#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ddg n HIS 227 N 0.00 0.00 0.00 9.51 -0.00 -1.26 -5.15 115.22 118.32 1ddg n HIS 227 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1ddg n HIS 227 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1ddg n HIS 227 CO 0.00 0.00 0.00 -2.37 0.46 0.00 0.00 176.34 174.43 1ddg n THR 228 N 0.00 0.00 -3.15 3.57 5.66 -1.26 -5.14 114.28 113.96 1ddg n THR 228 Ca 0.00 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.05 1ddg n THR 228 Cb 0.00 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1ddg n THR 228 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1ddg s SER 229 N 0.00 -0.74 -0.24 1.09 0.15 -1.26 -4.99 113.70 107.71 1ddg s SER 229 Ca 0.00 0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.84 1ddg s SER 229 Cb 0.00 1.50 0.27 0.00 -1.71 0.00 0.00 66.02 66.09 1ddg s SER 229 CO 0.00 -0.14 1.63 -0.81 1.20 0.00 0.00 173.24 175.12 1ddg n PRO 230 N 5.27 1.64 -4.82 5.44 -0.04 -1.26 -4.89 135.00 136.34 1ddg n PRO 230 Ca 0.04 -1.43 -0.33 0.00 -0.04 0.00 0.00 63.50 61.75 1ddg n PRO 230 Cb 0.56 -1.56 -0.13 0.00 -0.04 0.00 0.00 33.50 32.33 1ddg n PRO 230 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1ddg s TYR 231 N -1.60 2.75 0.30 0.54 2.02 -1.26 -4.90 117.35 115.20 1ddg s TYR 231 Ca 0.27 -0.12 -0.13 0.00 -0.37 0.00 0.00 57.07 56.72 1ddg s TYR 231 Cb 0.23 -1.64 0.05 0.00 -0.40 0.00 0.00 41.96 40.20 1ddg s TYR 231 CO 0.03 0.22 0.68 -1.13 -1.57 0.00 0.00 175.55 173.78 1ddg n SER 232 N 2.25 -1.83 -0.22 2.29 3.41 -0.51 -4.84 113.62 114.17 1ddg n SER 232 Ca -0.17 -2.23 0.03 0.00 -0.26 0.00 0.00 58.87 56.24 1ddg n SER 232 Cb 0.52 3.03 0.14 0.00 -0.26 0.00 0.00 64.21 67.64 1ddg n SER 232 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1ddg h LYS 233 N 0.00 0.19 -0.12 4.33 3.64 -1.93 -0.99 116.57 121.70 1ddg h LYS 233 Ca -0.27 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1ddg h LYS 233 Cb 1.01 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1ddg h LYS 233 CO 0.34 0.13 0.00 -0.25 -2.27 0.00 0.00 179.45 177.40 1ddg n ASP 234 N -5.21 2.66 -3.18 4.20 8.00 -1.26 -4.20 116.55 117.56 1ddg n ASP 234 Ca 0.11 -1.87 -0.20 0.00 0.71 0.00 0.00 54.79 53.54 1ddg n ASP 234 Cb 0.39 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.39 1ddg n ASP 234 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ddg n ALA 235 N 1.03 2.36 -1.56 2.24 0.00 -0.48 -5.13 120.51 118.97 1ddg n ALA 235 Ca 0.16 -3.54 -0.33 0.00 0.00 0.00 0.00 53.44 49.74 1ddg n ALA 235 Cb 0.52 -0.89 0.04 0.00 0.00 0.00 0.00 19.45 19.12 1ddg n ALA 235 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ddg s PRO 236 N -2.23 2.98 -0.10 0.00 0.04 -0.59 -1.42 135.00 133.69 1ddg s PRO 236 Ca 0.40 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 1ddg s PRO 236 Cb 0.30 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.83 1ddg s PRO 236 CO -0.09 -1.09 1.15 -1.17 0.04 0.00 0.00 177.00 175.84 1ddg s LEU 237 N -4.85 4.24 -0.48 -3.56 2.96 -0.10 -4.77 118.68 112.12 1ddg s LEU 237 Ca 0.64 1.69 -0.28 0.00 -0.22 0.00 0.00 54.13 55.97 1ddg s LEU 237 Cb -0.18 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 42.99 1ddg s LEU 237 CO 0.42 -0.58 1.08 -0.69 -1.32 0.00 0.00 176.35 175.26 1ddg s VAL 238 N 2.40 4.27 0.41 1.68 1.01 -1.26 -0.97 120.40 127.94 1ddg s VAL 238 Ca 0.53 1.04 0.03 0.00 0.00 0.00 0.00 61.98 63.58 1ddg s VAL 238 Cb -0.22 -4.57 0.03 0.00 0.00 0.00 0.00 36.38 31.63 1ddg s VAL 238 CO 0.19 -0.99 0.28 0.00 0.00 0.00 0.00 175.10 174.58 1ddg n ALA 239 N 7.69 0.61 -3.29 5.51 0.00 0.40 -4.90 120.51 126.53 1ddg n ALA 239 Ca 0.10 -1.65 -0.32 0.00 0.00 0.00 0.00 53.44 51.57 1ddg n ALA 239 Cb 0.49 0.70 -0.16 0.00 0.00 0.00 0.00 19.45 20.47 1ddg n ALA 239 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ddg s SER 240 N -3.38 3.30 -0.63 0.00 0.15 -1.20 -0.73 113.70 111.21 1ddg s SER 240 Ca 0.21 -0.52 -0.27 0.00 0.70 0.00 0.00 55.95 56.07 1ddg s SER 240 Cb -0.02 -1.46 0.01 0.00 -1.71 0.00 0.00 66.02 62.84 1ddg s SER 240 CO 0.14 0.14 1.43 -0.22 1.20 0.00 0.00 173.24 175.92 1ddg s LEU 241 N 0.46 3.31 -0.12 3.45 2.96 -0.18 -0.38 118.68 128.18 1ddg s LEU 241 Ca -0.14 0.04 -0.17 0.00 -0.22 0.00 0.00 54.13 53.64 1ddg s LEU 241 Cb -0.17 -2.81 -0.26 0.00 0.50 0.00 0.00 46.19 43.45 1ddg s LEU 241 CO 0.06 -1.85 0.50 0.28 -1.32 0.00 0.00 176.35 174.02 1ddg h SER 242 N 11.25 0.30 -3.44 3.68 0.02 -0.74 1.58 113.55 126.20 1ddg h SER 242 Ca -0.27 -0.81 -0.46 0.00 -0.84 0.00 0.00 61.79 59.41 1ddg h SER 242 Cb 1.09 -0.10 -0.34 0.00 0.14 0.00 0.00 62.40 63.19 1ddg h SER 242 CO 1.22 1.58 -0.79 -0.69 -1.14 0.00 0.00 176.83 177.01 1ddg s VAL 243 N -2.45 0.83 -0.33 2.27 1.01 -1.07 -4.63 120.40 116.03 1ddg s VAL 243 Ca -0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 1ddg s VAL 243 Cb 0.04 -0.79 0.12 0.00 0.00 0.00 0.00 36.38 35.76 1ddg s VAL 243 CO 0.73 0.29 0.18 0.21 0.00 0.00 0.00 175.10 176.51 1ddg s ASN 244 N 0.79 3.23 -0.12 3.32 2.47 -1.25 -0.37 114.94 123.01 1ddg s ASN 244 Ca -0.13 -1.87 0.02 0.00 0.42 0.00 0.00 52.86 51.30 1ddg s ASN 244 Cb -0.15 -0.42 0.01 0.00 -1.45 0.00 0.00 41.25 39.24 1ddg s ASN 244 CO 0.02 -0.36 -0.19 -1.58 -3.72 0.00 0.00 177.10 171.27 1ddg s GLN 245 N 1.42 2.61 0.05 0.43 2.00 -0.61 -4.97 119.66 120.59 1ddg s GLN 245 Ca 0.15 -0.71 -0.31 0.00 -2.00 0.00 0.00 55.36 52.49 1ddg s GLN 245 Cb -0.20 -2.14 -0.06 0.00 0.80 0.00 0.00 33.01 31.41 1ddg s GLN 245 CO -0.13 -0.02 1.22 0.21 -0.50 0.00 0.00 175.29 176.07 1ddg s LYS 246 N 0.86 4.41 0.00 1.67 2.20 -1.26 0.09 119.74 127.70 1ddg s LYS 246 Ca -0.08 1.79 0.04 0.00 -0.36 0.00 0.00 55.97 57.37 1ddg s LYS 246 Cb -0.15 -3.37 0.01 0.00 -1.51 0.00 0.00 37.83 32.81 1ddg s LYS 246 CO -0.01 -0.30 0.49 -0.89 -0.36 0.00 0.00 175.35 174.28 1ddg n ILE 247 N 4.02 0.00 -3.50 5.43 -0.00 0.20 -4.90 119.36 120.61 1ddg n ILE 247 Ca 0.09 -0.47 -0.28 0.00 -0.00 0.00 0.00 62.75 62.10 1ddg n ILE 247 Cb 0.46 1.06 -0.03 0.00 -0.00 0.00 0.00 39.64 41.13 1ddg n ILE 247 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 1ddg s THR 248 N -0.71 5.11 0.69 1.39 -4.23 -1.25 -4.65 115.64 111.99 1ddg s THR 248 Ca 0.04 -0.17 -0.12 0.00 -1.18 0.00 0.00 61.69 60.26 1ddg s THR 248 Cb 0.04 -3.74 0.01 0.00 1.34 0.00 0.00 72.50 70.14 1ddg s THR 248 CO 0.09 -0.28 1.07 -0.83 -0.54 0.00 0.00 174.62 174.13 1ddg s GLY 249 N -3.23 1.78 0.47 3.99 0.00 0.79 -4.88 107.32 106.24 1ddg s GLY 249 Ca 0.41 0.19 0.22 0.00 0.00 0.00 0.00 44.72 45.54 1ddg s GLY 249 CO 0.30 0.51 1.64 0.07 0.00 0.00 0.00 173.10 175.62 1ddg h ARG 250 N -0.53 0.00 0.00 2.90 0.11 -1.94 0.62 114.38 115.54 1ddg h ARG 250 Ca -0.44 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.63 1ddg h ARG 250 Cb 1.22 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.29 1ddg h ARG 250 CO 0.56 0.00 -0.26 0.09 0.10 0.00 0.00 179.97 180.46 1ddg n ASN 251 N -2.45 1.98 -4.78 0.08 3.02 -1.26 -5.03 115.26 106.82 1ddg n ASN 251 Ca -0.01 -3.39 -0.34 0.00 -0.03 0.00 0.00 54.58 50.80 1ddg n ASN 251 Cb 0.29 -0.46 0.01 0.00 -0.61 0.00 0.00 39.78 39.01 1ddg n ASN 251 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ddg s SER 252 N -2.97 5.70 0.47 6.41 0.15 0.21 -4.91 113.70 118.78 1ddg s SER 252 Ca 0.34 2.07 0.28 0.00 0.70 0.00 0.00 55.95 59.34 1ddg s SER 252 Cb 0.31 -2.57 0.86 0.00 -1.71 0.00 0.00 66.02 62.92 1ddg s SER 252 CO -0.02 -1.23 1.79 -0.33 1.20 0.00 0.00 173.24 174.66 1ddg h GLU 253 N 0.95 0.00 -6.73 5.44 4.39 -1.95 -3.45 114.58 113.24 1ddg h GLU 253 Ca -0.49 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 58.54 1ddg h GLU 253 Cb 1.25 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.66 1ddg h GLU 253 CO 0.57 0.00 -0.87 0.21 -1.16 0.00 0.00 179.01 177.76 1ddg s LYS 254 N -3.42 1.47 -0.33 2.33 2.20 -1.26 -5.09 119.74 115.64 1ddg s LYS 254 Ca 0.04 -1.24 -0.07 0.00 -0.36 0.00 0.00 55.97 54.34 1ddg s LYS 254 Cb 0.07 -1.83 0.03 0.00 -1.51 0.00 0.00 37.83 34.59 1ddg s LYS 254 CO 0.60 0.45 0.11 0.34 -0.36 0.00 0.00 175.35 176.48 1ddg s ASP 255 N -1.78 5.31 -0.11 1.43 2.15 -1.26 -4.81 116.67 117.59 1ddg s ASP 255 Ca 0.12 -0.98 0.02 0.00 0.43 0.00 0.00 52.55 52.14 1ddg s ASP 255 Cb -0.10 -1.89 -0.01 0.00 -0.30 0.00 0.00 42.92 40.62 1ddg s ASP 255 CO 0.05 -0.29 -0.17 -0.69 -0.17 0.00 0.00 175.17 173.90 1ddg s VAL 256 N 1.46 2.73 -0.17 1.11 1.01 -1.26 -0.23 120.40 125.04 1ddg s VAL 256 Ca 0.00 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 1ddg s VAL 256 Cb -0.19 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1ddg s VAL 256 CO 0.03 0.54 0.00 -0.13 0.00 0.00 0.00 175.10 175.55 1ddg s ARG 257 N 0.25 3.79 -0.27 2.72 1.81 -0.11 0.59 118.95 127.74 1ddg s ARG 257 Ca -0.11 -0.45 -0.25 0.00 -1.72 0.00 0.00 55.73 53.20 1ddg s ARG 257 Cb -0.16 -3.04 -0.00 0.00 -0.45 0.00 0.00 34.95 31.30 1ddg s ARG 257 CO 0.06 0.25 0.85 -1.58 -0.68 0.00 0.00 175.30 174.20 1ddg s HIS 258 N 0.38 3.27 -0.04 -0.53 5.65 0.11 -0.07 115.29 124.06 1ddg s HIS 258 Ca -0.01 1.07 0.06 0.00 0.25 0.00 0.00 55.06 56.43 1ddg s HIS 258 Cb -0.13 -3.16 -0.01 0.00 -1.18 0.00 0.00 32.58 28.09 1ddg s HIS 258 CO 0.02 -0.48 -0.23 0.42 -0.65 0.00 0.00 174.74 173.82 1ddg s ILE 259 N 2.96 1.85 -0.10 0.89 1.01 -0.53 -1.57 121.20 125.71 1ddg s ILE 259 Ca 0.35 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 60.07 1ddg s ILE 259 Cb -0.15 -1.56 -0.00 0.00 0.01 0.00 0.00 42.46 40.76 1ddg s ILE 259 CO 0.09 0.52 -0.23 -1.61 0.00 0.00 0.00 174.94 173.72 1ddg s GLU 260 N -0.27 3.09 -0.11 2.79 2.02 0.51 -0.97 118.70 125.75 1ddg s GLU 260 Ca 0.01 -0.86 0.01 0.00 0.02 0.00 0.00 54.97 54.16 1ddg s GLU 260 Cb -0.11 -2.34 -0.02 0.00 0.10 0.00 0.00 34.13 31.76 1ddg s GLU 260 CO 0.02 0.18 -0.15 0.42 0.02 0.00 0.00 175.26 175.74 1ddg s ILE 261 N 0.35 2.89 -0.06 -1.63 1.01 0.11 0.03 121.20 123.91 1ddg s ILE 261 Ca -0.18 -0.73 -0.27 0.00 0.00 0.00 0.00 60.65 59.47 1ddg s ILE 261 Cb -0.18 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.08 1ddg s ILE 261 CO 0.08 0.54 0.87 -0.62 0.00 0.00 0.00 174.94 175.82 1ddg s ASP 262 N 0.12 7.17 0.00 3.58 2.15 0.48 -1.87 116.67 128.31 1ddg s ASP 262 Ca -0.07 1.42 0.27 0.00 0.43 0.00 0.00 52.55 54.60 1ddg s ASP 262 Cb -0.15 -2.50 0.84 0.00 -0.30 0.00 0.00 42.92 40.81 1ddg s ASP 262 CO 0.05 -0.26 1.63 0.18 -0.17 0.00 0.00 175.17 176.60 1ddg n LEU 263 N 4.20 1.85 0.00 -1.34 4.77 0.52 -3.25 117.00 123.75 1ddg n LEU 263 Ca 0.04 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 1ddg n LEU 263 Cb 0.50 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1ddg n LEU 263 CO 0.50 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.49 1ddg n GLY 264 N 1.21 1.93 1.32 -0.72 0.00 -1.24 -1.61 105.19 106.09 1ddg n GLY 264 Ca 0.18 -0.24 0.06 0.00 0.00 0.00 0.00 46.02 46.01 1ddg n GLY 264 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ddg n ASP 265 N -0.52 3.86 0.11 1.61 2.03 -1.26 -4.44 116.55 117.93 1ddg n ASP 265 Ca 0.00 -2.47 0.05 0.00 0.52 0.00 0.00 54.79 52.89 1ddg n ASP 265 Cb 0.00 -0.55 0.50 0.00 -0.72 0.00 0.00 41.12 40.34 1ddg n ASP 265 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1ddg h SER 266 N 2.80 0.27 0.00 1.67 4.64 -1.72 -3.46 113.55 117.74 1ddg h SER 266 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1ddg h SER 266 Cb 1.30 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ddg h SER 266 CO 0.25 0.22 0.00 0.61 -0.87 0.00 0.00 176.83 177.04 1ddg n GLY 267 N -1.42 0.52 3.71 -0.77 0.00 -1.26 -4.99 105.19 100.97 1ddg n GLY 267 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ddg n GLY 267 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ddg s LEU 268 N 0.00 4.38 0.12 0.99 2.96 -1.26 -4.97 118.68 120.90 1ddg s LEU 268 Ca 0.00 2.80 0.09 0.00 -0.22 0.00 0.00 54.13 56.79 1ddg s LEU 268 Cb 0.00 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 1ddg s LEU 268 CO 0.00 -0.95 -0.21 -0.13 -1.32 0.00 0.00 176.35 173.74 1ddg s ARG 269 N 1.54 1.20 0.17 1.98 1.81 -1.26 -4.97 118.95 119.42 1ddg s ARG 269 Ca 0.75 -1.25 -0.13 0.00 -1.72 0.00 0.00 55.73 53.38 1ddg s ARG 269 Cb -0.48 -1.43 0.01 0.00 -0.45 0.00 0.00 34.95 32.60 1ddg s ARG 269 CO 0.33 0.32 0.39 1.52 -0.68 0.00 0.00 175.30 177.18 1ddg s TYR 270 N -1.40 0.12 0.14 -0.53 -0.85 -1.26 -4.96 117.35 108.61 1ddg s TYR 270 Ca 0.10 -0.48 0.10 0.00 -0.52 0.00 0.00 57.07 56.27 1ddg s TYR 270 Cb -0.09 0.16 -0.04 0.00 0.38 0.00 0.00 41.96 42.37 1ddg s TYR 270 CO 0.05 -0.79 -0.21 -0.65 -1.52 0.00 0.00 175.55 172.42 1ddg s GLN 271 N -3.91 1.63 0.08 -3.49 -0.21 -1.26 -4.71 119.66 107.79 1ddg s GLN 271 Ca 0.12 -1.31 -0.35 0.00 0.02 0.00 0.00 55.36 53.84 1ddg s GLN 271 Cb 0.01 -2.00 -0.14 0.00 1.00 0.00 0.00 33.01 31.88 1ddg s GLN 271 CO -0.03 0.45 1.57 -2.30 -2.12 0.00 0.00 175.29 172.86 1ddg n PRO 272 N 0.66 1.83 0.00 2.91 -0.02 -1.26 -0.53 135.00 138.59 1ddg n PRO 272 Ca -0.15 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1ddg n PRO 272 Cb 0.54 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1ddg n PRO 272 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ddg n GLY 273 N 3.35 2.72 3.72 -1.23 0.00 -1.26 -4.58 105.19 107.92 1ddg n GLY 273 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1ddg n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ddg