#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1za5 s PHE 202 N 0.00 3.41 0.09 0.66 0.40 -1.26 -5.08 117.98 116.20 1za5 s PHE 202 Ca 0.00 1.27 0.05 0.00 -0.60 0.00 0.00 56.93 57.65 1za5 s PHE 202 Cb 0.00 -2.61 -0.03 0.00 0.51 0.00 0.00 43.02 40.89 1za5 s PHE 202 CO 0.00 -0.10 -0.12 -1.21 0.70 0.00 0.00 175.22 174.48 1za5 s GLU 203 N -3.53 0.85 -0.34 0.44 2.02 -1.26 -4.94 118.70 111.94 1za5 s GLU 203 Ca 0.55 -1.06 -0.29 0.00 0.02 0.00 0.00 54.97 54.19 1za5 s GLU 203 Cb -0.10 -0.72 0.00 0.00 0.10 0.00 0.00 34.13 33.41 1za5 s GLU 203 CO 0.24 0.14 1.36 -1.17 0.02 0.00 0.00 175.26 175.86 1za5 s LEU 204 N -2.08 3.76 0.41 1.80 2.96 -1.26 -4.98 118.68 119.29 1za5 s LEU 204 Ca 0.02 1.07 -0.27 0.00 -0.22 0.00 0.00 54.13 54.73 1za5 s LEU 204 Cb -0.07 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.98 1za5 s LEU 204 CO 0.02 -1.23 1.45 -2.65 -1.32 0.00 0.00 176.35 172.62 1za5 n PRO 205 N 7.65 2.45 -1.79 0.98 -0.02 -1.26 -4.92 135.00 138.09 1za5 n PRO 205 Ca 0.16 0.86 -0.38 0.00 -2.02 0.00 0.00 63.50 62.12 1za5 n PRO 205 Cb 0.47 -2.64 0.04 0.00 -0.02 0.00 0.00 33.50 31.36 1za5 n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1za5 s ALA 206 N -1.15 2.83 0.53 3.55 0.00 -1.26 -4.93 121.76 121.32 1za5 s ALA 206 Ca 0.57 1.33 -0.22 0.00 0.00 0.00 0.00 51.96 53.64 1za5 s ALA 206 Cb -0.47 -3.57 -0.05 0.00 0.00 0.00 0.00 23.12 19.03 1za5 s ALA 206 CO 0.61 -1.37 1.34 -1.17 0.00 0.00 0.00 175.76 175.17 1za5 s LEU 207 N -3.51 3.89 0.00 0.00 2.96 -1.26 -4.88 118.68 115.87 1za5 s LEU 207 Ca 0.71 2.72 0.22 0.00 -0.22 0.00 0.00 54.13 57.56 1za5 s LEU 207 Cb -0.40 -4.25 1.13 0.00 0.50 0.00 0.00 46.19 43.17 1za5 s LEU 207 CO 0.48 -1.47 1.70 -2.65 -1.32 0.00 0.00 176.35 173.09 1za5 n PRO 208 N -0.90 0.36 -3.96 0.98 -0.02 -1.26 -4.87 135.00 125.32 1za5 n PRO 208 Ca 0.10 0.07 -0.12 0.00 -2.02 0.00 0.00 63.50 61.53 1za5 n PRO 208 Cb 0.45 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.42 1za5 n PRO 208 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1za5 s TYR 209 N -2.50 0.64 0.58 6.00 1.13 -1.26 -5.11 117.35 116.84 1za5 s TYR 209 Ca 0.22 -1.06 -0.19 0.00 -1.41 0.00 0.00 57.07 54.63 1za5 s TYR 209 Cb 0.15 0.32 -0.04 0.00 -1.10 0.00 0.00 41.96 41.29 1za5 s TYR 209 CO 0.32 -1.32 1.19 0.00 -2.51 0.00 0.00 175.55 173.23 1za5 s ALA 210 N -2.75 2.57 0.50 9.51 0.00 -1.26 -4.90 121.76 125.42 1za5 s ALA 210 Ca 0.24 0.98 0.22 0.00 0.00 0.00 0.00 51.96 53.39 1za5 s ALA 210 Cb -0.03 -3.44 1.28 0.00 0.00 0.00 0.00 23.12 20.94 1za5 s ALA 210 CO 0.16 -1.10 1.98 1.57 0.00 0.00 0.00 175.76 178.38 1za5 h LYS 211 N 0.94 0.13 -0.66 0.00 2.10 -1.98 -0.61 116.57 116.48 1za5 h LYS 211 Ca -0.50 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.14 1za5 h LYS 211 Cb 1.29 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1za5 h LYS 211 CO 0.55 0.09 0.00 -0.40 -2.00 0.00 0.00 179.45 177.69 1za5 n ASP 212 N -4.41 3.81 0.22 7.07 3.85 -1.26 -4.18 116.55 121.64 1za5 n ASP 212 Ca 0.10 -2.00 0.06 0.00 -0.71 0.00 0.00 54.79 52.24 1za5 n ASP 212 Cb 0.55 -0.44 0.48 0.00 -1.35 0.00 0.00 41.12 40.36 1za5 n ASP 212 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1za5 h ALA 213 N 4.09 1.45 -0.03 2.12 0.00 -1.46 -2.90 119.26 122.53 1za5 h ALA 213 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1za5 h ALA 213 Cb 0.96 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1za5 h ALA 213 CO 0.00 0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.85 1za5 n LEU 214 N -4.04 1.22 -4.75 0.00 4.77 -1.26 -4.54 117.00 108.39 1za5 n LEU 214 Ca -0.02 -0.42 -0.37 0.00 -0.03 0.00 0.00 56.01 55.17 1za5 n LEU 214 Cb 0.32 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.43 1za5 n LEU 214 CO 0.36 0.21 0.87 0.00 -1.33 0.00 0.00 177.39 177.51 1za5 s ALA 215 N -1.97 2.65 -2.42 -1.18 0.00 -1.09 -1.78 121.76 115.97 1za5 s ALA 215 Ca 0.39 1.08 0.28 0.00 0.00 0.00 0.00 51.96 53.71 1za5 s ALA 215 Cb 0.20 -3.47 0.98 0.00 0.00 0.00 0.00 23.12 20.83 1za5 s ALA 215 CO 0.33 -1.17 1.70 -0.35 0.00 0.00 0.00 175.76 176.27 1za5 n PRO 216 N -1.33 1.58 -0.15 0.00 -0.04 -1.26 -4.84 135.00 128.96 1za5 n PRO 216 Ca 0.12 -0.94 -0.08 0.00 -0.04 0.00 0.00 63.50 62.56 1za5 n PRO 216 Cb 0.48 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 1za5 n PRO 216 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1za5 h HIS 217 N 2.30 0.58 -3.25 0.54 3.86 -1.73 -3.39 115.15 114.05 1za5 h HIS 217 Ca 0.00 0.01 -0.45 0.00 -1.16 0.00 0.00 60.37 58.77 1za5 h HIS 217 Cb 0.52 -0.19 -0.38 0.00 1.06 0.00 0.00 27.41 28.41 1za5 h HIS 217 CO 0.00 0.37 -0.77 0.42 0.86 0.00 0.00 177.93 178.81 1za5 s ILE 218 N -6.13 0.39 0.77 2.45 1.01 -0.73 -4.90 121.20 114.06 1za5 s ILE 218 Ca -0.13 0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.43 1za5 s ILE 218 Cb 0.11 -0.61 0.05 0.00 0.01 0.00 0.00 42.46 42.03 1za5 s ILE 218 CO 0.73 0.19 1.08 -0.94 0.00 0.00 0.00 174.94 176.01 1za5 s SER 219 N 1.96 4.63 0.39 3.58 1.04 -1.26 -2.65 113.70 121.38 1za5 s SER 219 Ca 0.04 1.69 0.10 0.00 0.48 0.00 0.00 55.95 58.26 1za5 s SER 219 Cb -0.13 -2.44 0.80 0.00 0.10 0.00 0.00 66.02 64.35 1za5 s SER 219 CO -0.06 -1.94 1.93 0.00 0.98 0.00 0.00 173.24 174.15 1za5 h ALA 220 N -1.06 1.53 -0.58 5.32 0.00 -1.91 -2.00 119.26 120.56 1za5 h ALA 220 Ca -0.44 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.20 1za5 h ALA 220 Cb 1.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1za5 h ALA 220 CO 0.54 0.34 0.09 1.49 0.00 0.00 0.00 179.25 181.70 1za5 h GLU 221 N 0.22 0.97 -0.72 0.00 4.81 -1.92 0.13 114.58 118.07 1za5 h GLU 221 Ca 0.05 -0.26 -0.07 0.00 -0.13 0.00 0.00 59.36 58.94 1za5 h GLU 221 Cb 0.35 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1za5 h GLU 221 CO 0.02 0.92 0.18 1.15 -0.73 0.00 0.00 179.01 180.55 1za5 h THR 222 N 0.87 1.26 -0.44 0.32 2.02 -1.77 -2.08 112.91 113.09 1za5 h THR 222 Ca 0.18 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 1za5 h THR 222 Cb 0.43 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1za5 h THR 222 CO 0.01 0.38 0.24 0.40 0.37 0.00 0.00 175.52 176.92 1za5 h ILE 223 N 1.09 1.16 -0.74 3.11 1.08 -1.05 0.65 117.51 122.81 1za5 h ILE 223 Ca 0.23 -0.41 0.11 0.00 -0.39 0.00 0.00 64.86 64.40 1za5 h ILE 223 Cb 0.37 0.63 -0.08 0.00 -3.07 0.00 0.00 36.82 34.67 1za5 h ILE 223 CO 0.00 0.17 0.35 -0.08 -0.69 0.00 0.00 178.15 177.90 1za5 h GLU 224 N 0.57 0.54 0.00 2.37 4.81 -0.58 0.64 114.58 122.94 1za5 h GLU 224 Ca 0.15 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1za5 h GLU 224 Cb 0.06 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1za5 h GLU 224 CO -0.02 0.36 -0.52 1.88 -0.73 0.00 0.00 179.01 179.97 1za5 h TYR 225 N 0.56 0.00 -0.13 0.92 0.05 -0.99 -2.43 116.97 114.95 1za5 h TYR 225 Ca 