.02 -0.44 -2.19 112.91 116.90 1dkd h THR 266 Ca 0.00 -2.32 0.10 0.00 0.77 0.00 0.00 66.41 64.96 1dkd h THR 266 Cb 0.50 3.09 -0.01 0.00 -1.74 0.00 0.00 68.15 69.98 1dkd h THR 266 CO 0.00 0.55 0.28 0.24 0.37 0.00 0.00 175.52 176.95 1dkd h MET 267 N -0.95 0.00 -0.00 6.66 2.86 -0.83 -1.59 114.93 121.08 1dkd h MET 267 Ca -0.10 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1dkd h MET 267 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 1dkd h MET 267 CO -0.04 0.00 -0.26 0.54 1.06 0.00 0.00 176.91 178.21 1dkd n ARG 268 N -4.29 0.60 -0.39 1.72 1.74 -0.70 -4.97 116.66 110.37 1dkd n ARG 268 Ca 0.06 -0.31 0.00 0.00 -0.77 0.00 0.00 57.85 56.83 1dkd n ARG 268 Cb 0.45 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 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 1.36 1.28 0.16 -0.13 0.00 -0.60 -4.95 105.19 102.32 1dkd n GLY 269 Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 0.82 -2.96 -0.61 1.08 -1.65 -3.44 117.51 110.75 1dkd h ILE 270 Ca 0.00 -0.39 -0.25 0.00 -0.39 0.00 0.00 64.86 63.82 1dkd h ILE 270 Cb 0.00 1.05 -0.34 0.00 -3.07 0.00 0.00 36.82 34.46 1dkd h ILE 270 CO 0.00 0.09 -0.58 -0.69 -0.69 0.00 0.00 178.15 176.28 1dkd s VAL 271 N -5.31 -0.34 -0.49 1.67 1.01 -1.11 -4.88 120.40 110.96 1dkd s VAL 271 Ca -0.15 0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.86 1dkd s VAL 271 Cb 0.03 -0.38 0.03 0.00 0.00 0.00 0.00 36.38 36.07 1dkd s VAL 271 CO 0.61 0.13 1.11 -0.75 0.00 0.00 0.00 175.10 176.20 1dkd s LYS 272 N 2.36 3.66 0.18 2.72 2.20 -1.26 -3.92 119.74 125.68 1dkd s LYS 272 Ca 0.02 0.45 0.02 0.00 -0.36 0.00 0.00 55.97 56.10 1dkd s LYS 272 Cb -0.12 -3.93 -0.05 0.00 -1.51 0.00 0.00 37.83 32.23 1dkd s LYS 272 CO -0.07 -1.39 -0.00 0.54 -0.36 0.00 0.00 175.35 174.06 1dkd s VAL 273 N 4.39 0.75 -0.04 4.02 0.11 -1.26 -1.08 120.40 127.29 1dkd s VAL 273 Ca 0.45 -1.99 -0.08 0.00 -2.93 0.00 0.00 61.98 57.43 1dkd s VAL 273 Cb -0.08 -2.15 0.01 0.00 -1.53 0.00 0.00 36.38 32.64 1dkd s VAL 273 CO 0.30 -0.46 0.20 0.00 -3.33 0.00 0.00 175.10 171.82 1dkd s ALA 274 N -3.61 -0.50 -0.01 1.54 0.00 -0.76 -4.86 121.76 113.56 1dkd s ALA 274 Ca 0.24 0.30 0.03 0.00 0.00 0.00 0.00 51.96 52.54 1dkd s ALA 274 Cb 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 1dkd s ALA 274 CO 0.05 -0.16 -0.11 0.00 0.00 0.00 0.00 175.76 175.53 1dkd s ALA 275 N -0.62 0.91 0.03 0.00 0.00 -1.26 -0.58 121.76 120.24 1dkd s ALA 275 Ca -0.07 -0.47 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 1dkd s ALA 275 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1dkd s ALA 275 CO 0.01 0.22 -0.01 0.14 0.00 0.00 0.00 175.76 176.12 1dkd s VAL 276 N -0.23 0.14 0.44 0.00 -7.23 0.36 -1.15 120.40 112.73 1dkd s VAL 276 Ca 0.04 -1.17 -0.22 