#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rj8 s ALA 249 N 0.00 3.55 0.07 3.55 0.00 -1.20 -4.94 121.76 122.78 1rj8 s ALA 249 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.92 1rj8 s ALA 249 Cb 0.00 -2.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 1rj8 s ALA 249 CO 0.00 0.42 -0.05 0.14 0.00 0.00 0.00 175.76 176.27 1rj8 s VAL 250 N -1.42 0.48 -0.02 0.00 -7.23 -1.26 -1.16 120.40 109.78 1rj8 s VAL 250 Ca 0.38 -1.76 -0.00 0.00 -1.81 0.00 0.00 61.98 58.78 1rj8 s VAL 250 Cb -0.16 -1.46 0.03 0.00 0.56 0.00 0.00 36.38 35.35 1rj8 s VAL 250 CO 0.19 -0.85 0.03 0.54 -0.31 0.00 0.00 175.10 174.70 1rj8 s VAL 251 N -3.41 -0.04 -0.19 1.32 0.11 -0.63 -1.97 120.40 115.58 1rj8 s VAL 251 Ca 0.07 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.34 1rj8 s VAL 251 Cb 0.04 -0.10 0.04 0.00 -1.53 0.00 0.00 36.38 34.84 1rj8 s VAL 251 CO -0.06 0.10 -0.09 -2.28 -3.33 0.00 0.00 175.10 169.44 1rj8 s HIS 252 N 1.11 2.22 -0.12 1.54 5.04 -0.33 -1.12 115.29 123.62 1rj8 s HIS 252 Ca -0.09 -1.44 -0.06 0.00 -1.54 0.00 0.00 55.06 51.94 1rj8 s HIS 252 Cb -0.13 -1.55 -0.04 0.00 0.04 0.00 0.00 32.58 30.90 1rj8 s HIS 252 CO -0.03 -0.71 0.09 -0.51 -2.34 0.00 0.00 174.74 171.25 1rj8 s LEU 253 N 1.46 4.09 0.07 8.88 1.43 0.03 -3.42 118.68 131.22 1rj8 s LEU 253 Ca -0.00 0.33 0.08 0.00 -1.03 0.00 0.00 54.13 53.51 1rj8 s LEU 253 Cb -0.16 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 1rj8 s LEU 253 CO -0.08 0.37 -0.23 -1.10 0.23 0.00 0.00 176.35 175.54 1rj8 s GLN 254 N -0.80 1.41 0.70 1.70 -0.21 -0.43 -1.67 119.66 120.36 1rj8 s GLN 254 Ca 0.13 -1.09 -0.16 0.00 0.02 0.00 0.00 55.36 54.27 1rj8 s GLN 254 Cb -0.12 -1.63 0.02 0.00 1.00 0.00 0.00 33.01 32.29 1rj8 s GLN 254 CO 0.03 0.40 1.21 0.20 -2.12 0.00 0.00 175.29 175.01 1rj8 s GLY 255 N -1.49 2.42 0.03 3.09 0.00 -0.60 0.25 107.32 111.01 1rj8 s GLY 255 Ca 0.09 0.89 0.22 0.00 0.00 0.00 0.00 44.72 45.93 1rj8 s GLY 255 CO 0.03 1.30 0.89 -1.06 0.00 0.00 0.00 173.10 174.26 1rj8 n GLN 256 N -2.49 0.30 0.00 2.90 6.02 -0.80 -2.80 117.38 120.51 1rj8 n GLN 256 Ca 0.13 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1rj8 n GLN 256 Cb 0.50 -1.56 0.00 0.00 1.02 0.00 0.00 30.24 30.20 1rj8 n GLN 256 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rj8 n GLY 257 N 1.37 1.83 3.57 1.08 0.00 0.99 -4.86 105.19 109.17 1rj8 n GLY 257 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 1rj8 n GLY 257 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1rj8 s SER 258 N -2.00 4.01 -0.06 1.61 0.01 -1.26 -4.76 113.70 111.24 1rj8 s SER 258 Ca 0.00 -0.95 -0.30 0.00 1.31 0.00 0.00 55.95 56.02 1rj8 s SER 258 Cb 0.00 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.70 1rj8 s SER 258 CO 0.00 -0.08 1.05 0.00 0.41 0.00 0.00 173.24 174.62 1rj8 s ALA 259 N -2.48 3.37 -0.18 1.44 0.00 -1.26 -1.78 121.76 120.86 1rj8 s ALA 259 Ca 0.32 0.48 -0.01 0.00 0.00 0.00 0.00 51.96 52.76 1rj8 s ALA 259 Cb -0.03 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1rj8 s ALA 259 CO 0.18 -0.54 -0.13 0.42 0.00 0.00 0.00 175.76 175.69 1rj8 s ILE 260 N 1.77 2.78 -0.24 0.00 1.01 -0.23 -4.99 121.20 121.30 1rj8 s ILE 260 Ca 0.51 -0.71 -0.18 0.00 0.00 0.00 0.00 60.65 60.27 1rj8 s ILE 260 Cb -0.21 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 1rj8 s ILE 260 CO 0.22 0.49 0.52 -1.10 0.00 0.00 0.00 174.94 175.07 1rj8 s GLN 261 N 1.12 4.10 0.18 2.79 -0.21 -1.26 -0.82 119.66 125.56 1rj8 s GLN 261 Ca 0.01 0.36 -0.15 0.00 0.02 0.00 0.00 55.36 55.59 1rj8 s GLN 261 Cb -0.14 -3.63 0.16 0.00 1.00 0.00 0.00 33.01 30.40 1rj8 s GLN 261 CO -0.04 -0.30 1.66 0.28 -2.12 0.00 0.00 175.29 174.77 1rj8 h VAL 262 N 5.32 0.54 0.00 1.09 2.07 -1.38 -2.16 116.25 121.73 1rj8 h VAL 262 Ca -0.30 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1rj8 h VAL 262 Cb 1.14 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1rj8 h VAL 262 CO 0.72 0.01 -0.01 2.29 0.02 0.00 0.00 177.57 180.60 1rj8 n LYS 263 N -5.32 0.04 -0.00 1.57 2.85 -1.19 -2.21 118.16 113.90 1rj8 n LYS 263 Ca 0.04 0.03 0.06 0.00 -1.05 0.00 0.00 58.31 57.39 1rj8 n LYS 263 Cb 0.26 -1.54 -0.08 0.00 -0.65 0.00 0.00 35.03 33.02 1rj8 n LYS 263 