#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9h n GLY 224 N 0.00 1.31 1.44 0.00 0.00 -1.26 -4.88 105.19 101.81 1s9h n GLY 224 Ca 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1s9h n GLY 224 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1s9h n MET 225 N 0.00 2.03 0.07 1.61 2.81 -1.26 -4.33 117.12 118.05 1s9h n MET 225 Ca 0.00 -3.23 0.05 0.00 -1.81 0.00 0.00 57.70 52.72 1s9h n MET 225 Cb 0.00 -1.92 -0.03 0.00 -0.71 0.00 0.00 33.22 30.55 1s9h n MET 225 CO 0.00 0.00 0.00 1.49 1.51 0.00 0.00 175.97 178.97 1s9h h GLU 226 N 1.11 0.00 -0.50 0.03 4.57 -2.03 -3.35 114.58 114.41 1s9h h GLU 226 Ca 0.32 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.40 1s9h h GLU 226 Cb 1.81 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.38 1s9h h GLU 226 CO 0.58 0.17 -0.07 1.25 -1.18 0.00 0.00 179.01 179.76 1s9h h LEU 227 N 0.00 0.88 -0.77 1.64 5.85 -2.00 -3.18 115.31 117.73 1s9h h LEU 227 Ca -0.08 -0.26 0.08 0.00 0.84 0.00 0.00 57.88 58.46 1s9h h LEU 227 Cb 1.31 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 1s9h h LEU 227 CO 0.03 0.98 0.43 1.62 -0.34 0.00 0.00 178.44 181.16 1s9h h VAL 228 N 0.81 0.93 -0.77 1.05 3.04 -1.85 0.10 116.25 119.56 1s9h h VAL 228 Ca 0.14 -0.26 0.03 0.00 -1.01 0.00 0.00 66.70 65.60 1s9h h VAL 228 Cb 0.58 0.11 -0.04 0.00 -2.01 0.00 0.00 31.29 29.93 1s9h h VAL 228 CO 0.04 0.14 0.51 1.23 -1.01 0.00 0.00 177.57 178.47 1s9h h GLY 229 N 0.75 1.08 0.69 3.17 0.00 -1.77 -1.39 103.07 105.60 1s9h h GLY 229 Ca 0.36 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1s9h h GLY 229 CO -0.22 0.35 -0.20 -0.25 0.00 0.00 0.00 176.54 176.21 1s9h h TRP 230 N 0.97 0.40 -1.01 5.60 7.01 -1.19 -2.97 115.95 124.77 1s9h h TRP 230 Ca 0.30 -0.14 0.08 0.00 2.11 0.00 0.00 58.89 61.23 1s9h h TRP 230 Cb -0.01 -0.07 -0.07 0.00 -2.10 0.00 0.00 29.16 26.91 1s9h h TRP 230 CO -0.00 0.81 0.65 -0.07 -2.79 0.00 0.00 178.44 177.04 1s9h h LEU 231 N -0.13 1.02 -0.26 0.65 3.38 -0.51 -1.64 115.31 117.83 1s9h h LEU 231 Ca 0.00 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1s9h h LEU 231 Cb 0.79 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1s9h h LEU 231 CO 0.04 0.63 0.15 0.58 0.09 0.00 0.00 178.44 179.94 1s9h h VAL 232 N 1.14 1.10 -0.28 1.22 2.07 -1.25 0.49 116.25 120.74 1s9h h VAL 232 Ca 0.45 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.70 1s9h h VAL 232 Cb 0.23 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1s9h h VAL 232 CO -0.19 0.10 0.08 0.44 0.02 0.00 0.00 177.57 178.02 1s9h h ASP 233 N 0.32 0.42 0.47 0.57 3.32 -1.28 -2.63 116.42 117.62 1s9h h ASP 233 Ca 0.09 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 56.85 1s9h h ASP 233 Cb 0.02 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1s9h h ASP 233 CO -0.02 0.52 -0.38 0.11 -1.72 0.00 0.00 179.24 177.76 1s9h h LYS 234 N 0.29 0.00 -0.16 3.56 6.56 -1.23 -3.47 116.57 122.13 1s9h h LYS 234 Ca 0.09 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.68 1s9h h LYS 234 Cb 0.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 1s9h h LYS 234 CO -0.00 0.38 0.00 0.41 -2.06 0.00 0.00 179.45 178.18 1s9h n GLY 235 N -0.29 0.51 3.70 3.86 0.00 0.16 -5.02 105.19 108.11 1s9h n GLY 235 Ca -0.02 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 1s9h n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s9h s ILE 236 N -2.16 4.94 -0.34 -0.61 1.01 -0.44 -4.60 121.20 119.00 1s9h s ILE 236 Ca 0.00 1.74 0.13 0.00 0.00 0.00 0.00 60.65 62.52 1s9h s ILE 236 Cb 0.00 -4.18 -0.17 0.00 0.01 0.00 0.00 42.46 38.12 1s9h s ILE 236 CO 0.00 0.16 0.43 1.07 0.00 0.00 0.00 174.94 176.61 1s9h n THR 237 N 4.03 0.00 -3.86 2.92 5.66 -1.26 -4.77 114.28 117.01 1s9h n THR 237 Ca 0.03 -0.25 -0.10 0.00 -3.05 0.00 0.00 64.05 60.68 1s9h n THR 237 Cb 0.51 0.62 -0.08 0.00 -1.55 0.00 0.00 70.33 69.82 1s9h n THR 237 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1s9h s SER 238 N -2.85 0.06 0.38 1.09 1.04 -1.26 -4.95 113.70 107.21 1s9h s SER 238 Ca 0.00 -0.43 0.10 0.00 0.48 0.00 0.00 55.95 56.10 1s9h s SER 238 Cb 0.09 0.29 0.87 0.00 0.10 0.00 0.00 66.02 67.37 1s9h s SER 238 CO 0.55 -0.58 1.91 -0.08 0.98 0.00 0.00 173.24 176.03 1s9h h GLU 239 N 3.37 0.60 -0.32 4.02 4.81 -1.97 0.34 114.58 125.44 1s9h h GLU 239 Ca -0.32 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.82 1s9h h GLU 239 Cb 1.19 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1s9h h GLU 239 CO 0.50 0.40 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.95 1s9h h LYS 240 N 0.62 0.56 -0.81 1.92 3.64 -2.00 -1.58 116.57 118.93 1s9h h LYS 240 Ca 0.38 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1s9h h LYS 240 Cb 0.61 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 1s9h h LYS 240 CO -0.15 0.70 0.53 1.96 -2.27 0.00 0.00 179.45 180.23 1s9h h GLN 241 N 0.36 1.03 0.53 1.90 1.08 -1.08 -1.78 115.11 117.15 1s9h h GLN 241 Ca 0.09 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 1s9h h GLN 241 Cb 0.46 -0.23 0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1s9h h GLN 241 CO 0.02 0.68 -0.25 2.35 -0.95 0.00 0.00 178.83 180.68 1s9h h TRP 242 N 1.06 -0.66 -0.59 2.96 7.01 -0.22 -2.08 115.95 123.43 1s9h h TRP 242 Ca 0.31 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.35 1s9h h TRP 242 Cb -0.07 0.22 -0.05 0.00 -2.10 0.00 0.00 29.16 27.16 1s9h h TRP 242 CO -0.02 -0.37 0.30 0.82 -2.79 0.00 0.00 178.44 176.39 1s9h h ILE 243 N -0.81 0.94 -0.06 2.65 2.04 -1.19 0.11 117.51 121.18 1s9h h ILE 243 Ca -0.07 -0.20 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 1s9h h ILE 243 Cb 0.59 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1s9h h ILE 243 CO 0.12 0.10 -0.15 1.56 0.00 0.00 0.00 178.15 179.78 1s9h h GLN 244 N 0.57 0.10 0.00 2.37 4.20 -1.29 -2.53 115.11 118.53 1s9h h GLN 244 Ca 0.27 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.94 1s9h h GLN 244 Cb 0.19 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 1s9h h GLN 244 CO -0.19 0.26 -0.36 0.93 -0.67 0.00 0.00 178.83 178.80 1s9h h GLU 245 N 0.09 0.00 -2.25 1.46 5.08 -0.69 -3.44 114.58 114.84 1s9h h GLU 245 Ca 0.02 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.80 1s9h h GLU 245 Cb 0.33 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.19 1s9h h GLU 245 CO 0.02 0.14 -0.91 -3.47 -1.00 0.00 0.00 179.01 173.79 1s9h n ASP 246 N -4.66 1.12 -0.34 1.42 -0.08 0.34 -4.96 116.55 109.38 1s9h n ASP 246 Ca -0.07 -2.84 0.18 0.00 -1.51 0.00 0.00 54.79 50.55 1s9h n ASP 246 Cb 0.22 -0.64 0.39 0.00 2.34 0.00 0.00 41.12 43.42 1s9h n ASP 246 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1s9h h GLN 247 N 4.57 0.53 0.30 -0.67 4.15 -1.59 -1.84 115.11 120.56 1s9h h GLN 247 Ca 0.15 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 1s9h h GLN 247 Cb 0.83 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 1s9h h GLN 247 CO 0.55 0.35 -0.21 0.00 -1.93 0.00 0.00 178.83 177.59 1s9h h ALA 248 N 1.74 -0.49 -0.01 3.38 0.00 -1.93 0.88 119.26 122.84 1s9h h ALA 248 Ca 0.65 