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.16 1za5 h TYR 225 Cb 0.48 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.22 1za5 h TYR 225 CO -0.12 1.11 0.06 1.25 -1.05 0.00 0.00 178.16 179.40 1za5 h HIS 226 N -1.00 0.19 0.00 4.88 2.76 0.33 -0.13 115.15 122.18 1za5 h HIS 226 Ca -0.14 -0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 57.93 1za5 h HIS 226 Cb 1.05 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.94 1za5 h HIS 226 CO 0.17 0.26 -0.60 -0.92 -1.30 0.00 0.00 177.93 175.54 1za5 h TYR 227 N 0.06 0.00 0.00 5.26 5.03 -1.03 -1.05 116.97 125.24 1za5 h TYR 227 Ca 0.04 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.31 1za5 h TYR 227 Cb 0.14 0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.42 1za5 h TYR 227 CO -0.02 0.88 -0.18 0.78 -1.32 0.00 0.00 178.16 178.30 1za5 h GLY 228 N -1.00 0.00 0.00 1.82 0.00 -0.93 -2.88 103.07 100.08 1za5 h GLY 228 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1za5 h GLY 228 CO -0.08 0.00 -0.39 0.28 0.00 0.00 0.00 176.54 176.34 1za5 n LYS 229 N -4.20 0.18 0.37 4.80 5.02 -0.45 -4.47 118.16 119.41 1za5 n LYS 229 Ca -0.02 0.07 -0.17 0.00 -2.02 0.00 0.00 58.31 56.17 1za5 n LYS 229 Cb 0.25 -0.82 -0.08 0.00 -0.02 0.00 0.00 35.03 34.36 1za5 n LYS 229 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1za5 h HIS 230 N -0.34 -1.13 -0.52 2.13 3.86 -1.10 0.09 115.15 118.14 1za5 h HIS 230 Ca -0.01 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1za5 h HIS 230 Cb 0.38 0.40 -0.03 0.00 1.06 0.00 0.00 27.41 29.22 1za5 h HIS 230 CO -0.14 -0.63 0.33 1.25 0.86 0.00 0.00 177.93 179.60 1za5 h HIS 231 N -1.03 0.61 -0.72 2.45 -0.00 -1.24 -1.65 115.15 113.58 1za5 h HIS 231 Ca -0.09 0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.34 1za5 h HIS 231 Cb 0.82 -0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 27.98 1za5 h HIS 231 CO -0.08 0.37 0.44 0.37 -0.00 0.00 0.00 177.93 179.02 1za5 h GLN 232 N 0.66 0.81 -0.50 5.26 5.75 -1.50 -2.20 115.11 123.38 1za5 h GLN 232 Ca 0.20 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.58 1za5 h GLN 232 Cb -0.02 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1za5 h GLN 232 CO -0.07 0.53 0.03 1.15 -2.65 0.00 0.00 178.83 177.82 1za5 h THR 233 N 0.83 1.24 -0.61 2.39 2.02 -0.35 -1.98 112.91 116.46 1za5 h THR 233 Ca 0.30 -0.98 -0.05 0.00 0.77 0.00 0.00 66.41 66.46 1za5 h THR 233 Cb 0.09 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1za5 h THR 233 CO -0.14 0.35 0.19 1.88 0.37 0.00 0.00 175.52 178.17 1za5 h TYR 234 N 0.77 0.95 -0.05 3.16 0.05 -0.73 0.23 116.97 121.35 1za5 h TYR 234 Ca 0.15 -0.08 -0.00 0.00 0.05 0.00 0.00 58.73 58.86 1za5 h TYR 234 Cb 0.43 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 37.88 1za5 h TYR 234 CO 0.02 0.76 0.02 0.28 -1.05 0.00 0.00 178.16 178.19 1za5 h VAL 235 N 0.90 1.13 -0.54 -2.88 2.07 -0.96 -0.81 116.25 115.15 1za5 h VAL 235 Ca 0.20 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1za5 h VAL 235 Cb 0.25 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1za5 h VAL 235 CO -0.01 0.10 0.27 0.74 0.02 0.00 0.00 177.57 178.70 1za5 h THR 236 N -0.07 1.19 -0.10 2.57 2.02 -0.99 -1.84 112.91 115.70 1za5 h THR 236 Ca 0.02 -0.52 0.04 0.00 0.77 0.00 0.00 66.41 66.71 1za5 h THR 236 Cb 0.15 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 67.06 1za5 h THR 236 CO -0.00 0.21 -0.21 0.78 0.37 0.00 0.00 175.52 176.67 1za5 h ASN 237 N 0.72 -0.65 -0.22 4.18 -0.26 -0.37 -1.06 115.58 117.92 1za5 h ASN 237 Ca 0.19 0.10 0.05 0.00 -0.56 0.00 0.00 56.30 56.08 1za5 h ASN 237 Cb 0.09 0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 37.59 1za5 h ASN 237 CO -0.03 -0.27 -0.07 0.25 -1.06 0.00 0.00 177.43 176.25 1za5 h LEU 238 N -0.29 -0.26 -0.43 1.61 5.85 -0.88 -0.89 115.31 120.02 1za5 h LEU 238 Ca 0.09 0.07 0.05 0.00 0.84 0.00 0.00 57.88 58.93 1za5 h LEU 238 Cb 0.42 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.56 1za5 h LEU 238 CO -0.26 -0.10 0.17 0.78 -0.34 0.00 0.00 178.44 178.69 1za5 h ASN 239 N -0.03 0.19 -0.21 1.25 -0.26 -1.03 -1.33 115.58 114.15 1za5 h ASN 239 Ca 0.11 0.04 0.02 0.00 -0.56 0.00 0.00 56.30 55.92 1za5 h ASN 239 Cb 0.20 0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 37.45 1za5 h ASN 239 CO -0.25 0.14 0.06 0.78 -1.06 0.00 0.00 177.43 177.11 1za5 h ASN 240 N 0.34 0.04 0.14 5.81 -0.26 -0.70 -1.86 115.58 119.09 1za5 h ASN 240 Ca 0.20 0.03 -0.09 0.00 -0.56 0.00 0.00 56.30 55.88 1za5 h ASN 240 Cb 0.18 0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 1za5 h ASN 240 CO -0.19 0.05 -0.31 -0.07 -1.06 0.00 0.00 177.43 175.85 1za5 h LEU 241 N 0.15 0.27 -0.62 1.61 3.38 -0.85 -3.12 115.31 116.12 1za5 h LEU 241 Ca 0.09 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1za5 h LEU 241 Cb 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1za5 h LEU 241 CO -0.11 0.57 -0.40 2.30 0.09 0.00 0.00 178.44 180.89 1za5 n ILE 242 N -4.11 0.00 -1.67 1.22 -5.35 -0.53 -4.86 119.36 104.05 1za5 n ILE 242 Ca -0.01 -0.16 -0.46 0.00 -0.27 0.00 0.00 62.75 61.85 1za5 n ILE 242 Cb 0.41 0.74 -0.04 0.00 -1.74 0.00 0.00 39.64 39.01 1za5 n ILE 242 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 1za5 n LYS 243 N -0.52 2.23 -1.04 6.28 4.81 -0.71 -1.06 118.16 128.15 1za5 n LYS 243 Ca 0.10 0.81 -0.01 0.00 -0.87 0.00 0.00 58.31 58.33 1za5 n LYS 243 Cb 0.39 -2.60 -0.01 0.00 0.02 0.00 0.00 35.03 32.84 1za5 n LYS 243 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1za5 n GLY 244 N 3.62 0.44 3.62 3.14 0.00 -1.26 -5.01 105.19 109.74 1za5 n GLY 244 Ca 0.18 -0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1za5 n GLY 244 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1za5 n THR 245 N -2.66 0.00 1.69 2.61 -2.24 -0.22 -5.00 114.28 108.46 1za5 n THR 245 Ca -0.01 -2.05 0.15 0.00 -2.27 0.00 0.00 64.05 59.87 1za5 n THR 245 Cb 0.20 -0.09 0.84 0.00 -2.10 0.00 0.00 70.33 69.18 1za5 n THR 245 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1za5 n ALA 246 N -1.95 2.57 0.11 6.98 0.00 -1.26 -3.25 120.51 123.70 1za5 n ALA 246 Ca -0.16 -0.17 0.04 0.00 0.00 0.00 0.00 53.44 53.15 1za5 n ALA 246 Cb 0.59 -1.50 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 1za5 n ALA 246 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1za5 h PHE 247 N 0.00 0.00 -0.88 0.00 0.04 -1.95 -3.41 116.94 110.74 1za5 h PHE 247 Ca 0.00 0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.87 1za5 h PHE 247 Cb 0.13 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 38.16 1za5 h PHE 247 CO 0.00 0.41 -0.45 0.39 -0.60 0.00 0.00 178.31 178.06 1za5 n GLU 248 N -3.02 -0.32 -0.03 1.51 1.02 -1.20 -0.59 120.64 118.01 1za5 n GLU 248 Ca -0.02 1.34 0.08 0.00 -0.02 0.00 0.00 57.16 58.53 1za5 n GLU 248 Cb 0.73 -1.97 0.39 0.00 -0.02 0.00 0.00 31.44 30.56 1za5 n