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1rj8 n ASN 264 N -1.61 1.24 0.00 -5.58 3.02 -0.94 -4.74 115.26 106.65 1rj8 n ASN 264 Ca 0.07 -0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 1rj8 n ASN 264 Cb 0.35 1.23 0.00 0.00 -0.61 0.00 0.00 39.78 40.75 1rj8 n ASN 264 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1rj8 n ASP 265 N -1.55 4.95 -4.67 6.41 8.00 -0.86 -5.03 116.55 123.81 1rj8 n ASP 265 Ca 0.00 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.24 1rj8 n ASP 265 Cb 0.24 0.97 -0.07 0.00 -0.02 0.00 0.00 41.12 42.23 1rj8 n ASP 265 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rj8 s LEU 266 N -3.02 3.33 -0.39 0.64 1.43 -0.94 -5.06 118.68 114.67 1rj8 s LEU 266 Ca 0.00 -0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 52.56 1rj8 s LEU 266 Cb 0.00 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.28 1rj8 s LEU 266 CO 0.00 0.07 0.26 -0.44 0.23 0.00 0.00 176.35 176.47 1rj8 s SER 267 N -3.06 5.97 -1.88 2.29 0.01 -1.26 -4.45 113.70 111.31 1rj8 s SER 267 Ca 0.28 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.65 1rj8 s SER 267 Cb -0.09 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.03 1rj8 s SER 267 CO 0.19 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1rj8 n GLY 268 N 5.10 0.22 2.12 3.44 0.00 -1.26 -2.78 105.19 112.04 1rj8 n GLY 268 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1rj8 n GLY 268 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rj8 n GLY 269 N -0.82 0.76 3.66 -0.02 0.00 -1.26 -4.77 105.19 102.73 1rj8 n GLY 269 Ca -0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 1rj8 n GLY 269 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rj8 s VAL 270 N -2.90 4.97 0.13 1.61 1.01 -1.12 -0.05 120.40 124.05 1rj8 s VAL 270 Ca 0.00 1.31 -0.31 0.00 0.00 0.00 0.00 61.98 62.98 1rj8 s VAL 270 Cb 0.00 -4.00 -0.08 0.00 0.00 0.00 0.00 36.38 32.30 1rj8 s VAL 270 CO 0.00 0.07 1.39 -0.76 0.00 0.00 0.00 175.10 175.80 1rj8 s LEU 271 N 2.11 4.37 0.00 3.92 1.43 -0.62 -4.43 118.68 125.46 1rj8 s LEU 271 Ca 0.31 2.35 0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1rj8 s LEU 271 Cb -0.16 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1rj8 s LEU 271 CO 0.10 -0.65 0.02 -0.46 0.23 0.00 0.00 176.35 175.59 1rj8 n ASN 272 N 3.82 0.04 -3.43 2.29 6.94 -1.26 -4.45 115.26 119.21 1rj8 n ASN 272 Ca 0.11 -0.92 -0.39 0.00 -0.02 0.00 0.00 54.58 53.36 1rj8 n ASN 272 Cb 0.42 0.00 0.02 0.00 -2.36 0.00 0.00 39.78 37.86 1rj8 n ASN 272 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1rj8 n ASP 273 N -0.00 7.07 -4.83 0.53 2.03 -1.26 -4.53 116.55 115.55 1rj8 n ASP 273 Ca 0.00 -3.72 -0.37 0.00 0.52 0.00 0.00 54.79 51.22 1rj8 n ASP 273 Cb 0.22 -1.08 -0.06 0.00 -0.72 0.00 0.00 41.12 39.48 1rj8 n ASP 273 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 1rj8 s TRP 274 N -4.20 3.71 -0.28 -0.67 0.52 -1.26 -3.69 118.94 113.07 1rj8 s TRP 274 Ca 0.42 1.09 -0.14 0.00 0.02 0.00 0.00 56.10 57.49 1rj8 s TRP 274 Cb 0.24 -2.37 -0.04 0.00 -1.15 0.00 0.00 33.47 30.16 1rj8 s TRP 274 CO -0.18 0.56 0.33 0.45 0.02 0.00 0.00 176.95 178.14 1rj8 s SER 275 N -1.31 6.20 -1.23 2.95 0.15 0.14 -4.92 113.70 115.67 1rj8 s SER 275 Ca 0.30 0.20 -0.15 0.00 0.70 0.00 0.00 55.95 56.99 1rj8 s SER 275 Cb -0.17 -2.19 0.14 0.00 -1.71 0.00 0.00 66.02 62.09 1rj8 s SER 275 CO 0.17 -0.17 1.52 0.00 1.20 0.00 0.00 173.24 175.97 1rj8 s ARG 276 N 2.00 4.06 0.02 5.44 1.70 -1.26 -1.32 118.95 129.60 1rj8 s ARG 276 Ca 0.13 -2.41 -0.21 0.00 -0.47 0.00 0.00 55.73 52.77 1rj8 s ARG 276 Cb -0.16 -5.20 -0.17 0.00 -0.57 0.00 0.00 34.95 28.85 1rj8 s ARG 276 CO 0.10 -1.91 1.25 -0.84 -1.08 0.00 0.00 175.30 172.82 1rj8 h ILE 277 N 4.93 1.39 -3.44 4.99 3.07 -1.95 -3.43 117.51 123.07 1rj8 h ILE 277 Ca 0.36 -1.55 -0.47 0.00 1.55 0.00 0.00 64.86 64.74 1rj8 h ILE 277 Cb 0.87 2.14 -0.34 0.00 -0.27 0.00 0.00 36.82 39.22 1rj8 h ILE 277 CO 1.31 0.45 -0.80 0.28 -1.05 0.00 0.00 178.15 178.34 1rj8 s THR 278 N -3.92 0.90 -0.30 0.16 -1.32 -1.22 -5.05 115.64 104.90 1rj8 s THR 278 Ca -0.14 -0.34 -0.12 0.00 -1.21 0.00 0.00 61.69 59.88 1rj8 s THR 278 Cb 0.04 -0.85 0.13 0.00 -1.51 0.00 0.00 72.50 70.31 1rj8 s