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1s9h h ALA 248 Cb 1.25 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 19.31 1s9h h ALA 248 CO -0.49 -0.79 0.01 0.66 0.00 0.00 0.00 179.25 178.63 1s9h h SER 249 N -0.51 0.00 0.03 0.00 4.64 -1.76 0.47 113.55 116.43 1s9h h SER 249 Ca -0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1s9h h SER 249 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1s9h h SER 249 CO 0.01 0.00 -0.02 0.22 -0.87 0.00 0.00 176.83 176.17 1s9h h TYR 250 N 0.00 -0.04 -0.49 4.77 3.20 -0.80 0.25 116.97 123.86 1s9h h TYR 250 Ca 0.00 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 1s9h h TYR 250 Cb 0.02 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1s9h h TYR 250 CO 0.00 0.45 -0.06 0.82 -1.64 0.00 0.00 178.16 177.72 1s9h h ILE 251 N -0.55 1.26 0.52 1.81 2.04 -0.13 -0.48 117.51 121.99 1s9h h ILE 251 Ca -0.00 -1.15 -0.03 0.00 1.00 0.00 0.00 64.86 64.68 1s9h h ILE 251 Cb 0.50 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1s9h h ILE 251 CO 0.01 0.40 -0.25 -1.28 0.00 0.00 0.00 178.15 177.03 1s9h h SER 252 N 0.79 -0.59 -0.20 1.72 0.87 -0.10 0.29 113.55 116.32 1s9h h SER 252 Ca 0.14 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 1s9h h SER 252 Cb 0.57 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1s9h h SER 252 CO 0.03 -0.27 0.08 0.15 -0.53 0.00 0.00 176.83 176.29 1s9h h PHE 253 N -0.93 0.37 -0.11 2.24 3.57 -0.94 -2.09 116.94 119.05 1s9h h PHE 253 Ca -0.07 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.42 1s9h h PHE 253 Cb 0.61 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1s9h h PHE 253 CO 0.00 0.32 0.00 0.09 -2.23 0.00 0.00 178.31 176.49 1s9h n ASN 254 N -4.40 2.42 -4.72 0.41 3.02 -0.19 -4.87 115.26 106.93 1s9h n ASN 254 Ca 0.01 -1.80 -0.31 0.00 -0.03 0.00 0.00 54.58 52.45 1s9h n ASN 254 Cb 0.15 -0.06 0.13 0.00 -0.61 0.00 0.00 39.78 39.38 1s9h n ASN 254 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s9h s ALA 255 N -1.88 1.75 0.00 5.41 0.00 0.10 -2.41 121.76 124.73 1s9h s ALA 255 Ca 0.34 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.53 1s9h s ALA 255 Cb 0.20 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1s9h s ALA 255 CO 0.31 -2.25 0.00 0.00 0.00 0.00 0.00 175.76 173.81 1s9h n ALA 256 N -3.85 0.00 0.00 0.00 0.00 -1.26 -4.77 120.51 110.63 1s9h n ALA 256 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1s9h n ALA 256 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1s9h n ALA 256 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1s9h n SER 257 N 0.17 0.00 -3.92 0.00 2.88 -1.01 -5.10 113.62 106.63 1s9h n SER 257 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 1s9h n SER 257 Cb 0.00 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.33 1s9h n SER 257 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1s9h s ASN 258 N 0.00 4.56 0.10 -3.46 2.47 -1.24 -4.42 114.94 112.95 1s9h s ASN 258 Ca 0.00 -3.45 -0.31 0.00 0.42 0.00 0.00 52.86 49.52 1s9h s ASN 258 Cb 0.00 -1.63 -0.08 0.00 -1.45 0.00 0.00 41.25 38.09 1s9h s ASN 258 CO 0.00 -0.15 1.48 -0.44 -3.72 0.00 0.00 177.10 174.27 1s9h s SER 259 N -0.89 6.73 0.00 -4.21 0.01 -1.26 -4.90 113.70 109.19 1s9h s SER 259 Ca 0.21 2.38 0.27 0.00 1.31 0.00 0.00 55.95 60.12 1s9h s SER 259 Cb -0.15 -2.58 0.82 0.00 0.21 0.00 0.00 66.02 64.33 1s9h s SER 259 CO -0.09 -0.75 1.63 -1.14 0.41 0.00 0.00 173.24 173.31 1s9h n ARG 260 N 4.50 0.10 -0.09 12.44 3.00 -1.26 -3.54 116.66 131.81 1s9h n ARG 260 Ca 0.13 -0.04 -0.14 0.00 -0.00 0.00 0.00 57.85 57.80 1s9h n ARG 260 Cb 0.41 -1.50 -0.08 0.00 0.00 0.00 0.00 32.46 31.30 1s9h n ARG 260 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1s9h n SER 261 N -1.42 2.34 -0.15 6.15 3.41 -1.26 -4.21 113.62 118.49 1s9h n SER 261 Ca 0.07 -0.02 -0.01 0.00 -0.26 0.00 0.00 58.87 58.65 1s9h n SER 261 Cb 0.33 -0.34 0.23 0.00 -0.26 0.00 0.00 64.21 64.17 1s9h n SER 261 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1s9h h GLN 262 N -0.15 0.85 -0.37 4.33 4.15 -1.98 -0.74 115.11 121.20 1s9h h GLN 262 Ca -0.41 -0.12 -0.12 0.00 0.77 0.00 0.00 58.65 58.77 1s9h h GLN 262 Cb 1.56 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 29.09 1s9h h GLN 262 CO -0.11 0.69 -0.23 0.82 -1.93 0.00 0.00 178.83 178.07 1s9h h ILE 263 N 0.85 1.28 0.18 2.39 2.04 -1.81 -2.46 117.51 119.98 1s9h h ILE 263 Ca 0.20 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1s9h h ILE 263 Cb 0.14 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1s9h h ILE 263 CO -0.02 0.45 -0.09 0.50 0.00 0.00 0.00 178.15 179.00 1s9h h LYS 264 N 0.60 -0.23 -0.94 2.37 3.64 -1.62 -1.68 116.57 118.71 1s9h h LYS 264 Ca 0.08 0.02 0.15 0.00 -1.27 0.00 0.00 60.65 59.62 1s9h h LYS 264 Cb 0.79 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.58 1s9h h LYS 264 CO 0.06 -0.03 0.60 0.00 -2.27 0.00 0.00 179.45 177.81 1s9h h ALA 265 N 0.40 1.76 -0.16 5.00 0.00 -1.17 0.65 119.26 125.73 1s9h h ALA 265 Ca -0.02 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1s9h h ALA 265 Cb 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1s9h h ALA 265 CO 0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 179.25 179.23 1s9h h ALA 266 N 1.59 0.23 -0.22 0.00 0.00 -1.18 -1.43 119.26 118.25 1s9h h ALA 266 Ca 0.48 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1s9h h ALA 266 Cb 0.72 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1s9h h ALA 266 CO -0.24 -0.03 -0.17 -0.07 0.00 0.00 0.00 179.25 178.75 1s9h h LEU 267 N 0.02 0.36 -0.21 0.00 3.38 -0.37 0.15 115.31 118.65 1s9h h LEU 267 Ca 0.04 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1s9h h LEU 267 Cb 0.45 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1s9h h LEU 267 CO 0.01 0.55 -0.13 0.44 0.09 0.00 0.00 178.44 179.40 1s9h h ASP 268 N 0.34 0.47 -0.29 -0.43 3.32 -0.81 0.21 116.42 119.23 1s9h h ASP 268 Ca 0.06 -0.43 -0.05 0.00 0.02 0.00 0.00 57.03 56.63 1s9h h ASP 268 Cb 0.50 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1s9h h ASP 268 CO 0.03 0.80 -0.02 0.78 -1.72 0.00 0.00 179.24 179.11 1s9h h ASN 269 N 0.14 0.51 -0.10 6.45 2.35 -1.02 0.28 115.58 124.19 1s9h h ASN 269 Ca 0.04 -0.33 0.01 0.00 -0.55 0.00 0.00 56.30 55.47 1s9h h ASN 269 Cb 0.64 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 1s9h h ASN 269 CO 0.04 0.72 0.04 0.00 -1.65 0.00 0.00 177.43 176.57 1s9h h ALA 270 N 0.81 0.11 -0.82 -0.83 0.00 -0.68 -0.12 119.26 117.74 1s9h h ALA 270 Ca 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1s9h h ALA 270 Cb 0.47 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1s9h h ALA 270 CO 0.02 -0.42 0.46 0.78 0.00 0.00 0.00 179.25 180.09 1s9h h GLY 271 N 0.09 1.21 1.57 0.00 0.00 -0.45 -2.19 103.07 103.31 1s9h h GLY 271 Ca 0.04 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 1s9h h GLY 271 CO -0.04 0.51 -0.27 1.70 0.00 0.00 0.00 176.54 178.45 1s9h h LYS 272 N 1.13 0.50 0.00 4.80 1.63 -0.03 -2.21 116.57 122.39 1s9h h LYS 272 Ca 0.29 -0.19 -0.09 0.00 -0.85 0.00 0.00 