#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ikn h ALA 205 N 0.00 0.30 -0.04 3.52 0.00 -2.06 -2.37 119.26 118.61 3ikn h ALA 205 Ca 0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 3ikn h ALA 205 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ikn h ALA 205 CO 0.00 0.59 -0.41 0.66 0.00 0.00 0.00 179.25 180.09 3ikn h SER 206 N 0.45 0.10 0.11 0.00 4.64 -2.05 -2.65 113.55 114.15 3ikn h SER 206 Ca -0.03 -0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 61.12 3ikn h SER 206 Cb 1.28 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3ikn h SER 206 CO 0.14 0.50 -0.44 0.25 -0.87 0.00 0.00 176.83 176.41 3ikn h LEU 207 N 0.08 0.43 0.43 5.97 5.85 -1.96 -2.17 115.31 123.94 3ikn h LEU 207 Ca 0.01 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 3ikn h LEU 207 Cb 0.76 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.67 3ikn h LEU 207 CO 0.06 0.82 -0.21 -0.09 -0.34 0.00 0.00 178.44 178.68 3ikn h ARG 208 N 0.33 -0.56 -0.11 1.25 2.43 -1.07 -0.33 114.38 116.32 3ikn h ARG 208 Ca 0.03 0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3ikn h ARG 208 Cb 0.90 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.58 3ikn h ARG 208 CO 0.08 -0.28 0.09 -0.56 -1.51 0.00 0.00 179.97 177.79 3ikn h GLN 209 N -0.78 0.00 -0.28 0.20 3.07 -1.53 0.44 115.11 116.24 3ikn h GLN 209 Ca -0.06 0.00 -0.17 0.00 0.09 0.00 0.00 58.65 58.51 3ikn h GLN 209 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.10 3ikn h GLN 209 CO 0.10 0.00 -0.51 0.37 0.09 0.00 0.00 178.83 178.88 3ikn h GLN 210 N 0.00 0.84 -0.27 0.06 4.15 -1.08 -0.06 115.11 118.74 3ikn h GLN 210 Ca 0.05 -0.53 -0.18 0.00 0.77 0.00 0.00 58.65 58.77 3ikn h GLN 210 Cb 0.23 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.98 3ikn h GLN 210 CO -0.00 1.16 -0.54 0.28 -1.93 0.00 0.00 178.83 177.80 3ikn h VAL 211 N 0.61 1.28 -0.49 2.39 2.07 0.75 -1.37 116.25 121.50 3ikn h VAL 211 Ca 0.02 -1.74 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 3ikn h VAL 211 Cb 1.11 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 3ikn h VAL 211 CO 0.11 0.56 0.26 -0.08 0.02 0.00 0.00 177.57 178.44 3ikn h GLU 212 N 0.63 0.69 -0.12 1.57 4.57 -0.12 -1.51 114.58 120.30 3ikn h GLU 212 Ca 0.02 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 3ikn h GLU 212 Cb 1.14 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.59 3ikn h GLU 212 CO 0.12 0.56 -0.01 0.00 -1.18 0.00 0.00 179.01 178.49 3ikn h ALA 213 N 1.10 0.16 -0.60 2.92 0.00 -0.93 -2.65 119.26 119.25 3ikn h ALA 213 Ca 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3ikn h ALA 213 Cb 0.08 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3ikn h ALA 213 CO -0.03 -0.13 0.29 1.25 0.00 0.00 0.00 179.25 180.64 3ikn h LEU 214 N -0.08 0.76 -0.77 0.00 5.85 -1.18 -2.14 115.31 117.75 3ikn h LEU 214 Ca 0.03 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.55 3ikn h LEU 214 Cb 0.40 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3ikn h LEU 214 CO 0.01 0.65 -0.41 -0.61 -0.34 0.00 0.00 178.44 177.74 3ikn h GLN 215 N 0.85 0.44 -0.76 1.25 4.15 -1.24 0.19 115.11 119.98 3ikn h GLN 215 Ca 0.21 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 3ikn h GLN 215 Cb 0.08 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.74 3ikn h GLN 215 CO -0.03 0.77 0.28 0.78 -1.93 0.00 0.00 178.83 178.71 3ikn h GLY 216 N 1.13 1.23 1.02 2.39 0.00 -1.05 0.47 103.07 108.26 3ikn h GLY 216 Ca 0.03 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.60 3ikn h GLY 216 CO 0.07 0.65 0.09 1.46 0.00 0.00 0.00 176.54 178.81 3ikn h GLN 217 N 1.11 0.94 -0.58 4.80 4.20 -0.93 -1.35 115.11 123.31 3ikn h GLN 217 Ca 0.25 -0.25 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 3ikn h GLN 217 Cb 0.24 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3ikn h GLN 217 CO -0.02 0.90 -0.03 0.28 -0.67 0.00 0.00 178.83 179.30 3ikn h VAL 218 N 0.84 1.26 0.00 -0.54 2.07 -0.52 -0.72 116.25 118.64 3ikn h VAL 218 Ca 0.17 -1.17 -0.12 0.00 0.82 0.00 0.00 66.70 66.40 3ikn h VAL 218 Cb 0.42 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3ikn h VAL 218 CO 0.01 0.42 -0.56 1.56 0.02 0.00 0.00 177.57 179.02 3ikn h GLN 219 N 0.93 0.00 -0.25 1.57 4.20 -0.77 0.17 115.11 120.96 3ikn h GLN 219 Ca 0.16 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.70 3ikn h GLN 219 Cb 0.58 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 3ikn h GLN 219 CO 0.03 0.56 -0.54 0.45 -0.67 0.00 0.00 178.83 178.66 3ikn h HIS 220 N 0.00 0.94 -0.57 2.96 3.86 -1.00 -1.60 115.15 119.73 3ikn h HIS 220 Ca -0.01 -0.33 -0.07 0.00 -1.16 0.00 0.00 60.37 58.80 3ikn h HIS 220 Cb 1.02 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 3ikn h HIS 220 CO 0.00 1.12 0.07 1.25 0.86 0.00 0.00 177.93 181.23 3ikn h LEU 221 N 0.58 0.93 -0.62 2.43 5.85 -0.70 -1.20 115.31 122.58 3ikn h LEU 221 Ca 0.01 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.48 3ikn h LEU 221 Cb 1.12 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 3ikn h LEU 221 CO 0.11 0.97 0.40 1.56 -0.34 0.00 0.00 178.44 181.14 3ikn h GLN 222 N 0.86 0.77 -0.42 1.25 4.20 -0.50 0.12 115.11 121.40 3ikn h GLN 222 Ca 0.17 