THR 278 CO 0.77 0.30 0.70 -0.32 -2.21 0.00 0.00 174.62 173.86 1rj8 s MET 279 N 0.73 0.56 -0.38 7.08 1.75 -1.26 -1.19 119.30 126.60 1rj8 s MET 279 Ca -0.13 1.31 -0.29 0.00 -1.25 0.00 0.00 55.69 55.33 1rj8 s MET 279 Cb -0.15 0.68 0.02 0.00 2.84 0.00 0.00 34.83 38.21 1rj8 s MET 279 CO 0.02 -0.18 1.22 1.21 -0.65 0.00 0.00 175.02 176.65 1rj8 s ASN 280 N 2.58 6.66 0.46 1.11 2.47 -0.83 -4.90 114.94 122.49 1rj8 s ASN 280 Ca -0.06 0.88 0.30 0.00 0.42 0.00 0.00 52.86 54.40 1rj8 s ASN 280 Cb -0.10 -2.54 1.19 0.00 -1.45 0.00 0.00 41.25 38.35 1rj8 s ASN 280 CO -0.19 -1.15 1.89 -0.65 -3.72 0.00 0.00 177.10 173.28 1rj8 h PRO 281 N 9.25 0.00 0.00 0.43 0.11 -1.93 0.66 132.00 140.52 1rj8 h PRO 281 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1rj8 h PRO 281 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1rj8 h PRO 281 CO 1.07 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.73 1rj8 h LYS 282 N 0.00 0.00 0.00 1.05 1.57 -2.01 -3.36 116.57 113.82 1rj8 h LYS 282 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1rj8 h LYS 282 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1rj8 h LYS 282 CO 0.00 0.00 -0.99 0.28 -0.57 0.00 0.00 179.45 178.17 1rj8 n VAL 283 N -2.79 0.00 -5.11 0.50 0.31 -1.07 -4.74 118.33 105.43 1rj8 n VAL 283 Ca 0.03 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.06 1rj8 n VAL 283 Cb 0.42 -0.72 -0.15 0.00 -0.91 0.00 0.00 33.84 32.47 1rj8 n VAL 283 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1rj8 s PHE 284 N -1.99 2.25 -0.02 3.52 0.08 0.20 -0.88 117.98 121.14 1rj8 s PHE 284 Ca 0.00 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.67 1rj8 s PHE 284 Cb 0.00 -1.41 -0.00 0.00 -0.57 0.00 0.00 43.02 41.04 1rj8 s PHE 284 CO 0.00 0.02 -0.13 0.21 -0.10 0.00 0.00 175.22 175.22 1rj8 s LYS 285 N -0.83 1.23 -0.21 0.44 2.20 -0.58 -4.17 119.74 117.82 1rj8 s LYS 285 Ca 0.10 -0.46 -0.05 0.00 -0.36 0.00 0.00 55.97 55.20 1rj8 s LYS 285 Cb -0.10 -1.14 -0.02 0.00 -1.51 0.00 0.00 37.83 35.06 1rj8 s LYS 285 CO 0.00 0.23 -0.01 -1.17 -0.36 0.00 0.00 175.35 174.04 1rj8 s LEU 286 N -0.08 3.18 -0.42 5.43 2.96 -1.26 -1.05 118.68 127.45 1rj8 s LEU 286 Ca 0.01 -0.25 -0.23 0.00 -0.22 0.00 0.00 54.13 53.44 1rj8 s LEU 286 Cb -0.08 -1.81 0.02 0.00 0.50 0.00 0.00 46.19 44.82 1rj8 s LEU 286 CO 0.00 0.04 0.78 -1.00 -1.32 0.00 0.00 176.35 174.85 1rj8 s HIS 287 N 1.14 3.04 0.18 5.38 3.76 -0.87 -4.97 115.29 122.95 1rj8 s HIS 287 Ca 0.03 0.31 -0.09 0.00 -0.15 0.00 0.00 55.06 55.15 1rj8 s HIS 287 Cb -0.14 -3.55 0.06 0.00 1.11 0.00 0.00 32.58 30.05 1rj8 s HIS 287 CO 0.01 -0.88 1.59 -1.35 -0.85 0.00 0.00 174.74 173.26 1rj8 h PRO 288 N 8.79 0.99 0.63 8.40 0.11 -1.89 -1.48 132.00 147.55 1rj8 h PRO 288 Ca -0.25 -0.39 -0.03 0.00 0.11 0.00 0.00 66.00 65.45 1rj8 h PRO 288 Cb 1.09 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1rj8 h PRO 288 CO 0.94 1.06 -0.33 0.00 -0.21 0.00 0.00 178.00 179.46 1rj8 h ARG 289 N 0.87 -0.85 0.00 1.05 3.08 -1.93 -3.29 114.38 113.31 1rj8 h ARG 289 Ca 0.13 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1rj8 h ARG 289 Cb 0.72 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.96 1rj8 h ARG 289 CO 0.05 -0.56 0.00 0.66 -1.07 0.00 0.00 179.97 179.05 1rj8 h SER 290 N -0.88 0.00 -0.20 7.04 4.64 -1.90 -3.46 113.55 118.79 1rj8 h SER 290 Ca -0.09 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.15 1rj8 h SER 290 Cb 0.68 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 1rj8 h SER 290 CO 0.12 0.00 -0.08 0.61 -0.87 0.00 0.00 176.83 176.61 1rj8 n GLY 291 N 0.62 0.71 3.66 -0.77 0.00 -0.56 -4.76 105.19 104.08 1rj8 n GLY 291 Ca 0.03 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 1rj8 n GLY 291 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rj8 s GLU 292 N -2.20 4.13 -0.65 1.61 2.02 -1.20 -4.67 118.70 117.75 1rj8 s GLU 292 Ca 0.00 0.11 -0.20 0.00 0.02 0.00 0.00 54.97 54.90 1rj8 s GLU 292 Cb 0.00 -3.56 0.10 0.00 0.10 0.00 0.00 34.13 30.77 1rj8 s GLU 292 CO 0.00 -0.07 0.82 -1.17 0.02 0.00 0.00 175.26 174.87 1rj8 s LEU 293 N 1.41 5.09 -0.08 1.80 2.96 0.13 -2.04 118.68 127.93 1rj8 s LEU 293 Ca 0.17 -1.38 -0.22 0.00 -0.22 0.00 0.00 54.13 52.48 1rj8 