60.65 59.80 1s9h h LYS 272 Cb 0.01 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.60 1s9h h LYS 272 CO -0.05 0.72 -0.44 -0.84 -3.45 0.00 0.00 179.45 175.39 1s9h h ILE 273 N 0.44 0.80 0.31 2.00 3.07 -0.70 -2.83 117.51 120.60 1s9h h ILE 273 Ca 0.06 -2.01 -0.02 0.00 1.55 0.00 0.00 64.86 64.45 1s9h h ILE 273 Cb 0.69 2.31 0.00 0.00 -0.27 0.00 0.00 36.82 39.55 1s9h h ILE 273 CO 0.05 0.44 -0.15 0.24 -1.05 0.00 0.00 178.15 177.68 1s9h h MET 274 N 0.00 -0.40 0.00 0.16 2.86 -1.24 -0.21 114.93 116.09 1s9h h MET 274 Ca -0.00 0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1s9h h MET 274 Cb 1.27 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 33.02 1s9h h MET 274 CO 0.06 -0.27 -0.02 0.66 1.06 0.00 0.00 176.91 178.40 1s9h h SER 275 N -1.06 0.00 0.04 1.22 4.64 -1.53 0.57 113.55 117.43 1s9h h SER 275 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1s9h h SER 275 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1s9h h SER 275 CO 0.07 0.02 -1.65 0.18 -0.87 0.00 0.00 176.83 174.58 1s9h n LEU 276 N -3.70 0.33 -0.00 5.97 4.77 -1.07 -4.68 117.00 118.63 1s9h n LEU 276 Ca -0.03 -0.14 -0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1s9h n LEU 276 Cb 0.11 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.18 1s9h n LEU 276 CO 0.27 0.07 -0.53 0.41 -1.33 0.00 0.00 177.39 176.28 1s9h n THR 277 N -2.04 0.05 -2.31 -5.08 -1.04 -0.09 -5.06 114.28 98.71 1s9h n THR 277 Ca -0.01 -0.03 -0.25 0.00 -2.04 0.00 0.00 64.05 61.72 1s9h n THR 277 Cb 0.49 -0.82 0.09 0.00 -1.82 0.00 0.00 70.33 68.27 1s9h n THR 277 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1s9h s LYS 278 N -2.02 1.95 0.12 -2.82 3.01 0.20 -5.02 119.74 115.15 1s9h s LYS 278 Ca -0.01 -0.53 -0.06 0.00 -1.01 0.00 0.00 55.97 54.36 1s9h s LYS 278 Cb 0.00 -2.21 -0.02 0.00 -1.01 0.00 0.00 37.83 34.59 1s9h s LYS 278 CO 0.03 -1.35 0.17 0.95 0.51 0.00 0.00 175.35 175.65 1s9h s THR 279 N -3.23 0.12 0.25 2.17 -4.23 -1.26 -4.80 115.64 104.65 1s9h s THR 279 Ca 0.63 -1.50 -0.12 0.00 -1.18 0.00 0.00 61.69 59.51 1s9h s THR 279 Cb -0.09 -1.70 0.34 0.00 1.34 0.00 0.00 72.50 72.39 1s9h s THR 279 CO 0.45 -0.53 1.58 0.00 -0.54 0.00 0.00 174.62 175.58 1s9h h ALA 280 N 2.75 0.45 -0.35 3.99 0.00 -1.82 0.31 119.26 124.58 1s9h h ALA 280 Ca -0.33 0.32 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1s9h h ALA 280 Cb 1.20 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 1s9h h ALA 280 CO 0.55 -0.46 0.30 -1.35 0.00 0.00 0.00 179.25 178.29 1s9h h PRO 281 N -0.02 0.00 0.00 0.00 0.11 -1.95 -1.81 132.00 128.33 1s9h h PRO 281 Ca 0.39 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.49 1s9h h PRO 281 Cb 0.63 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.74 1s9h h PRO 281 CO -0.91 0.00 -0.07 -0.44 -0.21 0.00 0.00 178.00 176.38 1s9h h ASP 282 N 0.00 0.00 0.00 -2.05 3.32 -0.76 -3.22 116.42 113.71 1s9h h ASP 282 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1s9h h ASP 282 Cb 0.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1s9h h ASP 282 CO -0.00 0.07 0.00 -1.22 -1.72 0.00 0.00 179.24 176.36 1s9h n TYR 283 N -3.48 0.00 0.08 4.55 4.02 -0.73 -4.73 117.16 116.86 1s9h n TYR 283 Ca -0.02 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.94 1s9h n TYR 283 Cb 0.19 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.48 1s9h n TYR 283 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1s9h n LEU 284 N -0.84 0.85 -4.60 7.72 4.77 -0.88 -4.83 117.00 119.19 1s9h n LEU 284 Ca 0.00 0.35 -0.42 0.00 -0.03 0.00 0.00 56.01 55.90 1s9h n LEU 284 Cb 0.00 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1s9h n LEU 284 CO 0.00 -0.07 0.67 -0.69 -1.33 0.00 0.00 177.39 175.97 1s9h s VAL 285 N -3.21 4.67 1.05 4.08 1.01 -1.22 -4.00 120.40 122.79 1s9h s VAL 285 Ca -0.01 1.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.95 1s9h s VAL 285 Cb 0.09 -4.26 0.22 0.00 0.00 0.00 0.00 36.38 32.44 1s9h s VAL 285 CO 0.80 -0.44 1.09 0.61 0.00 0.00 0.00 175.10 177.15 1s9h n GLY 286 N 4.38 -1.18 2.12 4.51 0.00 0.18 -4.89 105.19 110.31 1s9h n GLY 286 Ca 0.05 -0.94 0.02 0.00 0.00 0.00 0.00 46.02 45.15 1s9h n GLY 286 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s9h n GLN 287 N -4.62 0.80 0.00 1.61 3.00 -1.26 -4.76 117.38 112.15 1s9h n GLN 287 Ca 0.08 -2.69 0.00 0.00 -0.01 0.00 0.00 57.00 54.38 1s9h n GLN 287 Cb 0.53 -0.74 0.00 0.00 0.00 0.00 0.00 30.24 30.03 1s9h n GLN 287 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1s9h n SER 295 N -0.01 0.00 -2.98 1.08 7.64 -1.26 -5.14 113.62 112.95 1s9h n SER 295 Ca 0.06 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.79 1s9h n SER 295 Cb 0.99 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 64.15 1s9h n SER 295 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1s9h n ASN 296 N 0.00 -1.18 0.00 6.43 5.03 -1.26 -4.96 115.26 119.32 1s9h n ASN 296 Ca 0.00 -2.89 0.00 0.00 0.87 0.00 0.00 54.58 52.56 1s9h n ASN 296 Cb 0.00 2.28 0.00 0.00 -1.02 0.00 0.00 39.78 41.04 1s9h n ASN 296 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1s9h n ARG 297 N -0.57 0.00 0.00 3.52 3.00 -1.26 -3.44 116.66 117.91 1s9h n ARG 297 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.86 1s9h n ARG 297 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.03 1s9h n ARG 297 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1s9h n ILE 298 N 0.00 0.00 -0.06 0.55 5.41 -1.26 0.25 119.36 124.25 1s9h n ILE 298 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.65 1s9h n ILE 298 Cb 0.00 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 38.88 1s9h n ILE 298 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 1s9h h TYR 299 N 0.00 -1.11 -0.35 1.39 3.20 -1.96 -0.56 116.97 117.58 1s9h h TYR 299 Ca 0.00 0.05 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 1s9h h TYR 299 Cb 0.00 0.52 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 1s9h h TYR 299 CO 0.00 -0.44 -0.28 0.87 -1.64 0.00 0.00 178.16 176.68 1s9h h LYS 300 N -0.39 0.73 -0.13 1.82 1.79 0.32 -2.42 116.57 118.30 1s9h h LYS 300 Ca 0.11 -0.32 0.04 0.00 -2.18 0.00 0.00 60.65 58.30 1s9h h LYS 300 Cb 0.59 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.21 1s9h h LYS 300 CO -0.47 0.93 0.10 0.82 -1.08 0.00 0.00 179.45 179.75 1s9h h ILE 301 N 0.63 0.81 -0.01 1.86 1.08 -0.51 0.46 117.51 121.84 1s9h h ILE 301 Ca 0.08 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.55 1s9h h ILE 301 Cb 0.79 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 1s9h h ILE 301 CO 0.06 0.00 -0.03 0.18 -0.69 0.00 0.00 178.15 177.68 1s9h n LEU 302 N -4.32 0.71 0.12 1.44 4.77 -0.27 -3.24 117.00 116.20 1s9h n LEU 302 Ca 0.00 -0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 55.75 1s9h n LEU 302 Cb 0.22 -0.04 0.11 0.00 -2.33 0.00 0.00 43.42 41.38 1s9h n LEU 302 CO 0.33 0.12 0.43 -0.33 -1.33 0.00 0.00 177.39 176.60 1s9h h GLU 303 N 1.07 0.03 -7.01 3.23 4.39 0.04 -3.00 114.58 113.33 1s9h h GLU 303 Ca 0.00 -0.03 -0.49 0.00 0.34 0.00 0.00 