GLU 248 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1za5 n GLY 249 N -1.29 -0.55 3.86 0.62 0.00 -1.26 -4.62 105.19 101.94 1za5 n GLY 249 Ca 0.04 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1za5 n GLY 249 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1za5 s LYS 250 N -1.91 3.90 0.91 1.61 -0.14 0.24 -5.08 119.74 119.27 1za5 s LYS 250 Ca 0.24 0.53 -0.12 0.00 -1.36 0.00 0.00 55.97 55.26 1za5 s LYS 250 Cb 0.12 -2.46 0.14 0.00 -1.68 0.00 0.00 37.83 33.95 1za5 s LYS 250 CO 0.19 0.12 1.11 -1.54 -0.76 0.00 0.00 175.35 174.47 1za5 s SER 251 N -2.58 3.44 0.09 2.83 1.04 -1.26 -4.84 113.70 112.42 1za5 s SER 251 Ca 0.52 1.19 -0.21 0.00 0.48 0.00 0.00 55.95 57.93 1za5 s SER 251 Cb -0.10 -1.85 -0.11 0.00 0.10 0.00 0.00 66.02 64.06 1za5 s SER 251 CO 0.22 -2.62 1.68 0.25 0.98 0.00 0.00 173.24 173.75 1za5 h LEU 252 N -1.54 0.17 -0.98 2.42 5.85 -1.97 -1.99 115.31 117.27 1za5 h LEU 252 Ca -0.51 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.14 1za5 h LEU 252 Cb 1.31 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1za5 h LEU 252 CO 0.59 0.22 0.65 -0.33 -0.34 0.00 0.00 178.44 179.22 1za5 h GLU 253 N 0.11 1.25 -0.79 1.25 3.07 -1.95 -1.06 114.58 116.46 1za5 h GLU 253 Ca 0.05 -0.08 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 1za5 h GLU 253 Cb 0.09 -0.28 -0.03 0.00 -0.84 0.00 0.00 28.75 27.68 1za5 h GLU 253 CO -0.01 0.83 0.30 0.93 -1.40 0.00 0.00 179.01 179.66 1za5 h GLU 254 N 1.29 1.19 -0.35 2.33 5.08 -1.86 -1.89 114.58 120.36 1za5 h GLU 254 Ca 0.38 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 58.40 1za5 h GLU 254 Cb -0.07 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 1za5 h GLU 254 CO -0.10 0.97 -0.21 0.82 -1.00 0.00 0.00 179.01 179.49 1za5 h ILE 255 N 1.16 1.29 -0.84 3.13 2.04 -0.83 -2.70 117.51 120.75 1za5 h ILE 255 Ca 0.26 -1.35 0.07 0.00 1.00 0.00 0.00 64.86 64.85 1za5 h ILE 255 Cb 0.24 1.39 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 1za5 h ILE 255 CO -0.02 0.44 0.55 0.40 0.00 0.00 0.00 178.15 179.52 1za5 h ILE 256 N 0.55 1.03 -0.00 -0.67 2.04 -0.93 -1.12 117.51 118.41 1za5 h ILE 256 Ca 0.07 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1za5 h ILE 256 Cb 0.76 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1za5 h ILE 256 CO 0.06 0.17 -0.13 0.54 0.00 0.00 0.00 178.15 178.78 1za5 n ARG 257 N -4.49 0.56 -0.16 2.37 1.74 -0.74 -4.10 116.66 111.84 1za5 n ARG 257 Ca 0.13 -0.19 0.02 0.00 -0.77 0.00 0.00 57.85 57.04 1za5 n ARG 257 Cb 0.23 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.20 1za5 n ARG 257 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1za5 n SER 258 N -1.06 0.85 -4.47 0.55 3.41 -0.73 -5.09 113.62 107.07 1za5 n SER 258 Ca 0.13 -1.89 -0.24 0.00 -0.26 0.00 0.00 58.87 56.61 1za5 n SER 258 Cb 0.29 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 64.00 1za5 n SER 258 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1za5 s SER 259 N -1.03 2.91 0.32 4.04 1.04 -0.50 -5.03 113.70 115.45 1za5 s SER 259 Ca 0.06 -1.43 -0.00 0.00 0.48 0.00 0.00 55.95 55.05 1za5 s SER 259 Cb 0.05 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.14 1za5 s SER 259 CO 0.01 -0.63 0.42 -1.84 0.98 0.00 0.00 173.24 172.18 1za5 n GLU 260 N -0.83 0.61 0.00 4.02 0.28 -1.26 -4.68 120.64 118.78 1za5 n GLU 260 Ca -0.05 -2.67 0.00 0.00 -0.16 0.00 0.00 57.16 54.28 1za5 n GLU 260 Cb 0.67 2.50 0.00 0.00 1.43 0.00 0.00 31.44 36.04 1za5 n GLU 260 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1za5 n GLY 261 N -0.54 2.12 0.36 -1.84 0.00 -1.26 -2.48 105.19 101.55 1za5 n GLY 261 Ca 0.02 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.63 1za5 n GLY 261 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1za5 h GLY 262 N 0.00 1.27 0.97 -0.02 0.00 -1.99 -0.53 103.07 102.77 1za5 h GLY 262 Ca 0.00 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 1za5 h GLY 262 CO 0.00 0.40 0.19 -2.08 0.00 0.00 0.00 176.54 175.05 1za5 h VAL 263 N 1.14 1.12 -0.17 4.60 2.07 -1.94 -1.38 116.25 121.69 1za5 h VAL 263 Ca 0.34 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1za5 h VAL 263 Cb -0.03 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1za5 h VAL 263 CO -0.09 0.12 0.02 0.15 0.02 0.00 0.00 177.57 177.78 1za5 h PHE 264 N 0.41 0.32 -0.63 1.57 3.04 -1.15 -0.82 116.94 119.68 1za5 h PHE 264 Ca 0.12 -0.05 0.07 0.00 3.98 0.00 0.00 57.97 62.09 1za5 h PHE 264 Cb 0.03 -0.08 -0.06 0.00 2.56 0.00 0.00 35.95 38.39 1za5 h PHE 264 CO -0.04 0.47 0.31 -0.91 -2.02 0.00 0.00 178.31 176.13 1za5 h ASN 265 N 0.07 0.42 -0.04 0.41 2.35 -0.94 0.15 115.58 118.00 1za5 h ASN 265 Ca 0.05 0.05 -0.26 0.00 -0.55 0.00 0.00 56.30 55.59 1za5 h ASN 265 Cb 0.34 -0.03 0.02 0.00 0.05 0.00 0.00 38.32 38.69 1za5 h ASN 265 CO 0.01 0.27 -0.98 0.78 -1.65 0.00 0.00 177.43 175.85 1za5 h ASN 266 N 0.57 0.93 -0.26 5.81 4.21 -1.23 -1.57 115.58 124.03 1za5 h ASN 266 Ca 0.29 -0.71 -0.01 0.00 1.21 0.00 0.00 56.30 57.08 1za5 h ASN 266 Cb 0.25 -0.28 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 1za5 h ASN 266 CO -0.22 1.51 0.11 0.00 -1.29 0.00 0.00 177.43 177.55 1za5 h ALA 267 N 0.44 0.33 -0.76 -0.83 0.00 -0.86 -0.20 119.26 117.39 1za5 h ALA 267 Ca -0.11 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1za5 h ALA 267 Cb 1.63 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 1za5 h ALA 267 CO 0.19 -0.09 0.28 0.00 0.00 0.00 0.00 179.25 179.63 1za5 h ALA 268 N 0.96 0.99 -0.56 0.00 0.00 -0.77 -2.10 119.26 117.78 1za5 h ALA 268 Ca 0.09 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1za5 h ALA 268 Cb 0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1za5 h ALA 268 CO -0.01 0.64 0.07 0.45 0.00 0.00 0.00 179.25 180.39 1za5 h HIS 269 N 1.11 0.97 -0.23 0.00 -0.00 -0.96 0.14 115.15 116.19 1za5 h HIS 269 Ca 0.25 -0.13 -0.03 0.00 -0.00 0.00 0.00 60.37 60.47 1za5 h HIS 269 Cb 0.25 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.38 1za5 h HIS 269 CO 0.02 0.84 0.04 0.28 -0.00 0.00 0.00 177.93 179.12 1za5 h VAL 270 N 0.86 1.22 0.09 2.45 2.07 -0.77 -1.86 116.25 120.32 1za5 h VAL 270 Ca 0.17 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1za5 h VAL 270 Cb 0.42 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1za5 h VAL 270 CO 0.01 0.23 -0.04 -0.25 0.02 0.00 0.00 177.57 177.54 1za5 h TRP 271 N 0.18 -0.11 -0.69 1.57 7.01 -1.19 -2.34 115.95 120.37 1za5 h TRP 271 Ca 0.07 -0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.17 1za5 h TRP 271 Cb 0.31 0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 27.33 1za5 h TRP 271 CO 0.02 0.11 0.32 -0.91 -2.79 0.00 0.00 178.44 175.19 1za5 h ASN 272 N -0.33 0.37 -0.39 2.65 4.21 -0.70 -1.42 115.58 119.97 1za5 h ASN 272 Ca -0.01 0.07 -0.10 0.00 1.21 0.00 0.00 56.30 57.47 1za5 h ASN 272 Cb 0.28 