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 3ikn h GLN 222 Cb 0.45 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 3ikn h GLN 222 CO 0.02 0.51 0.11 0.00 -0.67 0.00 0.00 178.83 178.80 3ikn h ALA 223 N 1.25 0.56 -0.46 3.87 0.00 -1.01 -0.67 119.26 122.79 3ikn h ALA 223 Ca 0.24 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3ikn h ALA 223 Cb -0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3ikn h ALA 223 CO -0.07 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.41 3ikn h ALA 224 N 0.97 0.62 -0.51 0.00 0.00 -0.91 -2.22 119.26 117.21 3ikn h ALA 224 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3ikn h ALA 224 Cb 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3ikn h ALA 224 CO -0.00 0.42 0.27 0.35 0.00 0.00 0.00 179.25 180.29 3ikn h PHE 225 N 0.67 0.72 -0.90 0.00 3.57 -0.64 -1.33 116.94 119.03 3ikn h PHE 225 Ca 0.13 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.65 3ikn h PHE 225 Cb 0.50 -0.23 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 3ikn h PHE 225 CO 0.04 0.54 0.58 1.03 -2.23 0.00 0.00 178.31 178.26 3ikn h SER 226 N 0.69 0.95 -0.16 0.41 0.87 -0.96 0.64 113.55 115.99 3ikn h SER 226 Ca 0.18 -0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 3ikn h SER 226 Cb 0.07 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 3ikn h SER 226 CO -0.03 0.64 -0.02 -0.61 -0.53 0.00 0.00 176.83 176.29 3ikn h GLN 227 N 1.10 0.29 0.00 2.24 4.15 -1.08 -2.85 115.11 118.96 3ikn h GLN 227 Ca 0.36 -0.10 -0.05 0.00 0.77 0.00 0.00 58.65 59.64 3ikn h GLN 227 Cb 0.04 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 3ikn h GLN 227 CO -0.13 0.53 -0.24 1.88 -1.93 0.00 0.00 178.83 178.95 3ikn h TYR 228 N 0.01 0.00 -0.43 3.99 0.05 -0.82 -2.09 116.97 117.67 3ikn h TYR 228 Ca 0.04 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 3ikn h TYR 228 Cb 0.42 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 3ikn h TYR 228 CO 0.04 0.24 -0.14 -0.22 -1.05 0.00 0.00 178.16 177.03 3ikn h LYS 229 N 0.00 0.86 -0.62 4.88 3.64 -0.77 0.51 116.57 125.06 3ikn h LYS 229 Ca -0.00 -0.34 -0.05 0.00 -1.27 0.00 0.00 60.65 58.98 3ikn h LYS 229 Cb 0.48 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 3ikn h LYS 229 CO 0.03 0.98 0.20 0.87 -2.27 0.00 0.00 179.45 179.26 3ikn h LYS 230 N 0.68 0.97 -0.33 1.90 1.57 -1.24 -2.23 116.57 117.89 3ikn h LYS 230 Ca 0.11 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3ikn h LYS 230 Cb 0.69 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 3ikn h LYS 230 CO 0.05 0.85 0.19 0.28 -0.57 0.00 0.00 179.45 180.25 3ikn h VAL 231 N 0.90 1.12 -0.54 0.50 2.07 -1.17 -2.95 116.25 116.18 3ikn h VAL 231 Ca 0.20 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.50 3ikn h VAL 231 Cb 0.29 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 3ikn h VAL 231 CO -0.01 0.12 0.19 -0.08 0.02 0.00 0.00 177.57 177.82 3ikn h GLU 232 N 0.42 0.36 0.00 1.57 4.57 -0.59 -2.45 114.58 118.46 3ikn h GLU 232 Ca 0.12 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 3ikn h GLU 232 Cb 0.03 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.54 3ikn h GLU 232 CO -0.02 0.24 0.00 -0.07 -1.18 0.00 0.00 179.01 177.97 3ikn h LEU 233 N 0.37 0.00 -9.16 1.64 3.38 -1.25 -3.43 115.31 106.86 3ikn h LEU 233 Ca 0.26 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.64 3ikn h LEU 233 Cb 0.30 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.96 3ikn h LEU 233 CO -0.27 0.00 0.04 0.12 0.09 0.00 0.00 178.44 178.42 3ikn s PHE 234 N -3.44 3.41 -0.81 1.13 5.36 -0.92 -0.49 117.98 122.22 3ikn s PHE 234 Ca 0.03 0.90 0.09 0.00 -0.96 0.00 0.00 56.93 57.00 3ikn s PHE 234 Cb 0.09 -2.73 0.26 0.00 -0.34 0.00 0.00 43.02 40.30 3ikn s PHE 234 CO 0.43 -0.09 1.21 -0.35 -1.46 0.00 0.00 175.22 174.95 3ikn n PRO 235 N 4.71 2.81 -0.28 10.12 -0.04 -1.26 -4.90 135.00 146.16 3ikn n PRO 235 Ca -0.03 -1.94 0.10 0.00 -0.04 0.00 0.00 63.50 61.58 3ikn n PRO 235 Cb 0.50 -1.23 0.25 0.00 -0.04 0.00 0.00 33.50 32.98 3ikn n PRO 235 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ikn n ASN 236 N 0.38 3.53 -4.32 3.54 3.02 -1.06 -4.99 115.26 115.35 3ikn n ASN 236 Ca 0.10 -1.98 -0.17 0.00 -0.03 0.00 0.00 54.58 52.50 3ikn n ASN 236 Cb 0.40 -0.36 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 3ikn n ASN 236 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3ikn s GLY 237 N -1.08 1.39 -0.12 7.41 0.00 0.36 -1.37 107.32 113.92 3ikn s GLY 237 Ca 0.39 -1.67 -0.06 0.00 0.00 0.00 0.00 44.72 43.39 3ikn s GLY 237 CO 0.28 -1.68 0.28 1.20 0.00 0.00 0.00 173.10 173.17 3ikn s GLN 238 N -3.76 0.24 -0.09 2.90 -1.52 0.01 -4.70 119.66 112.75 3ikn s GLN 238 Ca 0.23 0.58 -0.03 0.00 -1.95 0.00 0.00 55.36 54.19 3ikn s GLN 238 Cb 0.03 -0.10 -0.04 0.00 -0.22 0.00 0.00 33.01 32.68 3ikn s GLN 238 CO 0.06 -0.17 0.06 -1.54 -0.25 0.00 0.00 175.29 173.46 3ikn s SER 239 N 1.32 5.72 -0.19 5.90 1.04 -1.26 -0.54 113.70 125.69 3ikn s SER 239 Ca -0.09 0.26 -0.04 0.00 0.48 0.00 0.00 55.95 56.56 3ikn s SER 239 Cb -0.10 -1.71 0.10 0.00 0.10 0.00 0.00 66.02 64.40 3ikn s SER 239 CO -0.09 0.37 0.32 0.54 0.98 0.00 0.00 173.24 175.36 3ikn s VAL 240 N -0.99 -0.50 0.00 5.02 0.11 -0.28 -5.02 120.40 