0.00 -1.81 0.00 0.00 61.98 58.82 1dkd s VAL 276 Cb -0.05 -0.67 -0.09 0.00 0.56 0.00 0.00 36.38 36.13 1dkd s VAL 276 CO -0.00 -0.64 1.06 -0.54 -0.31 0.00 0.00 175.10 174.66 1dkd s LYS 277 N -2.24 3.98 0.40 4.82 1.02 -1.26 -2.69 119.74 123.77 1dkd s LYS 277 Ca -0.09 1.48 -0.25 0.00 0.02 0.00 0.00 55.97 57.13 1dkd s LYS 277 Cb -0.04 -2.35 -0.08 0.00 -0.52 0.00 0.00 37.83 34.83 1dkd s LYS 277 CO -0.04 -0.29 1.20 0.00 -0.92 0.00 0.00 175.35 175.30 1dkd s ALA 278 N -1.77 3.18 0.64 5.17 0.00 0.75 -4.77 121.76 124.95 1dkd s ALA 278 Ca 0.62 1.03 -0.13 0.00 0.00 0.00 0.00 51.96 53.48 1dkd s ALA 278 Cb -0.20 -3.40 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1dkd s ALA 278 CO 0.25 -0.59 1.04 -1.25 0.00 0.00 0.00 175.76 175.21 1dkd s PRO 279 N -2.26 3.28 0.30 0.00 0.04 -1.26 -4.93 135.00 130.18 1dkd s PRO 279 Ca 0.57 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.57 1dkd s PRO 279 Cb -0.32 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1dkd s PRO 279 CO 0.41 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 177.04 1dkd n GLY 280 N -1.90 -2.38 3.10 0.56 0.00 -1.26 -4.13 105.19 99.18 1dkd n GLY 280 Ca 0.07 -1.58 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.65 0.90 0.00 1.61 5.36 -1.26 -4.63 117.98 119.31 1dkd s PHE 281 Ca 0.00 -0.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.54 1dkd s PHE 281 Cb 0.00 -0.53 0.00 0.00 -0.34 0.00 0.00 43.02 42.15 1dkd s PHE 281 CO 0.00 -0.02 0.00 0.41 -1.46 0.00 0.00 175.22 174.15 1dkd n GLY 282 N 1.60 2.77 0.34 13.12 0.00 -1.26 -1.70 105.19 120.05 1dkd n GLY 282 Ca -0.21 0.02 0.10 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 0.37 -0.23 1.61 3.45 -2.00 -1.87 116.42 117.76 1dkd h ASP 283 Ca 0.00 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.36 1dkd h ASP 283 Cb 0.00 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.68 1dkd h ASP 283 CO 0.00 0.24 -0.22 0.03 -1.57 0.00 0.00 179.24 177.72 1dkd h ARG 284 N 0.42 0.69 -0.66 3.56 2.47 -1.73 -1.47 114.38 117.68 1dkd h ARG 284 Ca 0.24 -0.27 -0.05 0.00 -1.26 0.00 0.00 59.98 58.64 1dkd h ARG 284 Cb 0.40 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.65 1dkd h ARG 284 CO -0.06 0.86 0.21 -0.09 0.56 0.00 0.00 179.97 181.44 1dkd h ARG 285 N 0.61 1.00 -0.28 0.04 2.43 -1.03 0.69 114.38 117.85 1dkd h ARG 285 Ca 0.09 -0.19 -0.06 0.00 -0.81 0.00 0.00 59.98 59.01 1dkd h ARG 285 Cb 0.70 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1dkd h ARG 285 CO 0.05 0.85 -0.05 0.87 -1.51 0.00 0.00 179.97 180.19 1dkd h LYS 286 N 0.96 0.52 -0.37 0.20 1.57 -1.19 -0.88 116.57 117.39 1dkd h LYS 286 Ca 0.22 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1dkd h LYS 286 Cb 0.27 