s ASP 274 N -1.29 3.09 0.24 1.61 1.01 0.31 -4.37 116.67 117.28 1ddg s ASP 274 Ca 0.00 1.16 0.11 0.00 0.71 0.00 0.00 52.55 54.53 1ddg s ASP 274 Cb 0.00 -1.80 -0.05 0.00 1.01 0.00 0.00 42.92 42.08 1ddg s ASP 274 CO 0.00 -2.84 -0.20 0.00 0.21 0.00 0.00 175.17 172.35 1ddg s ALA 275 N -3.07 2.70 -0.18 5.23 0.00 -0.41 -1.80 121.76 124.24 1ddg s ALA 275 Ca 0.64 -1.76 -0.05 0.00 0.00 0.00 0.00 51.96 50.79 1ddg s ALA 275 Cb -0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.58 1ddg s ALA 275 CO 0.56 0.34 0.01 -1.17 0.00 0.00 0.00 175.76 175.50 1ddg s LEU 276 N -3.17 3.45 -0.01 0.00 2.96 0.12 -0.98 118.68 121.04 1ddg s LEU 276 Ca 0.26 -0.08 -0.25 0.00 -0.22 0.00 0.00 54.13 53.85 1ddg s LEU 276 Cb -0.06 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1ddg s LEU 276 CO 0.13 0.14 0.75 -0.83 -1.32 0.00 0.00 176.35 175.22 1ddg s GLY 277 N 0.58 2.72 -0.11 7.98 0.00 0.44 -1.55 107.32 117.39 1ddg s GLY 277 Ca -0.00 0.24 -0.01 0.00 0.00 0.00 0.00 44.72 44.95 1ddg s GLY 277 CO 0.02 1.18 -0.03 0.14 0.00 0.00 0.00 173.10 174.41 1ddg s VAL 278 N 0.42 0.70 0.48 1.40 1.01 -0.00 -1.54 120.40 122.87 1ddg s VAL 278 Ca 0.39 -0.15 -0.19 0.00 0.00 0.00 0.00 61.98 62.03 1ddg s VAL 278 Cb -0.19 -0.83 -0.09 0.00 0.00 0.00 0.00 36.38 35.27 1ddg s VAL 278 CO 0.21 0.25 1.00 0.26 0.00 0.00 0.00 175.10 176.83 1ddg s TRP 279 N 1.83 3.17 0.23 5.22 0.52 -0.36 -1.57 118.94 127.98 1ddg s TRP 279 Ca 0.04 1.56 0.01 0.00 0.02 0.00 0.00 56.10 57.73 1ddg s TRP 279 Cb -0.13 -2.94 -0.04 0.00 -1.15 0.00 0.00 33.47 29.21 1ddg s TRP 279 CO -0.07 -0.55 0.17 1.52 0.02 0.00 0.00 176.95 178.05 1ddg s TYR 280 N -2.20 1.28 0.16 -1.98 1.13 -1.26 -4.56 117.35 109.92 1ddg s TYR 280 Ca 0.64 -1.43 0.09 0.00 -1.41 0.00 0.00 57.07 54.95 1ddg s TYR 280 Cb -0.13 -0.58 -0.04 0.00 -1.10 0.00 0.00 41.96 40.11 1ddg s TYR 280 CO 0.21 -0.70 -0.20 1.14 -2.51 0.00 0.00 175.55 173.49 1ddg s GLN 281 N -3.99 1.28 0.65 -3.49 -2.07 -1.26 -4.90 119.66 105.88 1ddg s GLN 281 Ca 0.39 -1.38 -0.14 0.00 -1.82 0.00 0.00 55.36 52.42 1ddg s GLN 281 Cb 0.06 -1.43 -0.01 0.00 -1.09 0.00 0.00 33.01 30.54 1ddg s GLN 281 CO 0.16 0.30 1.07 -0.80 -1.32 0.00 0.00 175.29 174.70 1ddg s ASN 282 N -2.51 5.36 0.09 12.60 0.01 -0.22 -4.80 114.94 125.48 1ddg s ASN 282 Ca 0.15 1.82 -0.32 0.00 -0.71 0.00 0.00 52.86 53.79 1ddg s ASN 282 Cb -0.07 -2.53 -0.11 0.00 0.41 0.00 0.00 41.25 38.95 1ddg s ASN 282 CO 0.07 -1.45 1.82 -0.67 -1.51 0.00 0.00 177.10 175.35 1ddg n ASP 283 N -2.56 3.84 -0.05 -1.22 -0.08 -1.26 -4.87 116.55 110.35 1ddg n ASP 283 Ca 0.09 0.99 0.09 0.00 -1.51 0.00 0.00 54.79 54.46 1ddg n ASP 283 Cb 0.53 -1.50 0.48 0.00 2.34 0.00 0.00 41.12 42.97 1ddg n ASP 283 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1ddg h PRO 284 N 8.40 0.43 -0.21 -0.67 0.11 -1.97 -2.03 132.00 136.06 1ddg h PRO 284 Ca -0.47 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.50 1ddg h PRO 284 Cb 1.23 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1ddg h PRO 284 CO 0.94 0.28 -0.36 0.00 -0.21 0.00 0.00 178.00 178.65 1ddg h ALA 285 N 1.72 0.99 -0.34 -0.75 0.00 -1.99 -0.72 119.26 118.17 1ddg h ALA 285 Ca 0.23 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1ddg h ALA 285 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ddg h ALA 285 CO -0.06 0.61 -0.12 1.25 0.00 0.00 0.00 179.25 180.92 1ddg h LEU 286 N 0.38 0.70 -0.23 0.00 5.85 -1.80 -1.38 115.31 118.84 1ddg h LEU 286 Ca 0.04 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.38 1ddg h LEU 286 Cb 0.81 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1ddg h LEU 286 CO 0.07 0.93 0.13 0.58 -0.34 0.00 0.00 178.44 179.81 1ddg h VAL 287 N 0.47 1.03 -0.93 1.05 2.07 -1.11 -0.70 116.25 118.12 1ddg h VAL 287 Ca 0.08 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.53 1ddg h VAL 287 Cb 0.64 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 1ddg h VAL 287 CO 0.04 0.05 0.61 0.50 0.02 0.00 0.00 177.57 178.80 1ddg h LYS 288 N 0.28 1.19 -0.06 1.57 3.64 -1.09 -2.02 116.57 120.07 1ddg h LYS 288 Ca 0.09 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1ddg h LYS 288 Cb -0.01 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.54 1ddg h LYS 288 CO -0.04 0.79 0.03 1.49 -2.27 0.00 0.00 179.45 179.45 1ddg h GLU 289 N 1.22 0.08 -0.15 1.90 4.81 -0.65 -1.82 114.58 119.97 1ddg h GLU 289 Ca 0.35 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.60 1ddg h GLU 289 Cb -0.08 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 1ddg h GLU 289 CO -0.09 0.13 -0.01 1.25 -0.73 0.00 0.00 179.01 179.55 1ddg h LEU 290 N 0.01 -0.08 -0.85 1.64 7.12 -0.97 -2.19 115.31 120.00 1ddg h LEU 290 Ca 0.02 0.04 -0.05 0.00 0.13 0.00 0.00 57.88 58.01 1ddg h LEU 290 Cb 0.07 0.07 -0.03 0.00 -0.53 0.00 0.00 40.66 40.24 1ddg h LEU 290 CO -0.00 -0.02 0.25 0.58 -0.13 0.00 0.00 178.44 179.12 1ddg h VAL 291 N 0.04 1.25 -0.03 1.05 2.07 -1.30 -2.54 116.25 116.79 1ddg h VAL 291 Ca 0.07 -0.85 -0.13 0.00 0.82 0.00 0.00 66.70 66.61 1ddg h VAL 291 Cb 0.09 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1ddg h VAL 291 CO -0.13 0.34 -0.59 -0.08 0.02 0.00 0.00 177.57 177.13 1ddg h GLU 292 N 1.07 0.09 -0.23 1.57 4.81 -1.15 -0.85 114.58 119.88 1ddg h GLU 292 Ca 0.24 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 1ddg h GLU 292 Cb 0.26 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1ddg h GLU 292 CO -0.01 0.65 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.82 1ddg h LEU 293 N 0.06 0.32 -0.98 1.64 3.38 -1.00 -2.46 115.31 116.27 1ddg h LEU 293 Ca -0.01 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ddg h LEU 293 Cb 1.05 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1ddg h LEU 293 CO 0.08 0.40 0.00 0.18 0.09 0.00 0.00 178.44 179.19 1ddg n LEU 294 N -4.32 1.48 -2.26 1.67 4.32 -1.03 -4.30 117.00 112.57 1ddg n LEU 294 Ca 0.00 -0.61 -0.16 0.00 -0.02 0.00 0.00 56.01 55.22 1ddg n LEU 294 Cb 0.22 -0.09 0.03 0.00 -1.62 0.00 0.00 43.42 41.96 1ddg n LEU 294 CO 0.38 0.31 0.02 0.79 -1.22 0.00 0.00 177.39 177.66 1ddg n TRP 295 N 0.20 -1.47 -4.19 -1.77 8.01 -0.93 -2.67 117.44 114.62 1ddg n TRP 295 Ca 0.16 0.41 -0.24 0.00 -1.31 0.00 0.00 57.50 56.53 1ddg n TRP 295 Cb 0.30 -3.53 -0.07 0.00 -2.01 0.00 0.00 31.31 26.00 1ddg n TRP 295 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1ddg s LEU 296 N -4.94 3.16 -0.11 -0.99 1.43 -0.34 -4.89 118.68 112.00 1ddg s LEU 296 Ca 0.24 -0.85 0.16 0.00 -1.03 0.00 0.00 54.13 52.65 1ddg s LEU 296 Cb -0.10 -1.59 -0.24 0.00 0.03 0.00 0.00 46.19 44.29 1ddg s LEU 296 CO 0.29 -0.27 0.38 0.29 0.23 0.00 0.00 176.35 177.27 1ddg n LYS 297 N -1.08 0.66 0.00 1.70 4.01 -1.26 -4.26 118.16 117.93 1ddg n LYS 297 Ca -0.04 0.11 0.00 0.00 -0.51 0.00 0.00 58.31 57.87 1ddg n LYS 297 Cb 0.62 -1.64 0.00 0.00 -0.51 0.00 0.00 35.03 33.49 1ddg n LYS 297 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ddg n GLY 298 N 1.61 2.69 0.00 0.72 0.00 -1.26 -4.99 105.19 103.96 1ddg n GLY 298 Ca -0.23 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1ddg n GLY 298 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ddg n ASP 299 N 0.38 0.00 -2.25 1.61 5.68 -1.26 0.18 116.55 120.89 1ddg n ASP 299 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 54.79 54.27 1ddg n ASP 299 Cb 0.00 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1ddg n ASP 299 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1ddg n GLU 300 N 0.00 -4.21 -2.35 0.11 4.71 -1.26 0.66 120.64 118.30 1ddg n GLU 300 Ca 0.00 3.17 -0.40 0.00 -0.01 0.00 0.00 57.16 59.93 1ddg n GLU 300 Cb 0.00 -4.23 -0.03 0.00 -1.01 0.00 0.00 31.44 26.16 1ddg n GLU 300 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1ddg s PRO 301 N -0.79 4.45 0.01 3.49 0.04 -1.26 -0.04 135.00 140.89 1ddg s PRO 301 Ca -0.10 1.91 -0.00 0.00 0.04 0.00 0.00 61.00 62.85 1ddg s PRO 301 Cb 0.01 -3.05 -0.01 0.00 0.04 0.00 0.00 34.50 31.49 1ddg s PRO 301 CO 0.27 0.00 -0.01 0.08 0.04 0.00 0.00 177.00 177.38 1ddg s VAL 302 N -1.22 0.07 -0.13 -0.36 1.01 0.40 -4.87 120.40 115.31 1ddg s VAL 302 Ca 0.48 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1ddg s VAL 302 Cb -0.34 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.85 1ddg s VAL 302 CO 0.43 -0.30 -0.08 -0.89 0.00 0.00 0.00 175.10 174.26 1ddg s THR 303 N -0.88 3.51 -0.15 3.92 2.01 -1.26 -0.89 115.64 121.90 1ddg s THR 303 Ca -0.10 -0.50 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 1ddg s THR 303 Cb -0.06 -2.50 0.05 0.00 0.01 0.00 0.00 72.50 70.00 1ddg s THR 303 CO -0.01 0.52 0.00 -0.69 -0.69 0.00 0.00 174.62 173.76 1ddg s VAL 304 N 0.17 0.62 -1.21 3.82 1.01 -0.31 -4.89 120.40 119.61 1ddg s VAL 304 Ca -0.04 -0.38 -0.34 0.00 0.00 0.00 0.00 61.98 61.22 1ddg s VAL 304 Cb -0.14 -0.95 0.04 0.00 0.00 0.00 0.00 36.38 35.33 1ddg s VAL 304 CO 0.04 0.01 0.69 -0.62 0.00 0.00 0.00 175.10 175.22 1ddg n GLU 305 N 5.04 -0.28 -0.19 2.72 1.02 -1.26 -1.16 120.64 126.52 1ddg n GLU 305 Ca -0.09 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1ddg n GLU 305 Cb 0.48 -2.58 0.00 0.00 -0.02 0.00 0.00 31.44 29.32 1ddg n GLU 305 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ddg n GLY 306 N -2.08 1.69 3.08 0.62 0.00 -1.26 -5.05 105.19 102.20 1ddg n GLY 306 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 1ddg n GLY 306 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ddg s LYS 307 N -0.32 1.85 -0.22 1.61 2.47 -0.31 -5.10 119.74 119.72 1ddg s LYS 307 Ca 0.00 -0.53 -0.24 0.00 -1.56 0.00 0.00 55.97 53.64 1ddg s LYS 307 Cb 0.00 -1.54 -0.01 0.00 -1.46 0.00 0.00 37.83 34.82 1ddg s LYS 307 CO 0.00 0.13 0.81 0.99 0.16 0.00 0.00 175.35 177.43 1ddg s THR 308 N 0.38 4.87 0.05 3.43 2.01 -1.26 -1.16 115.64 123.96 1ddg s THR 308 Ca -0.11 1.54 0.04 0.00 0.31 0.00 0.00 61.69 63.48 1ddg s THR 308 Cb -0.14 -4.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.24 1ddg s THR 308 CO 0.04 -0.03 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.06 1ddg s LEU 309 N 2.57 2.21 0.56 4.42 1.43 -0.07 -4.93 118.68 124.87 1ddg s LEU 309 Ca 0.35 -0.50 -0.21 0.00 -1.03 0.00 0.00 54.13 52.74 1ddg s LEU 309 Cb -0.16 -0.46 -0.04 0.00 0.03 0.00 0.00 46.19 45.56 1ddg s LEU 309 CO 0.09 -0.05 1.31 -2.84 0.23 0.00 0.00 176.35 175.09 1ddg s PRO 310 N -1.36 3.09 0.24 1.29 0.02 -1.26 -0.45 135.00 136.57 1ddg s PRO 310 Ca -0.02 2.11 -0.13 0.00 0.02 0.00 0.00 61.00 62.97 1ddg s PRO 310 Cb -0.09 -2.16 0.32 0.00 0.02 0.00 0.00 34.50 32.59 1ddg s PRO 310 CO 0.01 -1.19 1.52 -0.11 -0.33 0.00 0.00 177.00 176.91 1ddg n LEU 311 N -1.18 -0.52 -0.21 -5.54 0.00 0.21 -1.99 117.00 107.77 1ddg n LEU 311 Ca 0.11 1.70 0.02 0.00 0.00 0.00 0.00 56.01 57.84 1ddg n LEU 311 Cb 0.46 -0.44 0.27 0.00 0.00 0.00 0.00 43.42 43.72 1ddg n LEU 311 CO 0.50 -1.57 1.23 -0.55 0.00 0.00 0.00 177.39 177.01 1ddg h ASN 312 N 0.00 0.81 0.79 1.96 -1.07 -0.45 -1.70 115.58 115.93 1ddg h ASN 312 Ca 0.39 -0.02 -0.21 0.00 0.07 0.00 0.00 56.30 56.54 1ddg h ASN 312 Cb 0.64 -0.20 -0.02 0.00 -2.07 0.00 0.00 38.32 36.67 1ddg h ASN 312 CO -0.99 0.57 -0.97 -0.08 0.07 0.00 0.00 177.43 176.04 1ddg h GLU 313 N 0.95 0.10 -0.52 4.14 4.81 -1.67 -1.63 114.58 120.76 1ddg h GLU 313 Ca 0.28 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 59.31 1ddg h GLU 313 Cb -0.03 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1ddg h GLU 313 CO -0.07 0.98 0.03 0.00 -0.73 0.00 0.00 179.01 179.22 1ddg h ALA 314 N 0.96 0.70 -0.20 2.92 0.00 -1.13 -1.15 119.26 121.36 1ddg h ALA 314 Ca -0.04 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.41 1ddg h ALA 314 Cb 1.66 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1ddg h ALA 314 CO 0.14 0.49 -0.64 -0.07 0.00 0.00 0.00 179.25 179.16 1ddg h LEU 315 N 0.77 0.84 -0.59 0.00 3.38 -1.34 0.14 115.31 118.51 1ddg h LEU 315 Ca 0.15 -0.49 -0.14 0.00 0.09 0.00 0.00 57.88 57.49 1ddg h LEU 315 Cb 0.48 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1ddg h LEU 315 CO 0.02 1.27 -0.38 -0.61 0.09 0.00 0.00 178.44 178.82 1ddg h GLN 316 N 0.54 0.69 0.00 1.13 4.15 -1.21 -3.35 115.11 117.06 1ddg h GLN 316 Ca -0.01 -0.35 -0.04 0.00 0.77 0.00 0.00 58.65 59.01 1ddg h GLN 316 Cb 1.24 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.93 1ddg h GLN 316 CO 0.13 0.96 -1.76 0.91 -1.93 0.00 0.00 178.83 177.14 1ddg n TRP 317 N -4.04 0.00 -0.41 3.99 7.02 -0.44 -1.05 117.44 122.50 1ddg n TRP 317 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1ddg n TRP 317 Cb 0.52 -0.42 0.00 0.00 -2.42 0.00 0.00 31.31 28.99 1ddg n TRP 317 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1ddg n HIS 318 N -2.13 0.00 -4.52 -5.99 8.25 0.47 -4.80 115.22 106.50 1ddg n HIS 318 Ca -0.06 -0.08 -0.21 0.00 -0.26 0.00 0.00 57.72 57.10 1ddg n HIS 318 Cb 0.50 -0.01 -0.14 0.00 1.12 0.00 0.00 29.99 31.46 1ddg n HIS 318 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1ddg s PHE 319 N -0.16 1.25 0.10 4.41 0.08 -1.17 -0.95 117.98 121.55 1ddg s PHE 319 Ca 0.00 -0.29 -0.31 0.00 0.12 0.00 0.00 56.93 56.46 1ddg s PHE 319 Cb 0.00 -0.78 -0.07 0.00 -0.57 0.00 0.00 43.02 41.61 1ddg s PHE 319 CO 0.00 0.01 1.25 -2.00 -0.10 0.00 0.00 175.22 174.38 1ddg s GLU 320 N -0.69 4.41 0.00 0.44 2.12 0.14 -4.43 118.70 120.69 1ddg s GLU 320 Ca 0.04 