118.75 3ikn s VAL 240 Ca 0.15 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.27 3ikn s VAL 240 Cb -0.12 -0.65 0.00 0.00 -1.53 0.00 0.00 36.38 34.08 3ikn s VAL 240 CO 0.05 -0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.40 3ikn n GLY 241 N 5.36 2.60 1.07 6.54 0.00 -1.26 -1.42 105.19 118.08 3ikn n GLY 241 Ca -0.06 -0.34 0.11 0.00 0.00 0.00 0.00 46.02 45.73 3ikn n GLY 241 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3ikn n GLU 242 N 13.48 2.38 -3.85 1.61 1.02 -1.26 -4.93 120.64 129.09 3ikn n GLU 242 Ca 0.00 -2.10 -0.33 0.00 -0.02 0.00 0.00 57.16 54.71 3ikn n GLU 242 Cb 0.00 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 29.88 3ikn n GLU 242 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3ikn s LYS 243 N -1.44 3.49 -0.09 3.49 2.20 -0.51 -5.02 119.74 121.86 3ikn s LYS 243 Ca 0.39 -0.28 0.01 0.00 -0.36 0.00 0.00 55.97 55.73 3ikn s LYS 243 Cb 0.22 -3.05 0.02 0.00 -1.51 0.00 0.00 37.83 33.51 3ikn s LYS 243 CO 0.30 0.63 -0.10 0.42 -0.36 0.00 0.00 175.35 176.24 3ikn s ILE 244 N -1.41 1.08 -0.13 5.43 1.01 -0.76 -1.12 121.20 125.30 3ikn s ILE 244 Ca 0.31 -0.39 -0.07 0.00 0.00 0.00 0.00 60.65 60.51 3ikn s ILE 244 Cb -0.13 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 3ikn s ILE 244 CO 0.21 0.36 0.11 -0.36 0.00 0.00 0.00 174.94 175.26 3ikn s PHE 245 N 1.17 3.47 -0.07 3.97 0.08 0.30 -0.60 117.98 126.30 3ikn s PHE 245 Ca -0.05 0.40 -0.03 0.00 0.12 0.00 0.00 56.93 57.37 3ikn s PHE 245 Cb -0.14 -1.96 0.03 0.00 -0.57 0.00 0.00 43.02 40.39 3ikn s PHE 245 CO -0.02 0.58 0.15 0.21 -0.10 0.00 0.00 175.22 176.04 3ikn s LYS 246 N -0.69 0.12 0.07 0.44 2.20 -0.10 -0.81 119.74 120.96 3ikn s LYS 246 Ca 0.13 0.34 -0.06 0.00 -0.36 0.00 0.00 55.97 56.02 3ikn s LYS 246 Cb -0.12 -0.11 -0.05 0.00 -1.51 0.00 0.00 37.83 36.04 3ikn s LYS 246 CO 0.03 -0.13 0.31 -0.08 -0.36 0.00 0.00 175.35 175.12 3ikn s THR 247 N 0.91 5.24 -0.58 3.43 -1.32 -0.47 -0.97 115.64 121.88 3ikn s THR 247 Ca -0.07 0.10 0.25 0.00 -1.21 0.00 0.00 61.69 60.76 3ikn s THR 247 Cb -0.09 -3.60 0.29 0.00 -1.51 0.00 0.00 72.50 67.59 3ikn s THR 247 CO -0.05 0.23 1.66 0.00 -2.21 0.00 0.00 174.62 174.25 3ikn h ALA 248 N 3.48 0.96 0.00 11.08 0.00 -1.57 -3.48 119.26 129.73 3ikn h ALA 248 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3ikn h ALA 248 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3ikn h ALA 248 CO 0.69 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.35 3ikn n GLY 249 N 1.22 1.03 3.37 0.00 0.00 -1.26 -5.04 105.19 104.50 3ikn n GLY 249 Ca 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3ikn n GLY 249 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3ikn s PHE 250 N -2.78 1.69 0.11 1.61 -0.12 -1.26 -5.02 117.98 112.21 3ikn s PHE 250 Ca 0.00 -1.11 0.03 0.00 -0.05 0.00 0.00 56.93 55.80 3ikn s PHE 250 Cb 0.00 -1.04 -0.04 0.00 -0.63 0.00 0.00 43.02 41.32 3ikn s PHE 250 CO 0.00 -0.22 0.16 0.14 -0.05 0.00 0.00 175.22 175.24 3ikn s VAL 251 N -3.59 4.85 0.13 -2.49 -7.23 -1.26 -1.57 120.40 109.25 3ikn s VAL 251 Ca 0.37 -0.74 -0.19 0.00 -1.81 0.00 0.00 61.98 59.62 3ikn s VAL 251 Cb 0.08 -3.41 0.05 0.00 0.56 0.00 0.00 36.38 33.66 3ikn s VAL 251 CO 0.14 0.04 0.47 -0.54 -0.31 0.00 0.00 175.10 174.90 3ikn s LYS 252 N -2.72 1.14 0.82 4.82 -0.14 -0.40 -4.83 119.74 118.43 3ikn s LYS 252 Ca 0.32 -0.61 -0.11 0.00 -1.36 0.00 0.00 55.97 54.21 3ikn s LYS 252 Cb -0.12 0.51 0.09 0.00 -1.68 0.00 0.00 37.83 36.63 3ikn s LYS 252 CO 0.25 -0.46 1.09 -2.14 -0.76 0.00 0.00 175.35 173.33 3ikn s PRO 253 N -3.73 1.85 0.15 -1.68 0.02 -1.26 -1.71 135.00 128.64 3ikn s PRO 253 Ca 0.02 0.89 -0.24 0.00 0.02 0.00 0.00 61.00 61.68 3ikn s PRO 253 Cb 0.01 -1.87 0.01 0.00 0.02 0.00 0.00 34.50 32.67 3ikn s PRO 253 CO -0.12 -1.85 1.61 0.35 -0.33 0.00 0.00 177.00 176.66 3ikn h PHE 254 N -1.27 -0.85 -0.63 6.54 3.57 -1.50 -0.83 116.94 121.97 3ikn h PHE 254 Ca -0.47 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.16 3ikn h PHE 254 Cb 1.26 0.41 -0.07 0.00 2.79 0.00 0.00 35.95 40.34 3ikn h PHE 254 CO 0.49 -0.38 0.29 1.15 -2.23 0.00 0.00 178.31 177.63 3ikn h THR 255 N -0.33 0.85 -0.55 4.41 2.02 -1.93 0.24 112.91 117.62 3ikn h THR 255 Ca 0.13 -0.18 -0.10 0.00 0.77 0.00 0.00 66.41 67.03 3ikn h THR 255 Cb 0.53 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 3ikn h THR 255 CO -0.41 0.09 -0.04 -0.33 0.37 0.00 0.00 175.52 175.20 3ikn h GLU 256 N 0.52 1.00 -0.47 6.66 3.07 -1.86 -1.89 114.58 121.61 3ikn h GLU 256 Ca 0.31 -0.34 -0.04 0.00 -0.50 0.00 0.00 59.36 58.79 3ikn h GLU 256 Cb 0.32 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 3ikn h GLU 256 CO -0.26 1.02 0.14 0.00 -1.40 0.00 0.00 179.01 178.51 3ikn h ALA 257 N 0.95 0.62 -0.76 3.43 0.00 -0.32 -1.93 119.26 121.25 3ikn h ALA 257 Ca 0.15 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3ikn h ALA 257 Cb 0.59 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3ikn h ALA 257 CO 0.04 0.28 0.48 0.37 0.00 0.00 0.00 179.25 180.41 3ikn h GLN 258 N 0.63 1.01 -0.53 0.00 4.15 -0.42 -2.44 115.11 117.50 3ikn h GLN 258 Ca 0.15 -0.08 -0.07 0.00 0.77 0.00 0.00 58.65 59.43 3ikn h GLN 258 Cb 0.28 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 