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1dkd h LYS 286 CO -0.01 0.71 0.22 0.00 -0.57 0.00 0.00 179.45 179.80 1dkd h ALA 287 N 0.79 0.47 -0.40 3.86 0.00 -0.94 -1.64 119.26 121.40 1dkd h ALA 287 Ca 0.07 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1dkd h ALA 287 Cb 0.51 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1dkd h ALA 287 CO 0.02 -0.03 0.06 0.52 0.00 0.00 0.00 179.25 179.82 1dkd h MET 288 N 0.48 0.61 -0.42 0.00 2.86 -0.80 -1.17 114.93 116.49 1dkd h MET 288 Ca 0.13 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.57 1dkd h MET 288 Cb 0.01 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1dkd h MET 288 CO -0.02 0.59 -0.05 1.25 1.06 0.00 0.00 176.91 179.74 1dkd h LEU 289 N 0.59 0.76 -1.13 1.22 5.85 -0.78 -1.94 115.31 119.88 1dkd h LEU 289 Ca 0.13 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 1dkd h LEU 289 Cb 0.28 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1dkd h LEU 289 CO 0.00 0.92 0.21 1.56 -0.34 0.00 0.00 178.44 180.79 1dkd h GLN 290 N 0.59 0.82 -0.58 1.25 1.08 -0.77 -1.01 115.11 116.48 1dkd h GLN 290 Ca 0.11 -0.13 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 1dkd h GLN 290 Cb 0.55 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.82 1dkd h GLN 290 CO 0.03 0.68 0.21 -0.44 -0.95 0.00 0.00 178.83 178.37 1dkd h ASP 291 N 0.80 0.83 -0.15 1.46 3.45 -0.94 -0.88 116.42 120.99 1dkd h ASP 291 Ca 0.19 -0.19 -0.05 0.00 0.43 0.00 0.00 57.03 57.41 1dkd h ASP 291 Cb 0.18 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.72 1dkd h ASP 291 CO -0.01 0.79 -0.05 0.40 -1.57 0.00 0.00 179.24 178.80 1dkd h ILE 292 N 0.81 1.19 -0.56 0.35 2.04 -0.78 -0.35 117.51 120.22 1dkd h ILE 292 Ca 0.19 -0.80 -0.08 0.00 1.00 0.00 0.00 64.86 65.17 1dkd h ILE 292 Cb 0.24 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1dkd h ILE 292 CO -0.01 0.27 0.02 0.00 0.00 0.00 0.00 178.15 178.42 1dkd h ALA 293 N 1.54 0.75 -0.29 1.87 0.00 -0.60 -1.15 119.26 121.37 1dkd h ALA 293 Ca 0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1dkd h ALA 293 Cb 0.35 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1dkd h ALA 293 CO 0.02 0.56 0.05 1.15 0.00 0.00 0.00 179.25 181.02 1dkd h THR 294 N 0.85 1.23 -0.37 0.00 2.02 -0.45 0.46 112.91 116.64 1dkd h THR 294 Ca 0.16 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 1dkd h THR 294 Cb 0.52 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1dkd h THR 294 CO 0.03 0.26 0.05 0.25 0.37 0.00 0.00 175.52 176.47 1dkd h LEU 295 N 0.30 0.53 -1.70 2.58 5.85 -0.95 -3.01 115.31 118.91 1dkd h LEU 295 Ca 0.09 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1dkd h LEU 295 Cb 0.33 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1dkd h LEU 295 CO 0.00 0.56 -0.06 0.35 -0.34 0.00 0.00 178.44 178.96 1dkd n THR 296 N -4.30 0.00 -1.60 1.05 -2.24 -0.45 -3.55 114.28 103.19 1dkd n THR 296 Ca 0.02 -0.47 -0.11 0.00 -2.27 0.00 0.00 64.05 61.22 1dkd n THR 296 Cb 0.22 1.