0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.48 1za5 h ASN 272 CO 0.02 0.20 -0.16 0.45 -1.29 0.00 0.00 177.43 176.66 1za5 h HIS 273 N 0.53 0.92 -0.77 1.19 3.86 -1.30 -0.06 115.15 119.51 1za5 h HIS 273 Ca 0.35 -0.22 -0.02 0.00 -1.16 0.00 0.00 60.37 59.33 1za5 h HIS 273 Cb 0.42 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.64 1za5 h HIS 273 CO -0.13 0.96 0.42 1.15 0.86 0.00 0.00 177.93 181.19 1za5 h THR 274 N 0.61 1.23 -0.42 2.45 2.02 -1.03 -0.10 112.91 117.66 1za5 h THR 274 Ca 0.09 -0.58 -0.08 0.00 0.77 0.00 0.00 66.41 66.61 1za5 h THR 274 Cb 0.70 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1za5 h THR 274 CO 0.05 0.26 -0.06 0.15 0.37 0.00 0.00 175.52 176.29 1za5 h PHE 275 N 1.08 0.87 -0.31 3.16 3.04 -1.11 -2.89 116.94 120.78 1za5 h PHE 275 Ca 0.27 -0.17 0.01 0.00 3.98 0.00 0.00 57.97 62.06 1za5 h PHE 275 Cb 0.03 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.31 1za5 h PHE 275 CO 0.01 0.88 0.19 -0.92 -2.02 0.00 0.00 178.31 176.45 1za5 h TYR 276 N 0.61 0.36 -0.21 0.41 3.20 -0.26 -1.89 116.97 119.19 1za5 h TYR 276 Ca 0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1za5 h TYR 276 Cb 0.58 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 1za5 h TYR 276 CO 0.05 0.22 0.07 -1.49 -1.64 0.00 0.00 178.16 175.36 1za5 h TRP 277 N 0.39 0.28 0.00 -3.82 -0.00 -0.97 -1.00 115.95 110.83 1za5 h TRP 277 Ca 0.12 -0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.00 1za5 h TRP 277 Cb -0.02 -0.09 0.00 0.00 -0.00 0.00 0.00 29.16 29.05 1za5 h TRP 277 CO -0.07 0.24 0.00 -0.91 -0.00 0.00 0.00 178.44 177.71 1za5 h ASN 278 N 0.29 0.00 0.56 -3.49 4.21 -1.24 -3.04 115.58 112.87 1za5 h ASN 278 Ca 0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.58 1za5 h ASN 278 Cb 0.09 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 1za5 h ASN 278 CO -0.01 0.00 0.00 0.00 -1.29 0.00 0.00 177.43 176.13 1za5 s LEU 280 N -2.58 2.76 -0.18 0.00 1.43 -1.15 -0.32 118.68 118.65 1za5 s LEU 280 Ca 0.27 -0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 1za5 s LEU 280 Cb 0.19 -1.42 0.14 0.00 0.03 0.00 0.00 46.19 45.14 1za5 s LEU 280 CO 0.44 0.09 1.10 0.00 0.23 0.00 0.00 176.35 178.21 1za5 s ALA 281 N -1.89 -1.98 0.68 4.21 0.00 -0.30 -4.67 121.76 117.82 1za5 s ALA 281 Ca 0.25 1.62 -0.11 0.00 0.00 0.00 0.00 51.96 53.72 1za5 s ALA 281 Cb -0.08 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.27 1za5 s ALA 281 CO 0.14 -0.35 1.06 -2.14 0.00 0.00 0.00 175.76 174.47 1za5 s PRO 282 N -1.37 3.07 -1.56 0.00 0.02 -1.26 -3.78 135.00 130.12 1za5 s PRO 282 Ca 0.02 0.81 -0.13 0.00 0.02 0.00 0.00 61.00 61.73 1za5 s PRO 282 Cb -0.01 -2.02 0.09 0.00 0.02 0.00 0.00 34.50 32.59 1za5 s PRO 282 CO -0.02 -0.97 0.86 0.09 -0.33 0.00 0.00 177.00 176.64 1za5 n ASN 283 N -3.02 -3.74 0.00 2.53 5.03 -1.26 -4.92 115.26 109.88 1za5 n ASN 283 Ca 0.07 -0.87 0.00 0.00 0.87 0.00 0.00 54.58 54.65 1za5 n ASN 283 Cb 0.54 -3.50 0.00 0.00 -1.02 0.00 0.00 39.78 35.80 1za5 n ASN 283 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1za5 n ALA 284 N -4.55 0.00 -0.50 5.41 0.00 -1.25 -5.12 120.51 114.51 1za5 n ALA 284 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1za5 n ALA 284 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1za5 n ALA 284 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1za5 n GLY 285 N 2.01 -0.06 7.00 0.00 0.00 0.29 -4.76 105.19 109.68 1za5 n GLY 285 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1za5 n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1za5 n GLY 286 N 0.00 -1.48 3.77 -0.02 0.00 -1.22 -4.79 105.19 101.45 1za5 n GLY 286 Ca 0.00 -1.24 -0.38 0.00 0.00 0.00 0.00 46.02 44.40 1za5 n GLY 286 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1za5 s GLU 287 N 0.00 4.24 0.77 1.61 2.12 -1.26 -5.00 118.70 121.19 1za5 s GLU 287 Ca 0.00 0.57 -0.11 0.00 0.36 0.00 0.00 54.97 55.79 1za5 s GLU 287 Cb 0.00 -3.34 0.06 0.00 0.26 0.00 0.00 34.13 31.10 1za5 s GLU 287 CO 0.00 0.38 1.08 -1.25 -0.54 0.00 0.00 175.26 174.93 1za5 s PRO 288 N -0.15 2.27 0.12 4.30 0.04 -1.26 -5.08 135.00 135.24 1za5 s PRO 288 Ca 0.28 0.86 0.01 0.00 0.04 0.00 0.00 61.00 62.19 1za5 s PRO 288 Cb -0.17 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 1za5 s PRO 288 CO 0.14 -1.55 0.05 0.25 0.04 0.00 0.00 177.00 175.93 1za5 n THR 289 N -3.42 0.00 -4.88 1.26 -2.24 -1.26 -4.58 114.28 99.16 1za5 n THR 289 Ca 0.08 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1za5 n THR 289 Cb 0.55 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1za5 n THR 289 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1za5 n GLY 290 N 1.17 0.84 0.37 3.38 0.00 -1.26 -2.91 105.19 106.77 1za5 n GLY 290 Ca -0.01 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.36 1za5 n GLY 290 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1za5 h LYS 291 N 0.00 1.02 -0.17 1.61 1.57 -1.99 -1.92 116.57 116.68 1za5 h LYS 291 Ca 0.00 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1za5 h LYS 291 Cb 0.00 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 1za5 h LYS 291 CO 0.00 0.67 0.08 0.28 -0.57 0.00 0.00 179.45 179.91 1za5 h VAL 292 N 1.05 1.15 -0.58 0.50 2.07 -1.96 -0.77 116.25 117.71 1za5 h VAL 292 Ca 0.43 -0.43 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1za5 h VAL 292 Cb 0.29 1.11 -0.05 0.00 -1.52 0.00 0.00 31.29 31.12 1za5 h VAL 292 CO -0.19 0.14 0.29 0.00 0.02 0.00 0.00 177.57 177.83 1za5 h ALA 293 N 0.93 0.76 -0.31 1.67 0.00 -1.30 -0.15 119.26 120.86 1za5 h ALA 293 Ca 0.06 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1za5 h ALA 293 Cb 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1za5 h ALA 293 CO -0.01 -0.06 0.15 0.93 0.00 0.00 0.00 179.25 180.26 1za5 h GLU 294 N 0.54 0.45 -0.54 0.00 5.08 -1.11 -0.92 114.58 118.08 1za5 h GLU 294 Ca 0.27 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1za5 h GLU 294 Cb 0.21 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1za5 h GLU 294 CO -0.20 0.43 0.33 0.00 -1.00 0.00 0.00 179.01 178.57 1za5 h ALA 295 N 1.00 0.69 -0.52 3.43 0.00 -0.69 -0.25 119.26 122.91 1za5 h ALA 295 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1za5 h ALA 295 Cb 0.13 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1za5 h ALA 295 CO -0.01 0.17 0.16 0.82 0.00 0.00 0.00 179.25 180.38 1za5 h ILE 296 N 0.73 1.23 -0.45 0.00 2.04 -0.87 -2.16 117.51 118.03 1za5 h ILE 296 Ca 0.19 -0.79 -0.07 0.00 1.00 0.00 0.00 64.86 65.20 1za5 h ILE 296 Cb -0.03 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 1za5 h ILE 296 CO -0.04 0.29 0.01 0.00 0.00 0.00 0.00 178.15 178.42 1za5 h ALA 297 N 1.02 1.17 -0.38 1.87 0.00 -0.86 0.14 119.26 122.23 1za5 h ALA 297 Ca 0.17 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1za5 h ALA 297 Cb 0.