1.88 0.00 0.00 0.36 0.00 0.00 54.97 57.25 1ddg s GLU 320 Cb -0.06 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 31.03 1ddg s GLU 320 CO 0.00 -0.27 0.00 1.28 -0.54 0.00 0.00 175.26 175.73 1ddg n LEU 321 N 3.61 0.00 -0.58 2.70 4.77 -1.26 -4.47 117.00 121.76 1ddg n LEU 321 Ca 0.09 -0.26 0.06 0.00 -0.03 0.00 0.00 56.01 55.87 1ddg n LEU 321 Cb 0.45 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.65 1ddg n LEU 321 CO 0.56 0.00 0.54 0.35 -1.33 0.00 0.00 177.39 177.52 1ddg n THR 322 N -1.06 0.54 -3.88 -5.08 -2.24 -1.26 -4.35 114.28 96.95 1ddg n THR 322 Ca 0.00 -0.77 -0.30 0.00 -2.27 0.00 0.00 64.05 60.71 1ddg n THR 322 Cb 0.00 0.84 -0.15 0.00 -2.10 0.00 0.00 70.33 68.92 1ddg n THR 322 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ddg s VAL 323 N -0.99 1.35 0.41 2.28 1.01 -1.26 -4.83 120.40 118.36 1ddg s VAL 323 Ca 0.19 -1.32 -0.07 0.00 0.00 0.00 0.00 61.98 60.78 1ddg s VAL 323 Cb 0.11 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1ddg s VAL 323 CO 0.16 -0.31 0.73 0.21 0.00 0.00 0.00 175.10 175.88 1ddg s ASN 324 N 1.44 6.41 0.04 3.32 3.84 -1.26 -4.91 114.94 123.82 1ddg s ASN 324 Ca 0.01 0.96 -0.02 0.00 0.21 0.00 0.00 52.86 54.01 1ddg s ASN 324 Cb -0.18 -2.25 -0.03 0.00 -0.55 0.00 0.00 41.25 38.24 1ddg s ASN 324 CO -0.11 -0.42 0.01 0.42 -2.79 0.00 0.00 177.10 174.22 1ddg s THR 325 N -2.44 0.17 0.43 -5.21 -4.23 -1.26 -4.73 115.64 98.37 1ddg s THR 325 Ca 0.48 -1.41 0.16 0.00 -1.18 0.00 0.00 61.69 59.74 1ddg s THR 325 Cb -0.10 -1.09 0.36 0.00 1.34 0.00 0.00 72.50 73.00 1ddg s THR 325 CO 0.36 -0.78 1.92 0.00 -0.54 0.00 0.00 174.62 175.57 1ddg h ALA 326 N 3.56 2.14 -0.19 3.99 0.00 -1.90 -1.31 119.26 125.56 1ddg h ALA 326 Ca -0.33 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.39 1ddg h ALA 326 Cb 1.17 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.91 1ddg h ALA 326 CO 0.56 -0.35 -0.64 -0.91 0.00 0.00 0.00 179.25 177.92 1ddg h ASN 327 N 0.40 0.88 -0.18 0.00 2.35 -1.97 -0.46 115.58 116.61 1ddg h ASN 327 Ca 0.38 -0.60 -0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1ddg h ASN 327 Cb 0.89 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1ddg h ASN 327 CO -0.12 1.33 0.09 0.40 -1.65 0.00 0.00 177.43 177.48 1ddg h ILE 328 N 0.49 1.11 -0.53 2.81 2.04 -1.76 0.27 117.51 121.93 1ddg h ILE 328 Ca -0.03 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.56 1ddg h ILE 328 Cb 1.26 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 1ddg h ILE 328 CO 0.14 0.11 0.29 0.58 0.00 0.00 0.00 178.15 179.26 1ddg h VAL 329 N 0.18 0.99 -0.45 1.67 2.07 -1.15 0.12 116.25 119.68 1ddg h VAL 329 Ca 0.06 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1ddg h VAL 329 Cb 0.09 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1ddg h VAL 329 CO -0.01 0.10 0.18 -0.08 0.02 0.00 0.00 177.57 177.79 1ddg h GLU 330 N 0.57 0.67 -0.05 1.57 4.81 -0.83 -2.00 114.58 119.32 1ddg h GLU 330 Ca 0.23 -0.12 -0.13 0.00 -0.13 0.00 0.00 59.36 59.21 1ddg h GLU 330 Cb 0.10 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1ddg h GLU 330 CO -0.14 0.61 -0.57 -0.91 -0.73 0.00 0.00 179.01 177.27 1ddg h ASN 331 N 0.58 0.17 -0.08 1.04 -0.26 0.05 -1.51 115.58 115.56 1ddg h ASN 331 Ca 0.15 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.78 1ddg h ASN 331 Cb 0.19 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 37.39 1ddg h ASN 331 CO -0.01 0.70 -0.02 0.22 -1.06 0.00 0.00 177.43 177.26 1ddg h TYR 332 N 0.11 0.17 -0.34 1.19 3.20 -0.67 0.10 116.97 120.73 1ddg h TYR 332 Ca -0.00 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.90 1ddg h TYR 332 Cb 1.03 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 39.20 1ddg h TYR 332 CO 0.01 0.47 -0.10 0.00 -1.64 0.00 0.00 178.16 176.90 1ddg h ALA 333 N 0.68 0.20 -0.11 1.82 0.00 -1.37 0.33 119.26 120.82 1ddg h ALA 333 Ca 0.02 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1ddg h ALA 333 Cb 0.41 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1ddg h ALA 333 CO 0.01 -0.47 0.00 1.15 0.00 0.00 0.00 179.25 179.94 1ddg h THR 334 N -0.02 1.24 -0.59 0.00 2.02 -1.25 0.28 112.91 114.60 1ddg h THR 334 Ca 0.17 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1ddg h THR 334 Cb 0.27 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1ddg h THR 334 CO -0.36 0.22 0.37 0.25 0.37 0.00 0.00 175.52 176.37 1ddg h LEU 335 N -0.08 0.69 -0.79 2.58 5.85 -0.47 -2.99 115.31 120.09 1ddg h LEU 335 Ca 0.03 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1ddg h LEU 335 Cb 0.34 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.19 1ddg h LEU 335 CO 0.00 0.52 -0.33 0.35 -0.34 0.00 0.00 178.44 178.64 1ddg n THR 336 N -4.66 0.00 -3.80 1.05 -2.24 0.11 -4.97 114.28 99.78 1ddg n THR 336 Ca 0.04 -0.21 -0.28 0.00 -2.27 0.00 0.00 64.05 61.33 1ddg n THR 336 Cb 0.03 0.82 0.02 0.00 -2.10 0.00 0.00 70.33 69.10 1ddg n THR 336 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ddg n ARG 337 N -0.26 -2.46 -2.13 -0.78 3.00 0.92 -4.87 116.66 110.08 1ddg n ARG 337 Ca 0.11 0.45 -0.43 0.00 -0.01 0.00 0.00 57.85 57.97 1ddg n ARG 337 Cb 0.41 -4.38 -0.02 0.00 0.00 0.00 0.00 32.46 28.46 1ddg n ARG 337 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 1ddg s SER 338 N -3.93 6.24 0.37 0.55 1.04 -0.77 -4.89 113.70 112.30 1ddg s SER 338 Ca 0.23 1.37 0.10 0.00 0.48 0.00 0.00 55.95 58.13 1ddg s SER 338 Cb -0.08 -2.53 0.85 0.00 0.10 0.00 0.00 66.02 64.35 1ddg s SER 338 CO 0.87 -1.42 1.88 -0.08 0.98 0.00 0.00 173.24 175.47 1ddg h GLU 339 N 11.31 0.64 0.00 4.02 4.81 -1.91 -1.18 114.58 132.27 1ddg h GLU 339 Ca -0.32 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1ddg h GLU 339 Cb 1.15 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.38 1ddg h GLU 339 CO 1.03 0.42 -0.64 1.79 -0.73 0.00 0.00 179.01 180.87 1ddg h THR 340 N 0.66 0.00 0.00 0.32 1.35 -1.98 -3.38 112.91 109.88 1ddg h THR 340 Ca 0.43 -0.91 -0.24 0.00 -0.55 0.00 0.00 66.41 65.13 1ddg h THR 340 Cb 0.71 1.58 -0.05 0.00 -1.73 0.00 0.00 68.15 68.66 1ddg h THR 340 CO -0.19 0.00 -2.12 0.18 -0.25 0.00 0.00 175.52 173.14 1ddg n LEU 341 N -2.70 0.16 -0.32 3.87 4.77 -0.92 -4.58 117.00 117.27 1ddg n LEU 341 Ca 0.02 0.07 0.07 0.00 -0.03 0.00 0.00 56.01 56.14 1ddg n LEU 341 Cb 0.53 0.30 0.23 0.00 -2.33 0.00 0.00 43.42 42.14 1ddg n LEU 341 CO 0.38 0.32 1.16 -0.07 -1.33 0.00 0.00 177.39 177.84 1ddg h LEU 342 N 0.00 0.72 -1.07 2.23 -0.00 -1.41 -1.97 115.31 113.81 1ddg h LEU 342 Ca -0.34 0.07 0.00 0.00 -0.00 0.00 0.00 57.88 57.61 1ddg h LEU 342 Cb 1.82 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 42.42 1ddg h LEU 342 CO 0.03 0.35 0.07 -2.65 -0.00 0.00 0.00 178.44 176.24 1ddg n PRO 343 N -4.75 0.10 0.08 1.13 -0.02 -1.26 -1.31 135.00 128.97 1ddg n PRO 343 Ca 0.18 0.59 -0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1ddg n PRO 343 Cb 0.39 -1.92 -0.04 0.00 -0.02 0.00 0.00 33.50 31.91 1ddg n PRO 343 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ddg h LEU 344 N 0.00 0.00 -9.28 2.45 3.38 -1.67 -3.45 115.31 106.74 1ddg h LEU 344 Ca 0.00 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.29 1ddg h LEU 344 Cb 0.15 0.00 0.06 0.00 0.09 0.00 0.00 40.66 40.96 1ddg h LEU 344 CO 0.00 0.62 0.41 0.52 0.09 0.00 0.00 178.44 180.08 1ddg n VAL 345 N -3.11 0.16 -1.72 1.22 0.31 -0.43 0.05 118.33 114.81 1ddg n VAL 345 Ca -0.03 -0.04 -0.14 0.00 -0.01 0.00 0.00 64.34 64.12 1ddg n VAL 345 Cb 0.82 -0.81 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 1ddg n VAL 345 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ddg n GLY 346 N 2.42 0.75 1.16 2.92 0.00 -1.26 -4.79 105.19 106.38 1ddg n GLY 346 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1ddg n GLY 346 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ddg n ASP 347 N -0.96 3.44 0.00 1.61 8.00 0.11 -4.99 116.55 123.75 1ddg n ASP 347 Ca -0.15 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.37 1ddg n ASP 347 Cb 0.51 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 1ddg n ASP 347 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ddg n LYS 348 N 1.45 0.00 0.19 -1.24 4.01 -1.26 -3.58 118.16 117.72 1ddg n LYS 348 Ca 0.20 0.00 0.11 0.00 -0.51 0.00 0.00 58.31 58.11 1ddg n LYS 348 Cb 0.59 0.00 0.12 0.00 -0.51 0.00 0.00 35.03 35.23 1ddg n LYS 348 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ddg h ALA 349 N -0.44 0.87 -0.64 7.82 0.00 -1.94 -3.08 119.26 121.86 1ddg h ALA 349 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1ddg h ALA 349 Cb 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1ddg h ALA 349 CO 0.00 0.07 0.14 0.87 0.00 0.00 0.00 179.25 180.33 1ddg h LYS 350 N 0.00 1.02 -0.31 0.00 1.57 -1.89 -1.30 116.57 115.66 1ddg h LYS 350 Ca -0.00 -0.24 -0.05 0.00 -1.87 0.00 0.00 60.65 58.48 1ddg h LYS 350 Cb 1.05 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1ddg h LYS 350 CO 0.01 0.91 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.72 1ddg h LEU 351 N 0.96 0.54 -0.97 2.94 3.38 -1.78 -0.48 115.31 119.91 1ddg h LEU 351 Ca 0.20 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 1ddg h LEU 351 Cb 0.37 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1ddg h LEU 351 CO 0.00 0.73 -0.35 1.56 0.09 0.00 0.00 178.44 180.48 1ddg h GLN 352 N 0.35 0.31 0.01 1.13 4.20 -1.47 -1.59 115.11 118.05 1ddg h GLN 352 Ca 0.09 -0.13 -0.27 0.00 0.06 0.00 0.00 58.65 58.39 1ddg h GLN 352 Cb 0.46 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.25 1ddg h GLN 352 CO 0.02 0.62 -1.06 1.25 -0.67 0.00 0.00 178.83 178.99 1ddg h HIS 353 N 0.27 1.05 -0.55 2.96 2.76 -1.17 -2.15 115.15 118.33 1ddg h HIS 353 Ca 0.03 -0.58 -0.05 0.00 -2.20 0.00 0.00 60.37 57.57 1ddg h HIS 353 Cb 0.74 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.56 1ddg h HIS 353 CO 0.02 1.42 0.14 -0.92 -1.30 0.00 0.00 177.93 177.28 1ddg h TYR 354 N 0.39 0.91 -0.06 5.26 3.20 -1.00 -2.79 116.97 122.89 1ddg h TYR 354 Ca -0.13 -0.11 -0.06 0.00 3.14 0.00 0.00 58.73 61.57 1ddg h TYR 354 Cb 1.71 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.72 1ddg h TYR 354 CO 0.10 0.79 -0.23 0.00 -1.64 0.00 0.00 178.16 177.18 1ddg h ALA 355 N 1.02 1.51 0.00 1.82 0.00 -1.30 0.14 119.26 122.44 1ddg h ALA 355 Ca 0.17 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1ddg h ALA 355 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1ddg h ALA 355 CO 0.00 0.36 -0.27 0.00 0.00 0.00 0.00 179.25 179.34 1ddg h ALA 356 N 1.68 0.88 0.00 0.00 0.00 -1.27 -3.33 119.26 117.22 1ddg h ALA 356 Ca 0.02 -0.25 -0.34 0.00 0.00 0.00 0.00 54.91 54.34 1ddg h ALA 356 Cb 0.47 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1ddg h ALA 356 CO 0.03 0.34 -2.23 2.41 0.00 0.00 0.00 179.25 179.80 1ddg n THR 357 N -3.25 1.40 -3.76 0.00 -1.04 -1.06 -4.90 114.28 101.66 1ddg n THR 357 Ca 0.02 -0.84 -0.28 0.00 -2.04 0.00 0.00 64.05 60.91 1ddg n THR 357 Cb 0.56 -0.57 -0.16 0.00 -1.82 0.00 0.00 70.33 68.34 1ddg n THR 357 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ddg s THR 358 N -2.54 0.70 0.94 12.58 2.01 0.02 -5.05 115.64 124.30 1ddg s THR 358 Ca -0.09 -0.80 -0.12 0.00 0.31 0.00 0.00 61.69 60.99 1ddg s THR 358 Cb 0.07 -1.24 0.08 0.00 0.01 0.00 0.00 72.50 71.42 1ddg s THR 358 CO 0.83 -0.29 0.69 -2.65 -0.69 0.00 0.00 174.62 172.51 1ddg n PRO 359 N 4.97 -0.40 -0.29 4.92 -0.02 -1.26 -4.58 135.00 138.34 1ddg n PRO 359 Ca -0.08 -0.07 -0.01 0.00 -2.02 0.00 0.00 63.50 61.33 1ddg n PRO 359 Cb 0.46 -2.06 0.12 0.00 -0.02 0.00 0.00 33.50 32.00 1ddg n PRO 359 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1ddg h ILE 360 N -1.72 1.06 0.00 4.25 2.04 -1.91 0.37 117.51 121.60 1ddg h ILE 360 Ca -0.44 -0.32 -0.09 0.00 1.00 0.00 0.00 64.86 65.01 1ddg h ILE 360 Cb 1.28 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1ddg h ILE 360 CO 0.37 0.17 -0.44 0.58 0.00 0.00 0.00 178.15 178.83 1ddg h VAL 361 N 0.93 1.20 0.14 1.67 2.07 -1.91 -1.65 116.25 118.70 1ddg h VAL 361 Ca 0.34 -1.56 -0.28 0.00 0.82 0.00 0.00 66.70 66.02 1ddg h VAL 361 Cb 0.12 1.87 0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1ddg h VAL 361 CO -0.15 0.43 -1.25 0.44 0.02 0.00 0.00 177.57 177.05 1ddg h ASP 362 N 0.00 0.58 -0.68 0.57 3.32 -1.69 -0.09 116.42 118.42 1ddg h ASP 362 Ca -0.00 -0.58 0.10 0.00 0.02 0.00 0.00 57.03 56.56 1ddg h ASP 362 Cb 0.83 -0.19 -0.08 0.00 0.22 0.00 0.00 39.33 40.12 1ddg h ASP 362 CO 0.06 1.44 0.30 -0.03 -1.72 0.00 0.00 179.24 179.28 1ddg h MET 363 N 0.13 0.48 0.00 3.56 4.05 -0.02 -0.58 114.93 122.56 1ddg h MET 363 Ca -0.16 -0.03 -0.07 0.00 -0.28 0.00 0.00 59.70 59.17 1ddg h MET 363 Cb 1.96 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 32.64 1ddg h MET 363 CO 0.22 0.32 -0.80 -0.39 0.23 0.00 0.00 176.91 176.49 1ddg h VAL 364 N 0.50 0.31 -0.87 -5.77 -1.51 -1.18 -2.56 116.25 105.17 1ddg h VAL 364 Ca 0.35 -1.51 0.04 0.00 -1.23 0.00 0.00 66.70 64.35 1ddg h VAL 364 Cb 0.43 1.93 -0.05 0.00 -2.13 0.00 0.00 31.29 31.46 1ddg h VAL 364 CO -0.31 0.17 0.56 -0.09 -1.23 0.00 0.00 177.57 176.67 1ddg h ARG 365 N 0.00 1.05 0.00 5.19 2.43 -0.67 0.15 114.38 122.53 1ddg h ARG 365 Ca -0.04 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.00 1ddg h ARG 365 Cb 1.23 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1ddg h ARG 365 CO 0.03 