59.36 59.19 1s9h h GLU 303 Cb 0.28 0.01 0.22 0.00 -0.10 0.00 0.00 28.75 29.15 1s9h h GLU 303 CO 0.00 0.71 -0.26 1.47 -1.16 0.00 0.00 179.01 179.77 1s9h n LEU 304 N -3.73 0.08 -3.57 1.33 -0.00 -1.20 -2.18 117.00 107.72 1s9h n LEU 304 Ca -0.01 0.12 -0.20 0.00 -0.00 0.00 0.00 56.01 55.92 1s9h n LEU 304 Cb 0.68 -1.26 -0.06 0.00 -0.00 0.00 0.00 43.42 42.78 1s9h n LEU 304 CO 0.43 -2.99 -0.26 0.59 -0.00 0.00 0.00 177.39 175.16 1s9h n ASN 305 N -3.39 0.28 -1.99 1.45 5.03 -1.26 -2.68 115.26 112.70 1s9h n ASN 305 Ca 0.06 -0.78 0.00 0.00 0.87 0.00 0.00 54.58 54.73 1s9h n ASN 305 Cb 0.55 -0.97 0.00 0.00 -1.02 0.00 0.00 39.78 38.33 1s9h n ASN 305 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1s9h n GLY 306 N -1.77 0.00 3.76 7.41 0.00 -0.93 -4.83 105.19 108.84 1s9h n GLY 306 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 1s9h n GLY 306 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s9h s TYR 307 N -2.28 3.60 -0.83 1.61 1.51 -1.09 -4.07 117.35 115.79 1s9h s TYR 307 Ca 0.00 1.73 -0.24 0.00 -1.01 0.00 0.00 57.07 57.55 1s9h s TYR 307 Cb 0.00 -3.19 0.06 0.00 -0.11 0.00 0.00 41.96 38.72 1s9h s TYR 307 CO 0.00 -0.36 1.25 0.34 -1.11 0.00 0.00 175.55 175.67 1s9h s ASP 308 N -1.08 6.32 0.37 2.29 2.15 -1.26 -4.61 116.67 120.85 1s9h s ASP 308 Ca 0.46 -1.06 0.20 0.00 0.43 0.00 0.00 52.55 52.58 1s9h s ASP 308 Cb -0.29 -2.52 1.26 0.00 -0.30 0.00 0.00 42.92 41.08 1s9h s ASP 308 CO 0.36 -1.56 1.62 -0.65 -0.17 0.00 0.00 175.17 174.77 1s9h h PRO 309 N 9.72 0.13 -0.85 4.34 0.11 -1.90 0.93 132.00 144.48 1s9h h PRO 309 Ca -0.08 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1s9h h PRO 309 Cb 1.04 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 1s9h h PRO 309 CO 1.28 0.09 0.44 1.96 -0.21 0.00 0.00 178.00 181.56 1s9h h GLN 310 N 0.14 1.20 0.23 1.05 4.20 -1.98 0.98 115.11 120.93 1s9h h GLN 310 Ca 0.80 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 59.34 1s9h h GLN 310 Cb 2.07 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 29.63 1s9h h GLN 310 CO -0.66 0.90 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.37 1s9h h TYR 311 N 1.19 -0.29 -0.82 2.96 3.20 0.27 -2.95 116.97 120.54 1s9h h TYR 311 Ca 0.29 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.27 1s9h h TYR 311 Cb 0.07 0.10 -0.08 0.00 1.54 0.00 0.00 36.73 38.36 1s9h h TYR 311 CO 0.01 0.07 0.45 0.00 -1.64 0.00 0.00 178.16 177.05 1s9h h ALA 312 N -0.51 1.18 -0.56 1.82 0.00 -0.28 -0.20 119.26 120.72 1s9h h ALA 312 Ca -0.03 0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1s9h h ALA 312 Cb 0.49 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1s9h h ALA 312 CO 0.05 0.02 0.37 0.00 0.00 0.00 0.00 179.25 179.69 1s9h h ALA 313 N 1.48 1.82 0.00 0.00 0.00 0.96 0.94 119.26 124.46 1s9h h ALA 313 Ca 0.41 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 1s9h h ALA 313 Cb 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1s9h h ALA 313 CO -0.29 0.10 -0.17 0.77 0.00 0.00 0.00 179.25 179.66 1s9h h SER 314 N 0.55 0.00 0.12 0.00 0.02 -0.85 -1.90 113.55 111.49 1s9h h SER 314 Ca 0.24 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1s9h h SER 314 Cb 0.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1s9h h SER 314 CO -0.07 0.17 -0.06 0.58 -1.14 0.00 0.00 176.83 176.32 1s9h h VAL 315 N 0.00 1.08 -0.22 2.27 2.07 -0.56 -2.01 116.25 118.88 1s9h h VAL 315 Ca -0.00 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.44 1s9h h VAL 315 Cb 0.66 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1s9h h VAL 315 CO 0.02 0.25 0.11 -0.26 0.02 0.00 0.00 177.57 177.71 1s9h h PHE 316 N -0.70 0.20 0.55 1.57 -1.00 -1.32 0.36 116.94 116.60 1s9h h PHE 316 Ca -0.02 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1s9h h PHE 316 Cb 0.53 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1s9h h PHE 316 CO 0.09 0.11 -0.42 1.25 -1.61 0.00 0.00 178.31 177.73 1s9h h LEU 317 N 0.23 -1.11 -1.50 1.54 6.46 -1.43 0.58 115.31 120.08 1s9h h LEU 317 Ca 0.09 0.08 0.12 0.00 -0.12 0.00 0.00 57.88 58.04 1s9h h LEU 317 Cb 0.02 0.35 -0.05 0.00 -0.73 0.00 0.00 40.66 40.25 1s9h h LEU 317 CO -0.06 -0.61 0.49 1.23 -0.62 0.00 0.00 178.44 178.86 1s9h h GLY 318 N -0.95 0.81 0.88 3.75 0.00 -1.25 0.12 103.07 106.43 1s9h h GLY 318 Ca -0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 1s9h h GLY 318 CO 0.01 0.11 0.04 -0.25 0.00 0.00 0.00 176.54 176.45 1s9h h TRP 319 N 0.53 0.49 -0.06 5.60 7.01 0.74 -2.29 115.95 127.98 1s9h h TRP 319 Ca 0.35 -0.07 0.02 0.00 2.11 0.00 0.00 58.89 61.30 1s9h h TRP 319 Cb 0.63 -0.13 -0.00 0.00 -2.10 0.00 0.00 29.16 27.55 1s9h h TRP 319 CO -0.00 0.56 0.13 0.00 -2.79 0.00 0.00 178.44 176.35 1s9h h ALA 320 N 0.87 1.39 -5.61 2.65 0.00 0.27 -3.41 119.26 115.42 1s9h h ALA 320 Ca 0.08 -0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.55 1s9h h ALA 320 Cb 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1s9h h ALA 320 CO 0.01 -0.16 -0.18 2.41 0.00 0.00 0.00 179.25 181.32 1s9h n THR 321 N -3.36 0.00 -0.03 0.00 -1.04 -0.60 -4.03 114.28 105.22 1s9h n THR 321 Ca -0.01 -1.68 -0.11 0.00 -2.04 0.00 0.00 64.05 60.21 1s9h n THR 321 Cb 0.22 -0.24 0.03 0.00 -1.82 0.00 0.00 70.33 68.52 1s9h n THR 321 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1s9h h LYS 322 N 0.00 0.67 0.00 -2.82 1.79 -1.80 -3.42 116.57 110.98 1s9h h LYS 322 Ca -0.26 -0.41 0.00 0.00 -2.18 0.00 0.00 60.65 57.80 1s9h h LYS 322 Cb 1.00 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1s9h h LYS 322 CO 0.40 1.03 0.00 1.17 -1.08 0.00 0.00 179.45 180.97 1s9h n LYS 323 N -3.98 0.00 -2.46 3.15 3.00 -1.23 -3.13 118.16 113.50 1s9h n LYS 323 Ca -0.03 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.92 1s9h n LYS 323 Cb 0.60 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.64 1s9h n LYS 323 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1s9h n PHE 324 N 0.00 3.17 0.00 5.64 3.01 -1.26 -5.04 117.46 122.98 1s9h n PHE 324 Ca 0.00 -2.84 0.00 0.00 1.01 0.00 0.00 57.45 55.62 1s9h n PHE 324 Cb 0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 39.48 38.57 1s9h n PHE 324 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s9h n GLY 325 N -0.30 0.96 0.37 1.37 0.00 -1.18 0.11 105.19 106.52 1s9h n GLY 325 Ca 0.45 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.74 1s9h n GLY 325 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1s9h n LYS 326 N 1.51 1.08 0.00 1.61 -0.00 -1.26 -4.38 118.16 116.72 1s9h n LYS 326 Ca 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 58.31 58.24 1s9h n LYS 326 Cb 0.00 -1.35 0.00 0.00 -0.00 0.00 0.00 35.03 33.68 1s9h n LYS 326 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1s9h n ARG 327 N -0.14 0.00 -0.12 -1.58 1.85 0.30 -4.38 116.66 112.59 1s9h n ARG 327 Ca 0.01 0.19 0.00 0.00 -1.00 0.00 0.00 57.85 57.05 1s9h n ARG 327 Cb 0.19 -0.86 0.00 0.00 -1.05 0.00 0.00 32.46 30.74 1s9h n ARG 327 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1s9h n ASN 328 N -1.08 0.00 0.00 2.89 5.03 -1.26 -3.68 115.26 117.16 1s9h n ASN 328 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1s9h n ASN 328 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1s9h n ASN 328 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1s9h n THR 329 N 0.45 0.00 -2.24 3.41 -2.24 -1.01 -4.72 114.28 107.93 1s9h n THR 329 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1s9h n THR 329 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1s9h n THR 329 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1s9h n ILE 330 N 0.00 5.43 -1.59 2.28 -5.35 -1.21 -1.63 119.36 117.28 1s9h n ILE 330 Ca 0.00 -4.87 -0.45 0.00 -0.27 0.00 0.00 62.75 57.16 1s9h n ILE 330 Cb 0.00 -1.95 -0.02 0.00 -1.74 0.00 0.00 39.64 35.93 1s9h n ILE 330 CO 0.00 0.00 0.00 1.87 -1.76 0.00 0.00 176.55 176.66 1s9h n TRP 331 N 1.36 1.35 -4.65 4.28 -0.00 -1.01 -4.43 117.44 114.34 1s9h n TRP 331 Ca 0.55 0.68 -0.33 0.00 -0.00 0.00 0.00 57.50 58.40 1s9h n TRP 331 Cb 0.26 -2.27 -0.16 0.00 -0.00 0.00 0.00 31.31 29.14 1s9h n TRP 331 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 177.69 177.18 1s9h s LEU 332 N 0.43 2.24 0.00 5.87 1.43 0.54 -2.44 118.68 126.75 1s9h s LEU 332 Ca 0.61 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1s9h s LEU 332 Cb -0.72 -1.48 0.00 0.00 0.03 0.00 0.00 46.19 44.02 1s9h s LEU 332 CO 0.58 0.09 0.00 2.22 0.23 0.00 0.00 176.35 179.47 1s9h n PHE 333 N 4.04 0.00 -1.27 0.29 1.16 -1.04 -3.03 117.46 117.61 1s9h n PHE 333 Ca -0.20 0.00 -0.50 0.00 -1.87 0.00 0.00 57.45 54.89 1s9h n PHE 333 Cb 0.52 -0.18 -0.07 0.00 -1.61 0.00 0.00 39.48 38.13 1s9h n PHE 333 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1s9h n GLY 334 N 2.22 -0.04 1.61 4.97 0.00 -1.26 -4.47 105.19 108.22 1s9h n GLY 334 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 46.02 46.67 1s9h n GLY 334 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1s9h n PRO 335 N 2.11 1.22 -2.90 1.61 -0.01 -1.26 -3.53 135.00 132.24 1s9h n PRO 335 Ca 0.20 -0.39 -0.13 0.00 -0.01 0.00 0.00 63.50 63.16 1s9h n PRO 335 Cb 0.01 -1.18 0.01 0.00 -0.01 0.00 0.00 33.50 32.34 1s9h n PRO 335 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1s9h n ALA 336 N 1.28 2.31 0.00 3.55 0.00 -1.25 -4.86 120.51 121.54 1s9h n ALA 336 Ca 0.08 -2.99 0.00 0.00 0.00 0.00 0.00 53.44 50.54 1s9h n ALA 336 Cb 0.53 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1s9h n ALA 336 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1s9h n THR 337 N 0.08 0.00 0.00 0.00 5.66 -1.26 -4.40 114.28 114.36 1s9h n THR 337 Ca 0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.15 1s9h n THR 337 Cb 0.74 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.52 1s9h n THR 337 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1s9h n THR 338 N 0.00 0.00 0.00 1.09 -2.24 -1.23 -3.73 114.28 108.17 1s9h n THR 338 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1s9h n THR 338 Cb 0.00 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1s9h n THR 338 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1s9h n ASN 342 N 0.30 0.00 0.02 3.42 2.85 -1.26 -3.68 115.26 116.91 1s9h n ASN 342 Ca 0.00 0.00 -0.17 0.00 -0.11 0.00 0.00 54.58 54.30 1s9h n ASN 342 Cb 0.00 0.00 -0.14 0.00 1.24 0.00 0.00 39.78 40.88 1s9h n ASN 342 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1s9h h ILE 343 N 0.00 0.84 0.06 -1.44 2.04 -1.99 -3.21 117.51 113.81 1s9h h ILE 343 Ca 0.00 -2.56 0.00 0.00 1.00 0.00 0.00 64.86 63.30 1s9h h ILE 343 Cb 0.00 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1s9h h ILE 343 CO 0.00 0.78 -0.06 0.00 0.00 0.00 0.00 178.15 178.87 1s9h h ALA 344 N 0.41 -0.11 -0.42 1.87 0.00 -1.88 -0.66 119.26 118.48 1s9h h ALA 344 Ca -0.34 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.61 1s9h h ALA 344 Cb 2.03 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 19.85 1s9h h ALA 344 CO 0.11 -0.57 0.14 1.05 0.00 0.00 0.00 179.25 179.99 1s9h h GLU 345 N -0.13 0.30 0.00 0.00 9.09 -1.88 0.38 114.58 122.35 1s9h h GLU 345 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.40 1s9h h GLU 345 Cb 0.12 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 1s9h h GLU 345 CO -0.02 0.20 0.00 0.00 0.05 0.00 0.00 179.01 179.24 1s9h h ALA 346 N 1.28 1.00 0.01 1.06 0.00 -1.46 -1.21 119.26 119.93 1s9h h ALA 346 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.75 1s9h h ALA 346 Cb 0.19 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1s9h h ALA 346 CO -0.20 0.00 -2.22 -0.89 0.00 0.00 0.00 179.25 175.93 1s9h n ILE 347 N -2.89 1.48 -0.06 0.00 5.41 -0.29 -3.85 119.36 119.17 1s9h n ILE 347 Ca -0.00 -0.79 -0.13 0.00 1.00 0.00 0.00 62.75 62.82 1s9h n ILE 347 Cb 0.21 -0.81 -0.07 0.00 -0.71 0.00 0.00 39.64 38.26 1s9h n ILE 347 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1s9h h ALA 348 N 0.80 0.23 0.00 -1.39 0.00 -0.03 -2.98 119.26 115.90 1s9h h ALA 348 Ca -0.49 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1s9h h ALA 348 Cb 2.13 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.88 1s9h h ALA 348 CO 0.03 0.17 0.00 0.72 0.00 0.00 0.00 179.25 180.17 1s9h n HIS 349 N -4.48 0.00 0.14 0.00 8.25 -0.48 -2.63 115.22 116.02 1s9h n HIS 349 Ca -0.06 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.45 1s9h n HIS 349 Cb 0.40 -0.13 0.04 0.00 1.12 0.00 0.00 29.99 31.43 1s9h n HIS 349 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1s9h h THR 350 N 0.00 0.50 -2.87 1.59 2.02 -1.63 -3.46 112.91 109.06 1s9h h THR 350 Ca 0.00 -1.74 -0.63 0.00 0.77 0.00 0.00 66.41 64.81 1s9h h THR 350 Cb 0.11 2.16 -0.05 0.00 -1.74 0.00 0.00 68.15 68.63 1s9h h THR 350 CO 0.00 0.28 -0.48 0.68 0.37 0.00 0.00 175.52 176.37 1s9h s VAL 351 N -3.06 5.40 0.18 3.16 -7.23 -1.08 -4.81 120.40 112.95 1s9h s VAL 351 Ca 0.03 -0.22 -0.22 0.00 -1.81 0.00 0.00 61.98 59.76 1s9h s VAL 351 Cb 0.07 -3.58 0.10 0.00 0.56 0.00 0.00 36.38 33.53 1s9h s VAL 351 CO 0.74 0.24 1.59 -0.65 -0.31 0.00 0.00 175.10 176.71 1s9h h PRO 352 N 3.47 -0.19 -5.75 4.82 0.11 -1.87 -3.42 132.00 129.17 1s9h h PRO 352 Ca -0.47 0.01 -0.51 0.00 0.11 0.00 0.00 66.00 65.14 1s9h h PRO 352 Cb 1.18 0.04 -0.25 0.00 0.11 0.00 0.00 31.00 32.08 1s9h h PRO 352 CO 0.72 -0.13 -0.82 -0.06 -0.21 0.00 0.00 178.00 177.51 1s9h s PHE 353 N -6.00 1.55 0.19 0.65 0.40 -1.26 -4.90 117.98 108.60 1s9h s PHE 353 Ca -0.14 -0.38 -0.19 0.00 -0.60 0.00 0.00 56.93 55.62 1s9h s PHE 353 Cb 0.15 -0.91 0.04 0.00 0.51 0.00 0.00 43.02 42.81 1s9h s PHE 353 CO 0.69 0.08 0.54 1.52 0.70 0.00 0.00 175.22 178.75 1s9h s TYR 354 N -0.90 -0.23 -0.23 0.36 -0.85 -1.26 -1.59 117.35 112.66 1s9h s TYR 354 Ca 0.04 -0.10 0.13 0.00 -0.52 0.00 0.00 57.07 56.63 1s9h s TYR 354 Cb -0.09 0.44 0.50 0.00 0.38 0.00 0.00 41.96 43.20 1s9h s TYR 354 CO 0.02 -0.91 1.43 0.41 -1.52 0.00 0.00 175.55 174.98 1s9h n GLY 355 N -0.35 4.50 0.89 5.49 0.00 -0.71 -4.92 105.19 110.10 1s9h n GLY 355 Ca -0.12 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.77 1s9h n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9h