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1za5 h ALA 297 CO -0.00 0.54 -0.18 0.00 0.00 0.00 0.00 179.25 179.61 1za5 h ALA 298 N 1.32 0.97 0.00 0.00 0.00 -0.74 0.89 119.26 121.70 1za5 h ALA 298 Ca 0.14 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.39 1za5 h ALA 298 Cb 0.41 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1za5 h ALA 298 CO 0.02 0.60 -1.87 0.43 0.00 0.00 0.00 179.25 178.42 1za5 n SER 299 N -4.14 0.74 -0.17 0.00 7.64 -0.84 -4.50 113.62 112.36 1za5 n SER 299 Ca 0.01 0.31 0.03 0.00 1.01 0.00 0.00 58.87 60.23 1za5 n SER 299 Cb 0.40 0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1za5 n SER 299 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1za5 n PHE 300 N -3.00 0.00 0.00 1.43 3.72 0.02 -4.95 117.46 114.68 1za5 n PHE 300 Ca -0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 1za5 n PHE 300 Cb 1.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.61 1za5 n PHE 300 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1za5 n GLY 301 N 0.75 2.57 3.51 1.37 0.00 0.31 -4.58 105.19 109.11 1za5 n GLY 301 Ca 0.03 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 1za5 n GLY 301 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1za5 s SER 302 N 0.00 -0.19 0.22 1.61 1.04 -1.26 -4.68 113.70 110.44 1za5 s SER 302 Ca 0.00 -0.59 -0.05 0.00 0.48 0.00 0.00 55.95 55.79 1za5 s SER 302 Cb 0.00 0.56 0.20 0.00 0.10 0.00 0.00 66.02 66.88 1za5 s SER 302 CO 0.00 -1.04 1.68 0.15 0.98 0.00 0.00 173.24 175.00 1za5 h PHE 303 N 2.26 0.97 -0.53 5.02 3.57 -1.91 -2.31 116.94 124.01 1za5 h PHE 303 Ca -0.29 -0.17 0.06 0.00 3.53 0.00 0.00 57.97 61.10 1za5 h PHE 303 Cb 1.25 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1za5 h PHE 303 CO 0.37 0.91 0.25 0.00 -2.23 0.00 0.00 178.31 177.61 1za5 h ALA 304 N 1.11 0.67 -0.22 2.41 0.00 -1.96 0.23 119.26 121.50 1za5 h ALA 304 Ca 0.14 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1za5 h ALA 304 Cb 0.58 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1za5 h ALA 304 CO 0.04 -0.12 0.06 -0.44 0.00 0.00 0.00 179.25 178.79 1za5 h ASP 305 N 0.47 0.33 -0.14 0.00 3.45 -1.83 -1.65 116.42 117.05 1za5 h ASP 305 Ca 0.24 -0.21 0.04 0.00 0.43 0.00 0.00 57.03 57.53 1za5 h ASP 305 Cb 0.19 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.83 1za5 h ASP 305 CO -0.19 0.46 -0.12 0.15 -1.57 0.00 0.00 179.24 177.97 1za5 h PHE 306 N 0.18 -0.29 -0.18 4.55 3.57 -0.85 -1.14 116.94 122.79 1za5 h PHE 306 Ca 0.07 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.63 1za5 h PHE 306 Cb 0.25 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 1za5 h PHE 306 CO 0.01 -0.18 -0.08 -0.22 -2.23 0.00 0.00 178.31 175.61 1za5 h LYS 307 N -0.13 -0.05 -0.12 1.11 3.64 -0.42 0.14 116.57 120.73 1za5 h LYS 307 Ca 0.09 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1za5 h LYS 307 Cb 0.27 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1za5 h LYS 307 CO -0.22 -0.04 0.02 0.00 -2.27 0.00 0.00 179.45 176.94 1za5 h ALA 308 N 1.11 0.12 -0.78 5.00 0.00 -1.08 0.55 119.26 124.18 1za5 h ALA 308 Ca 0.10 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1za5 h ALA 308 Cb 0.20 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1za5 h ALA 308 CO -0.22 -0.44 0.51 1.96 0.00 0.00 0.00 179.25 181.07 1za5 h GLN 309 N 0.07 1.01 -0.05 0.00 4.20 -0.85 0.17 115.11 119.65 1za5 h GLN 309 Ca 0.05 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1za5 h GLN 309 Cb 0.05 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.60 1za5 h GLN 309 CO -0.08 0.67 0.01 0.35 -0.67 0.00 0.00 178.83 179.11 1za5 h PHE 310 N 1.04 0.09 -0.38 2.96 3.57 -0.40 -1.24 116.94 122.58 1za5 h PHE 310 Ca 0.29 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.80 1za5 h PHE 310 Cb -0.10 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 1za5 h PHE 310 CO -0.02 0.28 0.21 1.15 -2.23 0.00 0.00 178.31 177.70 1za5 h THR 311 N -0.13 1.02 -0.46 4.41 2.02 -0.64 -0.92 112.91 118.21 1za5 h THR 311 Ca 0.02 -0.15 0.04 0.00 0.77 0.00 0.00 66.41 67.09 1za5 h THR 311 Cb 0.24 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 1za5 h THR 311 CO 0.00 0.08 0.23 -0.78 0.37 0.00 0.00 175.52 175.42 1za5 h ASP 312 N 0.43 0.33 -0.69 4.18 1.82 -0.54 -0.51 116.42 121.44 1za5 h ASP 312 Ca 0.15 0.02 -0.07 0.00 -0.39 0.00 0.00 57.03 56.74 1za5 h ASP 312 Cb 0.02 -0.04 -0.03 0.00 0.68 0.00 0.00 39.33 39.97 1za5 h ASP 312 CO -0.08 0.23 0.15 0.00 -1.61 0.00 0.00 179.24 177.93 1za5 h ALA 313 N 1.24 0.91 -0.51 -0.78 0.00 -0.89 -0.31 119.26 118.93 1za5 h ALA 313 Ca 0.20 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1za5 h ALA 313 Cb 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1za5 h ALA 313 CO -0.14 0.65 0.07 0.00 0.00 0.00 0.00 179.25 179.83 1za5 h ALA 314 N 1.07 0.68 -0.08 0.00 0.00 -0.78 -0.74 119.26 119.41 1za5 h ALA 314 Ca 0.21 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1za5 h ALA 314 Cb 0.40 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1za5 h ALA 314 CO 0.01 0.43 -0.54 0.82 0.00 0.00 0.00 179.25 179.97 1za5 h ILE 315 N 0.73 1.36 0.00 0.00 2.04 -0.92 -3.05 117.51 117.68 1za5 h ILE 315 Ca 0.15 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1za5 h ILE 315 Cb 0.42 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 1za5 h ILE 315 CO 0.01 0.54 -0.16 0.29 0.00 0.00 0.00 178.15 178.83 1za5 n LYS 316 N -3.92 0.17 -1.61 2.37 5.02 -0.14 -4.77 118.16 115.27 1za5 n LYS 316 Ca -0.02 0.11 -0.39 0.00 -2.02 0.00 0.00 58.31 55.99 1za5 n LYS 316 Cb 0.57 -1.67 -0.03 0.00 -0.02 0.00 0.00 35.03 33.88 1za5 n LYS 316 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1za5 s ASN 317 N -3.90 4.86 -0.01 4.39 3.84 -0.31 -4.89 114.94 118.93 1za5 s ASN 317 Ca 0.11 1.33 -0.30 0.00 0.21 0.00 0.00 52.86 54.21 1za5 s ASN 317 Cb 0.15 -2.51 -0.05 0.00 -0.55 0.00 0.00 41.25 38.29 1za5 s ASN 317 CO 0.61 -2.51 1.31 0.12 -2.79 0.00 0.00 177.10 173.84 1za5 s PHE 318 N 10.58 3.04 0.00 0.43 5.36 -1.26 -4.78 117.98 131.34 1za5 s PHE 318 Ca 0.97 1.00 0.00 0.00 -0.96 0.00 0.00 56.93 57.94 1za5 s PHE 318 Cb -0.22 -3.56 0.00 0.00 -0.34 0.00 0.00 43.02 38.90 1za5 s PHE 318 CO 0.29 -1.95 0.00 0.41 -1.46 0.00 0.00 175.22 172.51 1za5 n GLY 319 N 3.50 0.07 3.85 13.12 0.00 -1.26 -4.86 105.19 119.63 1za5 n GLY 319 Ca 0.12 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.59 1za5 n GLY 319 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1za5 s SER 320 N -4.00 6.75 0.00 1.61 0.01 -1.26 -4.74 113.70 112.07 1za5 s SER 320 Ca 0.00 0.98 0.00 0.00 1.31 0.00 0.00 55.95 58.24 1za5 s SER 320 Cb 0.00 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.98 1za5 s SER 320 CO 0.00 0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.36 1za5 n GLY 321 N 0.71 -1.22 2.99 3.44 0.00 -1.26 -0.68 105.19 109.17 1za5 n GLY 321 Ca -0.05 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.84 1za5 n GLY 321 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1za5 s TRP 322 N -3.00 0.41 -0.09 1.61 0.52 -0.46 -0.87 118.94 117.07 1za5 s TRP 322 Ca 0.00 -0.36 0.04 0.00 0.02 0.00 0.00 56.10 55.81 1za5 s TRP 322 Cb 0.00 -0.26 -0.00 0.00 -1.15 0.00 0.00 33.47 32.06 1za5 s TRP 322 CO 0.00 -0.09 -0.23 0.99 0.02 0.00 0.00 176.95 177.64 1za5 s THR 323 N -0.97 1.99 0.20 2.01 2.01 -0.98 0.04 115.64 119.94 1za5 s THR 323 Ca -0.08 -1.00 0.08 0.00 0.31 0.00 0.00 61.69 61.00 1za5 s THR 323 Cb -0.07 -1.72 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 1za5 s THR 323 CO -0.00 0.55 -0.16 0.26 -0.69 0.00 0.00 174.62 174.58 1za5 s TRP 324 N 0.22 1.77 -0.22 4.92 0.52 0.22 -1.93 118.94 124.45 1za5 s TRP 324 Ca -0.14 -0.52 -0.04 0.00 0.02 0.00 0.00 56.10 55.41 1za5 s TRP 324 Cb -0.17 -0.84 -0.01 0.00 -1.15 0.00 0.00 33.47 31.31 1za5 s TRP 324 CO 0.07 0.37 -0.04 -1.17 0.02 0.00 0.00 176.95 176.20 1za5 s LEU 325 N -3.11 2.92 0.27 2.99 2.96 -0.54 -1.36 118.68 122.80 1za5 s LEU 325 Ca 0.21 -0.38 0.06 0.00 -0.22 0.00 0.00 54.13 53.80 1za5 s LEU 325 Cb -0.03 -1.74 -0.06 0.00 0.50 0.00 0.00 46.19 44.86 1za5 s LEU 325 CO 0.07 -0.01 -0.05 0.68 -1.32 0.00 0.00 176.35 175.72 1za5 s VAL 326 N 1.43 1.52 -0.28 1.68 -7.23 0.63 -1.00 120.40 117.15 1za5 s VAL 326 Ca 0.05 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.09 1za5 s VAL 326 Cb -0.14 -2.41 0.04 0.00 0.56 0.00 0.00 36.38 34.42 1za5 s VAL 326 CO -0.03 -0.32 -0.01 -0.75 -0.31 0.00 0.00 175.10 173.68 1za5 s LYS 327 N -3.75 2.65 0.86 4.82 2.20 -0.22 -0.96 119.74 125.33 1za5 s LYS 327 Ca 0.29 -1.12 -0.11 0.00 -0.36 0.00 0.00 55.97 54.67 1za5 s LYS 327 Cb 0.04 -3.13 0.10 0.00 -1.51 0.00 0.00 37.83 33.33 1za5 s LYS 327 CO 0.11 -0.52 1.09 -0.80 -0.36 0.00 0.00 175.35 174.87 1za5 s ASN 328 N 1.31 3.84 0.62 1.43 0.01 0.74 -0.86 114.94 122.03 1za5 s ASN 328 Ca -0.02 1.53 0.33 0.00 -0.71 0.00 0.00 52.86 53.99 1za5 s ASN 328 Cb -0.18 -2.23 1.86 0.00 0.41 0.00 0.00 41.25 41.11 1za5 s ASN 328 CO -0.02 -2.41 2.16 0.77 -1.51 0.00 0.00 177.10 176.09 1za5 h SER 329 N -1.39 0.00 -0.18 -1.22 4.64 -1.87 0.55 113.55 114.07 1za5 h SER 329 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1za5 h SER 329 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1za5 h SER 329 CO 0.55 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.61 1za5 n ASP 330 N -3.51 1.10 0.00 4.97 3.85 -1.26 -4.89 116.55 116.80 1za5 n ASP 330 Ca -0.01 -1.89 0.00 0.00 -0.71 0.00 0.00 54.79 52.18 1za5 n ASP 330 Cb 0.24 -0.12 0.00 0.00 -1.35 0.00 0.00 41.12 39.88 1za5 n ASP 330 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1za5 n GLY 331 N 0.88 2.40 3.86 6.12 0.00 0.19 -5.03 105.19 113.61 1za5 n GLY 331 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1za5 n GLY 331 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1za5 s LYS 332 N -0.34 3.83 0.21 1.61 -0.14 -1.26 -4.76 119.74 118.90 1za5 s LYS 332 Ca 0.00 0.68 -0.00 0.00 -1.36 0.00 0.00 55.97 55.28 1za5 s LYS 332 Cb 0.00 -2.27 -0.04 0.00 -1.68 0.00 0.00 37.83 33.84 1za5 s LYS 332 CO 0.00 -0.16 0.40 -0.51 -0.76 0.00 0.00 175.35 174.32 1za5 s LEU 333 N -4.02 4.22 0.14 3.17 1.43 -1.26 -0.18 118.68 122.16 1za5 s LEU 333 Ca 0.54 0.39 -0.19 0.00 -1.03 0.00 0.00 54.13 53.84 1za5 s LEU 333 Cb -0.10 -3.17 0.05 0.00 0.03 0.00 0.00 46.19 43.00 1za5 s LEU 333 CO 0.33 -0.06 0.50 0.00 0.23 0.00 0.00 176.35 177.34 1za5 s ALA 334 N -1.90 -1.25 -0.19 4.21 0.00 -0.13 -4.90 121.76 117.60 1za5 s ALA 334 Ca 0.38 0.22 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1za5 s ALA 334 Cb -0.11 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 1za5 s ALA 334 CO 0.29 -0.69 -0.01 0.42 0.00 0.00 0.00 175.76 175.77 1za5 s ILE 335 N -3.72 3.92 0.06 0.00 1.01 -1.26 -0.27 121.20 120.94 1za5 s ILE 335 Ca 0.02 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1za5 s ILE 335 Cb 0.00 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.69 1za5 s ILE 335 CO -0.12 0.45 -0.07 0.68 0.00 0.00 0.00 174.94 175.88 1za5 s VAL 336 N 0.81 0.53 0.09 2.92 -7.23 -0.47 -4.98 120.40 112.07 1za5 s VAL 336 Ca -0.00 -1.39 0.09 0.00 -1.81 0.00 0.00 61.98 58.88 1za5 s VAL 336 Cb -0.14 -0.98 -0.03 0.00 0.56 0.00 0.00 36.38 35.78 1za5 s VAL 336 CO 0.02 -0.59 -0.24 -0.44 -0.31 0.00 0.00 175.10 173.54 1za5 s SER 337 N -2.12 2.88 0.18 4.85 0.01 -1.26 0.73 113.70 118.96 1za5 s SER 337 Ca -0.02 -0.66 0.09 0.00 1.31 0.00 0.00 55.95 56.67 1za5 s SER 337 Cb -0.04 -0.20 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1za5 s SER 337 CO -0.02 0.15 -0.19 0.42 0.41 0.00 0.00 173.24 174.01 1za5 s THR 338 N -1.00 1.96 -0.07 1.44 -4.23 0.11 -4.99 115.64 108.87 1za5 s THR 338 Ca 0.10 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 58.56 1za5 s THR 338 Cb -0.10 -1.95 -0.04 0.00 1.34 0.00 0.00 72.50 71.75 1za5 s THR 338 CO 0.04 -0.31 0.13 -0.55 -0.54 0.00 0.00 174.62 173.38 1za5 s SER 339 N -2.79 6.12 1.55 3.99 0.15 -1.26 -1.35 113.70 120.11 1za5 s SER 339 Ca 0.18 0.34 0.00 0.00 0.70 0.00 0.00 55.95 57.18 1za5 s SER 339 Cb -0.06 -1.90 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 1za5 s SER 339 CO 0.08 0.34 0.00 0.59 1.20 0.00 0.00 173.24 175.45 1za5 n ASN 340 N 1.57 0.00 -1.34 5.45 5.03 0.14 -0.96 115.26 125.15 1za5 n ASN 340 Ca -0.16 0.00 0.12 0.00 0.87 0.00 0.00 54.58 55.41 1za5 n ASN 340 Cb 0.54 0.00 0.31 0.00 -1.02 0.00 0.00 39.78 39.61 1za5 n ASN 340 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1za5 n ALA 341 N 10.29 2.39 -1.57 5.41 0.00 -1.26 -4.30 120.51 131.47 1za5 n ALA 341 Ca 0.00 -1.25 -0.38 0.00 0.00 0.00 0.00 53.44 51.81 1za5 n ALA 341 Cb 0.00 -0.93 0.05 0.00 0.00 0.00 0.00 19.45 18.57 1za5 n ALA 341 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1za5 n GLY 342 N 1.66 -0.69 3.24 0.00 0.00 -0.14 -4.56 105.19 104.71 1za5 n GLY 342 Ca 0.24 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1za5 n GLY 342 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1za5 s THR 343 N -1.58 0.02 -0.38 2.61 -1.32 -1.26 -4.75 115.64 108.98 1za5 s THR 343 Ca 0.74 -0.20 0.17 0.00 -1.21 0.00 0.00 61.69 61.19 1za5 s THR 343 Cb -0.42 -0.55 0.17 0.00 -1.51 0.00 0.00 72.50 70.19 1za5 s THR 343 CO 0.49 -0.11 1.53 -2.65 -2.21 0.00 0.00 174.62 171.67 1za5 n PRO 344 N 2.17 0.11 0.31 7.08 -0.02 -1.26 -2.19 135.00 141.21 1za5 n PRO 344 Ca -0.17 0.60 0.20 0.00 -2.02 0.00 0.00 63.50 62.11 1za5 n PRO 344 Cb 0.57 -1.86 1.03 0.00 -0.02 0.00 0.00 33.50 33.22 1za5 n PRO 344 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1za5 h LEU 345 N 0.00 0.00 -0.64 2.45 3.38 -1.96 -0.05 115.31 118.49 1za5 h LEU 345 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1za5 