s LEU 293 Cb -0.15 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 1rj8 s LEU 293 CO 0.08 -1.20 0.64 -0.70 -1.32 0.00 0.00 176.35 173.84 1rj8 s GLU 294 N 3.05 4.40 0.25 1.98 2.12 -0.21 -1.20 118.70 129.10 1rj8 s GLU 294 Ca 0.17 0.75 -0.23 0.00 0.36 0.00 0.00 54.97 56.02 1rj8 s GLU 294 Cb -0.20 -3.45 -0.09 0.00 0.26 0.00 0.00 34.13 30.65 1rj8 s GLU 294 CO 0.06 0.08 0.82 0.14 -0.54 0.00 0.00 175.26 175.81 1rj8 s VAL 295 N 0.79 4.40 -0.08 3.70 -7.23 -0.87 -1.53 120.40 119.58 1rj8 s VAL 295 Ca 0.34 1.55 0.16 0.00 -1.81 0.00 0.00 61.98 62.23 1rj8 s VAL 295 Cb -0.17 -3.96 -0.25 0.00 0.56 0.00 0.00 36.38 32.56 1rj8 s VAL 295 CO 0.16 0.23 0.38 0.18 -0.31 0.00 0.00 175.10 175.74 1rj8 n LEU 296 N 0.80 0.06 -4.23 1.32 4.77 -0.06 -1.06 117.00 118.60 1rj8 n LEU 296 Ca -0.01 -0.04 -0.18 0.00 -0.03 0.00 0.00 56.01 55.75 1rj8 n LEU 296 Cb 0.50 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.48 1rj8 n LEU 296 CO 0.44 0.01 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.37 1rj8 s VAL 297 N -3.09 1.31 1.09 4.08 1.01 -1.26 -4.56 120.40 118.98 1rj8 s VAL 297 Ca -0.05 -1.67 -0.13 0.00 0.00 0.00 0.00 61.98 60.13 1rj8 s VAL 297 Cb 0.11 -1.48 0.21 0.00 0.00 0.00 0.00 36.38 35.22 1rj8 s VAL 297 CO 0.68 -0.39 0.89 0.47 0.00 0.00 0.00 175.10 176.76 1rj8 n ASP 298 N 0.63 -1.27 0.00 3.32 8.00 -1.26 -4.17 116.55 121.79 1rj8 n ASP 298 Ca -0.16 0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.37 1rj8 n ASP 298 Cb 0.57 -1.28 0.00 0.00 -0.02 0.00 0.00 41.12 40.38 1rj8 n ASP 298 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rj8 n GLY 299 N 0.96 0.93 3.64 0.44 0.00 -0.47 -4.76 105.19 105.93 1rj8 n GLY 299 Ca 0.05 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 1rj8 n GLY 299 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rj8 s THR 300 N -1.86 4.99 -0.10 2.61 2.01 -1.03 -1.40 115.64 120.86 1rj8 s THR 300 Ca 0.00 1.17 0.02 0.00 0.31 0.00 0.00 61.69 63.19 1rj8 s THR 300 Cb 0.00 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.58 1rj8 s THR 300 CO 0.00 0.05 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.51 1rj8 s TYR 301 N 2.34 1.93 -0.17 4.92 1.51 -0.66 -1.12 117.35 126.10 1rj8 s TYR 301 Ca 0.27 -0.85 -0.22 0.00 -1.01 0.00 0.00 57.07 55.26 1rj8 s TYR 301 Cb -0.16 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.29 1rj8 s TYR 301 CO 0.09 -0.42 0.68 0.12 -1.11 0.00 0.00 175.55 174.91 1rj8 s PHE 302 N 0.82 3.42 -0.07 2.71 5.36 0.44 -1.67 117.98 128.98 1rj8 s PHE 302 Ca -0.10 1.05 0.04 0.00 -0.96 0.00 0.00 56.93 56.96 1rj8 s PHE 302 Cb -0.16 -2.84 -0.01 0.00 -0.34 0.00 0.00 43.02 39.67 1rj8 s PHE 302 CO 0.01 -0.15 -0.21 0.42 -1.46 0.00 0.00 175.22 173.84 1rj8 s ILE 303 N 1.79 2.45 0.07 3.12 1.01 -0.14 -0.07 121.20 129.43 1rj8 s ILE 303 Ca 0.32 -0.92 -0.00 0.00 0.00 0.00 0.00 60.65 60.05 1rj8 s ILE 303 Cb -0.16 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1rj8 s ILE 303 CO 0.12 0.56 -0.03 -0.72 0.00 0.00 0.00 174.94 174.87 1rj8 s TYR 304 N -0.15 0.68 -0.06 3.97 -0.85 -0.39 -1.49 117.35 119.07 1rj8 s TYR 304 Ca -0.03 -1.03 -0.31 0.00 -0.52 0.00 0.00 57.07 55.18 1rj8 s TYR 304 Cb -0.14 -0.44 0.07 0.00 0.38 0.00 0.00 41.96 41.83 1rj8 s TYR 304 CO 0.04 -0.32 0.68 -1.54 -1.52 0.00 0.00 175.55 172.89 1rj8 s SER 305 N -2.97 -0.66 -0.05 -0.18 1.04 -0.74 -1.25 113.70 108.88 1rj8 s SER 305 Ca 0.10 0.73 -0.02 0.00 0.48 0.00 0.00 55.95 57.24 1rj8 s SER 305 Cb 0.07 0.56 0.04 0.00 0.10 0.00 0.00 66.02 66.79 1rj8 s SER 305 CO -0.07 -0.60 0.11 -1.58 0.98 0.00 0.00 173.24 172.08 1rj8 s GLN 306 N -1.15 0.04 -0.12 4.02 0.74 0.13 -1.83 119.66 121.48 1rj8 s GLN 306 Ca -0.11 0.33 0.02 0.00 0.05 0.00 0.00 55.36 55.66 1rj8 s GLN 306 Cb -0.00 -0.22 -0.00 0.00 1.10 0.00 0.00 33.01 33.88 1rj8 s GLN 306 CO 0.10 -0.19 -0.20 0.08 -0.55 0.00 0.00 175.29 174.53 1rj8 s VAL 307 N 1.28 2.35 -0.71 1.34 1.01 -0.95 -1.36 120.40 123.37 1rj8 s VAL 307 Ca -0.07 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 1rj8 s VAL 307 Cb -0.12 -1.94 0.10 0.00 0.00 0.00 0.00 36.38 34.42 1rj8 s VAL 307 CO -0.05 0.54 0.90 -0.47 0.00 0.00 0.00 175.10 176.03 1rj8 s TYR 310 N 0.51 2.93 0.14 5.22 5.04 -1.25 -0.83 117.35 129.11 1rj8 s TYR 310 Ca -0.13 -0.95 -0.31 0.00 -2.44 0.00 0.00 57.07 53.24 1rj8 s TYR 310 Cb -0.17 -4.18 -0.08 0.00 0.35 0.00 0.00 41.96 37.88 1rj8 s TYR 310 CO 0.05 -1.46 1.41 0.71 -1.34 0.00 0.00 175.55 174.92 1rj8 s TYR 311 N 3.10 3.21 -0.11 4.97 2.02 -0.08 -1.48 117.35 128.99 1rj8 s TYR 311 Ca 0.21 0.92 -0.03 0.00 -0.37 0.00 0.00 57.07 57.80 1rj8 s TYR 311 Cb -0.16 -3.72 -0.06 0.00 -0.40 0.00 0.00 41.96 37.62 1rj8 s TYR 311 CO 0.03 -2.52 -0.12 -0.89 -1.57 0.00 0.00 175.55 170.48 1rj8 n ILE 312 N 3.78 0.61 -3.73 2.71 2.08 -0.87 -1.28 119.36 122.66 1rj8 n ILE 312 Ca 0.11 -0.19 -0.13 0.00 0.56 0.00 0.00 62.75 63.10 1rj8 n ILE 312 Cb 0.42 -1.32 -0.10 0.00 -0.75 0.00 0.00 39.64 37.89 1rj8 n ILE 312 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1rj8 s ASN 313 N -5.58 -0.40 0.33 4.38 3.04 -1.13 -4.43 114.94 111.15 1rj8 s ASN 313 Ca -0.15 0.71 -0.18 0.00 0.04 0.00 0.00 52.86 53.28 1rj8 s ASN 313 Cb 0.05 0.75 0.05 0.00 -1.54 0.00 0.00 41.25 40.56 1rj8 s ASN 313 CO 0.22 -0.20 0.83 0.72 -3.04 0.00 0.00 177.10 175.62 1rj8 s PHE 314 N -0.06 0.05 -0.16 0.43 -0.71 -1.26 -0.49 117.98 115.78 1rj8 s PHE 314 Ca -0.02 -0.64 0.00 0.00 -1.04 0.00 0.00 56.93 55.23 1rj8 s PHE 314 Cb -0.03 0.79 0.02 0.00 -1.21 0.00 0.00 43.02 42.59 1rj8 s PHE 314 CO 0.01 -1.38 -0.15 0.99 -1.34 0.00 0.00 175.22 173.35 1rj8 s THR 315 N -2.57 1.68 0.00 -4.49 2.01 -1.26 -4.93 115.64 106.07 1rj8 s THR 315 Ca 0.16 -0.70 0.00 0.00 0.31 0.00 0.00 61.69 61.46 1rj8 s THR 315 Cb -0.05 -1.56 0.00 0.00 0.01 0.00 0.00 72.50 70.90 1rj8 s THR 315 CO 0.09 0.48 0.00 -0.67 -0.69 0.00 0.00 174.62 173.83 1rj8 n ASP 316 N 4.74 0.00 -3.70 3.53 2.03 -1.26 -4.69 116.55 117.20 1rj8 n ASP 316 Ca -0.18 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.00 1rj8 n ASP 316 Cb 0.50 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.81 1rj8 n ASP 316 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1rj8 s PHE 317 N 0.00 -0.56 0.01 -0.67 -0.12 -1.26 -1.64 117.98 113.74 1rj8 s PHE 317 Ca 0.00 1.35 0.05 0.00 -0.05 0.00 0.00 56.93 58.28 1rj8 s PHE 317 Cb 0.00 0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 1rj8 s PHE 317 CO 0.00 -0.27 -0.12 0.00 -0.05 0.00 0.00 175.22 174.78 1rj8 s ALA 318 N 0.24 2.80 0.00 1.99 0.00 0.08 -4.96 121.76 121.91 1rj8 s ALA 318 Ca -0.00 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.89 1rj8 s ALA 318 Cb -0.04 -0.96 -0.00 0.00 0.00 0.00 0.00 23.12 22.12 1rj8 s ALA 318 CO 0.01 0.59 -0.03 -1.12 0.00 0.00 0.00 175.76 175.21 1rj8 s SER 319 N -1.30 0.29 0.20 0.00 0.01 -1.26 -1.04 113.70 110.59 1rj8 s SER 319 Ca 0.15 -0.11 0.05 0.00 1.31 0.00 0.00 55.95 57.36 1rj8 s SER 319 Cb -0.11 -0.01 -0.05 0.00 0.21 0.00 0.00 66.02 66.06 1rj8 s SER 319 CO 0.05 -0.01 -0.08 -0.72 0.41 0.00 0.00 173.24 172.89 1rj8 s TYR 320 N -0.24 1.51 -0.03 2.43 -0.85 -0.73 -1.27 117.35 118.19 1rj8 s TYR 320 Ca -0.01 -0.75 0.04 0.00 -0.52 0.00 0.00 57.07 55.83 1rj8 s TYR 320 Cb -0.02 -0.79 -0.01 0.00 0.38 0.00 0.00 41.96 41.52 1rj8 s TYR 320 CO -0.00 0.13 -0.15 -1.21 -1.52 0.00 0.00 175.55 172.80 1rj8 s GLU 321 N -3.75 1.40 -0.35 -3.49 2.02 0.20 -1.68 118.70 113.05 1rj8 s GLU 321 Ca 0.22 -0.53 -0.24 0.00 0.02 0.00 0.00 54.97 54.45 1rj8 s GLU 321 Cb 0.03 -1.29 0.01 0.00 0.10 0.00 0.00 34.13 32.98 1rj8 s GLU 321 CO 0.05 0.26 0.80 0.08 0.02 0.00 0.00 175.26 176.48 1rj8 s VAL 322 N -0.11 4.73 0.12 2.63 1.01 -0.36 -0.56 120.40 127.85 1rj8 s VAL 322 Ca 0.01 1.01 0.07 0.00 0.00 0.00 0.00 61.98 63.06 1rj8 s VAL 322 Cb -0.09 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1rj8 s VAL 322 CO 0.01 -0.40 -0.07 0.68 0.00 0.00 0.00 175.10 175.32 1rj8 s VAL 323 N 3.11 3.52 -0.17 2.92 -7.23 0.06 -0.74 120.40 121.88 1rj8 s VAL 323 Ca 0.33 -1.27 -0.01 0.00 -1.81 0.00 0.00 61.98 59.22 1rj8 s VAL 323 Cb -0.13 -2.68 0.04 0.00 0.56 0.00 0.00 36.38 34.17 1rj8 s VAL 323 CO 0.16 0.06 -0.04 -0.69 -0.31 0.00 0.00 175.10 174.28 1rj8 s VAL 324 N -1.35 1.04 -1.51 1.32 1.01 -0.01 -1.58 120.40 119.33 1rj8 s VAL 324 Ca 0.23 -0.61 -0.13 0.00 0.00 0.00 0.00 61.98 61.47 1rj8 s VAL 324 Cb -0.11 -1.25 0.08 0.00 0.00 0.00 0.00 36.38 35.10 1rj8 s VAL 