s VAL 370 N -0.14 4.77 0.00 0.00 0.11 -1.26 -4.51 120.40 119.37 1s9h s VAL 370 Ca 0.16 -0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.18 1s9h s VAL 370 Cb 0.20 -3.18 0.00 0.00 -1.53 0.00 0.00 36.38 31.87 1s9h s VAL 370 CO -0.08 0.41 0.00 0.47 -3.33 0.00 0.00 175.10 172.57 1s9h n ASP 371 N 4.03 -0.37 -4.21 3.54 8.00 -1.26 -4.94 116.55 121.33 1s9h n ASP 371 Ca -0.16 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.05 1s9h n ASP 371 Cb 0.52 -2.34 0.25 0.00 -0.02 0.00 0.00 41.12 39.53 1s9h n ASP 371 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1s9h s LYS 372 N -0.97 -1.32 -0.04 -1.24 3.01 -1.26 -4.78 119.74 113.14 1s9h s LYS 372 Ca 0.00 0.52 0.07 0.00 -1.01 0.00 0.00 55.97 55.55 1s9h s LYS 372 Cb 0.00 -1.53 -0.11 0.00 -1.01 0.00 0.00 37.83 35.18 1s9h s LYS 372 CO 0.00 -3.91 0.10 -1.33 0.51 0.00 0.00 175.35 170.73 1s9h n MET 373 N -5.00 1.42 -3.76 1.68 0.00 -0.62 -4.90 117.12 105.95 1s9h n MET 373 Ca 0.06 -0.04 -0.12 0.00 0.00 0.00 0.00 57.70 57.60 1s9h n MET 373 Cb 0.57 -1.18 -0.12 0.00 0.00 0.00 0.00 33.22 32.48 1s9h n MET 373 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1s9h s VAL 374 N -2.37 -0.02 -0.11 2.03 1.01 -1.24 -4.09 120.40 115.61 1s9h s VAL 374 Ca -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 1s9h s VAL 374 Cb 0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 1s9h s VAL 374 CO 0.31 0.03 -0.10 -0.63 0.00 0.00 0.00 175.10 174.71 1s9h s ILE 375 N 0.71 3.36 -0.05 2.22 1.01 -1.26 -1.74 121.20 125.44 1s9h s ILE 375 Ca -0.05 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.09 1s9h s ILE 375 Cb -0.06 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 1s9h s ILE 375 CO -0.04 0.54 -0.24 0.86 0.00 0.00 0.00 174.94 176.06 1s9h s TRP 376 N 0.01 2.45 0.02 3.97 -0.00 -1.26 -0.79 118.94 123.35 1s9h s TRP 376 Ca -0.02 -0.62 0.08 0.00 -0.00 0.00 0.00 56.10 55.53 1s9h s TRP 376 Cb -0.14 -1.59 -0.02 0.00 -0.00 0.00 0.00 33.47 31.71 1s9h s TRP 376 CO 0.04 -0.15 -0.22 -1.58 -0.00 0.00 0.00 176.95 175.03 1s9h s TRP 377 N -0.27 1.97 0.00 5.86 0.51 -1.13 -4.23 118.94 121.65 1s9h s TRP 377 Ca -0.00 -0.38 0.00 0.00 -2.12 0.00 0.00 56.10 53.60 1s9h s TRP 377 Cb -0.13 -1.21 0.00 0.00 -0.81 0.00 0.00 33.47 31.32 1s9h s TRP 377 CO 0.03 0.06 0.00 -0.85 -0.51 0.00 0.00 176.95 175.67 1s9h n GLU 378 N 2.08 0.00 0.00 4.98 0.28 -1.26 -1.77 120.64 124.95 1s9h n GLU 378 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.84 1s9h n GLU 378 Cb 0.53 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.40 1s9h n GLU 378 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1s9h n ALA 409 N 0.00 0.00 -0.41 -1.84 0.00 -1.26 -4.90 120.51 112.10 1s9h n ALA 409 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1s9h n ALA 409 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1s9h n ALA 409 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1s9h n GLN 410 N 0.00 0.00 -3.78 0.00 7.27 -1.26 -5.05 117.38 114.56 1s9h n GLN 410 Ca 0.00 0.31 -0.36 0.00 0.07 0.00 0.00 57.00 57.02 1s9h n GLN 410 Cb 0.00 -0.10 -0.13 0.00 2.41 0.00 0.00 30.24 32.42 1s9h n GLN 410 CO 0.00 0.00 0.00 -1.50 0.07 0.00 0.00 177.06 175.63 1s9h s ILE 411 N 0.00 4.16 0.69 1.69 1.10 -1.26 -4.69 121.20 122.88 1s9h s ILE 411 Ca 0.00 -0.22 -0.11 0.00 -0.51 0.00 0.00 60.65 59.80 1s9h s ILE 411 Cb 0.00 -2.94 0.00 0.00 0.15 0.00 0.00 42.46 39.68 1s9h s ILE 411 CO 0.00 0.35 1.08 1.51 -2.11 0.00 0.00 174.94 175.77 1s9h s ASP 412 N 1.59 5.57 -0.90 4.50 3.84 -1.26 -4.89 116.67 125.12 1s9h s ASP 412 Ca 0.06 1.24 -0.24 0.00 -0.00 0.00 0.00 52.55 53.62 1s9h s ASP 412 Cb -0.15 -2.11 -0.22 0.00 -1.38 0.00 0.00 42.92 39.06 1s9h s ASP 412 CO 0.02 -1.27 2.49 -2.65 -0.00 0.00 0.00 175.17 173.76 1s9h n PRO 413 N -2.98 0.21 -3.80 2.11 -0.02 -1.26 -4.93 135.00 124.33 1s9h n PRO 413 Ca 0.07 -0.07 -0.36 0.00 -2.02 0.00 0.00 63.50 61.11 1s9h n PRO 413 Cb 0.56 -1.87 -0.13 0.00 -0.02 0.00 0.00 33.50 32.04 1s9h n PRO 413 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1s9h s THR 414 N 7.68 3.89 0.04 3.45 -4.23 -1.26 -5.05 115.64 120.17 1s9h s THR 414 Ca 1.25 -0.47 -0.09 0.00 -1.18 0.00 0.00 61.69 61.20 1s9h s THR 414 Cb -0.88 -2.88 -0.02 0.00 1.34 0.00 0.00 72.50 70.06 1s9h s THR 414 CO 0.44 0.27 0.81 -2.65 -0.54 0.00 0.00 174.62 172.94 1s9h n PRO 415 N 4.86 -0.12 -0.67 3.99 -0.02 -1.26 -4.77 135.00 137.01 1s9h n PRO 415 Ca -0.16 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1s9h n PRO 415 Cb 0.50 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.80 1s9h n PRO 415 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1s9h n VAL 416 N -3.57 -2.70 -3.73 -1.45 0.31 -1.25 -3.00 118.33 102.94 1s9h n VAL 416 Ca 0.01 0.95 -0.22 0.00 -0.01 0.00 0.00 64.34 65.06 1s9h n VAL 416 Cb 0.07 -1.88 -0.18 0.00 -0.91 0.00 0.00 33.84 30.95 1s9h n VAL 416 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1s9h s ILE 417 N -1.36 0.20 0.02 2.52 -4.36 0.03 -2.40 121.20 115.84 1s9h s ILE 417 Ca 0.00 0.23 -0.13 0.00 -0.26 0.00 0.00 60.65 60.49 1s9h s ILE 417 Cb 0.00 -0.40 -0.06 0.00 1.25 0.00 0.00 42.46 43.26 1s9h s ILE 417 CO 0.00 0.22 0.40 -0.69 0.24 0.00 0.00 174.94 175.11 1s9h s VAL 418 N 2.05 5.07 -0.16 8.37 1.01 -1.26 -2.84 120.40 132.64 1s9h s VAL 418 Ca 0.05 0.69 -0.04 0.00 0.00 0.00 0.00 61.98 62.68 1s9h s VAL 418 Cb -0.12 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.65 1s9h s VAL 418 CO -0.04 0.49 0.13 -0.89 0.00 0.00 0.00 175.10 174.78 1s9h s THR 419 N -1.18 -0.17 -1.36 3.92 2.01 -0.73 -0.34 115.64 117.78 1s9h s THR 419 Ca 0.26 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.23 1s9h s THR 419 Cb -0.16 -0.53 0.00 0.00 0.01 0.00 0.00 72.50 71.82 1s9h s THR 419 CO 0.14 -0.17 0.00 -1.54 -0.69 0.00 0.00 174.62 172.36 1s9h n SER 420 N 5.30 0.00 -0.05 3.53 3.41 -1.17 -4.03 113.62 120.61 1s9h n SER 420 Ca -0.06 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1s9h n SER 420 Cb 0.49 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.43 1s9h n SER 420 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1s9h n ASN 421 N 0.82 0.51 -4.54 4.04 2.04 -1.26 -4.25 115.26 112.62 1s9h n ASN 421 Ca 0.00 -0.76 -0.20 0.00 -0.44 0.00 0.00 54.58 53.18 1s9h n ASN 421 Cb 0.00 0.79 -0.12 0.00 -2.53 0.00 0.00 39.78 37.91 1s9h n ASN 421 CO 0.00 0.00 0.00 0.41 -0.44 0.00 0.00 177.26 177.23 1s9h n THR 422 N -0.81 -0.01 -3.47 5.53 -1.04 -1.26 -5.12 114.28 108.10 1s9h n THR 422 Ca 0.01 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.15 1s9h n THR 422 Cb 0.09 -1.37 -0.07 0.00 -1.82 0.00 0.00 70.33 67.16 1s9h n THR 422 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1s9h s ASN 423 N 7.57 6.42 0.00 8.00 0.01 -1.26 -5.17 114.94 130.51 1s9h s ASN 423 Ca 1.08 0.49 0.00 0.00 -0.71 0.00 0.00 52.86 53.73 1s9h s ASN 423 Cb -0.43 -2.20 0.00 0.00 0.41 0.00 0.00 41.25 39.03 1s9h s ASN 423 CO 0.28 0.01 0.00 0.18 -1.51 0.00 0.00 177.10 176.06 1s9h n LEU 441 N 4.04 0.00 0.24 0.60 4.77 -1.26 -5.30 