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.83 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 1.20 0.83 0.00 3.38 0.00 0.13 -1.20 105.19 109.53 1dkd n GLY 297 Ca 0.12 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.43 1.52 2.83 -0.02 0.00 0.51 -4.62 105.19 103.97 1dkd n GLY 298 Ca -0.12 -2.06 -0.15 0.00 0.00 0.00 0.00 46.02 43.69 1dkd n GLY 298 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dkd s THR 299 N 0.80 0.08 -0.01 2.61 2.01 -0.09 -4.57 115.64 116.47 1dkd s THR 299 Ca 0.00 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 1dkd s THR 299 Cb 0.00 -0.16 -0.04 0.00 0.01 0.00 0.00 72.50 72.31 1dkd s THR 299 CO 0.00 0.09 1.16 -0.69 -0.69 0.00 0.00 174.62 174.49 1dkd s VAL 300 N 0.72 4.29 -0.59 3.82 1.01 -1.26 -4.54 120.40 123.86 1dkd s VAL 300 Ca -0.07 1.63 -0.25 0.00 0.00 0.00 0.00 61.98 63.30 1dkd s VAL 300 Cb -0.10 -4.05 0.04 0.00 0.00 0.00 0.00 36.38 32.28 1dkd s VAL 300 CO -0.02 0.06 1.03 -0.63 0.00 0.00 0.00 175.10 175.54 1dkd s ILE 301 N 1.62 4.24 -0.16 2.22 1.09 -0.27 -4.94 121.20 125.00 1dkd s ILE 301 Ca 0.56 0.34 0.01 0.00 -1.10 0.00 0.00 60.65 60.46 1dkd s ILE 301 Cb -0.25 -4.63 0.02 0.00 -1.06 0.00 0.00 42.46 36.53 1dkd s ILE 301 CO 0.25 -1.27 -0.19 -0.94 -0.10 0.00 0.00 174.94 172.69 1dkd s SER 302 N 3.06 2.99 0.46 3.58 1.04 -1.26 -1.47 113.70 122.10 1dkd s SER 302 Ca 0.32 -0.59 0.17 0.00 0.48 0.00 0.00 55.95 56.33 1dkd s SER 302 Cb -0.12 -1.39 1.10 0.00 0.10 0.00 0.00 66.02 65.72 1dkd s SER 302 CO 0.19 0.01 2.01 -0.33 0.98 0.00 0.00 173.24 176.10 1dkd h GLU 303 N 7.74 0.00 -0.96 4.02 5.08 -1.85 -1.95 114.58 126.66 1dkd h GLU 303 Ca -0.40 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.22 1dkd h GLU 303 Cb 1.16 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.27 1dkd h GLU 303 CO 0.58 0.17 0.50 0.93 -1.00 0.00 0.00 179.01 180.19 1dkd h GLU 304 N 0.00 0.42 -0.56 2.33 4.39 -1.93 0.56 114.58 119.80 1dkd h GLU 304 Ca -0.00 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.56 1dkd h GLU 304 Cb 0.32 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.81 1dkd h GLU 304 CO 0.02 0.28 0.12 0.44 -1.16 0.00 0.00 179.01 178.71 1dkd n ILE 305 N -5.00 2.73 -1.03 3.13 -5.35 -1.03 -4.94 119.36 107.86 1dkd n ILE 305 Ca 0.26 -1.74 -0.01 0.00 -0.27 0.00 0.00 62.75 60.99 1dkd n ILE 305 Cb 0.77 -0.31 -0.00 0.00 -1.74 0.00 0.00 39.64 38.35 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 -0.14 0.46 3.83 3.28 0.00 0.20 -5.04 105.19 107.77 1dkd n GLY 306 Ca 0.33 -0.91 