3ikn h GLN 258 CO -0.00 0.70 0.08 1.25 -1.93 0.00 0.00 178.83 178.92 3ikn h LEU 259 N 1.03 0.86 -0.57 -2.39 5.85 -1.12 -1.61 115.31 117.35 3ikn h LEU 259 Ca 0.27 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.76 3ikn h LEU 259 Cb -0.07 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.69 3ikn h LEU 259 CO -0.05 0.90 0.35 -0.07 -0.34 0.00 0.00 178.44 179.23 3ikn h LEU 260 N 0.77 0.56 -0.26 2.25 3.38 -1.04 0.22 115.31 121.19 3ikn h LEU 260 Ca 0.16 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 3ikn h LEU 260 Cb 0.42 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3ikn h LEU 260 CO 0.01 0.39 -0.08 0.00 0.09 0.00 0.00 178.44 178.86 3ikn h THR 262 N 0.27 1.26 0.00 0.00 1.35 -1.10 -0.47 112.91 114.21 3ikn h THR 262 Ca 0.07 -0.99 -0.03 0.00 -0.55 0.00 0.00 66.41 64.91 3ikn h THR 262 Cb 0.56 0.79 -0.00 0.00 -1.73 0.00 0.00 68.15 67.77 3ikn h THR 262 CO 0.03 0.36 -0.14 1.56 -0.25 0.00 0.00 175.52 177.08 3ikn h GLN 263 N 0.84 0.00 -0.04 4.72 4.20 -0.96 -1.54 115.11 122.33 3ikn h GLN 263 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 3ikn h GLN 263 Cb 0.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 3ikn h GLN 263 CO 0.01 0.14 0.00 0.00 -0.67 0.00 0.00 178.83 178.31 3ikn n ALA 264 N -2.33 2.60 -0.56 3.87 0.00 -0.92 -4.90 120.51 118.27 3ikn n ALA 264 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3ikn n ALA 264 Cb 0.24 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3ikn n ALA 264 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ikn n GLY 265 N 1.04 0.69 0.00 0.00 0.00 -0.58 -5.03 105.19 101.31 3ikn n GLY 265 Ca 0.18 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3ikn n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ikn n GLY 266 N -2.56 5.37 3.73 -0.02 0.00 -0.23 -4.97 105.19 106.51 3ikn n GLY 266 Ca 0.00 -1.32 -0.08 0.00 0.00 0.00 0.00 46.02 44.62 3ikn n GLY 266 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3ikn s GLN 267 N 2.88 1.66 0.60 1.61 -2.07 -1.05 -3.55 119.66 119.74 3ikn s GLN 267 Ca 0.00 -1.02 -0.19 0.00 -1.82 0.00 0.00 55.36 52.33 3ikn s GLN 267 Cb 0.00 0.56 -0.03 0.00 -1.09 0.00 0.00 33.01 32.45 3ikn s GLN 267 CO 0.00 -0.74 1.24 -0.51 -1.32 0.00 0.00 175.29 173.96 3ikn s LEU 268 N -2.93 3.66 -0.05 2.60 1.43 -1.26 -0.24 118.68 121.89 3ikn s LEU 268 Ca 0.13 2.46 -0.39 0.00 -1.03 0.00 0.00 54.13 55.31 3ikn s LEU 268 Cb -0.04 -4.58 -0.17 0.00 0.03 0.00 0.00 46.19 41.43 3ikn s LEU 268 CO 0.06 -1.67 1.39 0.00 0.23 0.00 0.00 176.35 176.35 3ikn n ALA 269 N -1.61 -1.38 -3.37 4.21 0.00 -0.47 -4.25 120.51 113.65 3ikn n ALA 269 Ca 0.14 0.51 -0.26 0.00 0.00 0.00 0.00 53.44 53.83 3ikn n ALA 269 Cb 0.49 -2.03 -0.08 0.00 0.00 0.00 0.00 19.45 17.82 3ikn n ALA 269 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3ikn n SER 270 N 3.04 1.40 -4.67 0.00 7.64 -1.26 -1.37 113.62 118.39 3ikn n SER 270 Ca 0.21 -2.91 -0.42 0.00 1.01 0.00 0.00 58.87 56.76 3ikn n SER 270 Cb 0.14 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.66 3ikn n SER 270 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3ikn s PRO 271 N -1.38 4.14 0.00 1.43 0.04 -1.26 -4.87 135.00 133.10 3ikn s PRO 271 Ca 0.35 2.61 0.14 0.00 0.04 0.00 0.00 61.00 64.13 3ikn s PRO 271 Cb 0.12 -4.00 0.34 0.00 0.04 0.00 0.00 34.50 31.00 3ikn s PRO 271 CO -0.10 -0.92 1.25 0.54 0.04 0.00 0.00 177.00 177.81 3ikn n ARG 272 N 7.00 2.48 -3.82 4.56 1.74 -1.26 -4.81 116.66 122.54 3ikn n ARG 272 Ca 0.19 -2.04 -0.07 0.00 -0.77 0.00 0.00 57.85 55.16 3ikn n ARG 272 Cb 0.40 -1.33 -0.02 0.00 -1.02 0.00 0.00 32.46 30.49 3ikn n ARG 272 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3ikn s SER 273 N -1.04 -0.27 0.27 0.55 1.04 -1.26 -4.55 113.70 108.44 3ikn s SER 273 Ca 0.27 -0.55 -0.02 0.00 0.48 0.00 0.00 55.95 56.13 3ikn s SER 273 Cb 0.15 0.70 0.37 0.00 0.10 0.00 0.00 66.02 67.33 3ikn s SER 273 CO 0.20 -1.28 1.81 0.00 0.98 0.00 0.00 173.24 174.95 3ikn h ALA 274 N 2.00 1.19 -0.39 5.32 0.00 -1.98 -0.14 119.26 125.26 3ikn h ALA 274 Ca -0.20 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3ikn h ALA 274 Cb 1.25 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3ikn h ALA 274 CO 0.24 0.56 0.12 0.00 0.00 0.00 0.00 179.25 180.17 3ikn h ALA 275 N 1.32 0.51 -0.42 0.00 0.00 -1.99 -0.38 119.26 118.30 3ikn h ALA 275 Ca 0.18 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3ikn h ALA 275 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3ikn h ALA 275 CO -0.00 0.16 -0.23 0.93 0.00 0.00 0.00 179.25 180.11 3ikn h GLU 276 N 0.48 0.86 -0.67 0.00 5.08 -1.89 -2.17 114.58 116.28 3ikn h GLU 276 Ca 0.12 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.08 3ikn h GLU 276 Cb 0.27 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 3ikn h GLU 276 CO -0.00 1.00 0.24 -0.97 -1.00 0.00 0.00 179.01 178.28 3ikn h ASN 277 N 0.75 0.93 -0.63 1.42 -1.24 -0.77 -1.14 115.58 114.89 3ikn h ASN 277 Ca 0.10 -0.14 -0.09 0.00 0.71 0.00 0.00 56.30 56.88 3ikn h ASN 277 Cb 0.77 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 39.55 3ikn h ASN 277 CO 0.06 0.84 0.05 0.00 -1.29 0.00 0.00 177.43 177.10 3ikn h ALA 278 N 1.29 0.88 -0.39 