0.69 -0.31 0.74 -1.51 0.00 0.00 179.97 179.60 1ddg h PHE 366 N 1.08 0.00 -1.58 2.20 0.04 -1.11 -3.37 116.94 114.20 1ddg h PHE 366 Ca 0.35 0.00 -0.48 0.00 2.80 0.00 0.00 57.97 60.64 1ddg h PHE 366 Cb 0.02 0.00 -0.34 0.00 2.20 0.00 0.00 35.95 37.83 1ddg h PHE 366 CO -0.02 0.31 -0.99 0.45 -0.60 0.00 0.00 178.31 177.46 1ddg n SER 367 N -3.19 -0.36 -4.78 2.17 2.88 -0.97 -5.07 113.62 104.30 1ddg n SER 367 Ca 0.03 -2.88 -0.31 0.00 -1.33 0.00 0.00 58.87 54.38 1ddg n SER 367 Cb 0.64 -0.11 0.09 0.00 -0.75 0.00 0.00 64.21 64.08 1ddg n SER 367 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1ddg s PRO 368 N -0.98 2.29 -0.07 -1.46 0.04 0.50 -4.68 135.00 130.64 1ddg s PRO 368 Ca 0.35 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 62.09 1ddg s PRO 368 Cb 0.21 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.94 1ddg s PRO 368 CO -0.13 -1.57 0.86 0.00 0.04 0.00 0.00 177.00 176.21 1ddg s ALA 369 N -2.98 -1.84 -0.14 8.56 0.00 -1.26 -5.08 121.76 119.02 1ddg s ALA 369 Ca 0.61 1.31 -0.29 0.00 0.00 0.00 0.00 51.96 53.58 1ddg s ALA 369 Cb -0.16 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 1ddg s ALA 369 CO 0.56 -0.45 1.25 1.14 0.00 0.00 0.00 175.76 178.26 1ddg s GLN 370 N -1.78 4.26 0.07 0.00 0.00 -1.26 -4.34 119.66 116.60 1ddg s GLN 370 Ca -0.02 1.66 0.08 0.00 -0.00 0.00 0.00 55.36 57.08 1ddg s GLN 370 Cb -0.00 -3.71 -0.03 0.00 0.00 0.00 0.00 33.01 29.26 1ddg s GLN 370 CO 0.00 -0.64 -0.21 -1.17 0.00 0.00 0.00 175.29 173.27 1ddg s LEU 371 N 3.17 2.23 0.45 2.60 2.96 -1.09 -5.04 118.68 123.96 1ddg s LEU 371 Ca 0.55 -0.60 -0.07 0.00 -0.22 0.00 0.00 54.13 53.79 1ddg s LEU 371 Cb -0.22 -0.97 -0.05 0.00 0.50 0.00 0.00 46.19 45.45 1ddg s LEU 371 CO 0.16 0.13 0.77 1.51 -1.32 0.00 0.00 176.35 177.60 1ddg s ASP 372 N -1.51 6.35 0.43 3.68 1.47 -1.26 -4.76 116.67 121.07 1ddg s ASP 372 Ca 0.08 0.99 0.13 0.00 1.18 0.00 0.00 52.55 54.93 1ddg s ASP 372 Cb -0.09 -2.27 1.00 0.00 -0.34 0.00 0.00 42.92 41.22 1ddg s ASP 372 CO 0.03 -0.51 1.97 0.00 0.68 0.00 0.00 175.17 177.34 1ddg h ALA 373 N 0.61 1.99 -0.01 2.11 0.00 -1.96 -1.72 119.26 120.28 1ddg h ALA 373 Ca -0.47 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.24 1ddg h ALA 373 Cb 1.20 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1ddg h ALA 373 CO 0.63 -0.13 -0.84 0.93 0.00 0.00 0.00 179.25 179.83 1ddg h GLU 374 N 0.45 0.23 -0.52 0.00 5.08 -1.92 -2.71 114.58 115.18 1ddg h GLU 374 Ca 0.29 -0.23 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1ddg h GLU 374 Cb 0.55 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 1ddg h GLU 374 CO -0.09 0.94 -0.10 0.00 -1.00 0.00 0.00 179.01 178.76 1ddg h ALA 375 N 0.98 0.82 0.76 3.43 0.00 -1.72 -2.41 119.26 121.12 1ddg h ALA 375 Ca -0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1ddg h ALA 375 Cb 1.45 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ddg h ALA 375 CO 0.13 0.66 -0.40 1.25 0.00 0.00 0.00 179.25 180.89 1ddg h LEU 376 N 0.87 -0.96 -1.62 0.00 6.46 -1.38 -2.60 115.31 116.08 1ddg h LEU 376 Ca 0.14 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.91 1ddg h LEU 376 Cb 0.65 0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.84 1ddg h LEU 376 CO 0.05 -0.65 -0.14 0.40 -0.62 0.00 0.00 178.44 177.47 1ddg h ILE 377 N -1.06 0.46 0.00 4.05 2.04 -1.47 -0.24 117.51 121.29 1ddg h ILE 377 Ca -0.10 -0.73 -0.13 0.00 1.00 0.00 0.00 64.86 64.90 1ddg h ILE 377 Cb 0.83 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1ddg h ILE 377 CO 0.15 0.14 -0.62 -1.13 0.00 0.00 0.00 178.15 176.68 1ddg h ASN 378 N 0.00 0.00 0.36 1.72 -1.24 -1.44 -3.20 115.58 111.79 1ddg h ASN 378 Ca -0.00 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.88 1ddg h ASN 378 Cb 0.49 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 1ddg h ASN 378 CO 0.02 0.62 -0.53 0.25 -1.29 0.00 0.00 177.43 176.50 1ddg h LEU 379 N 0.00 0.20-10.13 0.34 5.85 -0.63 -3.47 115.31 107.47 1ddg h LEU 379 Ca -0.01 -0.10 -0.51 0.00 0.84 0.00 0.00 57.88 58.10 1ddg h LEU 379 Cb 1.12 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1ddg h LEU 379 CO 0.08 0.69 -0.05 -0.76 -0.34 0.00 0.00 178.44 178.06 1ddg s LEU 380 N -8.00 3.97 0.08 2.25 1.02 -1.10 -4.84 118.68 112.06 1ddg s LEU 380 Ca -0.04 0.84 0.01 0.00 0.02 0.00 0.00 54.13 54.97 1ddg s LEU 380 Cb 0.13 -3.69 -0.04 0.00 0.02 0.00 0.00 46.19 42.61 1ddg s LEU 380 CO 0.78 -0.28 0.18 -0.13 0.02 0.00 0.00 176.35 176.92 1ddg s ARG 381 N -3.71 3.25 0.60 1.70 0.52 -1.26 -4.98 118.95 115.08 1ddg s ARG 381 Ca 0.46 -0.55 -0.18 0.00 -0.52 0.00 0.00 55.73 54.94 1ddg s ARG 381 Cb -0.11 -2.92 -0.03 0.00 0.52 0.00 0.00 34.95 32.42 1ddg s ARG 381 CO 0.31 0.58 1.15 -2.14 0.02 0.00 0.00 175.30 175.23 1ddg s PRO 382 N -2.58 3.00 0.23 3.54 0.02 -1.26 0.25 135.00 138.20 1ddg s PRO 382 Ca 0.33 1.64 -0.30 0.00 0.02 0.00 0.00 61.00 62.69 1ddg s PRO 382 Cb -0.12 -1.95 -0.09 0.00 0.02 0.00 0.00 34.50 32.35 1ddg s PRO 382 CO 0.26 -1.14 1.20 -1.17 -0.33 0.00 0.00 177.00 175.82 1ddg s LEU 383 N -4.25 4.47 0.09 -5.54 0.20 -0.12 -4.02 118.68 109.50 1ddg s LEU 383 Ca 0.73 2.33 0.05 0.00 0.69 0.00 0.00 54.13 57.92 1ddg s LEU 383 Cb -0.25 -3.62 -0.03 0.00 -0.43 0.00 0.00 46.19 41.85 1ddg s LEU 383 CO 0.34 -0.35 -0.13 0.42 -0.29 0.00 0.00 176.35 176.34 1ddg s THR 384 N -0.47 1.07 0.68 3.68 -4.23 -1.26 -4.88 115.64 110.23 1ddg s THR 384 Ca 0.51 -1.47 -0.16 0.00 -1.18 0.00 0.00 61.69 59.39 1ddg s THR 384 Cb -0.34 -1.22 0.01 0.00 1.34 0.00 0.00 72.50 72.29 1ddg s THR 384 CO 0.40 -0.37 1.16 -2.16 -0.54 0.00 0.00 174.62 173.11 1ddg s PRO 385 N -2.23 2.57 -0.00 3.99 0.04 -1.26 -4.81 135.00 133.30 1ddg s PRO 385 Ca 0.02 1.59 -0.02 0.00 0.04 0.00 0.00 61.00 62.63 1ddg s PRO 385 Cb -0.07 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1ddg s PRO 385 CO 0.02 -1.47 0.16 1.03 0.04 0.00 0.00 177.00 176.78 1ddg s ARG 386 N -3.91 3.35 -0.10 4.56 3.00 -0.61 -4.85 118.95 120.39 1ddg s ARG 386 Ca 0.71 -0.37 -0.11 0.00 0.00 0.00 0.00 55.73 55.95 1ddg s ARG 386 Cb -0.25 -3.04 -0.05 0.00 0.00 0.00 0.00 34.95 31.62 1ddg s ARG 386 CO 0.41 0.66 0.27 -0.51 0.00 0.00 0.00 175.30 176.13 1ddg s LEU 387 N -1.95 4.37 -0.07 2.53 1.02 -1.26 -0.82 118.68 122.49 1ddg s LEU 387 Ca 0.27 0.62 0.01 0.00 0.02 0.00 0.00 54.13 55.05 1ddg s LEU 387 Cb -0.13 -2.32 0.02 0.00 0.02 0.00 0.00 46.19 43.79 1ddg s LEU 387 CO 0.19 0.29 -0.08 -0.31 0.02 0.00 0.00 176.35 176.46 1ddg s TYR 388 N -0.57 1.18 0.21 0.29 2.02 -0.59 -4.94 117.35 114.94 1ddg s TYR 388 Ca 0.18 -0.46 -0.31 0.00 -0.37 0.00 0.00 57.07 56.11 1ddg s TYR 388 Cb -0.14 -0.97 -0.11 0.00 -0.40 0.00 0.00 41.96 40.35 1ddg s TYR 388 CO 0.07 -0.32 1.60 -1.12 -1.57 0.00 0.00 175.55 174.20 1ddg s SER 389 N 1.14 6.50 0.16 2.29 0.01 -1.26 0.12 113.70 122.66 1ddg s SER 389 Ca -0.07 2.75 -0.31 0.00 1.31 0.00 0.00 55.95 59.64 1ddg s SER 389 Cb -0.14 -2.61 -0.08 0.00 0.21 0.00 0.00 66.02 63.40 1ddg s SER 389 CO -0.01 -0.86 1.36 -0.63 0.41 0.00 0.00 173.24 173.50 1ddg s ILE 390 N 0.81 3.21 -0.42 1.44 1.01 -0.74 -4.32 121.20 122.19 1ddg s ILE 390 Ca 0.69 0.93 0.16 0.00 0.00 0.00 0.00 60.65 62.42 1ddg s ILE 390 Cb -0.46 -3.59 0.69 0.00 0.01 0.00 0.00 42.46 39.11 1ddg s ILE 390 CO 0.36 0.11 1.61 0.00 0.00 0.00 0.00 174.94 177.01 1ddg n ALA 391 N 3.27 3.39 -2.27 9.38 0.00 0.13 -3.73 120.51 130.68 1ddg n ALA 391 Ca 0.09 -1.95 -0.08 0.00 0.00 0.00 0.00 53.44 51.50 1ddg n ALA 391 Cb 0.42 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.84 1ddg n ALA 391 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ddg s SER 392 N -1.18 0.34 -0.06 0.00 1.04 -1.25 -3.48 113.70 109.10 1ddg s SER 392 Ca 0.49 -0.90 0.03 0.00 0.48 0.00 0.00 55.95 56.05 1ddg s SER 392 Cb 0.36 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1ddg s SER 392 CO 0.15 -0.66 -0.15 -0.55 0.98 0.00 0.00 173.24 173.01 1ddg s SER 393 N -2.91 3.90 0.51 7.02 0.15 -1.26 -4.63 113.70 116.48 1ddg s SER 393 Ca 0.08 -0.26 0.27 0.00 0.70 0.00 0.00 55.95 56.75 1ddg s SER 393 Cb 0.07 -0.97 1.33 0.00 -1.71 0.00 0.00 66.02 64.74 1ddg s SER 393 CO -0.09 0.30 2.00 1.56 1.20 0.00 0.00 173.24 178.22 1ddg h GLN 394 N 5.66 0.00 -0.37 5.44 4.20 -1.84 0.17 115.11 128.38 1ddg h GLN 394 Ca -0.41 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.40 1ddg h GLN 394 Cb 1.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 1ddg h GLN 394 CO 0.51 0.14 0.27 0.00 -0.67 0.00 0.00 178.83 179.08 1ddg h ALA 395 N 1.86 2.32 0.00 3.87 0.00 -1.92 -3.27 119.26 122.12 1ddg h ALA 395 Ca -0.00 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.53 1ddg h ALA 395 Cb 0.46 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 1ddg h ALA 395 CO 0.02 -0.46 -2.19 -1.91 0.00 0.00 0.00 179.25 174.71 1ddg n GLU 396 N -4.38 0.51 -2.82 0.00 4.07 -0.67 -4.99 120.64 112.36 1ddg n GLU 396 Ca 0.06 0.22 -0.26 0.00 -0.06 0.00 0.00 57.16 57.12 1ddg n GLU 396 Cb 0.45 -1.35 0.00 0.00 -0.06 0.00 0.00 31.44 30.48 1ddg n GLU 396 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 1ddg s VAL 397 N -2.48 4.65 0.00 6.31 1.01 0.51 -5.05 120.40 125.34 1ddg s VAL 397 Ca -0.33 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1ddg s VAL 397 Cb 0.12 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.75 1ddg s VAL 397 CO 0.42 -0.66 0.00 -0.62 0.00 0.00 0.00 175.10 174.24 1ddg n GLU 398 N -2.17 0.00 0.00 2.72 1.02 -1.26 -4.25 120.64 116.69 1ddg n GLU 398 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1ddg n GLU 398 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 1ddg n GLU 398 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ddg n ASN 399 N -1.04 0.00 -3.83 1.62 5.15 -1.26 -4.68 115.26 111.21 1ddg n ASN 399 Ca 0.00 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.87 1ddg n ASN 399 Cb 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 39.78 39.17 1ddg n ASN 399 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1ddg s GLU 400 N -0.07 0.68 -0.06 1.20 2.02 -1.26 -0.35 118.70 120.85 1ddg s GLU 400 Ca 0.00 -0.56 0.03 0.00 0.02 0.00 0.00 54.97 54.47 1ddg s GLU 400 Cb 0.00 0.28 0.00 0.00 0.10 0.00 0.00 34.13 34.52 1ddg s GLU 400 CO 0.00 -0.19 -0.16 0.08 0.02 0.00 0.00 175.26 175.01 1ddg s VAL 401 N -2.32 1.38 0.05 2.63 1.01 -0.78 -4.82 120.40 117.53 1ddg s VAL 401 Ca -0.07 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.32 1ddg s VAL 401 Cb -0.02 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 1ddg s VAL 401 CO -0.03 0.40 -0.15 -1.00 0.00 0.00 0.00 175.10 174.33 1ddg s HIS 402 N 0.30 2.64 0.05 5.22 3.76 -1.26 0.06 115.29 126.06 1ddg s HIS 402 Ca -0.09 -0.20 -0.02 0.00 -0.15 0.00 0.00 55.06 54.60 1ddg s HIS 402 Cb -0.14 -1.48 -0.03 0.00 1.11 0.00 0.00 32.58 32.04 1ddg s HIS 402 CO 0.03 0.31 -0.00 0.54 -0.85 0.00 0.00 174.74 174.77 1ddg s VAL 403 N -0.99 0.18 -0.35 -0.90 0.11 -0.14 0.22 120.40 118.54 1ddg s VAL 403 Ca 0.16 -1.51 0.03 0.00 -2.93 0.00 0.00 61.98 57.73 1ddg s VAL 403 Cb -0.11 -1.19 0.10 0.00 -1.53 0.00 0.00 36.38 33.65 1ddg s VAL 403 CO 0.07 -0.84 0.06 -0.89 -3.33 0.00 0.00 175.10 170.18 1ddg s THR 404 N -3.28 2.36 -0.35 5.04 2.01 -1.26 -1.45 115.64 118.71 1ddg s THR 404 Ca 0.01 -2.33 -0.07 0.00 0.31 0.00 0.00 61.69 59.61 1ddg s THR 404 Cb 0.03 -2.74 0.04 0.00 0.01 0.00 0.00 72.50 69.84 1ddg s THR 404 CO -0.08 -0.61 0.13 -0.69 -0.69 0.00 0.00 174.62 172.69 1ddg s VAL 405 N 0.92 3.97 -0.23 3.82 1.01 0.90 -4.90 120.40 125.88 1ddg s VAL 405 Ca 0.11 -1.09 -0.29 0.00 0.00 0.00 0.00 61.98 60.71 1ddg s VAL 405 Cb -0.19 -3.25 -0.00 0.00 0.00 0.00 0.00 36.38 32.93 1ddg s VAL 405 CO -0.08 -0.21 1.20 -0.83 0.00 0.00 0.00 175.10 175.19 1ddg s GLY 406 N 1.46 1.58 -0.19 4.51 0.00 -1.26 -0.93 107.32 112.49 1ddg s GLY 406 Ca -0.01 0.25 -0.14 0.00 0.00 0.00 0.00 44.72 44.82 1ddg s GLY 406 CO 0.04 2.42 0.32 0.54 0.00 0.00 0.00 173.10 176.42 1ddg s VAL 407 N 3.66 5.27 -0.54 1.40 0.11 0.68 -4.89 120.40 126.08 1ddg s VAL 407 Ca 0.52 0.56 -0.28 0.00 -2.93 0.00 0.00 61.98 59.85 1ddg s VAL 407 Cb -0.18 -3.66 0.01 0.00 -1.53 0.00 0.00 36.38 31.02 1ddg s VAL 407 CO 0.15 0.32 1.48 -0.69 -3.33 0.00 0.00 175.10 173.03 1ddg s VAL 408 N 0.94 3.73 -0.04 2.04 1.01 -1.26 -4.51 120.40 122.31 1ddg s VAL 408 Ca 0.16 0.63 0.03 0.00 0.00 0.00 0.00 61.98 62.80 1ddg s VAL 408 Cb -0.14 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.92 1ddg s VAL 408 CO 0.06 -1.07 -0.11 -0.13 0.00 0.00 0.00 175.10 173.85 1ddg s ARG 409 N 5.63 1.24 0.18 2.72 0.52 -1.26 -0.04 118.95 127.94 1ddg s ARG 409 Ca 0.56 -0.37 -0.24 0.00 -0.52 0.00 0.00 55.73 55.16 1ddg s ARG 409 Cb -0.12 -1.11 0.05 0.00 0.52 0.00 0.00 34.95 34.30 1ddg s ARG 409 CO 0.26 0.11 0.77 1.52 0.02 0.00 0.00 175.30 177.98 1ddg s TYR 410 N 0.29 -0.28 0.20 -0.53 1.13 -0.54 -4.99 117.35 112.63 1ddg s TYR 410 Ca -0.06 -0.04 0.10 0.00 -1.41 0.00 0.00 57.07 55.67 1ddg s TYR 410 Cb -0.11 0.63 -0.04 0.00 -1.10 0.00 0.00 41.96 41.34 1ddg s TYR 410 CO 0.01 -0.95 -0.20 0.16 -2.51 0.00 0.00 175.55 172.07 1ddg s ASP 411 N -2.82 3.07 -0.30 -0.18 -4.77 -1.26 0.75 116.67 111.15 1ddg s ASP 411 Ca 0.08 -0.92 0.01 0.00 -3.30 0.00 0.00 52.55 48.41 1ddg s ASP 411 Cb -0.03 -0.21 0.09 0.00 -1.09 0.00 0.00 42.92 41.68 1ddg s ASP 411 CO -0.01 0.00 0.06 -0.69 0.70 0.00 