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.84 4.16 -0.13 1.61 -1.94 -0.76 -4.96 119.30 115.44 1dkd s MET 307 Ca 0.00 0.92 0.02 0.00 -1.71 0.00 0.00 55.69 54.92 1dkd s MET 307 Cb 0.00 -2.39 0.00 0.00 2.01 0.00 0.00 34.83 34.45 1dkd s MET 307 CO 0.00 0.11 -0.21 -1.21 -0.01 0.00 0.00 175.02 173.70 1dkd s GLU 308 N -2.91 3.08 0.33 2.03 2.02 -1.26 -3.97 118.70 118.02 1dkd s GLU 308 Ca 0.56 -0.83 0.01 0.00 0.02 0.00 0.00 54.97 54.73 1dkd s GLU 308 Cb -0.11 -2.46 0.55 0.00 0.10 0.00 0.00 34.13 32.22 1dkd s GLU 308 CO 0.16 0.04 1.98 1.25 0.02 0.00 0.00 175.26 178.72 1dkd h LEU 309 N 7.17 0.83 -2.34 1.80 5.85 -1.94 -0.50 115.31 126.18 1dkd h LEU 309 Ca -0.29 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 1dkd h LEU 309 Cb 1.20 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 1dkd h LEU 309 CO 0.54 0.59 -0.02 -0.08 -0.34 0.00 0.00 178.44 179.13 1dkd h GLU 310 N 0.98 0.00 -0.44 1.25 4.81 -1.95 -1.80 114.58 117.42 1dkd h GLU 310 Ca 0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1dkd h GLU 310 Cb -0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.31 1dkd h GLU 310 CO -0.07 0.02 0.00 1.63 -0.73 0.00 0.00 179.01 179.87 1dkd n LYS 311 N -3.87 2.48 -1.98 1.92 5.02 -0.21 -4.73 118.16 116.78 1dkd n LYS 311 Ca -0.03 -2.26 -0.38 0.00 -2.02 0.00 0.00 58.31 53.63 1dkd n LYS 311 Cb 0.11 -1.51 0.02 0.00 -0.02 0.00 0.00 35.03 33.62 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 -1.43 2.93 0.38 7.82 0.00 -0.68 -5.00 121.76 125.78 1dkd s ALA 312 Ca 0.40 1.18 0.04 0.00 0.00 0.00 0.00 51.96 53.58 1dkd s ALA 312 Cb 0.23 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 1dkd s ALA 312 CO 0.31 -1.05 0.12 0.95 0.00 0.00 0.00 175.76 176.09 1dkd s THR 313 N -1.38 0.68 0.51 0.00 -4.23 -1.26 -4.37 115.64 105.58 1dkd s THR 313 Ca 0.67 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.35 1dkd s THR 313 Cb -0.36 -2.46 0.31 0.00 1.34 0.00 0.00 72.50 71.32 1dkd s THR 313 CO 0.43 0.00 2.09 -0.07 -0.54 0.00 0.00 174.62 176.53 1dkd h LEU 314 N 1.92 0.07 -1.67 4.79 3.38 -1.96 -1.43 115.31 120.42 1dkd h LEU 314 Ca -0.36 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.57 1dkd h LEU 314 Cb 1.26 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1dkd h LEU 314 CO 0.59 0.05 -0.19 -0.33 0.09 0.00 0.00 178.44 178.64 1dkd h GLU 315 N 0.08 0.00 0.00 1.13 5.08 -2.00 -2.18 114.58 116.68 1dkd h GLU 315 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1dkd h GLU 315 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1dkd h GLU 315 CO -0.01 0.19 -0.04 -0.25 -1.00 0.00 0.00 179.01 177.91 1dkd n ASP 316 N -3.99 0.38 -4.78 1.42 8.00 -0.54 -4.78 116.55 112.27 1dkd n ASP 316 Ca -0.02 0.49 -0.39 0.00 0.71 0.00 0.00 54.79 