1.57 0.00 -0.86 0.16 119.26 121.91 3ikn h ALA 278 Ca 0.22 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3ikn h ALA 278 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3ikn h ALA 278 CO -0.01 0.67 0.03 0.00 0.00 0.00 0.00 179.25 179.94 3ikn h ALA 279 N 1.04 0.52 -0.75 0.00 0.00 -0.98 -2.66 119.26 116.43 3ikn h ALA 279 Ca 0.19 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3ikn h ALA 279 Cb 0.50 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ikn h ALA 279 CO 0.02 0.26 0.24 1.25 0.00 0.00 0.00 179.25 181.02 3ikn h LEU 280 N 0.50 1.09 -1.32 0.00 5.85 -1.04 -2.64 115.31 117.75 3ikn h LEU 280 Ca 0.11 -0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.73 3ikn h LEU 280 Cb 0.42 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 3ikn h LEU 280 CO 0.01 1.00 0.53 -0.61 -0.34 0.00 0.00 178.44 179.04 3ikn h GLN 281 N 1.11 0.74 -0.72 1.25 4.15 -0.70 -1.96 115.11 118.99 3ikn h GLN 281 Ca 0.24 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.68 3ikn h GLN 281 Cb 0.30 -0.17 -0.06 0.00 0.21 0.00 0.00 27.48 27.77 3ikn h GLN 281 CO -0.01 0.49 0.41 1.96 -1.93 0.00 0.00 178.83 179.76 3ikn h GLN 282 N 0.77 0.73 -0.39 1.69 4.20 -1.13 0.87 115.11 121.84 3ikn h GLN 282 Ca 0.37 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.91 3ikn h GLN 282 Cb 0.43 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 3ikn h GLN 282 CO -0.15 0.48 -0.28 -0.07 -0.67 0.00 0.00 178.83 178.14 3ikn h LEU 283 N 0.75 0.85 -0.54 1.46 3.38 -1.44 0.25 115.31 120.02 3ikn h LEU 283 Ca 0.33 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3ikn h LEU 283 Cb 0.21 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3ikn h LEU 283 CO -0.19 1.07 0.20 0.58 0.09 0.00 0.00 178.44 180.19 3ikn h VAL 284 N 0.70 1.23 -0.40 1.22 2.07 -1.01 -1.62 116.25 118.44 3ikn h VAL 284 Ca 0.08 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.81 3ikn h VAL 284 Cb 0.82 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3ikn h VAL 284 CO 0.07 0.27 -0.04 0.58 0.02 0.00 0.00 177.57 178.47 3ikn h VAL 285 N 0.74 1.27 -0.91 2.57 2.07 -0.70 0.23 116.25 121.52 3ikn h VAL 285 Ca 0.18 -1.09 0.03 0.00 0.82 0.00 0.00 66.70 66.64 3ikn h VAL 285 Cb 0.23 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 3ikn h VAL 285 CO -0.01 0.37 0.59 0.00 0.02 0.00 0.00 177.57 178.54 3ikn h ALA 286 N 0.87 1.19 0.00 1.67 0.00 -0.72 -2.12 119.26 120.15 3ikn h ALA 286 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ikn h ALA 286 Cb 0.54 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3ikn h ALA 286 CO 0.03 0.47 -0.59 1.63 0.00 0.00 0.00 179.25 180.79 3ikn n LYS 287 N -4.50 0.11 -3.74 0.00 4.76 -0.63 -4.95 118.16 109.21 3ikn n LYS 287 Ca 0.11 0.02 -0.25 0.00 -2.87 0.00 0.00 58.31 55.32 3ikn n LYS 287 Cb 0.08 -1.56 0.05 0.00 -1.84 0.00 0.00 35.03 31.75 3ikn n LYS 287 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3ikn n ASN 288 N -1.72 -4.14 -3.67 4.39 5.15 0.74 -4.98 115.26 111.02 3ikn n ASN 288 Ca 0.04 -0.71 -0.15 0.00 -0.60 0.00 0.00 54.58 53.16 3ikn n ASN 288 Cb 0.38 -4.35 -0.15 0.00 -0.53 0.00 0.00 39.78 35.13 3ikn n ASN 288 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3ikn s GLU 289 N -6.27 0.09 0.54 1.20 0.41 -0.89 -5.04 118.70 108.73 3ikn s GLU 289 Ca 0.43 0.62 -0.22 0.00 -0.41 0.00 0.00 54.97 55.39 3ikn s GLU 289 Cb -0.21 -0.17 -0.06 0.00 -1.78 0.00 0.00 34.13 31.91 3ikn s GLU 289 CO 0.79 -0.28 1.29 0.00 -0.49 0.00 0.00 175.26 176.57 3ikn n ALA 290 N 5.20 1.33 -2.44 5.21 0.00 -1.26 -4.64 120.51 123.92 3ikn n ALA 290 Ca -0.08 0.13 -0.23 0.00 0.00 0.00 0.00 53.44 53.26 3ikn n ALA 290 Cb 0.50 -2.31 -0.11 0.00 0.00 0.00 0.00 19.45 17.53 3ikn n ALA 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ikn s ALA 291 N -1.31 2.32 0.35 0.00 0.00 -0.89 -0.95 121.76 121.28 3ikn s ALA 291 Ca 0.71 -1.63 -0.22 0.00 0.00 0.00 0.00 51.96 50.82 3ikn s ALA 291 Cb -0.43 -0.23 -0.10 0.00 0.00 0.00 0.00 23.12 22.36 3ikn s ALA 291 CO 0.50 0.29 0.89 -0.06 0.00 0.00 0.00 175.76 177.37 3ikn s PHE 292 N -2.12 3.50 0.52 0.00 0.08 -1.08 -0.52 117.98 118.37 3ikn s PHE 292 Ca 0.21 1.59 0.08 0.00 0.12 0.00 0.00 56.93 58.93 3ikn s PHE 292 Cb -0.06 -2.80 0.05 0.00 -0.57 0.00 0.00 43.02 39.64 3ikn s PHE 292 CO 0.09 0.09 0.62 -0.51 -0.10 0.00 0.00 175.22 175.42 3ikn s LEU 293 N -2.59 3.17 0.32 -0.37 1.43 0.06 -4.46 118.68 116.24 3ikn s LEU 293 Ca 0.54 -0.83 0.22 0.00 -1.03 0.00 0.00 54.13 53.03 3ikn s LEU 293 Cb -0.14 -1.80 0.17 0.00 0.03 0.00 0.00 46.19 44.46 3ikn s LEU 293 CO 0.18 -1.10 1.36 0.77 0.23 0.00 0.00 176.35 177.80 3ikn h SER 294 N 0.49 0.00 -3.93 2.29 4.64 -1.40 -3.43 113.55 112.20 3ikn h SER 294 Ca -0.35 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.49 3ikn h SER 294 Cb 1.29 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.39 3ikn h SER 294 CO 0.47 0.09 0.42 -0.04 -0.87 0.00 0.00 176.83 176.89 3ikn s MET 295 N -3.22 4.25 0.14 4.77 -1.94 -1.26 -4.53 119.30 117.51 3ikn s MET 295 Ca 0.04 1.55 -0.07 0.00 -1.71 0.00 0.00 55.69 55.50 3ikn s MET 295 Cb 0.07 -2.65 -0.01 0.00 2.01 0.00 0.00 34.83 34.24 3ikn s MET 295 CO 0.73 -0.07 0.22 0.95 -0.01 0.00 0.00 175.02 176.83 