0.00 175.17 175.23 1ddg s VAL 412 N -2.18 1.34 -1.55 2.11 1.01 0.21 -4.78 120.40 116.56 1ddg s VAL 412 Ca 0.21 -1.60 -0.14 0.00 0.00 0.00 0.00 61.98 60.44 1ddg s VAL 412 Cb -0.05 -1.94 0.10 0.00 0.00 0.00 0.00 36.38 34.48 1ddg s VAL 412 CO 0.09 -0.56 0.87 -0.62 0.00 0.00 0.00 175.10 174.89 1ddg n GLU 413 N 4.67 -4.68 -0.03 2.72 -0.58 -1.26 -1.38 120.64 120.09 1ddg n GLU 413 Ca -0.02 0.54 0.00 0.00 -0.42 0.00 0.00 57.16 57.26 1ddg n GLU 413 Cb 0.42 -5.37 0.00 0.00 -0.57 0.00 0.00 31.44 25.92 1ddg n GLU 413 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ddg n GLY 414 N -1.55 0.40 3.52 0.62 0.00 -1.26 -5.07 105.19 101.85 1ddg n GLY 414 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1ddg n GLY 414 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ddg s ARG 415 N -0.95 3.21 -0.05 1.61 1.81 -0.48 -5.08 118.95 119.02 1ddg s ARG 415 Ca 0.00 -0.56 -0.30 0.00 -1.72 0.00 0.00 55.73 53.16 1ddg s ARG 415 Cb 0.00 -2.73 -0.06 0.00 -0.45 0.00 0.00 34.95 31.72 1ddg s ARG 415 CO 0.00 0.43 1.69 0.00 -0.68 0.00 0.00 175.30 176.74 1ddg s ALA 416 N -0.18 3.59 0.34 2.13 0.00 -1.26 0.65 121.76 127.02 1ddg s ALA 416 Ca 0.02 0.96 0.08 0.00 0.00 0.00 0.00 51.96 53.02 1ddg s ALA 416 Cb -0.13 -3.77 -0.07 0.00 0.00 0.00 0.00 23.12 19.16 1ddg s ALA 416 CO 0.03 -1.46 -0.06 1.03 0.00 0.00 0.00 175.76 175.30 1ddg s ARG 417 N 4.14 1.76 0.06 0.00 1.81 0.23 -4.93 118.95 122.01 1ddg s ARG 417 Ca 0.75 -1.93 -0.24 0.00 -1.72 0.00 0.00 55.73 52.59 1ddg s ARG 417 Cb -0.34 -1.49 0.06 0.00 -0.45 0.00 0.00 34.95 32.73 1ddg s ARG 417 CO 0.31 0.06 0.58 0.00 -0.68 0.00 0.00 175.30 175.56 1ddg s ALA 418 N -2.78 -1.50 0.48 2.13 0.00 -1.26 -1.47 121.76 117.37 1ddg s ALA 418 Ca 0.32 0.72 -0.23 0.00 0.00 0.00 0.00 51.96 52.77 1ddg s ALA 418 Cb 0.05 0.44 -0.07 0.00 0.00 0.00 0.00 23.12 23.54 1ddg s ALA 418 CO 0.15 -0.55 1.24 0.20 0.00 0.00 0.00 175.76 176.80 1ddg s GLY 419 N -2.03 2.83 0.03 0.00 0.00 0.95 -4.93 107.32 104.16 1ddg s GLY 419 Ca -0.05 1.09 -0.16 0.00 0.00 0.00 0.00 44.72 45.60 1ddg s GLY 419 CO -0.02 1.58 1.24 -1.33 0.00 0.00 0.00 173.10 174.56 1ddg h GLY 420 N 1.92 -0.66 1.21 0.20 0.00 -1.90 -2.33 103.07 101.51 1ddg h GLY 420 Ca -0.50 0.25 -0.21 0.00 0.00 0.00 0.00 47.33 46.88 1ddg h GLY 420 CO 0.59 -0.23 -0.69 0.00 0.00 0.00 0.00 176.54 176.21 1ddg h ALA 421 N -1.68 0.39 -0.06 3.60 0.00 -1.94 -2.16 119.26 117.42 1ddg h ALA 421 Ca -0.05 -0.57 -0.13 0.00 0.00 0.00 0.00 54.91 54.16 1ddg h ALA 421 Cb 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ddg h ALA 421 CO 0.08 0.69 -0.54 0.66 0.00 0.00 0.00 179.25 180.13 1ddg h SER 422 N 0.57 0.19 1.71 0.00 4.64 -1.91 -2.32 113.55 116.43 1ddg h SER 422 Ca -0.03 -0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.14 1ddg h SER 422 Cb 1.30 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1ddg h SER 422 CO 0.14 0.69 -0.29 0.77 -0.87 0.00 0.00 176.83 177.28 1ddg h SER 423 N 0.13 0.00 -0.17 4.97 4.64 -1.48 -2.46 113.55 119.18 1ddg h SER 423 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1ddg h SER 423 Cb 1.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 1ddg h SER 423 CO 0.08 0.27 0.03 0.15 -0.87 0.00 0.00 176.83 176.49 1ddg h PHE 424 N 0.00 0.29 -0.32 4.77 3.57 -0.98 -0.08 116.94 124.19 1ddg h PHE 424 Ca -0.00 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.39 1ddg h PHE 424 Cb 1.21 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.86 1ddg h PHE 424 CO 0.00 0.43 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.38 1ddg h LEU 425 N 0.08 0.61 -0.42 0.59 3.38 -1.51 0.13 115.31 118.17 1ddg h LEU 425 Ca 0.05 -0.35 -0.10 0.00 0.09 0.00 0.00 57.88 57.57 1ddg h LEU 425 Cb 0.29 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1ddg h LEU 425 CO 0.00 0.82 -0.11 0.00 0.09 0.00 0.00 178.44 179.24 1ddg h ALA 426 N 0.81 0.58 0.00 1.53 0.00 -1.47 -3.41 119.26 117.32 1ddg h ALA 426 Ca 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1ddg h ALA 426 Cb 0.54 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ddg h ALA 426 CO 0.03 0.48 -1.08 -0.25 0.00 0.00 0.00 179.25 178.42 1ddg n ASP 427 N -4.29 4.66 -0.37 0.00 8.00 -0.05 -4.85 116.55 119.65 1ddg n ASP 427 Ca -0.01 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.53 1ddg n ASP 427 Cb 0.38 0.80 0.09 0.00 -0.02 0.00 0.00 41.12 42.37 1ddg n ASP 427 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ddg n ARG 428 N -1.80 2.90 -3.74 -1.24 1.74 0.46 -4.83 116.66 110.14 1ddg n ARG 428 Ca -0.01 -1.85 -0.27 0.00 -0.77 0.00 0.00 57.85 54.94 1ddg n ARG 428 Cb 0.29 -1.17 -0.16 0.00 -1.02 0.00 0.00 32.46 30.39 1ddg n ARG 428 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ddg s VAL 429 N -1.07 0.53 0.00 1.55 1.01 -1.20 -5.01 120.40 116.20 1ddg s VAL 429 Ca 0.14 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1ddg s VAL 429 Cb 0.08 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.43 1ddg s VAL 429 CO 0.09 -0.19 0.00 -0.62 0.00 0.00 0.00 175.10 174.38 1ddg n GLU 430 N 5.05 0.00 -3.70 2.72 -0.58 -1.26 -4.90 120.64 117.96 1ddg n GLU 430 Ca -0.09 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.51 1ddg n GLU 430 Cb 0.47 -0.10 -0.14 0.00 -0.57 0.00 0.00 31.44 31.11 1ddg n GLU 430 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1ddg s GLU 431 N 0.00 0.12 0.00 3.49 2.56 -1.26 -4.83 118.70 118.78 1ddg s GLU 431 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 54.97 55.53 1ddg s GLU 431 Cb 0.00 -0.15 0.00 0.00 2.00 0.00 0.00 34.13 35.98 1ddg s GLU 431 CO 0.00 -0.23 0.00 0.39 -0.56 0.00 0.00 175.26 174.86 1ddg n GLU 432 N 4.79 0.00 -0.75 4.30 1.02 0.54 -4.95 120.64 125.59 1ddg n GLU 432 Ca -0.15 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.67 1ddg n GLU 432 Cb 0.51 -2.45 0.16 0.00 -0.02 0.00 0.00 31.44 29.64 1ddg n GLU 432 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ddg n GLY 433 N -2.16 -0.39 3.79 0.62 0.00 -1.26 -4.03 105.19 101.76 1ddg n GLY 433 Ca 0.00 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1ddg n GLY 433 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ddg s GLU 434 N -4.51 4.44 -0.00 1.61 2.02 -1.26 -1.01 118.70 120.00 1ddg s GLU 434 Ca 0.68 1.29 0.01 0.00 0.02 0.00 0.00 54.97 56.97 1ddg s GLU 434 Cb -0.24 -2.59 -0.00 0.00 0.10 0.00 0.00 34.13 31.39 1ddg s GLU 434 CO 0.57 0.14 -0.04 0.14 0.02 0.00 0.00 175.26 176.09 1ddg s VAL 435 N -1.78 0.33 -0.27 2.63 -7.23 0.09 -4.86 120.40 109.30 1ddg s VAL 435 Ca 0.54 -0.23 -0.11 0.00 -1.81 0.00 0.00 61.98 60.38 1ddg s VAL 435 Cb -0.16 -0.29 -0.05 0.00 0.56 0.00 0.00 36.38 36.44 1ddg s VAL 435 CO 0.21 0.06 0.18 -0.13 -0.31 0.00 0.00 175.10 175.12 1ddg s ARG 436 N -0.18 3.96 0.01 4.82 0.52 -1.26 0.15 118.95 126.98 1ddg s ARG 436 Ca 0.01 -0.31 0.01 0.00 -0.52 0.00 0.00 55.73 54.91 1ddg s ARG 436 Cb -0.02 -3.64 -0.01 0.00 0.52 0.00 0.00 34.95 31.80 1ddg s ARG 436 CO -0.00 -0.15 -0.03 0.08 0.02 0.00 0.00 175.30 175.22 1ddg s VAL 437 N 1.66 0.18 0.13 3.52 1.01 -0.14 -1.23 120.40 125.53 1ddg s VAL 437 Ca 0.07 -0.57 -0.17 0.00 0.00 0.00 0.00 61.98 61.31 1ddg s VAL 437 Cb -0.16 -0.25 0.04 0.00 0.00 0.00 0.00 36.38 36.01 1ddg s VAL 437 CO 0.10 -0.25 0.43 0.72 0.00 0.00 0.00 175.10 176.10 1ddg s PHE 438 N -0.84 -0.25 -0.19 5.22 -0.71 -0.59 -0.92 117.98 119.70 1ddg s PHE 438 Ca -0.08 -0.05 -0.13 0.00 -1.04 0.00 0.00 56.93 55.63 1ddg s PHE 438 Cb -0.06 0.30 -0.05 0.00 -1.21 0.00 0.00 43.02 42.01 1ddg s PHE 438 CO -0.00 -0.72 0.25 0.42 -1.34 0.00 0.00 175.22 173.83 1ddg s ILE 439 N -3.79 5.32 -0.44 -4.49 -1.09 -1.26 0.16 121.20 115.61 1ddg s ILE 439 Ca 0.03 0.44 -0.12 0.00 -2.23 0.00 0.00 60.65 58.76 1ddg s ILE 439 Cb 0.01 -3.59 0.08 0.00 -1.58 0.00 0.00 42.46 37.38 1ddg s ILE 439 CO -0.12 0.37 0.32 -0.70 -1.23 0.00 0.00 174.94 173.58 1ddg s GLU 440 N 0.69 2.78 0.37 2.79 2.56 -0.16 -4.88 118.70 122.85 1ddg s GLU 440 Ca 0.14 -1.41 -0.26 0.00 0.00 0.00 0.00 54.97 53.43 1ddg s GLU 440 Cb -0.13 -3.95 -0.09 0.00 2.00 0.00 0.00 34.13 31.96 1ddg s GLU 440 CO 0.03 -0.99 1.16 -1.01 -0.56 0.00 0.00 175.26 173.90 1ddg s HIS 441 N 1.53 3.17 -0.49 5.30 3.76 -1.26 -1.28 115.29 126.01 1ddg s HIS 441 Ca 0.03 1.57 0.03 0.00 -0.15 0.00 0.00 55.06 56.54 1ddg s HIS 441 Cb -0.24 -3.39 0.14 0.00 1.11 0.00 0.00 32.58 30.21 1ddg s HIS 441 CO 0.04 -1.20 0.29 1.21 -0.85 0.00 0.00 174.74 174.24 1ddg s ASN 442 N -1.05 3.65 0.00 1.40 3.84 -1.26 -4.90 114.94 116.62 1ddg s ASN 442 Ca 0.54 -2.91 0.23 0.00 0.21 0.00 0.00 52.86 50.93 1ddg s ASN 442 Cb -0.31 -1.12 1.35 0.00 -0.55 0.00 0.00 41.25 40.62 1ddg s ASN 442 CO 0.40 -0.22 1.76 0.47 -2.79 0.00 0.00 177.10 176.71 1ddg n ASP 443 N 3.17 0.00 -1.68 -4.21 8.00 -1.26 -2.62 116.55 117.95 1ddg n ASP 443 Ca 0.12 -0.62 0.08 0.00 0.71 0.00 0.00 54.79 55.08 1ddg n ASP 443 Cb 0.36 -0.05 0.37 0.00 -0.02 0.00 0.00 41.12 41.79 1ddg n ASP 443 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1ddg n ASN 444 N -1.05 5.22 -3.36 -2.24 5.03 -1.26 -4.69 115.26 112.92 1ddg n ASN 444 Ca 0.16 -2.77 -0.17 0.00 0.87 0.00 0.00 54.58 52.68 1ddg n ASN 444 Cb 0.10 -0.63 -0.08 0.00 -1.02 0.00 0.00 39.78 38.15 1ddg n ASN 444 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1ddg s PHE 445 N -2.45 -0.28 -0.10 3.10 5.36 -1.08 -4.63 117.98 117.90 1ddg s PHE 445 Ca 0.52 -0.85 -0.16 0.00 -0.96 0.00 0.00 56.93 55.48 1ddg s PHE 445 Cb 0.38 -0.41 0.04 0.00 -0.34 0.00 0.00 43.02 42.68 1ddg s PHE 445 CO 0.18 -0.97 0.40 1.03 -1.46 0.00 0.00 175.22 174.40 1ddg s ARG 446 N 1.40 0.59 0.75 10.12 1.81 -1.26 -4.20 118.95 128.16 1ddg s ARG 446 Ca 0.17 0.29 -0.15 0.00 -1.72 0.00 0.00 55.73 54.32 1ddg s ARG 446 Cb -0.15 0.28 0.05 0.00 -0.45 0.00 0.00 34.95 34.67 1ddg s ARG 446 CO -0.03 -0.12 1.23 1.28 -0.68 0.00 0.00 175.30 176.98 1ddg n LEU 447 N 2.16 4.98 -4.77 2.53 4.77 -1.26 -4.93 117.00 120.48 1ddg n LEU 447 Ca -0.16 0.67 -0.40 0.00 -0.03 0.00 0.00 56.01 56.09 1ddg n LEU 447 Cb 0.57 -1.52 0.02 0.00 -2.33 0.00 0.00 43.42 40.15 1ddg n LEU 447 CO 0.17 -1.46 1.08 -2.84 -1.33 0.00 0.00 177.39 173.01 1ddg s PRO 448 N -3.84 3.66 0.76 3.23 0.02 -1.26 -4.99 135.00 132.57 1ddg s PRO 448 Ca 0.77 2.44 -0.13 0.00 0.02 0.00 0.00 61.00 64.10 1ddg s PRO 448 Cb -0.32 -2.65 0.06 0.00 0.02 0.00 0.00 34.50 31.61 1ddg s PRO 448 CO 0.47 -0.85 1.15 0.00 -0.33 0.00 0.00 177.00 177.45 1ddg s ALA 449 N -1.20 2.08 -0.07 -1.55 0.00 -1.26 -4.60 121.76 115.16 1ddg s ALA 449 Ca 0.61 0.64 -0.02 0.00 0.00 0.00 0.00 51.96 53.20 1ddg s ALA 449 Cb -0.44 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.28 1ddg s ALA 449 CO 0.57 -1.92 0.03 -1.71 0.00 0.00 0.00 175.76 172.74 1ddg n ASN 450 N -3.11 -2.68 0.00 0.00 2.85 -1.26 -4.80 115.26 106.26 1ddg n ASN 450 Ca 0.12 0.39 0.06 0.00 -0.11 0.00 0.00 54.58 55.04 1ddg n ASN 450 Cb 0.51 -2.21 0.25 0.00 1.24 0.00 0.00 39.78 39.57 1ddg n ASN 450 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1ddg n PRO 451 N 0.33 0.00 0.08 1.20 -0.04 -1.26 -1.92 135.00 133.39 1ddg n PRO 451 Ca -0.06 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1ddg n PRO 451 Cb 0.09 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.23 1ddg n PRO 451 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1ddg h GLU 452 N 0.00 0.00 -6.61 0.54 3.07 -1.93 0.18 114.58 109.83 1ddg h GLU 452 Ca 0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 1ddg h GLU 452 Cb 0.20 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1ddg h GLU 452 CO 0.00 0.00 0.61 0.99 -1.40 0.00 0.00 179.01 179.21 1ddg s THR 453 N -3.18 3.51 0.49 1.13 2.01 -0.81 -4.38 115.64 114.41 1ddg s THR 453 Ca 0.06 1.19 -0.20 0.00 0.31 0.00 0.00 61.69 63.05 1ddg s THR 453 Cb 0.12 -3.76 -0.08 0.00 0.01 0.00 0.00 72.50 68.80 1ddg s THR 453 CO 0.71 0.15 1.07 -2.16 -0.69 0.00 0.00 174.62 173.70 1ddg s PRO 454 N 0.26 3.70 -0.04 4.92 0.05 -1.26 -4.44 135.00 138.20 1ddg s PRO 454 Ca 0.57 1.47 0.02 0.00 0.05 0.00 0.00 61.00 63.11 1ddg s PRO 454 Cb -0.34 -2.12 0.01 0.00 0.05 0.00 0.00 34.50 32.10 1ddg s PRO 454 CO 0.35 -0.53 -0.09 0.14 0.05 0.00 0.00 177.00 176.92 1ddg s VAL 455 N -1.87 0.81 -0.21 -0.36 -7.23 -0.51 -1.53 120.40 109.50 1ddg s VAL 455 Ca 0.68 -0.34 -0.04 0.00 -1.81 0.00 0.00 61.98 60.47 1ddg s VAL 455 Cb -0.20 -0.74 -0.01 0.00 0.56 0.00 0.00 36.38 36.00 1ddg s VAL 455 CO 0.23 0.26 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.61 1ddg s ILE 456 N 0.38 3.43 -0.19 -0.62 1.01 0.09 -1.28 121.20 124.03 1ddg s ILE 456 Ca -0.06 -0.48 -0.02 0.00 0.00 0.00 0.00 60.65 60.09 1ddg s ILE 456 Cb -0.11 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 1ddg s ILE 456 CO 0.01 0.43 -0.09 -0.04 0.00 0.00 0.00 174.94 175.25 1ddg s MET 457 N 1.32 3.33 -0.35 2.79 -1.94 0.13 -0.50 119.30 124.08 1ddg s MET 457 Ca 0.04 -0.67 0.01 0.00 -1.71 0.00 0.00 55.69 53.36 1ddg s MET 457 Cb -0.14 -2.83 0.09 0.00 2.01 0.00 0.00 34.83 33.96 1ddg s MET 457 CO -0.02 -0.06 0.08 0.42 -0.01 0.00 0.00 175.02 175.42 1ddg s ILE 458 N 1.08 2.66 -0.46 2.53 1.01 0.37 -0.27 121.20 128.12 1ddg s ILE 458 Ca 0.00 -2.08 0.06 0.00 0.00 0.00 0.00 60.65 58.63 1ddg s ILE 458 Cb -0.15 -2.83 0.19 0.00 0.01 0.00 0.00 42.46 39.69 1ddg s ILE 458 CO -0.02 -0.52 0.57 0.61 0.00 0.00 0.00 174.94 175.58 1ddg n GLY 459 N 4.42 0.86 