117.00 120.09 1s9h n LEU 441 Ca -0.10 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.01 1s9h n LEU 441 Cb 0.51 0.00 0.73 0.00 -2.33 0.00 0.00 43.42 42.33 1s9h n LEU 441 CO 0.40 0.00 0.97 -0.61 -1.33 0.00 0.00 177.39 176.81 1s9h h GLN 442 N 0.00 0.00 -1.01 3.23 5.75 -2.01 0.88 115.11 121.95 1s9h h GLN 442 Ca 0.00 0.00 -0.59 0.00 -0.15 0.00 0.00 58.65 57.91 1s9h h GLN 442 Cb 0.00 0.00 -0.29 0.00 1.07 0.00 0.00 27.48 28.26 1s9h h GLN 442 CO 0.00 0.00 0.76 -3.47 -2.65 0.00 0.00 178.83 173.47 1s9h n ASP 443 N -2.53 5.76 -2.70 -0.69 -0.08 -1.26 -4.35 116.55 110.70 1s9h n ASP 443 Ca -0.02 -3.68 -0.04 0.00 -1.51 0.00 0.00 54.79 49.55 1s9h n ASP 443 Cb 0.18 -0.91 0.11 0.00 2.34 0.00 0.00 41.12 42.84 1s9h n ASP 443 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1s9h n ARG 444 N -1.00 1.36 0.00 -0.67 5.12 0.31 -4.83 116.66 116.94 1s9h n ARG 444 Ca 0.61 -1.84 0.00 0.00 -1.93 0.00 0.00 57.85 54.68 1s9h n ARG 444 Cb 1.15 -0.10 0.00 0.00 -1.16 0.00 0.00 32.46 32.34 1s9h n ARG 444 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1s9h n MET 445 N -1.06 0.00 -2.97 5.56 0.00 -1.24 -4.61 117.12 112.80 1s9h n MET 445 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 57.70 57.21 1s9h n MET 445 Cb 0.86 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 34.03 1s9h n MET 445 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1s9h s PHE 446 N -0.84 3.59 -0.28 3.17 0.40 -0.65 -4.31 117.98 119.06 1s9h s PHE 446 Ca 0.00 1.34 -0.08 0.00 -0.60 0.00 0.00 56.93 57.59 1s9h s PHE 446 Cb 0.00 -2.88 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1s9h s PHE 446 CO 0.00 0.05 0.09 -1.59 0.70 0.00 0.00 175.22 174.47 1s9h s LYS 447 N 0.92 3.41 -0.20 0.44 0.00 -1.26 -2.40 119.74 120.63 1s9h s LYS 447 Ca 0.40 -0.65 -0.03 0.00 0.00 0.00 0.00 55.97 55.69 1s9h s LYS 447 Cb -0.18 -3.38 -0.01 0.00 0.00 0.00 0.00 37.83 34.25 1s9h s LYS 447 CO 0.20 -0.32 -0.05 -0.06 0.00 0.00 0.00 175.35 175.12 1s9h s PHE 448 N 1.58 2.95 -0.51 1.78 0.40 -1.02 -2.73 117.98 120.42 1s9h s PHE 448 Ca 0.05 -0.83 -0.20 0.00 -0.60 0.00 0.00 56.93 55.35 1s9h s PHE 448 Cb -0.16 -2.06 0.06 0.00 0.51 0.00 0.00 43.02 41.36 1s9h s PHE 448 CO 0.04 -0.46 0.66 -1.21 0.70 0.00 0.00 175.22 174.95 1s9h s GLU 449 N 1.24 3.15 -1.18 0.44 2.02 -1.26 -2.49 118.70 120.61 1s9h s GLU 449 Ca 0.03 -0.81 -0.05 0.00 0.02 0.00 0.00 54.97 54.16 1s9h s GLU 449 Cb -0.14 -4.09 0.22 0.00 0.10 0.00 0.00 34.13 30.22 1s9h s GLU 449 CO -0.02 -1.24 1.96 1.28 0.02 0.00 0.00 175.26 177.27 1s9h n LEU 450 N 6.29 7.31 -4.39 1.80 4.32 -1.26 -4.78 117.00 126.29 1s9h n LEU 450 Ca -0.06 -5.06 -0.45 0.00 -0.02 0.00 0.00 56.01 50.43 1s9h n LEU 450 Cb 0.46 -1.31 -0.03 0.00 -1.62 0.00 0.00 43.42 40.92 1s9h n LEU 450 CO 0.55 1.87 0.64 0.42 -1.22 0.00 0.00 177.39 179.65 1s9h s THR 451 N -2.14 4.96 0.00 -5.08 -4.23 -1.26 -3.87 115.64 104.02 1s9h s THR 451 Ca 0.43 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 1s9h s THR 451 Cb 0.15 -4.60 0.00 0.00 1.34 0.00 0.00 72.50 69.39 1s9h s THR 451 CO -0.05 -1.26 0.00 -2.11 -0.54 0.00 0.00 174.62 170.66 1s9h n ARG 452 N 5.90 0.00 -3.34 3.99 0.00 -1.26 -4.65 116.66 117.30 1s9h n ARG 452 Ca 0.09 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.83 1s9h n ARG 452 Cb 0.46 0.00 -0.07 0.00 -0.00 0.00 0.00 32.46 32.85 1s9h n ARG 452 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 1s9h s ARG 453 N -0.91 0.37 0.33 2.89 6.06 -1.26 -4.71 118.95 121.72 1s9h s ARG 453 Ca 0.00 0.20 -0.26 0.00 -2.50 0.00 0.00 55.73 53.17 1s9h s ARG 453 Cb 0.00 -0.44 -0.10 0.00 0.06 0.00 0.00 34.95 34.47 1s9h s ARG 453 CO 0.00 -0.91 0.95 -0.51 -2.50 0.00 0.00 175.30 172.32 1s9h s LEU 454 N 2.51 4.30 0.95 -0.88 1.43 -1.26 -5.06 118.68 120.67 1s9h s LEU 454 Ca 0.10 1.83 -0.15 0.00 -1.03 0.00 0.00 54.13 54.88 1s9h s LEU 454 Cb -0.14 -4.06 0.20 0.00 0.03 0.00 0.00 46.19 42.23 1s9h s LEU 454 CO -0.26 -0.10 1.31 1.51 0.23 0.00 0.00 176.35 179.04 1s9h s ASP 455 N -1.66 3.12 0.58 2.29 1.47 -1.26 -4.94 116.67 116.26 1s9h s ASP 455 Ca 0.51 0.17 0.36 0.00 1.18 0.00 0.00 52.55 54.77 1s9h s ASP 455 Cb -0.18 -0.20 1.59 0.00 -0.34 0.00 0.00 42.92 43.79 1s9h s ASP 455 CO 0.23 -2.72 2.07 0.45 0.68 0.00 0.00 175.17 175.87 1s9h h HIS 456 N -1.59 0.00 0.16 2.11 -0.00 -2.05 -3.28 115.15 110.50 1s9h h HIS 456 Ca -0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 59.93 1s9h h HIS 456 Cb 1.23 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.64 1s9h h HIS 456 CO -1.18 0.00 -0.12 -0.44 -0.00 0.00 0.00 177.93 176.19 1s9h h ASP 457 N 0.00 -0.32 -4.15 2.45 3.32 -2.03 -3.43 116.42 112.26 1s9h h ASP 457 Ca -0.00 0.02 -0.51 0.00 0.02 0.00 0.00 57.03 56.56 1s9h h ASP 457 Cb 0.41 0.10 0.10 0.00 0.22 0.00 0.00 39.33 40.16 1s9h h ASP 457 CO 0.00 -0.18 0.41 -0.36 -1.72 0.00 0.00 179.24 177.39 1s9h s PHE 458 N -3.70 2.51 0.00 4.55 0.08 -1.24 -5.01 117.98 115.17 1s9h s PHE 458 Ca -0.04 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.56 1s9h s PHE 458 Cb 0.01 -3.30 0.00 0.00 -0.57 0.00 0.00 43.02 39.16 1s9h s PHE 458 CO 0.15 -1.88 0.00 0.41 -0.10 0.00 0.00 175.22 173.79 1s9h n GLY 459 N -0.03 3.98 3.76 4.36 0.00 -1.26 -4.84 105.19 111.17 1s9h n GLY 459 Ca 0.12 -0.41 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 1s9h n GLY 459 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s9h s LYS 460 N 3.10 3.68 0.27 1.61 -2.85 -1.26 -4.94 119.74 119.34 1s9h s LYS 460 Ca 0.00 2.15 0.01 0.00 -1.00 0.00 0.00 55.97 57.13 1s9h s LYS 460 Cb 0.00 -2.55 0.38 0.00 -2.06 0.00 0.00 37.83 33.60 1s9h s LYS 460 CO 0.00 -0.73 1.72 0.28 0.10 0.00 0.00 175.35 176.72 1s9h h VAL 461 N 2.08 1.26 -1.36 1.79 2.07 -1.98 -3.49 116.25 116.61 1s9h h VAL 461 Ca -0.50 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 65.80 1s9h h VAL 461 Cb 1.26 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1s9h h VAL 461 CO 0.61 0.40 -0.16 0.41 0.02 0.00 0.00 177.57 178.84 1s9h n THR 462 N -4.14 -3.45 -0.34 2.57 -1.04 -1.26 -4.35 114.28 102.27 1s9h n THR 462 Ca 0.00 0.54 0.17 0.00 -2.04 0.00 0.00 64.05 62.72 1s9h n THR 462 Cb 0.39 -2.33 0.39 0.00 -1.82 0.00 0.00 70.33 66.96 1s9h n THR 462 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 1s9h h LYS 463 N 0.66 0.60 -0.46 -2.82 -0.00 -1.96 -0.67 116.57 111.92 1s9h h LYS 463 Ca 0.00 -0.04 0.04 0.00 -0.00 0.00 0.00 60.65 60.66 1s9h h LYS 463 Cb 0.00 -0.13 -0.04 0.00 -0.00 0.00 0.00 32.23 32.05 1s9h h LYS 463 CO 0.00 0.40 0.22 0.37 -0.00 0.00 0.00 179.45 180.44 1s9h h GLN 464 N 0.62 0.42 -0.10 0.07 5.75 -1.95 -0.76 115.11 119.15 1s9h h GLN 464 Ca 0.59 -0.03 -0.16 0.00 -0.15 0.00 0.00 58.65 58.90 1s9h h GLN 464 Cb 1.12 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 1s9h h GLN 464 CO -0.37 0.28 -0.62 0.93 -2.65 0.00 0.00 178.83 176.40 1s9h h GLU 465 N 0.44 0.35 0.25 1.69 5.08 -1.34 -0.01 114.58 121.03 1s9h h GLU 465 Ca 0.21 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1s9h h GLU 465 Cb 0.13 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1s9h