h LEU 345 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1za5 h LEU 345 CO 0.00 0.01 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1za5 n THR 346 N -3.18 0.18 -3.89 0.22 -2.24 -0.93 -4.83 114.28 99.61 1za5 n THR 346 Ca -0.02 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1za5 n THR 346 Cb 0.15 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1za5 n THR 346 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1za5 n THR 347 N -0.08 0.00 1.18 4.28 -2.24 -0.03 -5.05 114.28 112.33 1za5 n THR 347 Ca 0.11 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.02 1za5 n THR 347 Cb 0.18 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.66 1za5 n THR 347 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1za5 n ASP 348 N -1.31 2.46 -4.78 3.42 8.00 -1.26 -4.94 116.55 118.14 1za5 n ASP 348 Ca 0.00 -1.82 -0.38 0.00 0.71 0.00 0.00 54.79 53.31 1za5 n ASP 348 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 1za5 n ASP 348 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1za5 s ALA 349 N -2.01 3.33 -0.32 2.24 0.00 -1.26 -4.16 121.76 119.58 1za5 s ALA 349 Ca 0.31 0.42 -0.15 0.00 0.00 0.00 0.00 51.96 52.54 1za5 s ALA 349 Cb 0.20 -3.06 -0.02 0.00 0.00 0.00 0.00 23.12 20.25 1za5 s ALA 349 CO 0.32 0.24 0.39 0.99 0.00 0.00 0.00 175.76 177.69 1za5 s THR 350 N -1.43 5.15 0.24 0.00 2.01 -0.04 -4.54 115.64 117.03 1za5 s THR 350 Ca 0.44 0.27 -0.30 0.00 0.31 0.00 0.00 61.69 62.41 1za5 s THR 350 Cb -0.20 -3.80 -0.10 0.00 0.01 0.00 0.00 72.50 68.41 1za5 s THR 350 CO 0.25 -0.02 1.45 -2.84 -0.69 0.00 0.00 174.62 172.77 1za5 s PRO 351 N 2.09 4.26 -0.03 4.92 0.02 -1.26 -1.06 135.00 143.94 1za5 s PRO 351 Ca 0.14 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.47 1za5 s PRO 351 Cb -0.16 -3.12 -0.03 0.00 0.02 0.00 0.00 34.50 31.21 1za5 s PRO 351 CO 0.11 -0.43 -0.00 1.28 -0.33 0.00 0.00 177.00 177.63 1za5 n LEU 352 N 2.50 0.82 -3.63 -5.54 4.77 -0.17 -4.88 117.00 110.88 1za5 n LEU 352 Ca 0.07 -0.01 -0.15 0.00 -0.03 0.00 0.00 56.01 55.89 1za5 n LEU 352 Cb 0.40 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 1za5 n LEU 352 CO 0.61 0.20 0.27 -0.22 -1.33 0.00 0.00 177.39 176.92 1za5 s LEU 353 N -4.47 -0.11 0.06 2.23 2.96 -1.09 -4.36 118.68 113.91 1za5 s LEU 353 Ca -0.02 0.66 -0.11 0.00 -0.22 0.00 0.00 54.13 54.44 1za5 s LEU 353 Cb 0.01 2.03 0.01 0.00 0.50 0.00 0.00 46.19 48.73 1za5 s LEU 353 CO 0.10 -0.45 0.23 0.28 -1.32 0.00 0.00 176.35 175.19 1za5 s THR 354 N -0.82 0.11 -0.06 3.68 -1.32 -1.26 -1.47 115.64 114.51 1za5 s THR 354 Ca -0.09 -0.92 0.01 0.00 -1.21 0.00 0.00 61.69 59.48 1za5 s THR 354 Cb -0.03 -1.08 0.02 0.00 -1.51 0.00 0.00 72.50 69.91 1za5 s THR 354 CO 0.06 -0.51 -0.06 0.54 -2.21 0.00 0.00 174.62 172.44 1za5 s VAL 355 N -3.08 0.68 -0.22 5.08 0.11 -0.81 -4.89 120.40 117.26 1za5 s VAL 355 Ca -0.01 -0.19 -0.28 0.00 -2.93 0.00 0.00 61.98 58.57 1za5 s VAL 355 Cb 0.01 -0.69 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1za5 s VAL 355 CO -0.07 0.26 0.98 -0.62 -3.33 0.00 0.00 175.10 172.33 1za5 s ASP 356 N 1.01 7.04 -0.14 3.54 3.68 -1.26 -2.32 116.67 128.21 1za5 s ASP 356 Ca -0.09 1.30 0.16 0.00 2.13 0.00 0.00 52.55 56.04 1za5 s ASP 356 Cb -0.14 -2.51 0.48 0.00 -1.45 0.00 0.00 42.92 39.29 1za5 s ASP 356 CO -0.00 -0.61 1.38 1.33 0.13 0.00 0.00 175.17 177.40 1za5 n VAL 357 N 5.23 2.04 -2.11 1.11 0.24 -0.05 -4.80 118.33 119.99 1za5 n VAL 357 Ca 0.10 -1.74 -0.39 0.00 -2.04 0.00 0.00 64.34 60.27 1za5 n VAL 357 Cb 0.47 -0.12 -0.01 0.00 -1.47 0.00 0.00 33.84 32.71 1za5 n VAL 357 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1za5 s TRP 358 N -2.50 2.90 0.57 6.34 0.52 -1.22 -4.41 118.94 121.14 1za5 s TRP 358 Ca 0.38 1.44 0.27 0.00 0.02 0.00 0.00 56.10 58.21 1za5 s TRP 358 Cb 0.30 -3.62 1.59 0.00 -1.15 0.00 0.00 33.47 30.59 1za5 s TRP 358 CO 0.10 -1.91 2.11 0.93 0.02 0.00 0.00 176.95 178.19 1za5 h GLU 359 N 2.77 0.00 0.00 4.98 5.08 -1.93 -1.08 114.58 124.41 1za5 h GLU 359 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1za5 h GLU 359 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1za5 h GLU 359 CO 0.63 0.00 0.00 1.12 -1.00 0.00 0.00 179.01 179.76 1za5 h HIS 360 N 0.00 0.00 0.00 4.33 2.07 -1.97 0.10 115.15 119.68 1za5 h HIS 360 Ca 0.09 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.56 1za5 h HIS 360 Cb 0.46 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.43 1za5 h HIS 360 CO 0.00 0.00 -0.22 0.00 -3.07 0.00 0.00 177.93 174.64 1za5 h ALA 361 N 2.00 1.02 0.00 6.11 0.00 -1.50 -3.38 119.26 123.51 1za5 h ALA 361 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1za5 h ALA 361 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1za5 h ALA 361 CO 0.00 0.28 0.00 2.48 0.00 0.00 0.00 179.25 182.01 1za5 n TYR 362 N -3.39 0.00 0.13 0.00 4.11 -0.85 -4.91 117.16 112.26 1za5 n TYR 362 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.90 57.96 1za5 n TYR 362 Cb 0.43 0.00 0.52 0.00 -0.00 0.00 0.00 39.34 40.28 1za5 n TYR 362 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.86 175.94 1za5 h TYR 363 N 0.00 0.24 -0.53 -3.48 3.20 -1.01 0.50 116.97 115.89 1za5 h TYR 363 Ca 0.00 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.77 1za5 h TYR 363 Cb 0.10 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1za5 h TYR 363 CO 0.00 0.18 -0.08 0.82 -1.64 0.00 0.00 178.16 177.44 1za5 h ILE 364 N 0.26 1.26 0.00 1.81 2.04 -1.85 -1.23 117.51 119.80 1za5 h ILE 364 Ca 0.07 -1.22 -0.13 0.00 1.00 0.00 0.00 64.86 64.58 1za5 h ILE 364 Cb 0.03 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1za5 h ILE 364 CO -0.01 0.43 -1.75 0.47 0.00 0.00 0.00 178.15 177.29 1za5 n ASP 365 N -4.15 0.40 0.00 1.72 10.43 -0.86 -4.66 116.55 119.42 1za5 n ASP 365 Ca 0.02 0.17 0.00 0.00 2.57 0.00 0.00 54.79 57.55 1za5 n ASP 365 Cb 0.38 0.98 0.00 0.00 1.84 0.00 0.00 41.12 44.32 1za5 n ASP 365 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 1za5 n TYR 366 N -2.62 0.00 -1.20 1.24 4.02 0.17 -5.06 117.16 113.71 1za5 n TYR 366 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 1za5 n TYR 366 Cb 0.78 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.10 1za5 n TYR 366 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1za5 n ARG 367 N -0.13 0.00 0.00 -0.72 5.12 -0.47 -1.07 116.66 119.39 1za5 n ARG 367 Ca 0.00 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 56.04 1za5 n ARG 367 Cb 0.10 0.00 0.59 0.00 -1.16 0.00 0.00 32.46 31.99 1za5 n ARG 367 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1za5 n ASN 368 N 2.94 0.00 -3.54 0.55 0.23 -1.26 -4.29 115.26 109.89 1za5 n ASN 368 Ca 0.00 0.02 -0.39 0.00 -0.53 0.00 0.00 54.58 53.68 1za5 n ASN 368 Cb 0.00 -0.31 -0.02 0.00 -2.08 0.00 0.00 39.78 37.36 1za5 n ASN 368 