3.78 6.18 0.00 -0.46 -1.25 105.19 118.71 1ddg n GLY 459 Ca -0.02 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 1ddg n GLY 459 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ddg s PRO 460 N 0.35 3.12 5.39 1.61 0.04 -1.26 -2.48 135.00 141.77 1ddg s PRO 460 Ca 0.32 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.83 1ddg s PRO 460 Cb 0.05 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1ddg s PRO 460 CO -0.13 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.31 1ddg n GLY 461 N -0.24 2.85 0.00 0.56 0.00 -0.91 -1.69 105.19 105.75 1ddg n GLY 461 Ca 0.11 -0.34 0.09 0.00 0.00 0.00 0.00 46.02 45.88 1ddg n GLY 461 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ddg n THR 462 N 0.00 0.38 0.16 2.61 -2.24 -1.26 -2.26 114.28 111.66 1ddg n THR 462 Ca 0.00 0.09 0.05 0.00 -2.27 0.00 0.00 64.05 61.93 1ddg n THR 462 Cb 0.00 -0.80 0.26 0.00 -2.10 0.00 0.00 70.33 67.69 1ddg n THR 462 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ddg n GLY 463 N 0.22 -0.75 0.28 3.38 0.00 -0.68 -2.45 105.19 105.18 1ddg n GLY 463 Ca 0.10 0.05 0.18 0.00 0.00 0.00 0.00 46.02 46.35 1ddg n GLY 463 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ddg h ILE 464 N 0.00 0.00 0.13 -0.61 6.09 -1.13 -3.38 117.51 118.60 1ddg h ILE 464 Ca 0.00 -0.35 0.01 0.00 -1.37 0.00 0.00 64.86 63.15 1ddg h ILE 464 Cb 0.07 1.31 -0.02 0.00 0.47 0.00 0.00 36.82 38.66 1ddg h ILE 464 CO 0.00 0.00 -0.18 0.00 -3.07 0.00 0.00 178.15 174.90 1ddg h ALA 465 N 2.02 -0.32 0.00 0.18 0.00 -1.76 -0.84 119.26 118.55 1ddg h ALA 465 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ddg h ALA 465 Cb 0.37 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ddg h ALA 465 CO 0.00 -0.71 0.00 -1.00 0.00 0.00 0.00 179.25 177.54 1ddg h PRO 466 N -0.36 0.00 0.00 0.00 0.13 -1.74 -2.16 132.00 127.87 1ddg h PRO 466 Ca 0.02 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.98 1ddg h PRO 466 Cb 0.36 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.47 1ddg h PRO 466 CO -0.08 0.00 -0.82 0.74 -0.23 0.00 0.00 178.00 177.61 1ddg h PHE 467 N 0.00 0.00 -0.49 1.56 0.04 -1.42 0.42 116.94 117.05 1ddg h PHE 467 Ca 0.00 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1ddg h PHE 467 Cb 0.22 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 1ddg h PHE 467 CO 0.00 0.77 0.12 -0.09 -0.60 0.00 0.00 178.31 178.51 1ddg h ARG 468 N 0.00 0.78 -0.91 1.51 2.43 -0.99 -1.76 114.38 115.45 1ddg h ARG 468 Ca -0.02 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1ddg h ARG 468 Cb 1.60 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 31.01 1ddg h ARG 468 CO 0.10 0.75 0.56 0.00 -1.51 0.00 0.00 179.97 179.88 1ddg h ALA 469 N 0.99 1.16 -0.45 2.80 0.00 -1.14 -1.85 119.26 120.78 1ddg h ALA 469 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ddg h ALA 469 Cb 0.32 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ddg h ALA 469 CO 0.00 0.60 0.18 0.74 0.00 0.00 0.00 179.25 180.77 1ddg h PHE 470 N 1.25 0.69 -0.14 0.00 -1.00 0.02 -2.06 116.94 115.70 1ddg h PHE 470 Ca 0.33 -0.05 -0.18 0.00 2.81 0.00 0.00 57.97 60.87 1ddg h PHE 470 Cb -0.08 -0.21 -0.00 0.00 3.61 0.00 0.00 35.95 39.28 1ddg h PHE 470 CO 0.00 0.60 -0.66 0.52 -1.61 0.00 0.00 178.31 177.16 1ddg h MET 471 N 0.59 0.55 -0.55 1.51 2.86 -1.27 -0.69 114.93 117.92 1ddg h MET 471 Ca 0.15 -0.40 -0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1ddg h MET 471 Cb 0.20 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 1ddg h MET 471 CO -0.01 1.02 0.27 1.96 1.06 0.00 0.00 176.91 181.21 1ddg h GLN 472 N 0.40 0.77 -0.01 1.72 4.20 -1.27 0.28 115.11 121.20 1ddg h GLN 472 Ca -0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1ddg h GLN 472 Cb 1.23 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.86 1ddg h GLN 472 CO 0.12 0.60 -0.01 0.37 -0.67 0.00 0.00 178.83 179.23 1ddg h GLN 473 N 0.78 0.04 -0.12 1.46 5.75 -0.99 -1.56 115.11 120.46 1ddg h GLN 473 Ca 0.19 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.52 1ddg h GLN 473 Cb 0.07 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1ddg h GLN 473 CO -0.03 0.51 -0.60 0.00 -2.65 0.00 0.00 178.83 176.06 1ddg h ARG 474 N -0.43 0.42 -0.41 1.69 3.08 -0.98 -0.41 114.38 117.34 1ddg h ARG 474 Ca 0.00 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.76 1ddg h ARG 474 Cb 0.50 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1ddg h ARG 474 CO 0.00 0.89 0.21 0.00 -1.07 0.00 0.00 179.97 180.01 1ddg h ALA 475 N 1.04 0.53 -0.70 0.04 0.00 -0.48 -0.89 119.26 118.80 1ddg h ALA 475 Ca -0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1ddg h ALA 475 Cb 1.13 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1ddg h ALA 475 CO 0.10 0.07 0.29 0.00 0.00 0.00 0.00 179.25 179.71 1ddg h ALA 476 N 1.06 0.90 -0.00 0.00 0.00 -0.83 -2.53 119.26 117.87 1ddg h ALA 476 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ddg h ALA 476 Cb 0.09 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ddg h ALA 476 CO -0.02 0.51 -0.06 -0.25 0.00 0.00 0.00 179.25 179.43 1ddg n ASP 477 N -4.39 0.10 -3.85 0.00 8.00 -0.20 -4.92 116.55 111.29 1ddg n ASP 477 Ca 0.05 0.15 -0.30 0.00 0.71 0.00 0.00 54.79 55.41 1ddg n ASP 477 Cb 0.17 -0.33 0.01 0.00 -0.02 0.00 0.00 41.12 40.95 1ddg n ASP 477 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ddg n GLU 478 N -1.39 -2.17 -2.05 -1.24 -0.58 -0.75 -4.94 120.64 107.52 1ddg n GLU 478 Ca 0.09 0.40 -0.42 0.00 -0.42 0.00 0.00 57.16 56.81 1ddg n GLU 478 Cb 0.31 -4.18 -0.03 0.00 -0.57 0.00 0.00 31.44 26.97 1ddg n GLU 478 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ddg s ALA 479 N -3.72 3.69 -0.86 0.62 0.00 -0.41 -4.92 121.76 116.16 1ddg s ALA 479 Ca 0.24 1.24 0.27 0.00 0.00 0.00 0.00 51.96 53.71 1ddg s ALA 479 Cb -0.09 -3.58 0.84 0.00 0.00 0.00 0.00 23.12 20.28 1ddg s ALA 479 CO 0.88 -0.71 1.70 -2.30 0.00 0.00 0.00 175.76 175.33 1ddg n PRO 480 N 4.03 0.13 -1.65 0.00 -0.02 -1.21 -4.89 135.00 131.39 1ddg n PRO 480 Ca 0.13 0.08 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 1ddg n PRO 480 Cb 0.40 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1ddg n PRO 480 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ddg n GLY 481 N 1.41 0.16 3.77 -1.23 0.00 0.64 -4.95 105.19 105.00 1ddg n GLY 481 Ca 0.06 0.22 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 1ddg n GLY 481 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ddg s LYS 482 N -1.97 3.89 -0.04 1.61 1.02 -1.26 -4.92 119.74 118.06 1ddg s LYS 482 Ca 0.60 1.74 0.03 0.00 0.02 0.00 0.00 55.97 58.36 1ddg s LYS 482 Cb -0.57 -2.48 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1ddg s LYS 482 CO 0.59 -0.43 -0.13 -0.80 -0.92 0.00 0.00 175.35 173.66 1ddg s ASN 483 N -1.35 1.71 -0.11 2.83 0.01 -1.25 -1.42 114.94 115.35 1ddg s ASN 483 Ca 0.61 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 52.49 1ddg s ASN 483 Cb -0.28 -0.57 0.02 0.00 0.41 0.00 0.00 41.25 40.84 1ddg s ASN 483 CO 0.34 0.09 -0.09 0.86 -1.51 0.00 0.00 177.10 176.78 1ddg s TRP 484 N 0.28 1.55 -0.08 2.20 -0.11 -0.40 -0.09 118.94 122.29 1ddg s TRP 484 Ca -0.07 -0.74 0.04 0.00 1.22 0.00 0.00 56.10 56.55 1ddg s TRP 484 Cb -0.12 -1.23 -0.01 0.00 -1.50 0.00 0.00 33.47 30.61 1ddg s TRP 484 CO 0.02 -0.47 -0.19 -1.17 -4.62 0.00 0.00 176.95 170.52 1ddg s LEU 485 N 1.43 2.42 -0.26 5.86 2.96 -0.58 0.18 118.68 130.69 1ddg s LEU 485 Ca 0.00 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.51 1ddg s LEU 485 Cb -0.13 -1.49 0.03 0.00 0.50 0.00 0.00 46.19 45.10 1ddg s LEU 485 CO -0.06 0.24 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.81 1ddg s PHE 486 N -0.11 3.11 0.04 5.38 0.40 0.63 -0.77 117.98 126.65 1ddg s PHE 486 Ca -0.03 -1.59 0.04 0.00 -0.60 0.00 0.00 56.93 54.75 1ddg s PHE 486 Cb -0.14 -2.08 -0.02 0.00 0.51 0.00 0.00 43.02 41.29 1ddg s PHE 486 CO 0.04 -0.74 -0.12 0.12 0.70 0.00 0.00 175.22 175.22 1ddg s PHE 487 N 1.32 1.07 0.06 0.36 5.36 -0.34 -1.36 117.98 124.45 1ddg s PHE 487 Ca -0.01 -0.35 -0.07 0.00 -0.96 0.00 0.00 56.93 55.54 1ddg s PHE 487 Cb -0.17 -0.63 -0.01 0.00 -0.34 0.00 0.00 43.02 41.86 1ddg s PHE 487 CO -0.03 0.01 0.12 0.20 -1.46 0.00 0.00 175.22 174.06 1ddg s GLY 488 N -1.13 0.17 0.00 13.12 0.00 -1.26 0.54 107.32 118.77 1ddg s GLY 488 Ca -0.00 -0.66 0.00 0.00 0.00 0.00 0.00 44.72 44.06 1ddg s GLY 488 CO 0.01 -0.81 0.00 0.70 0.00 0.00 0.00 173.10 173.00 1ddg n ASN 489 N 0.31 0.00 0.13 1.64 3.02 -0.31 -2.14 115.26 117.91 1ddg n ASN 489 Ca -0.16 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.25 1ddg n ASN 489 Cb 0.61 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.70 1ddg n ASN 489 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1ddg h PRO 490 N 0.00 -0.26 -4.42 3.52 0.11 -1.90 -1.43 132.00 127.62 1ddg h PRO 490 Ca 0.00 0.02 -0.54 0.00 0.11 0.00 0.00 66.00 65.59 1ddg h PRO 490 Cb 0.00 0.06 -0.36 0.00 0.11 0.00 0.00 31.00 30.81 1ddg h PRO 490 CO 0.00 -0.14 -0.81 -1.01 -0.21 0.00 0.00 178.00 175.83 1ddg s HIS 491 N -6.00 1.60 0.20 0.65 3.76 -1.26 0.16 115.29 114.40 1ddg s HIS 491 Ca -0.14 -0.75 -0.12 0.00 -0.15 0.00 0.00 55.06 53.90 1ddg s HIS 491 Cb 0.05 -1.24 0.24 0.00 1.11 0.00 0.00 32.58 32.74 1ddg s HIS 491 CO 0.64 -0.46 1.69 0.35 -0.85 0.00 0.00 174.74 176.12 1ddg h PHE 492 N 7.72 0.05 -0.16 1.40 3.57 -1.92 0.21 116.94 127.82 1ddg h PHE 492 Ca -0.31 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.10 1ddg h PHE 492 Cb 1.15 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 1ddg h PHE 492 CO 0.48 -0.09 -0.43 1.15 -2.23 0.00 0.00 178.31 177.19 1ddg h THR 493 N 0.17 1.31 0.00 4.41 2.02 -1.99 -3.26 112.91 115.57 1ddg h THR 493 Ca 0.28 -1.60 -0.08 0.00 0.77 0.00 0.00 66.41 65.79 1ddg h THR 493 Cb 0.43 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.50 1ddg h THR 493 CO -0.43 0.49 -1.65 -0.62 0.37 0.00 0.00 175.52 173.68 1ddg n GLU 494 N -4.01 0.99 -0.99 6.66 -0.58 -1.09 -4.71 120.64 116.92 1ddg n GLU 494 Ca -0.02 -0.08 0.05 0.00 -0.42 0.00 0.00 57.16 56.70 1ddg n GLU 494 Cb 0.51 -1.30 0.12 0.00 -0.57 0.00 0.00 31.44 30.20 1ddg n GLU 494 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1ddg n ASP 495 N -2.11 1.38 -4.44 1.62 8.00 0.70 -0.15 116.55 121.56 1ddg n ASP 495 Ca -0.08 -3.03 -0.44 0.00 0.71 0.00 0.00 54.79 51.95 1ddg n ASP 495 Cb 0.52 -0.42 -0.00 0.00 -0.02 0.00 0.00 41.12 41.20 1ddg n ASP 495 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1ddg s PHE 496 N -1.76 3.58 0.12 1.24 2.19 -1.23 -4.84 117.98 117.28 1ddg s PHE 496 Ca 0.36 -2.14 -0.32 0.00 0.33 0.00 0.00 56.93 55.16 1ddg s PHE 496 Cb 0.37 -4.23 -0.12 0.00 -1.31 0.00 0.00 43.02 37.73 1ddg s PHE 496 CO -0.11 -1.33 1.75 1.28 1.83 0.00 0.00 175.22 178.64 1ddg n LEU 497 N 5.28 3.69 -1.92 6.12 4.77 -1.26 -2.20 117.00 131.49 1ddg n LEU 497 Ca 0.33 1.03 -0.18 0.00 -0.03 0.00 0.00 56.01 57.15 1ddg n LEU 497 Cb 0.43 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.00 1ddg n LEU 497 CO 0.58 0.02 -0.22 -1.22 -1.33 0.00 0.00 177.39 175.22 1ddg n TYR 498 N 4.84 -0.67 -0.28 -1.77 4.01 -1.26 -4.93 117.16 117.11 1ddg n TYR 498 Ca 0.18 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.94 1ddg n TYR 498 Cb 0.33 -3.49 0.23 0.00 -0.31 0.00 0.00 39.34 36.11 1ddg n TYR 498 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 1ddg h GLN 499 N 0.00 1.03 -0.21 -0.72 3.07 -1.83 0.19 115.11 116.64 1ddg h GLN 499 Ca -0.42 -0.06 -0.02 0.00 0.09 0.00 0.00 58.65 58.24 1ddg h GLN 499 Cb 1.29 -0.23 -0.01 0.00 0.08 0.00 0.00 27.48 28.61 1ddg h GLN 499 CO 0.52 0.68 0.06 0.28 0.09 0.00 0.00 178.83 180.46 1ddg h VAL 500 N 1.06 1.10 -0.35 1.86 2.07 -1.91 -1.46 116.25 118.62 1ddg h VAL 500 Ca 0.34 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 1ddg h VAL 500 Cb 0.04 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1ddg h VAL 500 CO -0.10 0.13 0.02 -0.33 0.02 0.00 0.00 177.57 177.31 1ddg h GLU 501 N 0.30 0.60 -0.23 1.57 5.08 -1.02 -1.81 114.58 119.06 1ddg h GLU 501 Ca 0.07 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 1ddg h GLU 501 Cb 0.11 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1ddg h GLU 501 CO -0.00 0.70 0.07 -1.49 -1.00 0.00 0.00 179.01 177.29 1ddg h TRP 502 N 0.42 0.38 -0.83 4.33 -0.00 -1.22 -0.42 115.95 118.61 1ddg h TRP 502 Ca 0.10 -0.04 0.02 0.00 -0.00 0.00 0.00 58.89 58.97 1ddg h TRP 502 Cb 0.42 -0.11 -0.04 0.00 -0.00 0.00 0.00 29.16 29.42 1ddg h TRP 502 CO 0.03 0.44 0.55 1.96 -0.00 0.00 0.00 178.44 181.42 1ddg h GLN 503 N 0.21 1.04 -0.49 0.49 4.20 -1.25 0.19 115.11 119.50 1ddg h GLN 503 Ca 0.07 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.64 1ddg h GLN 503 Cb 0.24 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1ddg h GLN 503 CO -0.00 0.69 -0.01 0.00 -0.67 0.00 0.00 178.83 178.84 1ddg h ARG 504 N 1.07 0.87 -0.73 1.46 3.08 -1.07 -0.50 114.38 118.57 1ddg h ARG 504 Ca 0.32 -0.28 0.01 0.00 0.07 0.00 0.00 59.98 60.09 1ddg h ARG 504 Cb -0.05 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.89 1ddg h ARG 504 CO -0.08 0.92 0.48 1.88 -1.07 0.00 0.00 179.97 182.09 1ddg h TYR 505 N 0.73 0.92 -0.46 3.04 0.05 0.22 0.25 116.97 121.73 1ddg h TYR 505 Ca 0.14 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.92 1ddg h TYR 505 Cb 0.53 