55.58 1dkd n ASP 316 Cb 0.28 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 40.74 1dkd n ASP 316 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1dkd s LEU 317 N -3.68 4.54 0.00 0.64 1.43 -0.82 -0.92 118.68 119.88 1dkd s LEU 317 Ca 0.12 1.71 -0.14 0.00 -1.03 0.00 0.00 54.13 54.80 1dkd s LEU 317 Cb 0.16 -3.49 0.21 0.00 0.03 0.00 0.00 46.19 43.10 1dkd s LEU 317 CO 0.57 0.14 1.27 0.61 0.23 0.00 0.00 176.35 179.18 1dkd n GLY 318 N 1.33 -1.11 3.30 -3.19 0.00 0.43 -4.38 105.19 101.58 1dkd n GLY 318 Ca -0.03 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 1dkd n GLY 318 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dkd s GLN 319 N -5.77 0.88 0.21 1.61 -0.21 -0.34 -1.17 119.66 114.86 1dkd s GLN 319 Ca 0.74 -0.38 -0.20 0.00 0.02 0.00 0.00 55.36 55.54 1dkd s GLN 319 Cb -0.02 0.39 0.04 0.00 1.00 0.00 0.00 33.01 34.41 1dkd s GLN 319 CO 0.51 -0.29 0.61 0.00 -2.12 0.00 0.00 175.29 174.00 1dkd s ALA 320 N -2.40 -1.21 -0.04 6.09 0.00 -1.20 -2.06 121.76 120.94 1dkd s ALA 320 Ca -0.06 -0.05 -0.24 0.00 0.00 0.00 0.00 51.96 51.61 1dkd s ALA 320 Cb -0.01 0.87 -0.19 0.00 0.00 0.00 0.00 23.12 23.79 1dkd s ALA 320 CO -0.02 -0.87 1.10 0.87 0.00 0.00 0.00 175.76 176.84 1dkd h LYS 321 N 2.08 -0.11 -3.99 0.00 1.79 -0.21 -3.21 116.57 112.92 1dkd h LYS 321 Ca -0.27 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.10 1dkd h LYS 321 Cb 1.27 0.03 -0.15 0.00 -1.58 0.00 0.00 32.23 31.80 1dkd h LYS 321 CO 0.33 0.38 -0.53 1.03 -1.08 0.00 0.00 179.45 179.58 1dkd s ARG 322 N -3.86 0.69 -0.03 3.15 0.52 -1.02 0.57 118.95 118.97 1dkd s ARG 322 Ca -0.15 -1.02 -0.00 0.00 -0.52 0.00 0.00 55.73 54.03 1dkd s ARG 322 Cb 0.01 0.26 0.03 0.00 0.52 0.00 0.00 34.95 35.77 1dkd s ARG 322 CO 0.60 -0.18 0.03 0.08 0.02 0.00 0.00 175.30 175.84 1dkd s VAL 323 N -3.63 0.04 -0.16 3.52 1.01 -0.62 -0.80 120.40 119.76 1dkd s VAL 323 Ca 0.04 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.25 1dkd s VAL 323 Cb 0.05 -0.19 0.02 0.00 0.00 0.00 0.00 36.38 36.26 1dkd s VAL 323 CO -0.09 0.14 -0.19 -0.69 0.00 0.00 0.00 175.10 174.27 1dkd s VAL 324 N 1.37 1.93 0.01 2.92 1.01 -0.11 -1.32 120.40 126.21 1dkd s VAL 324 Ca -0.05 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.14 1dkd s VAL 324 Cb -0.13 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1dkd s VAL 324 CO -0.03 0.52 -0.24 -0.63 0.00 0.00 0.00 175.10 174.73 1dkd s ILE 325 N 1.20 1.90 0.11 2.22 1.01 0.28 -0.72 121.20 127.21 1dkd s ILE 325 Ca 0.02 -1.15 0.02 0.00 0.00 0.00 0.00 60.65 59.54 1dkd s ILE 325 Cb -0.14 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.72 1dkd s ILE 325 CO -0.09 0.42 0.06 -0.46 0.00 0.00 0.00 174.94 174.87 1dkd n ASN 326 N 2.19 0.47 0.26 3.58 0.23 -0.61 0.53 