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1za5 n ALA 369 N -1.31 5.38 -0.19 -2.53 0.00 -0.23 -4.72 120.51 116.90 1za5 n ALA 369 Ca 0.11 -3.41 0.12 0.00 0.00 0.00 0.00 53.44 50.25 1za5 n ALA 369 Cb 0.20 -3.45 0.43 0.00 0.00 0.00 0.00 19.45 16.63 1za5 n ALA 369 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1za5 h ARG 370 N 6.25 0.56 -0.50 0.00 2.43 -1.84 -0.89 114.38 120.39 1za5 h ARG 370 Ca 0.60 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.69 1za5 h ARG 370 Cb 0.50 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 1za5 h ARG 370 CO 1.82 0.37 0.16 -1.35 -1.51 0.00 0.00 179.97 179.46 1za5 h PRO 371 N 0.58 0.74 -0.56 0.20 0.11 -1.98 -0.26 132.00 130.82 1za5 h PRO 371 Ca 0.37 -0.13 -0.11 0.00 0.11 0.00 0.00 66.00 66.25 1za5 h PRO 371 Cb 0.64 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 1za5 h PRO 371 CO -0.14 0.64 -0.07 0.78 -0.21 0.00 0.00 178.00 179.01 1za5 h GLY 372 N 0.90 1.13 0.91 -0.55 0.00 -1.58 -1.42 103.07 102.47 1za5 h GLY 372 Ca 0.17 -0.89 0.01 0.00 0.00 0.00 0.00 47.33 46.62 1za5 h GLY 372 CO -0.01 0.81 0.08 -1.82 0.00 0.00 0.00 176.54 175.61 1za5 h TYR 373 N 0.93 0.16 -0.74 5.60 3.20 -0.79 -2.01 116.97 123.32 1za5 h TYR 373 Ca 0.15 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.07 1za5 h TYR 373 Cb 0.64 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.82 1za5 h TYR 373 CO 0.04 0.09 0.46 -0.07 -1.64 0.00 0.00 178.16 177.04 1za5 h LEU 374 N 0.18 0.74 -0.60 2.82 -0.00 -0.89 0.18 115.31 117.74 1za5 h LEU 374 Ca 0.07 0.00 0.07 0.00 -0.00 0.00 0.00 57.88 58.03 1za5 h LEU 374 Cb 0.02 -0.15 -0.06 0.00 -0.00 0.00 0.00 40.66 40.47 1za5 h LEU 374 CO -0.06 0.50 0.29 -0.08 -0.00 0.00 0.00 178.44 179.10 1za5 h GLU 375 N 0.88 0.52 0.00 1.13 4.81 -0.82 -1.46 114.58 119.64 1za5 h GLU 375 Ca 0.30 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 1za5 h GLU 375 Cb 0.06 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1za5 h GLU 375 CO -0.13 0.34 -0.40 0.45 -0.73 0.00 0.00 179.01 178.55 1za5 h HIS 376 N 0.54 0.00 -0.76 0.92 3.86 -0.72 -3.05 115.15 115.94 1za5 h HIS 376 Ca 0.28 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 1za5 h HIS 376 Cb 0.25 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.68 1za5 h HIS 376 CO -0.11 0.40 0.45 0.35 0.86 0.00 0.00 177.93 179.88 1za5 h PHE 377 N 0.00 1.01 -0.27 2.45 3.57 0.36 -2.22 116.94 121.85 1za5 h PHE 377 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1za5 h PHE 377 Cb 1.17 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 1za5 h PHE 377 CO 0.00 0.68 0.16 -1.49 -2.23 0.00 0.00 178.31 175.43 1za5 h TRP 378 N 1.04 0.34 0.00 0.41 4.06 -1.27 -0.57 115.95 119.97 1za5 h TRP 378 Ca 0.27 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.23 1za5 h TRP 378 Cb -0.03 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 28.02 1za5 h TRP 378 CO -0.01 0.23 0.00 0.00 -3.56 0.00 0.00 178.44 175.10 1za5 n ALA 379 N -2.50 1.83 0.50 1.49 0.00 -0.84 -3.25 120.51 117.75 1za5 n ALA 379 Ca 0.01 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.46 1za5 n ALA 379 Cb 0.08 -1.32 -0.06 0.00 0.00 0.00 0.00 19.45 18.15 1za5 n ALA 379 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1za5 n LEU 380 N -1.65 0.50 -4.67 0.00 4.77 -0.25 -3.43 117.00 112.27 1za5 n LEU 380 Ca 0.04 -0.49 -0.51 0.00 -0.03 0.00 0.00 56.01 55.03 1za5 n LEU 380 Cb 0.23 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.26 1za5 n LEU 380 CO 0.18 0.13 1.26 0.52 -1.33 0.00 0.00 177.39 178.14 1za5 n VAL 381 N -1.27 0.25 -2.98 4.08 0.31 -1.01 -1.14 118.33 116.57 1za5 n VAL 381 Ca 0.02 -0.05 -0.44 0.00 -0.01 0.00 0.00 64.34 63.86 1za5 n VAL 381 Cb 0.17 -1.43 -0.02 0.00 -0.91 0.00 0.00 33.84 31.66 1za5 n VAL 381 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1za5 s ASN 382 N 2.42 6.78 0.60 4.52 3.04 0.57 -0.54 114.94 132.32 1za5 s ASN 382 Ca 0.89 -2.40 0.39 0.00 0.04 0.00 0.00 52.86 51.78 1za5 s ASN 382 Cb -0.83 -2.38 1.99 0.00 -1.54 0.00 0.00 41.25 38.49 1za5 s ASN 382 CO 0.50 -0.92 2.19 -0.50 -3.04 0.00 0.00 177.10 175.34 1za5 h TRP 383 N 8.24 0.00 -0.33 0.43 4.06 -1.90 -1.88 115.95 124.57 1za5 h TRP 383 Ca 0.20 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.08 1za5 h TRP 383 Cb 0.98 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.13 1za5 h TRP 383 CO 1.13 0.00 -0.04 1.49 -3.56 0.00 0.00 178.44 177.46 1za5 h GLU 384 N 0.00 0.62 -0.48 0.49 4.81 -1.96 0.18 114.58 118.23 1za5 h GLU 384 Ca 0.00 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 1za5 h GLU 384 Cb 0.18 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1za5 h GLU 384 CO 0.00 0.77 0.12 0.35 -0.73 0.00 0.00 179.01 179.52 1za5 h PHE 385 N 0.41 0.80 -0.81 0.92 3.57 -1.64 -1.73 116.94 118.45 1za5 h PHE 385 Ca 0.09 -0.09 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1za5 h PHE 385 Cb 0.51 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 1za5 h PHE 385 CO 0.04 0.72 0.52 0.28 -2.23 0.00 0.00 178.31 177.64 1za5 h VAL 386 N 0.65 1.11 -0.51 1.41 2.07 -1.26 -0.65 116.25 119.07 1za5 h VAL 386 Ca 0.15 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.30 1za5 h VAL 386 Cb 0.32 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1za5 h VAL 386 CO 0.00 0.18 0.22 0.00 0.02 0.00 0.00 177.57 177.99 1za5 h ALA 387 N 1.35 0.66 -0.83 1.67 0.00 -0.63 -0.90 119.26 120.58 1za5 h ALA 387 Ca 0.33 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1za5 h ALA 387 Cb 0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1za5 h ALA 387 CO -0.12 0.26 0.53 -0.22 0.00 0.00 0.00 179.25 179.71 1za5 h LYS 388 N 0.69 1.11 -0.72 0.00 3.64 -0.68 0.02 116.57 120.63 1za5 h LYS 388 Ca 0.17 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1za5 h LYS 388 Cb 0.18 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1za5 h LYS 388 CO -0.02 0.75 0.23 -0.91 -2.27 0.00 0.00 179.45 177.23 1za5 h ASN 389 N 1.13 1.04 -0.38 4.20 -0.26 -0.78 -1.96 115.58 118.57 1za5 h ASN 389 Ca 0.30 -0.21 -0.15 0.00 -0.56 0.00 0.00 56.30 55.68 1za5 h ASN 389 Cb -0.10 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.88 1za5 h ASN 389 CO -0.06 0.97 -0.35 0.25 -1.06 0.00 0.00 177.43 177.18 1za5 h LEU 390 N 1.06 0.97 -0.02 1.61 5.85 -0.60 -3.23 115.31 120.94 1za5 h LEU 390 Ca 0.23 -0.46 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1za5 h LEU 390 Cb 0.30 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1za5 h LEU 390 CO -0.01 1.23 0.00 0.00 -0.34 0.00 0.00 178.44 179.32 1za5 h ALA 391 N 0.77 1.00 0.00 1.25 0.00 -0.93 -3.51 119.26 117.84 1za5 h ALA 391 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1za5 h ALA 391 Cb 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1za5 h ALA 391 CO 0.09 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.34