3ikn s THR 296 N -1.57 0.10 -0.26 2.05 -4.23 -0.94 -3.65 115.64 107.13 3ikn s THR 296 Ca 0.55 -1.42 0.11 0.00 -1.18 0.00 0.00 61.69 59.75 3ikn s THR 296 Cb -0.24 -1.73 0.46 0.00 1.34 0.00 0.00 72.50 72.34 3ikn s THR 296 CO 0.30 -0.44 1.18 -0.90 -0.54 0.00 0.00 174.62 174.22 3ikn n ASP 297 N -0.15 3.65 -0.14 3.99 5.75 -0.90 -1.12 116.55 127.63 3ikn n ASP 297 Ca -0.09 -3.44 -0.07 0.00 -0.01 0.00 0.00 54.79 51.18 3ikn n ASP 297 Cb 0.63 -0.39 0.10 0.00 -1.03 0.00 0.00 41.12 40.42 3ikn n ASP 297 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 3ikn h SER 298 N 1.97 0.86 -0.00 -1.12 0.02 -1.85 -3.13 113.55 110.30 3ikn h SER 298 Ca 0.20 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.90 3ikn h SER 298 Cb 1.42 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 3ikn h SER 298 CO 0.50 0.95 -0.00 0.50 -1.14 0.00 0.00 176.83 177.64 3ikn h LYS 299 N 0.80 0.01 -3.68 3.45 3.64 -1.89 -3.42 116.57 115.49 3ikn h LYS 299 Ca 0.14 -0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.97 3ikn h LYS 299 Cb 0.55 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.98 3ikn h LYS 299 CO 0.03 0.50 -0.77 0.99 -2.27 0.00 0.00 179.45 177.93 3ikn s THR 300 N -4.24 0.75 0.06 1.00 2.01 -1.23 -5.11 115.64 108.89 3ikn s THR 300 Ca -0.16 -0.82 -0.37 0.00 0.31 0.00 0.00 61.69 60.65 3ikn s THR 300 Cb 0.02 -1.27 -0.16 0.00 0.01 0.00 0.00 72.50 71.09 3ikn s THR 300 CO 0.68 -0.28 1.40 1.21 -0.69 0.00 0.00 174.62 176.94 3ikn n GLU 301 N 4.95 1.25 0.00 4.92 4.07 -1.18 -0.92 120.64 133.72 3ikn n GLU 301 Ca -0.08 0.45 0.00 0.00 -0.06 0.00 0.00 57.16 57.47 3ikn n GLU 301 Cb 0.46 -2.11 0.00 0.00 -0.06 0.00 0.00 31.44 29.72 3ikn n GLU 301 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3ikn n GLY 302 N 2.75 1.88 3.13 8.31 0.00 -1.26 -5.00 105.19 115.00 3ikn n GLY 302 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3ikn n GLY 302 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ikn s LYS 303 N -0.52 2.21 0.13 1.61 2.36 -0.10 -5.08 119.74 120.35 3ikn s LYS 303 Ca 0.00 -1.98 -0.29 0.00 -2.55 0.00 0.00 55.97 51.15 3ikn s LYS 303 Cb 0.00 -3.67 -0.07 0.00 -1.05 0.00 0.00 37.83 33.04 3ikn s LYS 303 CO 0.00 -1.12 0.92 -0.06 1.55 0.00 0.00 175.35 176.65 3ikn s PHE 304 N 0.89 3.85 0.09 4.03 0.40 -1.26 -4.28 117.98 121.70 3ikn s PHE 304 Ca 0.10 1.78 0.01 0.00 -0.60 0.00 0.00 56.93 58.22 3ikn s PHE 304 Cb -0.23 -3.00 -0.04 0.00 0.51 0.00 0.00 43.02 40.27 3ikn s PHE 304 CO -0.04 0.29 -0.04 0.95 0.70 0.00 0.00 175.22 177.08 3ikn s THR 305 N -0.32 0.53 0.77 0.64 -4.23 -0.27 -3.24 115.64 109.51 3ikn s THR 305 Ca 0.44 -1.91 -0.11 0.00 -1.18 0.00 0.00 61.69 58.93 3ikn s THR 305 Cb -0.24 -1.71 0.06 0.00 1.34 0.00 0.00 72.50 71.96 3ikn s THR 305 CO 0.29 -0.84 1.14 -0.31 -0.54 0.00 0.00 174.62 174.36 3ikn s TYR 306 N -3.73 3.06 0.55 3.99 2.02 -0.27 -2.21 117.35 120.75 3ikn s TYR 306 Ca 0.13 0.81 0.32 0.00 -0.37 0.00 0.00 57.07 57.96 3ikn s TYR 306 Cb 0.06 -3.34 1.48 0.00 -0.40 0.00 0.00 41.96 39.77 3ikn s TYR 306 CO -0.05 -1.56 1.86 -1.35 -1.57 0.00 0.00 175.55 172.88 3ikn h PRO 307 N -0.89 0.00 0.00 -1.71 0.11 -1.90 0.19 132.00 127.80 3ikn h PRO 307 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3ikn h PRO 307 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3ikn h PRO 307 CO 0.65 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.69 3ikn n THR 308 N -4.13 0.69 0.00 -1.15 -2.24 -1.26 -4.89 114.28 101.29 3ikn n THR 308 Ca 0.18 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 3ikn n THR 308 Cb 0.98 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 3ikn n THR 308 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ikn n GLY 309 N 0.77 0.23 3.77 3.38 0.00 0.68 -5.07 105.19 108.95 3ikn n GLY 309 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3ikn n GLY 309 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ikn s GLU 310 N -0.91 4.33 0.54 1.61 2.12 -1.26 -4.72 118.70 120.40 3ikn s GLU 310 Ca 0.00 1.99 -0.18 0.00 0.36 0.00 0.00 54.97 57.14 3ikn s GLU 310 Cb 0.00 -2.97 -0.06 0.00 0.26 0.00 0.00 34.13 31.36 3ikn s GLU 310 CO 0.00 -0.13 1.06 -1.12 -0.54 0.00 0.00 175.26 174.53 3ikn s SER 311 N -0.79 6.00 0.36 -1.70 0.01 -1.26 -1.11 113.70 115.20 3ikn s SER 311 Ca 0.50 1.94 -0.27 0.00 1.31 0.00 0.00 55.95 59.44 3ikn s SER 311 Cb -0.35 -2.55 -0.12 0.00 0.21 0.00 0.00 66.02 63.21 3ikn s SER 311 CO 0.45 -1.02 1.20 0.18 0.41 0.00 0.00 173.24 174.46 3ikn n LEU 312 N -1.43 3.22 -0.37 2.44 4.77 -1.20 -4.85 117.00 119.58 3ikn n LEU 312 Ca 0.10 1.16 0.05 0.00 -0.03 0.00 0.00 56.01 57.29 3ikn n LEU 312 Cb 0.52 -1.44 0.03 0.00 -2.33 0.00 0.00 43.42 40.21 3ikn n LEU 312 CO 0.43 -0.82 0.36 1.33 -1.33 0.00 0.00 177.39 177.36 3ikn n VAL 313 N 0.08 0.00 -3.58 4.08 0.24 -1.26 -4.99 118.33 112.90 3ikn n VAL 313 Ca 0.07 -0.47 -0.14 0.00 -2.04 0.00 0.00 64.34 61.75 3ikn n VAL 313 Cb 0.37 1.19 -0.06 0.00 -1.47 0.00 0.00 33.84 33.87 3ikn n VAL 313 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 3ikn s TYR 314 N -1.03 -0.63 0.06 6.34 5.04 -1.26 -4.95 117.35 120.93 3ikn s TYR 314 Ca 0.11 1.32 -0.16 0.00 -2.44 0.00 0.00 57.07 55.90 3ikn s TYR 314 Cb 0.09 0.36 0.03 