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 37.94 1ddg h TYR 505 CO 0.04 0.58 0.21 0.28 -1.05 0.00 0.00 178.16 178.22 1ddg h VAL 506 N 0.99 1.19 -0.68 -2.88 2.07 -0.49 -0.52 116.25 115.92 1ddg h VAL 506 Ca 0.27 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 1ddg h VAL 506 Cb -0.11 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1ddg h VAL 506 CO -0.06 0.21 0.17 0.50 0.02 0.00 0.00 177.57 178.42 1ddg h LYS 507 N 0.60 1.09 0.00 1.57 3.64 -0.53 -2.07 116.57 120.86 1ddg h LYS 507 Ca 0.16 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1ddg h LYS 507 Cb 0.14 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1ddg h LYS 507 CO -0.02 0.96 0.00 0.39 -2.27 0.00 0.00 179.45 178.51 1ddg n GLU 508 N -4.28 0.91 -1.20 1.90 1.02 0.84 -4.88 120.64 114.95 1ddg n GLU 508 Ca 0.05 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.12 1ddg n GLU 508 Cb 0.25 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1ddg n GLU 508 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ddg n GLY 509 N 0.78 0.88 0.11 0.62 0.00 -0.65 -4.90 105.19 102.03 1ddg n GLY 509 Ca 0.20 -0.49 -0.16 0.00 0.00 0.00 0.00 46.02 45.58 1ddg n GLY 509 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1ddg h VAL 510 N 0.00 1.08 -3.61 1.61 3.04 -1.37 -3.41 116.25 113.59 1ddg h VAL 510 Ca -0.14 -2.77 -0.64 0.00 -1.01 0.00 0.00 66.70 62.15 1ddg h VAL 510 Cb 0.54 2.69 -0.14 0.00 -2.01 0.00 0.00 31.29 32.37 1ddg h VAL 510 CO 0.20 0.79 0.28 -0.22 -1.01 0.00 0.00 177.57 177.61 1ddg s LEU 511 N -6.84 4.33 -0.03 3.16 2.96 -0.92 -3.96 118.68 117.38 1ddg s LEU 511 Ca -0.09 -0.17 -0.21 0.00 -0.22 0.00 0.00 54.13 53.44 1ddg s LEU 511 Cb 0.07 -2.89 -0.27 0.00 0.50 0.00 0.00 46.19 43.61 1ddg s LEU 511 CO 0.84 -0.86 1.00 0.74 -1.32 0.00 0.00 176.35 176.75 1ddg h THR 512 N 5.93 1.49 -4.04 3.68 2.02 -0.74 -3.37 112.91 117.88 1ddg h THR 512 Ca -0.25 -2.26 -0.15 0.00 0.77 0.00 0.00 66.41 64.52 1ddg h THR 512 Cb 1.09 2.89 -0.19 0.00 -1.74 0.00 0.00 68.15 70.20 1ddg h THR 512 CO 0.93 0.64 -0.67 -0.13 0.37 0.00 0.00 175.52 176.66 1ddg s ARG 513 N -2.85 0.43 -0.08 6.66 0.52 -0.87 -5.03 118.95 117.73 1ddg s ARG 513 Ca -0.14 -0.81 -0.09 0.00 -0.52 0.00 0.00 55.73 54.18 1ddg s ARG 513 Cb 0.02 0.15 0.02 0.00 0.52 0.00 0.00 34.95 35.66 1ddg s ARG 513 CO 0.81 -0.08 0.23 0.96 0.02 0.00 0.00 175.30 177.25 1ddg s ILE 514 N -2.33 0.01 -0.05 1.52 -5.25 -1.25 -1.52 121.20 112.32 1ddg s ILE 514 Ca -0.08 -0.09 0.05 0.00 -0.99 0.00 0.00 60.65 59.54 1ddg s ILE 514 Cb -0.03 -0.36 -0.01 0.00 2.95 0.00 0.00 42.46 45.01 1ddg s ILE 514 CO -0.04 -0.05 -0.20 -1.81 -1.79 0.00 0.00 174.94 171.05 1ddg s ASP 515 N -0.09 2.51 -0.09 4.36 1.11 0.05 -4.98 116.67 119.54 1ddg s ASP 515 Ca -0.02 -0.42 -0.00 0.00 0.18 0.00 0.00 52.55 52.29 1ddg s ASP 515 Cb -0.02 -0.73 -0.03 0.00 1.07 0.00 0.00 42.92 43.21 1ddg s ASP 515 CO 0.01 0.18 -0.07 -0.76 1.18 0.00 0.00 175.17 175.70 1ddg s LEU 516 N 0.00 3.11 -0.27 1.23 1.02 -1.26 -1.20 118.68 121.32 1ddg s LEU 516 Ca -0.05 -0.09 0.02 0.00 0.02 0.00 0.00 54.13 54.03 1ddg s LEU 516 Cb -0.13 -1.69 0.07 0.00 0.02 0.00 0.00 46.19 44.46 1ddg s LEU 516 CO 0.03 0.30 -0.06 0.00 0.02 0.00 0.00 176.35 176.64 1ddg s ALA 517 N -0.43 2.40 -0.66 4.21 0.00 0.19 -4.95 121.76 122.52 1ddg s ALA 517 Ca 0.06 -1.77 -0.10 0.00 0.00 0.00 0.00 51.96 50.15 1ddg s ALA 517 Cb -0.12 -1.61 0.17 0.00 0.00 0.00 0.00 23.12 21.56 1ddg s ALA 517 CO 0.02 -1.30 0.56 -1.58 0.00 0.00 0.00 175.76 173.46 1ddg s TRP 518 N 1.18 3.54 0.11 0.00 0.52 -1.25 -1.16 118.94 121.87 1ddg s TRP 518 Ca -0.04 -2.11 -0.10 0.00 0.02 0.00 0.00 56.10 53.87 1ddg s TRP 518 Cb -0.19 -3.57 0.10 0.00 -1.15 0.00 0.00 33.47 28.66 1ddg s TRP 518 CO -0.07 -0.95 0.81 0.45 0.02 0.00 0.00 176.95 177.21 1ddg n SER 519 N 4.16 -0.37 -0.56 2.95 2.88 -0.54 -1.94 113.62 120.19 1ddg n SER 519 Ca 0.05 0.91 0.09 0.00 -1.33 0.00 0.00 58.87 58.59 1ddg n SER 519 Cb 0.42 -0.19 0.21 0.00 -0.75 0.00 0.00 64.21 63.90 1ddg n SER 519 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ddg n ARG 520 N -4.75 2.29 0.00 -1.46 1.74 0.42 -3.84 116.66 111.07 1ddg n ARG 520 Ca 0.05 -2.72 0.15 0.00 -0.77 0.00 0.00 57.85 54.55 1ddg n ARG 520 Cb 0.20 -1.70 0.71 0.00 -1.02 0.00 0.00 32.46 30.65 1ddg n ARG 520 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1ddg n ASP 521 N -0.85 0.11 -2.63 0.55 9.92 -0.82 -4.89 116.55 117.93 1ddg n ASP 521 Ca 0.19 -0.17 -0.09 0.00 -0.53 0.00 0.00 54.79 54.18 1ddg n ASP 521 Cb 0.78 -0.25 0.01 0.00 -0.64 0.00 0.00 41.12 41.03 1ddg n ASP 521 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ddg n GLN 522 N -1.25 0.89 -0.17 -1.24 0.00 -1.26 -5.06 117.38 109.30 1ddg n GLN 522 Ca 0.13 -2.12 -0.08 0.00 0.00 0.00 0.00 57.00 54.93 1ddg n GLN 522 Cb 0.26 2.44 0.01 0.00 0.00 0.00 0.00 30.24 32.95 1ddg n GLN 522 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1ddg h LYS 523 N 0.00 0.69 -6.21 2.61 6.56 -1.92 -3.42 116.57 114.88 1ddg h LYS 523 Ca -0.28 -0.09 -0.58 0.00 -1.06 0.00 0.00 60.65 58.65 1ddg h LYS 523 Cb 1.08 -0.13 -0.04 0.00 -0.57 0.00 0.00 32.23 32.57 1ddg h LYS 523 CO 0.36 0.55 -0.12 -1.83 -2.06 0.00 0.00 179.45 176.36 1ddg s GLU 524 N -5.81 3.99 -0.08 3.15 -1.05 -1.26 -5.04 118.70 112.60 1ddg s GLU 524 Ca -0.13 0.49 -0.30 0.00 -0.15 0.00 0.00 54.97 54.89 1ddg s GLU 524 Cb 0.11 -3.07 -0.03 0.00 -0.44 0.00 0.00 34.13 30.70 1ddg s GLU 524 CO 0.76 0.57 1.26 0.15 0.95 0.00 0.00 175.26 178.94 1ddg s LYS 525 N -1.56 4.30 -0.03 -4.83 -0.14 -1.26 -4.84 119.74 111.37 1ddg s LYS 525 Ca 0.32 1.72 0.04 0.00 -1.36 0.00 0.00 55.97 56.69 1ddg s LYS 525 Cb -0.16 -3.63 -0.03 0.00 -1.68 0.00 0.00 37.83 32.33 1ddg s LYS 525 CO 0.18 -0.55 -0.13 0.08 -0.76 0.00 0.00 175.35 174.17 1ddg s VAL 526 N 2.67 3.18 0.26 3.17 1.01 -1.25 -4.99 120.40 124.45 1ddg s VAL 526 Ca 0.57 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.82 1ddg s VAL 526 Cb -0.25 -2.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.79 1ddg s VAL 526 CO 0.20 0.53 0.03 -0.31 0.00 0.00 0.00 175.10 175.56 1ddg s TYR 527 N -0.80 1.68 0.28 5.22 2.02 -1.26 -2.91 117.35 121.58 1ddg s TYR 527 Ca 0.13 -0.97 0.01 0.00 -0.37 0.00 0.00 57.07 55.86 1ddg s TYR 527 Cb -0.11 -1.02 0.54 0.00 -0.40 0.00 0.00 41.96 40.97 1ddg s TYR 527 CO 0.02 -0.07 1.85 -0.39 -1.57 0.00 0.00 175.55 175.39 1ddg h VAL 528 N 2.35 0.96 0.00 0.71 -1.51 -1.88 -0.91 116.25 115.97 1ddg h VAL 528 Ca -0.39 -0.35 -0.01 0.00 -1.23 0.00 0.00 66.70 64.71 1ddg h VAL 528 Cb 1.23 -0.15 -0.00 0.00 -2.13 0.00 0.00 31.29 30.24 1ddg h VAL 528 CO 0.65 0.19 -0.07 0.06 -1.23 0.00 0.00 177.57 177.17 1ddg h GLN 529 N 1.02 0.00 -0.12 5.19 -0.00 -1.95 0.52 115.11 119.77 1ddg h GLN 529 Ca 0.47 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.97 1ddg h GLN 529 Cb 0.41 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.89 1ddg h GLN 529 CO -0.23 0.07 -0.60 -0.44 -0.00 0.00 0.00 178.83 177.63 1ddg h ASP 530 N 0.00 0.44 0.48 0.06 3.32 -1.56 -2.59 116.42 116.57 1ddg h ASP 530 Ca -0.00 -0.25 -0.16 0.00 0.02 0.00 0.00 57.03 56.64 1ddg h ASP 530 Cb 0.13 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1ddg h ASP 530 CO 0.01 0.94 -0.71 0.11 -1.72 0.00 0.00 179.24 177.86 1ddg h LYS 531 N 0.29 0.19 -0.54 3.56 1.79 -0.84 -2.16 116.57 118.87 1ddg h LYS 531 Ca -0.00 -0.16 -0.07 0.00 -2.18 0.00 0.00 60.65 58.24 1ddg h LYS 531 Cb 1.13 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.79 1ddg h LYS 531 CO 0.10 0.82 0.08 -0.07 -1.08 0.00 0.00 179.45 179.31 1ddg h LEU 532 N 0.13 0.86 0.21 2.94 3.38 -0.77 0.14 115.31 122.21 1ddg h LEU 532 Ca -0.02 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1ddg h LEU 532 Cb 1.26 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1ddg h LEU 532 CO 0.11 0.91 -0.10 0.03 0.09 0.00 0.00 178.44 179.48 1ddg h ARG 533 N 0.79 -0.27 -0.08 1.13 3.08 -1.50 -1.86 114.38 115.67 1ddg h ARG 533 Ca 0.16 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.25 1ddg h ARG 533 Cb 0.42 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 1ddg h ARG 533 CO 0.01 0.00 0.09 1.49 -1.07 0.00 0.00 179.97 180.49 1ddg h GLU 534 N -0.54 0.00 -0.60 0.04 4.22 -1.24 -1.14 114.58 115.31 1ddg h GLU 534 Ca -0.03 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.41 1ddg h GLU 534 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1ddg h GLU 534 CO 0.05 0.00 0.00 1.04 -2.18 0.00 0.00 179.01 177.92 1ddg n GLN 535 N -3.82 2.53 -0.33 1.92 1.13 0.48 -4.75 117.38 114.54 1ddg n GLN 535 Ca -0.01 -2.36 -0.06 0.00 -1.94 0.00 0.00 57.00 52.63 1ddg n GLN 535 Cb 0.19 -1.52 -0.04 0.00 0.11 0.00 0.00 30.24 28.98 1ddg n GLN 535 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ddg n GLY 536 N 1.55 -1.96 0.22 1.08 0.00 -0.43 -1.85 105.19 103.80 1ddg n GLY 536 Ca 0.22 0.95 -0.03 0.00 0.00 0.00 0.00 46.02 47.15 1ddg n GLY 536 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ddg h ALA 537 N 0.68 1.08 -0.06 4.61 0.00 -1.85 -1.18 119.26 122.54 1ddg h ALA 537 Ca 0.19 -0.38 -0.20 0.00 0.00 0.00 0.00 54.91 54.51 1ddg h ALA 537 Cb 0.39 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ddg h ALA 537 CO -0.78 0.58 -0.81 1.49 0.00 0.00 0.00 179.25 179.72 1ddg h GLU 538 N 0.33 0.47 -0.41 0.00 4.57 -1.81 -2.61 114.58 115.12 1ddg h GLU 538 Ca 0.04 -0.42 0.02 0.00 -1.18 0.00 0.00 59.36 57.82 1ddg h GLU 538 Cb 0.76 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 29.42 1ddg h GLU 538 CO 0.06 1.06 0.23 1.25 -1.18 0.00 0.00 179.01 180.43 1ddg h LEU 539 N 0.30 0.36 -0.81 1.64 5.85 -1.11 -2.03 115.31 119.50 1ddg h LEU 539 Ca -0.05 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 1ddg h LEU 539 Cb 1.42 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 1ddg h LEU 539 CO 0.14 0.26 0.41 -0.25 -0.34 0.00 0.00 178.44 178.66 1ddg h TRP 540 N 0.46 1.15 -0.69 1.25 2.91 -1.21 0.10 115.95 119.92 1ddg h TRP 540 Ca 0.16 -0.05 0.04 0.00 1.13 0.00 0.00 58.89 60.18 1ddg h TRP 540 Cb 0.03 -0.36 -0.05 0.00 -0.51 0.00 0.00 29.16 28.27 1ddg h TRP 540 CO -0.08 0.82 0.42 -0.09 -1.03 0.00 0.00 178.44 178.48 1ddg h ARG 541 N 1.14 0.77 -0.24 2.65 2.43 -1.19 -1.92 114.38 118.02 1ddg h ARG 541 Ca 0.28 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.32 1ddg h ARG 541 Cb 0.08 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1ddg h ARG 541 CO -0.04 0.51 -0.17 -1.49 -1.51 0.00 0.00 179.97 177.27 1ddg h TRP 542 N 0.79 0.63 -0.69 2.20 4.06 -0.83 -2.86 115.95 119.25 1ddg h TRP 542 Ca 0.29 -0.17 0.12 0.00 2.06 0.00 0.00 58.89 61.19 1ddg h TRP 542 Cb 0.10 -0.14 -0.09 0.00 -1.00 0.00 0.00 29.16 28.03 1ddg h TRP 542 CO -0.06 0.84 0.25 0.82 -3.56 0.00 0.00 178.44 176.73 1ddg h ILE 543 N 0.25 0.68 0.00 1.49 1.08 -0.76 -1.26 117.51 118.98 1ddg h ILE 543 Ca 0.05 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.38 1ddg h ILE 543 Cb 0.70 0.24 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 1ddg h ILE 543 CO 0.05 0.07 0.00 -1.13 -0.69 0.00 0.00 178.15 176.45 1ddg h ASN 544 N 0.40 0.00 -0.17 1.72 -0.73 -1.30 -0.12 115.58 115.39 1ddg h ASN 544 Ca 0.37 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.54 1ddg h ASN 544 Cb 0.53 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.12 1ddg h ASN 544 CO -0.38 0.00 0.00 0.47 -0.37 0.00 0.00 177.43 177.15 1ddg n ASP 545 N -2.73 1.01 0.00 1.15 8.00 -0.68 -4.89 116.55 118.40 1ddg n ASP 545 Ca 0.02 -1.89 0.00 0.00 0.71 0.00 0.00 54.79 53.63 1ddg n ASP 545 Cb 0.34 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1ddg n ASP 545 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ddg n GLY 546 N 0.85 0.76 3.75 0.44 0.00 -0.06 -4.72 105.19 106.21 1ddg n GLY 546 Ca 0.09 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 1ddg n GLY 546 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ddg s ALA 547 N -2.00 2.64 -0.06 4.61 0.00 -0.56 -4.62 121.76 121.77 1ddg s ALA 547 Ca 0.00 1.11 -0.16 0.00 0.00 0.00 0.00 51.96 52.91 1ddg s ALA 547 Cb 0.00 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 1ddg s ALA 547 CO 0.00 -1.21 0.43 -1.01 0.00 0.00 0.00 175.76 173.97 1ddg s HIS 548 N -1.48 3.62 -0.11 0.00 3.76 -0.58 -4.80 115.29 115.70 1ddg s HIS 548 Ca 0.75 0.92 0.01 0.00 -0.15 0.00 0.00 55.06 56.60 1ddg s HIS 548 Cb -0.34 -2.40 -0.01 0.00 1.11 0.00 0.00 32.58 30.94 1ddg s HIS 548 CO 0.38 0.42 -0.15 0.42 -0.85 0.00 0.00 174.74 174.96 1ddg s ILE 549 N -0.28 2.90 -0.05 0.60 1.01 0.35 -0.74 121.20 124.99 1ddg s ILE 549 Ca 0.24 -0.73 0.05 0.00 0.00 0.00 0.00 60.65 60.21 1ddg s ILE 549 Cb -0.16 -2.19 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 1ddg s ILE 549 CO 0.11 0.54 -0.22 -0.31 0.00 0.00 0.00 174.94 175.07 1ddg s TYR 550 N 0.15 2.11 -0.12 3.97 1.51 0.35 -0.80 117.35 124.52 1ddg s TYR 550 Ca -0.08 -0.62 0.03 0.00 -1.01 0.00 0.00 57.07 55.39 1ddg s TYR 550 Cb -0.15 -1.40 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 1ddg s TYR 550 CO 0.05 -0.19 -0.20 0.08 -1.11 0.00 0.00 175.55 174.18 1ddg s VAL 551 N -0.08 1.83 0.01 0.71 1.01 0.40 -0.48 120.40 123.80 1ddg s VAL 551 Ca -0.03 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1ddg s VAL 551 Cb -0.13 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1ddg s VAL 551 CO 0.03 0.51 -0.05 0.00 0.00 0.00 0.00 