115.26 121.90 1dkd n ASN 326 Ca -0.16 -1.65 0.09 0.00 -0.53 0.00 0.00 54.58 52.33 1dkd n ASN 326 Cb 0.52 0.39 0.66 0.00 -2.08 0.00 0.00 39.78 39.27 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 0.00 0.00 -3.83 3.64 -1.94 -2.51 116.57 111.93 1dkd h LYS 327 Ca -0.08 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.20 1dkd h LYS 327 Cb 0.36 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1dkd h LYS 327 CO 0.13 0.04 -1.49 -0.25 -2.27 0.00 0.00 179.45 175.61 1dkd n ASP 328 N -4.35 3.08 -4.23 4.20 8.00 -1.26 -3.84 116.55 118.15 1dkd n ASP 328 Ca -0.03 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.34 1dkd n ASP 328 Cb 0.13 0.89 -0.10 0.00 -0.02 0.00 0.00 41.12 42.02 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 -2.30 0.36 0.00 -3.53 -4.23 -1.21 -1.80 115.64 102.93 1dkd s THR 329 Ca -0.04 -1.97 0.05 0.00 -1.18 0.00 0.00 61.69 58.55 1dkd s THR 329 Cb 0.03 -2.34 -0.02 0.00 1.34 0.00 0.00 72.50 71.52 1dkd s THR 329 CO 0.33 -0.23 -0.17 -0.89 -0.54 0.00 0.00 174.62 173.12 1dkd s THR 330 N -3.88 1.32 -0.06 3.99 2.01 -0.79 -1.58 115.64 116.64 1dkd s THR 330 Ca 0.31 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.51 1dkd s THR 330 Cb 0.07 -1.12 0.02 0.00 0.01 0.00 0.00 72.50 71.49 1dkd s THR 330 CO 0.08 0.30 -0.04 -0.89 -0.69 0.00 0.00 174.62 173.38 1dkd s THR 331 N -0.50 0.58 -0.21 -0.82 2.01 0.11 -2.01 115.64 114.81 1dkd s THR 331 Ca 0.06 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 61.92 1dkd s THR 331 Cb -0.07 -0.65 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 1dkd s THR 331 CO -0.00 0.26 0.01 -0.63 -0.69 0.00 0.00 174.62 173.58 1dkd s ILE 332 N 1.38 3.99 -0.14 1.82 1.01 0.11 -0.94 121.20 128.44 1dkd s ILE 332 Ca -0.04 -0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.32 1dkd s ILE 332 Cb -0.13 -2.82 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 1dkd s ILE 332 CO -0.03 0.41 -0.12 -0.63 0.00 0.00 0.00 174.94 174.57 1dkd s ILE 333 N 1.14 3.11 -0.55 2.92 1.01 0.02 -1.73 121.20 127.12 1dkd s ILE 333 Ca 0.03 -0.64 -0.17 0.00 0.00 0.00 0.00 60.65 59.87 1dkd s ILE 333 Cb -0.14 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.04 1dkd s ILE 333 CO 0.02 0.52 0.64 0.47 0.00 0.00 0.00 174.94 176.58 1dkd n ASP 334 N 3.58 -6.88 -4.84 3.58 8.00 0.12 -1.59 116.55 118.52 1dkd n ASP 334 Ca -0.18 0.04 -0.32 0.00 0.71 0.00 0.00 54.79 55.04 1dkd n ASP 334 Cb 0.53 -3.91 0.01 0.00 -0.02 0.00 0.00 41.12 37.72 1dkd n ASP 334 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1dkd s GLY 335 N -2.44 1.87 0.00 0.44 0.00 -1.26 -1.36 107.32 104.57 1dkd s GLY 335 Ca 0.20 0.12 0.17 0.00 0.00 0.00 0.00 44.72 45.21 1dkd s GLY 335 CO 0.81 0.41 1.41 3.33 0.00 0.00 0.00 173.10 179.07