0.00 0.35 0.00 0.00 41.96 42.79 3ikn s TYR 314 CO 0.17 -0.43 0.37 -1.54 -1.34 0.00 0.00 175.55 172.78 3ikn s SER 315 N -0.42 -0.21 -0.34 4.32 1.04 -1.26 -4.94 113.70 111.88 3ikn s SER 315 Ca -0.04 -0.15 0.16 0.00 0.48 0.00 0.00 55.95 56.40 3ikn s SER 315 Cb -0.03 0.41 0.43 0.00 0.10 0.00 0.00 66.02 66.94 3ikn s SER 315 CO 0.03 -0.69 1.00 -3.20 0.98 0.00 0.00 173.24 171.36 3ikn n ASN 316 N 0.36 0.71 -4.76 7.02 5.15 -1.26 -5.08 115.26 117.39 3ikn n ASN 316 Ca -0.18 -2.73 -0.41 0.00 -0.60 0.00 0.00 54.58 50.66 3ikn n ASN 316 Cb 0.61 -0.21 -0.01 0.00 -0.53 0.00 0.00 39.78 39.64 3ikn n ASN 316 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 3ikn n TRP 317 N -0.10 2.95 -1.46 1.20 7.02 -1.26 -0.19 117.44 125.59 3ikn n TRP 317 Ca 0.09 0.38 -0.31 0.00 -1.02 0.00 0.00 57.50 56.63 3ikn n TRP 317 Cb 0.80 -2.56 0.07 0.00 -2.42 0.00 0.00 31.31 27.20 3ikn n TRP 317 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3ikn s ALA 318 N -0.71 2.49 0.22 6.99 0.00 0.32 -4.68 121.76 126.39 3ikn s ALA 318 Ca 0.57 0.19 -0.32 0.00 0.00 0.00 0.00 51.96 52.41 3ikn s ALA 318 Cb -0.48 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.27 3ikn s ALA 318 CO 0.58 -1.44 1.39 -2.30 0.00 0.00 0.00 175.76 173.99 3ikn n PRO 319 N -3.23 1.91 -0.79 0.00 -0.02 -1.26 -1.46 135.00 130.16 3ikn n PRO 319 Ca 0.08 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3ikn n PRO 319 Cb 0.53 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 3ikn n PRO 319 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ikn n GLY 320 N 2.26 0.88 3.57 -1.23 0.00 -1.26 -5.04 105.19 104.37 3ikn n GLY 320 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 3ikn n GLY 320 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ikn s GLU 321 N -0.21 2.06 0.33 1.61 0.41 -0.53 -4.07 118.70 118.30 3ikn s GLU 321 Ca 0.00 -1.25 -0.21 0.00 -0.41 0.00 0.00 54.97 53.10 3ikn s GLU 321 Cb 0.00 -2.17 -0.10 0.00 -1.78 0.00 0.00 34.13 30.09 3ikn s GLU 321 CO 0.00 0.44 0.85 -1.25 -0.49 0.00 0.00 175.26 174.81 3ikn s PRO 322 N -2.78 4.28 0.00 0.39 0.04 -1.26 -4.66 135.00 131.01 3ikn s PRO 322 Ca 0.25 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.30 3ikn s PRO 322 Cb -0.09 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.87 3ikn s PRO 322 CO 0.15 0.20 0.57 0.27 0.04 0.00 0.00 177.00 178.22 3ikn n ASN 323 N 0.08 1.09 -4.00 6.66 0.23 -1.26 -5.03 115.26 113.04 3ikn n ASN 323 Ca 0.03 -1.24 -0.31 0.00 -0.53 0.00 0.00 54.58 52.53 3ikn n ASN 323 Cb 0.52 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.20 3ikn n ASN 323 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 3ikn n ASP 324 N -0.12 -1.58 -4.68 0.53 2.03 -1.26 -4.82 116.55 106.65 3ikn n ASP 324 Ca 0.00 -1.12 -0.43 0.00 0.52 0.00 0.00 54.79 53.77 3ikn n ASP 324 Cb 0.11 -2.58 -0.01 0.00 -0.72 0.00 0.00 41.12 37.92 3ikn n ASP 324 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3ikn n ASP 325 N -2.77 2.57 0.00 1.67 -0.08 -1.26 -0.45 116.55 116.22 3ikn n ASP 325 Ca -0.24 1.20 0.00 0.00 -1.51 0.00 0.00 54.79 54.24 3ikn n ASP 325 Cb 0.65 -1.46 0.00 0.00 2.34 0.00 0.00 41.12 42.65 3ikn n ASP 325 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3ikn n GLY 326 N 0.83 0.34 2.15 0.27 0.00 -1.26 -1.98 105.19 105.53 3ikn n GLY 326 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 3ikn n GLY 326 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ikn n GLY 327 N -1.93 0.58 2.62 -0.02 0.00 0.40 -4.95 105.19 101.90 3ikn n GLY 327 Ca 0.00 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 3ikn n GLY 327 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ikn n SER 328 N 1.00 -1.44 -3.80 1.61 3.41 -0.84 -5.05 113.62 108.50 3ikn n SER 328 Ca -0.06 -3.26 -0.30 0.00 -0.26 0.00 0.00 58.87 54.99 3ikn n SER 328 Cb 0.32 1.13 -0.14 0.00 -0.26 0.00 0.00 64.21 65.26 3ikn n SER 328 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3ikn s GLU 329 N -0.45 1.13 0.00 4.33 2.02 -1.26 -4.30 118.70 120.18 3ikn s GLU 329 Ca 0.26 -1.63 0.14 0.00 0.02 0.00 0.00 54.97 53.75 3ikn s GLU 329 Cb 0.33 -2.44 0.11 0.00 0.10 0.00 0.00 34.13 32.24 3ikn s GLU 329 CO -0.06 -1.04 0.94 -0.25 0.02 0.00 0.00 175.26 174.88 3ikn n ASP 330 N 4.21 2.16 -4.87 -0.19 8.00 -1.23 -4.57 116.55 120.07 3ikn n ASP 330 Ca 0.03 -1.58 -0.24 0.00 0.71 0.00 0.00 54.79 53.71 3ikn n ASP 330 Cb 0.39 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.46 3ikn n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ikn s VAL 332 N -2.65 0.89 0.15 0.00 1.01 -1.24 -0.33 120.40 118.23 3ikn s VAL 332 Ca 0.40 -0.41 0.10 0.00 0.00 0.00 0.00 61.98 62.08 3ikn s VAL 332 Cb -0.02 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 3ikn s VAL 332 CO 0.24 0.28 -0.22 -1.83 0.00 0.00 0.00 175.10 173.56 3ikn s GLU 333 N 0.24 1.59 -0.13 2.72 -1.05 -0.11 -0.76 118.70 121.20 3ikn s GLU 333 Ca -0.05 -1.37 0.01 0.00 -0.15 0.00 0.00 54.97 53.42 3ikn s GLU 333 Cb -0.10 -1.95 -0.01 0.00 -0.44 0.00 0.00 34.13 31.63 3ikn s GLU 333 CO 0.01 0.44 -0.16 -1.50 0.95 0.00 0.00 175.26 175.00 3ikn s ILE 334 N -1.36 2.73 0.79 1.83 2.07 0.33 -1.48 121.20 126.10 3ikn s ILE 334 Ca 0.18 -0.77 -0.09 0.00 -1.41 0.00 0.00 60.65 