175.10 175.58 1ddg n GLY 553 N 2.51 0.66 3.71 0.00 0.00 -1.00 -4.05 105.19 107.02 1ddg n GLY 553 Ca -0.16 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1ddg n GLY 553 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ddg s ASP 554 N -4.00 6.56 -0.03 1.61 2.15 -1.26 -1.61 116.67 120.09 1ddg s ASP 554 Ca 0.00 2.62 0.03 0.00 0.43 0.00 0.00 52.55 55.63 1ddg s ASP 554 Cb 0.00 -2.59 -0.25 0.00 -0.30 0.00 0.00 42.92 39.78 1ddg s ASP 554 CO 0.00 -0.87 0.72 0.00 -0.17 0.00 0.00 175.17 174.85 1ddg h ALA 555 N 7.28 0.51 -0.91 3.66 0.00 -0.94 -2.38 119.26 126.47 1ddg h ALA 555 Ca -0.43 -1.29 0.14 0.00 0.00 0.00 0.00 54.91 53.33 1ddg h ALA 555 Cb 1.20 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 1ddg h ALA 555 CO 0.92 1.36 0.58 -2.95 0.00 0.00 0.00 179.25 179.17 1ddg h ASN 556 N 0.04 0.69 0.00 0.00 -1.07 -1.91 -3.32 115.58 110.01 1ddg h ASN 556 Ca -0.28 0.04 0.00 0.00 0.07 0.00 0.00 56.30 56.14 1ddg h ASN 556 Cb 2.00 -0.09 0.00 0.00 -2.07 0.00 0.00 38.32 38.16 1ddg h ASN 556 CO 0.11 0.34 -0.08 0.54 0.07 0.00 0.00 177.43 178.42 1ddg n ARG 557 N -4.58 0.09 0.06 4.14 5.12 -1.26 -4.85 116.66 115.38 1ddg n ARG 557 Ca 0.18 0.00 -0.11 0.00 -1.93 0.00 0.00 57.85 55.99 1ddg n ARG 557 Cb 0.47 -0.54 -0.05 0.00 -1.16 0.00 0.00 32.46 31.18 1ddg n ARG 557 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 1ddg h MET 558 N 0.00 -0.28 -0.79 5.56 4.05 -1.72 -2.12 114.93 119.64 1ddg h MET 558 Ca 0.00 0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.48 1ddg h MET 558 Cb 0.08 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 30.89 1ddg h MET 558 CO 0.00 -0.18 0.52 0.00 0.23 0.00 0.00 176.91 177.47 1ddg h ALA 559 N 0.63 1.57 -0.22 0.39 0.00 -1.52 -0.09 119.26 120.01 1ddg h ALA 559 Ca 0.05 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 1ddg h ALA 559 Cb 0.35 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ddg h ALA 559 CO -0.16 0.34 -0.54 0.87 0.00 0.00 0.00 179.25 179.76 1ddg h LYS 560 N 0.92 0.76 0.00 0.00 1.57 -1.66 -0.83 116.57 117.33 1ddg h LYS 560 Ca 0.32 -0.52 -0.14 0.00 -1.87 0.00 0.00 60.65 58.44 1ddg h LYS 560 Cb 0.11 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1ddg h LYS 560 CO -0.10 1.14 -0.68 -0.44 -0.57 0.00 0.00 179.45 178.81 1ddg h ASP 561 N 0.50 0.00 0.38 0.86 3.32 -0.90 -2.08 116.42 118.50 1ddg h ASP 561 Ca -0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 1ddg h ASP 561 Cb 1.16 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1ddg h ASP 561 CO 0.12 0.68 -0.66 0.58 -1.72 0.00 0.00 179.24 178.24 1ddg h VAL 562 N 0.00 1.40 -0.37 -1.35 2.07 -0.99 -1.90 116.25 115.11 1ddg h VAL 562 Ca -0.01 -2.10 -0.05 0.00 0.82 0.00 0.00 66.70 65.37 1ddg h VAL 562 Cb 1.21 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 33.05 1ddg h VAL 562 CO 0.09 0.62 0.05 -0.08 0.02 0.00 0.00 177.57 178.27 1ddg h GLU 563 N 0.18 0.61 -0.31 1.57 4.81 -0.79 -1.66 114.58 119.00 1ddg h GLU 563 Ca -0.01 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 58.97 1ddg h GLU 563 Cb 1.19 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 1ddg h GLU 563 CO 0.10 0.68 -0.13 -0.56 -0.73 0.00 0.00 179.01 178.38 1ddg h GLN 564 N 0.45 0.54 -0.77 1.92 3.07 -1.31 -0.25 115.11 118.76 1ddg h GLN 564 Ca 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 58.65 58.66 1ddg h GLN 564 Cb 0.37 -0.05 -0.04 0.00 0.08 0.00 0.00 27.48 27.84 1ddg h GLN 564 CO 0.01 0.66 0.36 0.00 0.09 0.00 0.00 178.83 179.94 1ddg h ALA 565 N 1.37 1.19 -0.13 0.06 0.00 -1.22 -0.44 119.26 120.09 1ddg h ALA 565 Ca 0.09 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1ddg h ALA 565 Cb 0.52 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1ddg h ALA 565 CO 0.03 0.61 -0.34 -0.07 0.00 0.00 0.00 179.25 179.48 1ddg h LEU 566 N 1.09 0.26 -0.21 0.00 3.38 -0.41 -1.96 115.31 117.45 1ddg h LEU 566 Ca 0.26 -0.09 -0.22 0.00 0.09 0.00 0.00 57.88 57.92 1ddg h LEU 566 Cb 0.13 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1ddg h LEU 566 CO -0.03 0.59 -0.92 -0.07 0.09 0.00 0.00 178.44 178.10 1ddg h LEU 567 N 0.22 0.43 -0.63 1.67 -0.00 -0.64 -2.61 115.31 113.75 1ddg h LEU 567 Ca 0.03 -0.34 -0.04 0.00 -0.00 0.00 0.00 57.88 57.53 1ddg h LEU 567 Cb 0.72 -0.13 -0.03 0.00 -0.00 0.00 0.00 40.66 41.22 1ddg h LEU 567 CO 0.05 1.14 0.25 -0.33 -0.00 0.00 0.00 178.44 179.56 1ddg h GLU 568 N 0.18 0.94 -0.25 1.13 5.08 -0.92 -1.90 114.58 118.84 1ddg h GLU 568 Ca -0.07 -0.17 -0.15 0.00 -1.00 0.00 0.00 59.36 57.97 1ddg h GLU 568 Cb 1.55 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 1ddg h GLU 568 CO 0.15 0.80 -0.46 0.28 -1.00 0.00 0.00 179.01 178.78 1ddg h VAL 569 N 0.88 1.30 -0.08 3.13 2.07 -1.41 0.30 116.25 122.44 1ddg h VAL 569 Ca 0.21 -1.66 -0.15 0.00 0.82 0.00 0.00 66.70 65.92 1ddg h VAL 569 Cb 0.21 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1ddg h VAL 569 CO -0.02 0.53 -0.61 0.40 0.02 0.00 0.00 177.57 177.89 1ddg h ILE 570 N 0.53 1.38 0.22 4.57 2.04 -1.35 -1.85 117.51 123.05 1ddg h ILE 570 Ca 0.03 -1.98 -0.01 0.00 1.00 0.00 0.00 64.86 63.90 1ddg h ILE 570 Cb 1.00 1.99 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1ddg h ILE 570 CO 0.09 0.59 -0.11 0.00 0.00 0.00 0.00 178.15 178.73 1ddg h ALA 571 N 1.13 -0.29 -0.80 1.87 0.00 -1.25 -3.37 119.26 116.55 1ddg h ALA 571 Ca -0.01 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1ddg h ALA 571 Cb 1.13 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1ddg h ALA 571 CO 0.10 -0.30 -0.47 0.39 0.00 0.00 0.00 179.25 178.97 1ddg n GLU 572 N -4.97 -0.35 -4.13 0.00 -0.58 0.08 -1.22 120.64 109.48 1ddg n GLU 572 Ca -0.05 1.34 -0.35 0.00 -0.42 0.00 0.00 57.16 57.69 1ddg n GLU 572 Cb 0.18 -1.98 -0.12 0.00 -0.57 0.00 0.00 31.44 28.95 1ddg n GLU 572 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1ddg s PHE 573 N -5.09 3.08 0.00 -0.32 0.40 -0.70 -4.69 117.98 110.66 1ddg s PHE 573 Ca -0.10 -0.29 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 1ddg s PHE 573 Cb 0.09 -2.06 0.00 0.00 0.51 0.00 0.00 43.02 41.56 1ddg s PHE 573 CO 0.49 -0.10 0.00 0.41 0.70 0.00 0.00 175.22 176.72 1ddg n GLY 574 N 3.94 0.92 0.42 4.36 0.00 -1.26 -4.34 105.19 109.24 1ddg n GLY 574 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1ddg n GLY 574 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ddg n GLY 575 N -0.40 0.62 0.00 -0.02 0.00 -1.25 -5.01 105.19 99.12 1ddg n GLY 575 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 1ddg n GLY 575 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ddg n MET 576 N -0.32 1.15 -1.19 1.61 1.56 -0.36 -4.90 117.12 114.68 1ddg n MET 576 Ca 0.00 0.00 -0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1ddg n MET 576 Cb 0.14 0.00 -0.00 0.00 2.15 0.00 0.00 33.22 35.51 1ddg n MET 576 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1ddg n ASP 577 N 0.00 -3.00 -0.13 6.12 2.03 -1.26 -4.52 116.55 115.79 1ddg n ASP 577 Ca 0.00 0.25 -0.07 0.00 0.52 0.00 0.00 54.79 55.49 1ddg n ASP 577 Cb 0.00 -1.56 -0.00 0.00 -0.72 0.00 0.00 41.12 38.83 1ddg n ASP 577 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1ddg h THR 578 N 0.57 0.25 -0.52 5.18 2.02 -1.97 -0.93 112.91 117.51 1ddg h THR 578 Ca -0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1ddg h THR 578 Cb 0.00 0.25 -0.05 0.00 -1.74 0.00 0.00 68.15 66.62 1ddg h THR 578 CO 0.00 0.00 0.26 -0.08 0.37 0.00 0.00 175.52 176.07 1ddg h GLU 579 N -0.21 0.48 0.00 6.66 4.22 -2.00 -1.64 114.58 122.09 1ddg h GLU 579 Ca 0.19 -0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.55 1ddg h GLU 579 Cb 0.52 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1ddg h GLU 579 CO -0.55 0.32 -0.25 0.00 -2.18 0.00 0.00 179.01 176.34 1ddg h ALA 580 N 1.29 1.18 -0.09 2.92 0.00 -1.69 -1.96 119.26 120.90 1ddg h ALA 580 Ca 0.23 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.72 1ddg h ALA 580 Cb 0.16 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1ddg h ALA 580 CO -0.17 0.31 -0.74 0.00 0.00 0.00 0.00 179.25 178.65 1ddg h ALA 581 N 1.75 0.53 0.04 0.00 0.00 -0.30 -1.38 119.26 119.90 1ddg h ALA 581 Ca -0.00 -0.61 0.03 0.00 0.00 0.00 0.00 54.91 54.33 1ddg h ALA 581 Cb 0.62 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1ddg h ALA 581 CO 0.03 0.75 -0.26 -0.44 0.00 0.00 0.00 179.25 179.33 1ddg h ASP 582 N 0.33 -0.77 -0.89 0.00 3.32 -0.90 -0.64 116.42 116.87 1ddg h ASP 582 Ca -0.04 0.10 0.08 0.00 0.02 0.00 0.00 57.03 57.19 1ddg h ASP 582 Cb 1.33 0.31 -0.07 0.00 0.22 0.00 0.00 39.33 41.12 1ddg h ASP 582 CO 0.13 -0.34 0.54 -0.33 -1.72 0.00 0.00 179.24 177.53 1ddg h GLU 583 N -0.42 0.91 -0.11 3.56 5.08 -1.28 -2.41 114.58 119.91 1ddg h GLU 583 Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1ddg h GLU 583 Cb 0.49 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1ddg h GLU 583 CO -0.21 0.61 0.02 0.35 -1.00 0.00 0.00 179.01 178.78 1ddg h PHE 584 N 0.94 0.20 -0.37 4.33 3.57 -0.80 -0.90 116.94 123.91 1ddg h PHE 584 Ca 0.41 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.90 1ddg h PHE 584 Cb 0.28 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1ddg h PHE 584 CO -0.03 0.39 0.25 1.25 -2.23 0.00 0.00 178.31 177.93 1ddg h LEU 585 N -0.05 0.38 -0.21 0.59 5.85 -0.89 -2.17 115.31 118.81 1ddg h LEU 585 Ca 0.03 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.57 1ddg h LEU 585 Cb 0.30 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1ddg h LEU 585 CO 0.00 0.27 -0.54 0.28 -0.34 0.00 0.00 178.44 178.11 1ddg h SER 586 N 0.44 0.84 -0.14 1.25 0.02 -1.16 -2.61 113.55 112.19 1ddg h SER 586 Ca 0.15 -0.57 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1ddg h SER 586 Cb 0.05 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1ddg h SER 586 CO -0.03 1.26 0.07 1.05 -1.14 0.00 0.00 176.83 178.04 1ddg h GLU 587 N 0.46 0.25 -0.46 3.45 -0.00 -0.56 -2.69 114.58 115.03 1ddg h GLU 587 Ca -0.01 -0.02 -0.02 0.00 -0.00 0.00 0.00 59.36 59.31 1ddg h GLU 587 Cb 1.16 -0.05 -0.02 0.00 -0.00 0.00 0.00 28.75 29.84 1ddg h GLU 587 CO 0.12 0.21 0.22 -0.07 -0.00 0.00 0.00 179.01 179.49 1ddg h LEU 588 N 0.25 0.60 -0.30 3.06 4.07 -1.31 -0.90 115.31 120.77 1ddg h LEU 588 Ca 0.06 -0.12 -0.02 0.00 0.08 0.00 0.00 57.88 57.88 1ddg h LEU 588 Cb 0.06 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.63 1ddg h LEU 588 CO -0.01 0.55 0.10 0.03 -1.08 0.00 0.00 178.44 178.04 1ddg h ARG 589 N 0.60 0.45 -0.07 1.13 3.08 -1.15 0.84 114.38 119.25 1ddg h ARG 589 Ca 0.16 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1ddg h ARG 589 Cb 0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1ddg h ARG 589 CO -0.02 0.49 -0.19 0.28 -1.07 0.00 0.00 179.97 179.46 1ddg h VAL 590 N 0.32 1.18 0.00 2.04 2.07 -1.38 -1.35 116.25 119.12 1ddg h VAL 590 Ca 0.10 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1ddg h VAL 590 Cb 0.22 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1ddg h VAL 590 CO -0.00 0.25 0.00 -0.62 0.02 0.00 0.00 177.57 177.21 1ddg n GLU 591 N -4.26 0.73 -1.93 1.57 1.02 -0.35 -4.90 120.64 112.52 1ddg n GLU 591 Ca -0.02 0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.05 1ddg n GLU 591 Cb 0.29 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 1ddg n GLU 591 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ddg n ARG 592 N -1.12 -0.62 0.00 3.49 3.00 -0.51 -4.92 116.66 115.98 1ddg n ARG 592 Ca 0.19 0.48 0.06 0.00 -0.00 0.00 0.00 57.85 58.59 1ddg n ARG 592 Cb 0.16 -4.40 0.02 0.00 0.00 0.00 0.00 32.46 28.23 1ddg n ARG 592 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1ddg n ARG 593 N -2.01 1.57 -3.77 -0.14 1.74 0.28 -4.74 116.66 109.60 1ddg n ARG 593 Ca -0.09 -0.88 -0.30 0.00 -0.77 0.00 0.00 57.85 55.81 1ddg n ARG 593 Cb 0.50 -1.19 -0.15 0.00 -1.02 0.00 0.00 32.46 30.59 1ddg n ARG 593 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 1ddg s TYR 594 N -1.44 1.75 0.01 -1.55 5.04 -1.04 0.13 117.35 120.25 1ddg s TYR 594 Ca 0.12 -1.64 0.07 0.00 -2.44 0.00 0.00 57.07 53.18 1ddg s TYR 594 Cb 0.10 -1.63 -0.02 0.00 0.35 0.00 0.00 41.96 40.76 1ddg s TYR 594 CO 0.27 -0.82 -0.21 -0.65 -1.34 0.00 0.00 175.55 172.80 1ddg s GLN 595 N 1.61 1.56 0.03 4.97 -0.21 0.02 -4.43 119.66 123.21 1ddg s GLN 595 Ca 0.06 -0.83 0.03 0.00 0.02 0.00 0.00 55.36 54.64 1ddg s GLN 595 Cb -0.17 -1.59 -0.02 0.00 1.00 0.00 0.00 33.01 32.23 1ddg s GLN 595 CO -0.20 0.42 -0.08 1.03 -2.12 0.00 0.00 175.29 174.34 1ddg s ARG 596 N -0.79 0.57 -0.42 2.91 0.52 -1.26 -0.45 118.95 120.03 1ddg s ARG 596 Ca 0.08 -0.63 0.02 0.00 -0.52 0.00 0.00 55.73 54.68 1ddg s ARG 596 Cb -0.08 -0.43 0.15 0.00 0.52 0.00 0.00 34.95 35.10 1ddg s ARG 596 CO 0.00 0.10 0.27 0.34 0.02 0.00 0.00 175.30 176.03 1ddg s ASP 597 N -1.18 2.98 0.15 0.23 2.15 0.10 -4.94 116.67 116.16 1ddg s ASP 597 Ca -0.05 -2.67 0.11 0.00 0.43 0.00 0.00 52.55 50.37 1ddg s ASP 597 Cb -0.08 -0.72 -0.04 0.00 -0.30 0.00 0.00 42.92 41.78 1ddg s ASP 597 CO 0.00 -0.25 -0.24 0.68 -0.17 0.00 0.00 175.17 175.20 1ddg s VAL 598 N 0.40 2.44 0.00 1.11 -7.23 -1.26 -2.38 120.40 113.48 1ddg s VAL 598 Ca 0.22 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 1ddg s VAL 598 Cb -0.16 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.66 1ddg s VAL 598 CO -0.05 0.02 0.00 0.00 -0.31 0.00 0.00 175.10 174.75