324 CO 0.15 0.09 1.00 0.47 0.00 0.00 0.00 175.10 176.82 1rj8 n ASP 325 N 4.89 -4.86 0.00 3.32 8.00 -0.49 -2.45 116.55 124.97 1rj8 n ASP 325 Ca -0.11 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.63 1rj8 n ASP 325 Cb 0.48 -4.01 0.00 0.00 -0.02 0.00 0.00 41.12 37.56 1rj8 n ASP 325 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rj8 n GLU 326 N -4.71 -0.18 -3.66 -1.24 1.02 -1.26 -5.01 120.64 105.61 1rj8 n GLU 326 Ca 0.03 0.04 -0.36 0.00 -0.02 0.00 0.00 57.16 56.85 1rj8 n GLU 326 Cb 0.53 -3.23 -0.07 0.00 -0.02 0.00 0.00 31.44 28.65 1rj8 n GLU 326 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1rj8 s LYS 327 N -0.38 4.01 0.34 3.49 2.20 -1.02 -5.01 119.74 123.37 1rj8 s LYS 327 Ca 0.00 0.01 -0.29 0.00 -0.36 0.00 0.00 55.97 55.33 1rj8 s LYS 327 Cb 0.00 -3.35 -0.11 0.00 -1.51 0.00 0.00 37.83 32.86 1rj8 s LYS 327 CO 0.00 0.43 1.55 -2.14 -0.36 0.00 0.00 175.35 174.83 1rj8 s PRO 328 N -0.09 4.11 0.02 4.03 0.02 -1.26 -0.83 135.00 140.99 1rj8 s PRO 328 Ca 0.15 2.59 -0.01 0.00 0.02 0.00 0.00 61.00 63.75 1rj8 s PRO 328 Cb -0.13 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.40 1rj8 s PRO 328 CO 0.04 -0.60 -0.03 0.34 -0.33 0.00 0.00 177.00 176.42 1rj8 n PHE 329 N 1.29 0.00 -4.34 6.54 7.35 0.09 -4.86 117.46 123.53 1rj8 n PHE 329 Ca 0.05 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.49 1rj8 n PHE 329 Cb 0.38 -0.06 -0.12 0.00 0.35 0.00 0.00 39.48 40.04 1rj8 n PHE 329 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1rj8 s LEU 330 N -6.48 2.39 -0.01 -2.13 1.43 -1.04 -4.99 118.68 107.85 1rj8 s LEU 330 Ca -0.02 -0.80 0.04 0.00 -1.03 0.00 0.00 54.13 52.31 1rj8 s LEU 330 Cb 0.01 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 45.26 1rj8 s LEU 330 CO 0.03 0.05 -0.12 -1.58 0.23 0.00 0.00 176.35 174.96 1rj8 s GLN 331 N -2.45 0.94 -0.08 1.70 0.74 -1.26 -1.23 119.66 118.02 1rj8 s GLN 331 Ca 0.14 -0.44 0.02 0.00 0.05 0.00 0.00 55.36 55.13 1rj8 s GLN 331 Cb -0.08 -0.91 0.01 0.00 1.10 0.00 0.00 33.01 33.14 1rj8 s GLN 331 CO 0.07 0.25 -0.14 0.00 -0.55 0.00 0.00 175.29 174.91 1rj8 s THR 333 N 0.72 0.54 0.23 0.00 2.01 -1.26 -1.77 115.64 116.11 1rj8 s THR 333 Ca -0.13 -0.28 0.05 0.00 0.31 0.00 0.00 61.69 61.64 1rj8 s THR 333 Cb -0.16 -0.47 -0.05 0.00 0.01 0.00 0.00 72.50 71.83 1rj8 s THR 333 CO 0.03 0.16 -0.05 -0.13 -0.69 0.00 0.00 174.62 173.94 1rj8 s ARG 334 N -0.08 1.34 0.33 4.92 1.81 -0.21 -4.98 118.95 122.08 1rj8 s ARG 334 Ca 0.02 -1.65 0.06 0.00 -1.72 0.00 0.00 55.73 52.43 1rj8 s ARG 334 Cb -0.04 -0.82 -0.07 0.00 -0.45 0.00 0.00 34.95 33.58 1rj8 s ARG 334 CO -0.00 0.00 0.00 -1.12 -0.68 0.00 0.00 175.30 173.50 1rj8 s SER 335 N -3.32 2.92 -0.24 0.23 0.01 -1.26 -0.74 113.70 111.29 1rj8 s SER 335 Ca 0.26 -1.31 -0.21 0.00 1.31 0.00 0.00 55.95 56.00 1rj8 s SER 335 Cb 0.04 -0.20 0.06 0.00 0.21 0.00 0.00 66.02 66.13 1rj8 s SER 335 CO 0.08 -0.47 0.63 -0.51 0.41 0.00 0.00 173.24 173.39 1rj8 s ILE 336 N -3.03 -0.00 0.27 1.44 2.07 -0.65 -4.95 121.20 116.34 1rj8 s ILE 336 Ca 0.34 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 59.33 1rj8 s ILE 336 Cb 0.07 -0.89 -0.09 0.00 0.13 0.00 0.00 42.46 41.68 1rj8 s ILE 336 CO 0.15 0.00 0.88 -1.83 -1.91 0.00 0.00 174.94 172.23 1rj8 s GLU 337 N 0.55 4.55 -0.39 3.50 -1.05 -1.26 -4.17 118.70 120.43 1rj8 s GLU 337 Ca -0.02 1.23 -0.43 0.00 -0.15 0.00 0.00 54.97 55.61 1rj8 s GLU 337 Cb -0.05 -2.95 -0.17 0.00 -0.44 0.00 0.00 34.13 30.52 1rj8 s GLU 337 CO -0.02 0.38 1.80 2.41 0.95 0.00 0.00 175.26 180.77 1rj8 n THR 338 N 0.87 0.15 0.00 1.83 -1.04 -1.26 -1.91 114.28 112.92 1rj8 n THR 338 Ca -0.01 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 1rj8 n THR 338 Cb 0.50 -0.92 0.00 0.00 -1.82 0.00 0.00 70.33 68.09 1rj8 n THR 338 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1rj8 n GLY 339 N 4.85 2.86 3.73 3.41 0.00 -1.26 -5.01 105.19 113.76 1rj8 n GLY 339 Ca 0.34 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1rj8 n GLY 339 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rj8 s LYS 340 N -0.12 1.64 -0.25 1.61 2.20 -0.80 -5.02 119.74 119.00 1rj8 s LYS 340 Ca 0.00 1.09 -0.10 0.00 -0.36 0.00 0.00 55.97 56.60 1rj8 s LYS 340 Cb 0.00 -1.83 -0.05 0.00 -1.51 0.00 0.00 37.83 34.44 1rj8 s LYS 340 CO 0.00 -2.05 0.16 0.95 -0.36 0.00 0.00 175.35 174.05 1rj8 s THR 341 N -2.86 5.33 -0.64 3.43 -4.23 -1.26 -4.82 115.64 110.59 1rj8 s THR 341 Ca 0.63 0.17 0.05 0.00 -1.18 0.00 0.00 61.69 61.36 1rj8 s THR 341 Cb -0.18 -3.49 0.17 0.00 1.34 0.00 0.00 72.50 70.33 1rj8 s THR 341 CO 0.57 0.33 0.45 0.21 -0.54 0.00 0.00 174.62 175.64 1rj8 s ASN 342 N 1.17 4.26 -0.17 3.99 2.47 -1.26 -5.07 114.94 120.33 1rj8 s ASN 342 Ca 0.07 -3.64 -0.29 0.00 0.42 0.00 0.00 52.86 49.42 1rj8 s ASN 342 Cb -0.14 -1.44 -0.01 0.00 -1.45 0.00 0.00 41.25 38.21 1rj8 s ASN 342 CO 0.05 -0.11 1.16 -0.31 -3.72 0.00 0.00 177.10 174.18 1rj8 s TYR 343 N -1.09 3.09 -0.29 0.43 1.51 -1.26 -4.43 117.35 115.31 1rj8 s TYR 343 Ca 0.25 1.22 -0.13 0.00 -1.01 0.00 0.00 57.07 57.40 1rj8 s TYR 343 Cb -0.06 -3.40 0.10 0.00 -0.11 0.00 0.00 41.96 38.50 1rj8 s TYR 343 CO -0.15 -1.15 0.66 1.21 -1.11 0.00 0.00 175.55 175.01 1rj8 s ASN 344 N 1.61 -1.02 -0.19 2.29 3.84 -0.40 -5.01 114.94 116.06 1rj8 s ASN 344 Ca 0.51 1.53 -0.25 0.00 0.21 0.00 0.00 52.86 54.85 1rj8 s ASN 344 Cb -0.19 1.79 -0.01 0.00 -0.55 0.00 0.00 41.25 42.29 1rj8 s ASN 344 CO 0.12 -0.23 0.85 0.42 -2.79 0.00 0.00 177.10 175.47 1rj8 s THR 345 N 2.22 4.86 -0.49 -5.21 -4.23 -1.26 -0.90 115.64 110.62 1rj8 s THR 345 Ca -0.08 1.65 -0.07 0.00 -1.18 0.00 0.00 61.69 62.01 1rj8 s THR 345 Cb -0.08 -4.15 0.13 0.00 1.34 0.00 0.00 72.50 69.74 1rj8 s THR 345 CO -0.19 -0.01 0.34 0.00 -0.54 0.00 0.00 174.62 174.22 1rj8 s TYR 347 N 1.07 3.63 0.07 0.00 6.14 -1.26 -2.24 117.35 124.76 1rj8 s TYR 347 Ca 0.08 0.70 -0.08 0.00 0.64 0.00 0.00 57.07 58.42 1rj8 s TYR 347 Cb -0.24 -2.11 -0.01 0.00 0.42 0.00 0.00 41.96 40.02 1rj8 s TYR 347 CO -0.02 0.64 0.16 -0.08 0.64 0.00 0.00 175.55 176.89 1rj8 s THR 348 N -0.86 0.14 0.05 4.34 -1.32 -0.76 -4.97 115.64 112.26 1rj8 s THR 348 Ca 0.18 -1.19 -0.27 0.00 -1.21 0.00 0.00 61.69 59.20 1rj8 s THR 348 Cb -0.14 -1.24 0.08 0.00 -1.51 0.00 0.00 72.50 69.70 1rj8 s THR 348 CO 0.07 -0.66 0.74 0.00 -2.21 0.00 0.00 174.62 172.56 1rj8 s ALA 349 N -3.50 -1.72 -0.00 11.08 0.00 -1.26 -1.79 121.76 124.56 1rj8 s ALA 349 Ca 0.02 0.87 -0.30 0.00 0.00 0.00 0.00 51.96 52.55 1rj8 s ALA 349 Cb 0.04 0.48 0.11 0.00 0.00 0.00 0.00 23.12 23.75 1rj8 s ALA 349 CO -0.09 -0.65 1.20 0.20 0.00 0.00 0.00 175.76 176.42 1rj8 s GLY 350 N -2.31 -0.37 -0.08 0.00 0.00 -0.55 -5.01 107.32 98.99 1rj8 s GLY 350 Ca 0.00 0.69 0.01 0.00 0.00 0.00 0.00 44.72 45.43 1rj8 s GLY 350 CO -0.07 0.15 -0.10 0.54 0.00 0.00 0.00 173.10 173.62 1rj8 s VAL 351 N -2.62 3.40 0.12 1.40 0.11 -1.26 -0.96 120.40 120.58 1rj8 s VAL 351 Ca 0.13 -0.58 -0.07 0.00 -2.93 0.00 0.00 61.98 58.53 1rj8 s VAL 351 Cb 0.03 -2.39 -0.01 0.00 -1.53 0.00 0.00 36.38 32.48 1rj8 s VAL 351 CO -0.03 0.57 0.19 0.00 -3.33 0.00 0.00 175.10 172.50 1rj8 s LEU 353 N -2.93 4.35 0.20 0.00 1.43 -1.26 -1.66 118.68 118.82 1rj8 s LEU 353 Ca 0.12 1.14 0.09 0.00 -1.03 0.00 0.00 54.13 54.44 1rj8 s LEU 353 Cb 0.05 -2.97 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 1rj8 s LEU 353 CO -0.05 -0.01 -0.16 -0.76 0.23 0.00 0.00 176.35 175.59 1rj8 s LEU 354 N 0.36 2.52 0.41 1.79 1.43 -0.49 -4.99 118.68 119.71 1rj8 s LEU 354 Ca 0.33 -0.97 0.08 0.00 -1.03 0.00 0.00 54.13 52.54 1rj8 s LEU 354 Cb -0.18 -0.78 -0.03 0.00 0.03 0.00 0.00 46.19 45.23 1rj8 s LEU 354 CO 0.17 -0.10 0.30 -0.54 0.23 0.00 0.00 176.35 176.41 1rj8 s LYS 355 N -3.35 2.42 0.60 1.70 -0.14 -1.26 -1.36 119.74 118.34 1rj8 s LYS 355 Ca 0.21 -1.65 -0.19 0.00 -1.36 0.00 0.00 55.97 52.99 1rj8 s LYS 355 Cb -0.03 -2.23 -0.03 0.00 -1.68 0.00 0.00 37.83 33.86 1rj8 s LYS 355 CO 0.08 -0.16 1.22 0.00 -0.76 0.00 0.00 175.35 175.72 1rj8 s ALA 356 N -2.52 2.52 0.00 5.17 0.00 -1.26 -3.12 121.76 122.56 1rj8 s ALA 356 Ca 0.45 1.03 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1rj8 s ALA 356 Cb -0.01 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1rj8 s ALA 356 CO 0.26 -1.22 0.00 0.54 0.00 0.00 0.00 175.76 175.34 1rj8 n ARG 357 N -1.64 0.00 -2.40 0.00 1.74 -0.22 -4.97 116.66 109.16 1rj8 n ARG 357 Ca 0.14 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.85 