58.56 3ikn s ILE 334 Cb -0.09 -2.13 0.11 0.00 0.13 0.00 0.00 42.46 40.47 3ikn s ILE 334 CO 0.09 0.53 1.11 -0.36 -1.91 0.00 0.00 174.94 174.40 3ikn s PHE 335 N 0.51 2.44 -0.01 3.50 0.08 -0.38 -2.10 117.98 122.03 3ikn s PHE 335 Ca -0.11 0.37 0.31 0.00 0.12 0.00 0.00 56.93 57.62 3ikn s PHE 335 Cb -0.16 -3.44 1.46 0.00 -0.57 0.00 0.00 43.02 40.30 3ikn s PHE 335 CO 0.04 -1.81 1.92 1.79 -0.10 0.00 0.00 175.22 177.06 3ikn h THR 336 N -0.92 0.00 -0.30 0.64 1.35 -1.89 -0.50 112.91 111.30 3ikn h THR 336 Ca -0.44 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 3ikn h THR 336 Cb 1.29 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 3ikn h THR 336 CO 0.53 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.34 3ikn n ASN 337 N -2.65 2.18 0.00 5.36 0.23 -1.26 -4.73 115.26 114.39 3ikn n ASN 337 Ca -0.00 -1.86 0.00 0.00 -0.53 0.00 0.00 54.58 52.19 3ikn n ASN 337 Cb 0.17 -0.19 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 3ikn n ASN 337 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ikn n GLY 338 N 1.21 2.66 3.82 4.83 0.00 -0.20 -5.03 105.19 112.48 3ikn n GLY 338 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3ikn n GLY 338 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ikn s LYS 339 N -0.22 3.37 0.16 1.61 -0.14 -1.26 -4.69 119.74 118.57 3ikn s LYS 339 Ca 0.00 1.08 0.04 0.00 -1.36 0.00 0.00 55.97 55.73 3ikn s LYS 339 Cb 0.00 -2.04 -0.04 0.00 -1.68 0.00 0.00 37.83 34.07 3ikn s LYS 339 CO 0.00 -0.76 0.17 -1.58 -0.76 0.00 0.00 175.35 172.42 3ikn s TRP 340 N -2.66 3.23 -0.15 3.18 0.52 0.73 -1.24 118.94 122.56 3ikn s TRP 340 Ca 0.61 0.01 -0.09 0.00 0.02 0.00 0.00 56.10 56.65 3ikn s TRP 340 Cb -0.14 -1.55 0.05 0.00 -1.15 0.00 0.00 33.47 30.68 3ikn s TRP 340 CO 0.41 0.52 0.37 1.21 0.02 0.00 0.00 176.95 179.47 3ikn s ASN 341 N -3.15 -0.43 0.22 2.95 2.47 -0.55 -0.52 114.94 115.92 3ikn s ASN 341 Ca 0.32 0.78 -0.30 0.00 0.42 0.00 0.00 52.86 54.08 3ikn s ASN 341 Cb -0.10 0.69 -0.08 0.00 -1.45 0.00 0.00 41.25 40.31 3ikn s ASN 341 CO 0.25 -0.17 1.10 1.51 -3.72 0.00 0.00 177.10 176.07 3ikn s ASP 342 N 1.05 7.27 0.04 -4.21 -4.77 -1.26 -0.93 116.67 113.85 3ikn s ASP 342 Ca -0.07 2.16 0.01 0.00 -3.30 0.00 0.00 52.55 51.35 3ikn s ASP 342 Cb -0.07 -2.61 -0.02 0.00 -1.09 0.00 0.00 42.92 39.12 3ikn s ASP 342 CO -0.08 -0.18 -0.05 -0.60 0.70 0.00 0.00 175.17 174.95 3ikn s ARG 343 N -0.80 0.46 0.28 2.11 6.06 0.55 -4.87 118.95 122.73 3ikn s ARG 343 Ca 0.47 -0.77 -0.30 0.00 -2.50 0.00 0.00 55.73 52.63 3ikn s ARG 343 Cb -0.30 -0.07 -0.12 0.00 0.06 0.00 0.00 34.95 34.52 3ikn s ARG 343 CO 0.37 -0.01 1.63 0.00 -2.50 0.00 0.00 175.30 174.79 3ikn s ALA 344 N -1.76 3.79 0.36 6.12 0.00 -1.26 -1.45 121.76 127.56 3ikn s ALA 344 Ca -0.10 1.59 0.39 0.00 0.00 0.00 0.00 51.96 53.83 3ikn s ALA 344 Cb -0.08 -3.66 1.88 0.00 0.00 0.00 0.00 23.12 21.26 3ikn s ALA 344 CO -0.01 -0.98 2.16 0.00 0.00 0.00 0.00 175.76 176.93 3ikn n GLY 346 N -0.53 -1.59 3.78 0.00 0.00 -1.26 -1.93 105.19 103.65 3ikn n GLY 346 Ca -0.01 0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 3ikn n GLY 346 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ikn s GLU 347 N -3.16 2.84 -0.18 1.61 0.41 -0.98 -4.75 118.70 114.49 3ikn s GLU 347 Ca 0.09 1.25 -0.11 0.00 -0.41 0.00 0.00 54.97 55.79 3ikn s GLU 347 Cb 0.12 -1.97 -0.05 0.00 -1.78 0.00 0.00 34.13 30.45 3ikn s GLU 347 CO 0.54 -1.20 0.18 0.15 -0.49 0.00 0.00 175.26 174.45 3ikn s LYS 348 N -4.35 4.19 0.15 1.61 1.02 -1.26 -3.90 119.74 117.20 3ikn s LYS 348 Ca 0.64 -0.11 -0.00 0.00 0.02 0.00 0.00 55.97 56.52 3ikn s LYS 348 Cb -0.18 -3.41 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 3ikn s LYS 348 CO 0.45 0.30 0.04 1.03 -0.92 0.00 0.00 175.35 176.24 3ikn s ARG 349 N 0.35 1.02 0.29 1.68 1.81 -0.69 -4.78 118.95 118.62 3ikn s ARG 349 Ca 0.11 -1.49 -0.30 0.00 -1.72 0.00 0.00 55.73 52.33 3ikn s ARG 349 Cb -0.12 0.06 -0.12 0.00 -0.45 0.00 0.00 34.95 34.32 3ikn s ARG 349 CO 0.00 -0.22 1.56 -0.11 -0.68 0.00 0.00 175.30 175.85 3ikn n LEU 350 N -0.16 4.22 -4.60 2.53 7.94 -0.12 -1.27 117.00 125.53 3ikn n LEU 350 Ca -0.05 1.15 -0.41 0.00 -1.11 0.00 0.00 56.01 55.59 3ikn n LEU 350 Cb 0.64 -1.57 -0.07 0.00 0.53 0.00 0.00 43.42 42.94 3ikn n LEU 350 CO 0.32 0.06 0.33 -0.69 -1.11 0.00 0.00 177.39 176.31 3ikn s VAL 351 N -0.10 4.99 -0.07 1.96 1.01 -0.61 -2.63 120.40 124.94 3ikn s VAL 351 Ca 0.64 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.46 3ikn s VAL 351 Cb -0.51 -3.94 0.02 0.00 0.00 0.00 0.00 36.38 31.95 3ikn s VAL 351 CO 0.50 -0.07 -0.04 -0.69 0.00 0.00 0.00 175.10 174.80 3ikn s VAL 352 N 2.49 0.61 0.30 2.92 1.01 -1.26 -1.40 120.40 125.07 3ikn s VAL 352 Ca 0.24 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.21 3ikn s VAL 352 Cb -0.15 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 3ikn s VAL 352 CO 0.11 0.27 0.14 0.00 0.00 0.00 0.00 175.10 175.62 3ikn s GLU 354 N -3.83 1.68 0.00 0.00 -1.05 0.67 -0.92 118.70 115.25 3ikn s GLU 354 Ca 0.36 -0.90 0.00 0.00 -0.15 0.00 0.00 54.97 54.28 3ikn s GLU 354 Cb -0.05 -1.72 0.00 0.00 -0.44 0.00 0.00 34.13 31.92 3ikn s GLU 354 CO 0.23 0.46 0.24 1.19 0.95 0.00 0.00 175.26 178.33