h GLU 465 CO -0.16 0.86 -0.12 0.28 -1.00 0.00 0.00 179.01 178.87 1s9h h VAL 466 N 0.26 0.78 -0.31 3.13 2.07 -1.05 1.00 116.25 122.13 1s9h h VAL 466 Ca -0.01 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1s9h h VAL 466 Cb 1.15 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1s9h h VAL 466 CO 0.10 0.04 0.15 0.11 0.02 0.00 0.00 177.57 178.00 1s9h h LYS 467 N -0.43 0.42 0.01 1.57 6.56 -1.09 -1.93 116.57 121.67 1s9h h LYS 467 Ca -0.03 -0.04 -0.20 0.00 -1.06 0.00 0.00 60.65 59.32 1s9h h LYS 467 Cb 0.33 -0.09 -0.02 0.00 -0.57 0.00 0.00 32.23 31.88 1s9h h LYS 467 CO 0.06 0.33 -0.93 0.38 -2.06 0.00 0.00 179.45 177.23 1s9h h ASP 468 N 0.42 0.09 0.15 0.86 2.03 -0.44 0.51 116.42 120.04 1s9h h ASP 468 Ca 0.11 -0.08 -0.01 0.00 -0.73 0.00 0.00 57.03 56.32 1s9h h ASP 468 Cb 0.04 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.52 1s9h h ASP 468 CO -0.02 0.96 -0.07 0.15 -1.03 0.00 0.00 179.24 179.23 1s9h h PHE 469 N 0.03 -0.19 0.00 4.15 3.57 0.18 -2.37 116.94 122.31 1s9h h PHE 469 Ca -0.03 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1s9h h PHE 469 Cb 1.61 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 40.41 1s9h h PHE 469 CO 0.01 0.06 -0.15 0.74 -2.23 0.00 0.00 178.31 176.74 1s9h h PHE 470 N -0.42 0.00 0.29 0.41 -1.00 -1.55 -1.92 116.94 112.76 1s9h h PHE 470 Ca -0.02 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 1s9h h PHE 470 Cb 0.33 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.89 1s9h h PHE 470 CO -0.00 0.15 -0.14 0.00 -1.61 0.00 0.00 178.31 176.71 1s9h h ARG 471 N 0.00 -0.37 -0.32 1.51 3.08 -1.39 -1.48 114.38 115.40 1s9h h ARG 471 Ca -0.00 0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.14 1s9h h ARG 471 Cb 0.28 0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.33 1s9h h ARG 471 CO 0.02 -0.14 -0.32 2.35 -1.07 0.00 0.00 179.97 180.82 1s9h h TRP 472 N -0.55 -0.87 -0.30 3.04 7.01 -1.03 0.41 115.95 123.65 1s9h h TRP 472 Ca -0.04 0.05 0.09 0.00 2.11 0.00 0.00 58.89 61.10 1s9h h TRP 472 Cb 0.41 0.43 -0.01 0.00 -2.10 0.00 0.00 29.16 27.89 1s9h h TRP 472 CO -0.01 -0.38 0.48 0.00 -2.79 0.00 0.00 178.44 175.74 1s9h h ALA 473 N 0.68 1.91 0.00 2.65 0.00 -1.13 0.24 119.26 123.61 1s9h h ALA 473 Ca 0.15 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.83 1s9h h ALA 473 Cb 0.53 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1s9h h ALA 473 CO -0.48 -0.64 -1.31 1.57 0.00 0.00 0.00 179.25 178.40 1s9h h LYS 474 N 0.00 0.00 -0.24 0.00 5.09 0.86 -3.06 116.57 119.21 1s9h h LYS 474 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.88 1s9h h LYS 474 Cb 1.10 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.43 1s9h h LYS 474 CO -0.00 0.58 0.00 -0.25 -2.09 0.00 0.00 179.45 177.69 1s9h n ASP 475 N -3.11 1.60 0.00 7.07 8.00 0.80 -4.67 116.55 126.24 1s9h n ASP 475 Ca -0.08 -1.86 0.00 0.00 0.71 0.00 0.00 54.79 53.55 1s9h n ASP 475 Cb 0.94 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 1s9h n ASP 475 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1s9h n HIS 476 N 0.33 0.00 -1.32 1.24 8.25 -1.03 -5.08 115.22 117.61 1s9h n HIS 476 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 1s9h n HIS 476 Cb 0.28 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1s9h n HIS 476 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1s9h n VAL 477 N -0.78 -2.45 -3.52 1.59 0.31 -1.16 -5.07 118.33 107.25 1s9h n VAL 477 Ca 0.00 1.22 -0.17 0.00 -0.01 0.00 0.00 64.34 65.39 1s9h n VAL 477 Cb 0.00 -2.04 -0.06 0.00 -0.91 0.00 0.00 33.84 30.84 1s9h n VAL 477 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1s9h s VAL 478 N -5.19 0.00 0.39 2.52 -7.23 -1.26 -5.08 120.40 104.56 1s9h s VAL 478 Ca 0.00 0.00 -0.26 0.00 -1.81 0.00 0.00 61.98 59.91 1s9h s VAL 478 Cb 0.00 -1.00 -0.11 0.00 0.56 0.00 0.00 36.38 35.83 1s9h s VAL 478 CO 0.00 0.00 1.23 -1.84 -0.31 0.00 0.00 175.10 174.18 1s9h n GLU 479 N 0.81 1.89 -4.55 4.82 0.00 -1.26 -4.90 120.64 117.46 1s9h n GLU 479 Ca -0.18 0.67 -0.33 0.00 0.00 0.00 0.00 57.16 57.32 1s9h n GLU 479 Cb 0.58 -2.30 -0.13 0.00 0.00 0.00 0.00 31.44 29.58 1s9h n GLU 479 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1s9h s VAL 480 N -1.17 3.49 -0.42 3.84 1.01 -1.26 -5.07 120.40 120.82 1s9h s VAL 480 Ca 0.59 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 1s9h s VAL 480 Cb -0.54 -2.51 0.02 0.00 0.00 0.00 0.00 36.38 33.35 1s9h s VAL 480 CO 0.59 0.50 1.26 -1.83 0.00 0.00 0.00 175.10 175.63 1s9h s GLU 481 N 0.41 3.71 -0.38 2.72 1.03 -1.26 -4.95 118.70 119.98 1s9h s GLU 481 Ca -0.07 0.83 -0.28 0.00 0.03 0.00 0.00 54.97 55.48 1s9h s GLU 481 Cb -0.15 -3.94 -0.03 0.00 -0.80 0.00 0.00 34.13 29.21 1s9h s GLU 481 CO 0.04 -1.39 1.90 -1.01 -1.33 0.00 0.00 175.26 173.46 1s9h s HIS 482 N 4.79 1.66 -0.24 4.83 0.09 -1.26 -4.91 115.29 120.25 1s9h s HIS 482 Ca 0.54 0.71 -0.32 0.00 -0.00 0.00 0.00 55.06 55.99 1s9h s HIS 482 Cb -0.11 -4.06 0.16 0.00 -0.00 0.00 0.00 32.58 28.57 1s9h s HIS 482 CO 0.30 -2.92 1.27 -1.83 -0.00 0.00 0.00 174.74 171.56 1s9h s GLU 483 N 6.17 0.20 0.30 1.40 -1.05 -1.26 -5.13 118.70 119.32 1s9h s GLU 483 Ca 0.81 -0.01 -0.29 0.00 -0.15 0.00 0.00 54.97 55.33 1s9h s GLU 483 Cb -0.21 0.09 -0.10 0.00 -0.44 0.00 0.00 34.13 33.48 1s9h s GLU 483 CO 0.31 -0.08 1.11 0.12 0.95 0.00 0.00 175.26 177.68 1s9h s PHE 484 N -1.62 3.50 -0.01 4.83 5.36 -1.26 -4.28 117.98 124.51 1s9h s PHE 484 Ca 0.08 1.67 -0.00 0.00 -0.96 0.00 0.00 56.93 57.72 1s9h s PHE 484 Cb -0.01 -3.31 0.00 0.00 -0.34 0.00 0.00 43.02 39.36 1s9h s PHE 484 CO -0.05 -0.68 0.00 0.66 -1.46 0.00 0.00 175.22 173.70 1s9h n TYR 485 N 1.04 -0.06 -2.19 10.12 4.02 -1.26 -4.91 117.16 123.91 1s9h n TYR 485 Ca -0.00 0.03 -0.34 0.00 -0.01 0.00 0.00 57.90 57.57 1s9h n TYR 485 Cb 0.45 -1.54 0.00 0.00 -0.02 0.00 0.00 39.34 38.23 1s9h n TYR 485 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1s9h s VAL 486 N -0.17 3.44 0.07 -0.72 -7.23 -1.11 -4.85 120.40 109.84 1s9h s VAL 486 Ca 0.00 0.81 0.04 0.00 -1.81 0.00 0.00 61.98 61.02 1s9h s VAL 486 Cb -0.00 -3.31 0.06 0.00 0.56 0.00 0.00 36.38 33.70 1s9h s VAL 486 CO 0.01 -0.28 0.29 0.29 -0.31 0.00 0.00 175.10 175.11 1s9h n LYS 487 N -1.56 -0.01 0.00 4.82 5.02 -1.26 -4.68 118.16 120.48 1s9h n LYS 487 Ca 0.10 0.26 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1s9h n LYS 487 Cb 0.52 -0.46 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1s9h n LYS 487 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1s9h n LYS 488 N -3.43 0.00 -3.12 1.97 3.00 -1.26 -4.86 118.16 110.46 1s9h n LYS 488 Ca 0.07 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.17 1s9h n LYS 488 Cb 0.24 -1.06 0.01 0.00 0.00 0.00 0.00 35.03 34.22 1s9h n LYS 488 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1s9h s GLY 489 N 0.00 1.64 0.00 3.14 0.00 -1.26 -3.18 107.32 107.66 1s9h s GLY 489 Ca 0.00 -1.28 0.05 0.00 0.00 0.00 0.00 44.72 43.49 1s9h s GLY 489 CO 0.00 -1.13 0.77 0.61 0.00 0.00 0.00 173.10 173.35