1rj8 n ARG 357 Cb 0.49 -1.96 -0.03 0.00 -1.02 0.00 0.00 32.46 29.95 1rj8 n ARG 357 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1rj8 s GLN 358 N -0.02 4.06 -0.16 5.56 -0.21 -1.18 -4.84 119.66 122.87 1rj8 s GLN 358 Ca 0.00 1.68 0.01 0.00 0.02 0.00 0.00 55.36 57.07 1rj8 s GLN 358 Cb 0.00 -2.57 0.01 0.00 1.00 0.00 0.00 33.01 31.44 1rj8 s GLN 358 CO 0.00 -0.27 -0.19 0.15 -2.12 0.00 0.00 175.29 172.86 1rj8 s LYS 359 N -2.44 3.07 -0.10 2.91 1.02 -1.26 -2.05 119.74 120.89 1rj8 s LYS 359 Ca 0.58 -0.81 -0.05 0.00 0.02 0.00 0.00 55.97 55.71 1rj8 s LYS 359 Cb -0.26 -2.55 -0.04 0.00 -0.52 0.00 0.00 37.83 34.46 1rj8 s LYS 359 CO 0.33 -0.08 0.09 0.42 -0.92 0.00 0.00 175.35 175.18 1rj8 s ILE 360 N 1.01 5.04 0.02 2.17 1.01 -0.34 -1.39 121.20 128.72 1rj8 s ILE 360 Ca -0.02 0.01 -0.13 0.00 0.00 0.00 0.00 60.65 60.51 1rj8 s ILE 360 Cb -0.15 -3.18 0.02 0.00 0.01 0.00 0.00 42.46 39.16 1rj8 s ILE 360 CO -0.05 0.60 0.27 0.00 0.00 0.00 0.00 174.94 175.76 1rj8 s ALA 361 N -0.99 -0.62 -0.40 9.38 0.00 -0.61 0.17 121.76 128.69 1rj8 s ALA 361 Ca 0.15 0.04 -0.15 0.00 0.00 0.00 0.00 51.96 52.01 1rj8 s ALA 361 Cb -0.12 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1rj8 s ALA 361 CO 0.04 -0.33 0.29 0.08 0.00 0.00 0.00 175.76 175.83 1rj8 s VAL 362 N -2.05 5.21 -0.24 0.00 1.01 -1.26 -0.76 120.40 122.31 1rj8 s VAL 362 Ca -0.09 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1rj8 s VAL 362 Cb -0.03 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.48 1rj8 s VAL 362 CO -0.00 -0.28 -0.06 -0.75 0.00 0.00 0.00 175.10 174.01 1rj8 s LYS 363 N 1.68 3.01 0.14 2.72 2.20 0.28 -1.59 119.74 128.17 1rj8 s LYS 363 Ca 0.05 -0.86 -0.31 0.00 -0.36 0.00 0.00 55.97 54.49 1rj8 s LYS 363 Cb -0.19 -2.97 -0.08 0.00 -1.51 0.00 0.00 37.83 33.08 1rj8 s LYS 363 CO 0.10 -0.33 1.39 -1.64 -0.36 0.00 0.00 175.35 174.51 1rj8 s MET 364 N 1.37 4.32 0.03 4.03 -1.94 0.93 -0.63 119.30 127.42 1rj8 s MET 364 Ca 0.02 2.10 -0.17 0.00 -1.71 0.00 0.00 55.69 55.93 1rj8 s MET 364 Cb -0.16 -3.23 -0.26 0.00 2.01 0.00 0.00 34.83 33.19 1rj8 s MET 364 CO -0.05 -0.42 1.10 0.28 -0.01 0.00 0.00 175.02 175.92 1rj8 h VAL 365 N 4.12 1.35 -3.23 -6.03 2.07 -1.50 -3.41 116.25 109.62 1rj8 h VAL 365 Ca -0.43 -2.30 -0.67 0.00 0.82 0.00 0.00 66.70 64.12 1rj8 h VAL 365 Cb 1.21 2.65 -0.14 0.00 -1.52 0.00 0.00 31.29 33.49 1rj8 h VAL 365 CO 0.85 0.69 -0.60 -1.00 0.02 0.00 0.00 177.57 177.53 1rj8 s HIS 366 N -3.06 3.22 -0.39 1.57 3.76 -1.25 -5.01 115.29 114.12 1rj8 s HIS 366 Ca -0.11 0.20 0.23 0.00 -0.15 0.00 0.00 55.06 55.22 1rj8 s HIS 366 Cb 0.05 -1.84 0.24 0.00 1.11 0.00 0.00 32.58 32.14 1rj8 s HIS 366 CO 0.88 0.45 1.42 0.00 -0.85 0.00 0.00 174.74 176.64 1rj8 h ALA 367 N 5.37 0.82 -0.20 -1.40 0.00 -1.97 -3.27 119.26 118.61 1rj8 h ALA 367 Ca -0.49 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1rj8 h ALA 367 Cb 1.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1rj8 h ALA 367 CO 0.57 0.00 0.02 -0.40 0.00 0.00 0.00 179.25 179.44 1rj8 n ASP 368 N -2.90 2.58 -4.84 0.00 5.68 -1.26 -3.15 116.55 112.66 1rj8 n ASP 368 Ca 0.03 -2.32 -0.37 0.00 -0.50 0.00 0.00 54.79 51.63 1rj8 n ASP 368 Cb 0.53 -0.56 -0.06 0.00 -1.14 0.00 0.00 41.12 39.89 1rj8 n ASP 368 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1rj8 s ILE 369 N -1.51 4.99 0.04 2.12 1.01 -1.24 -4.41 121.20 122.20 1rj8 s ILE 369 Ca 0.17 0.82 0.08 0.00 0.00 0.00 0.00 60.65 61.72 1rj8 s ILE 369 Cb 0.13 -3.72 -0.03 0.00 0.01 0.00 0.00 42.46 38.85 1rj8 s ILE 369 CO 0.05 0.49 -0.21 -0.44 0.00 0.00 0.00 174.94 174.83 1rj8 s SER 370 N -1.27 3.59 0.05 3.58 0.01 0.35 -1.27 113.70 118.75 1rj8 s SER 370 Ca 0.27 -0.47 0.01 0.00 1.31 0.00 0.00 55.95 57.08 1rj8 s SER 370 Cb -0.16 -0.51 -0.03 0.00 0.21 0.00 0.00 66.02 65.53 1rj8 s SER 370 CO 0.15 0.26 -0.06 0.27 0.41 0.00 0.00 173.24 174.28 1rj8 s ILE 371 N -0.87 0.46 -0.39 1.44 -4.36 0.00 -2.05 121.20 115.44 1rj8 s ILE 371 Ca 0.13 -1.35 -0.14 0.00 -0.26 0.00 0.00 60.65 59.04 1rj8 s ILE 371 Cb -0.10 -0.92 0.01 0.00 1.25 0.00 0.00 42.46 42.70 1rj8 s ILE 371 CO 0.04 -0.60 0.27 0.21 0.24 0.00 0.00 174.94 175.10 1rj8 s ASN 372 N -2.08 6.02 -0.10 4.36 3.84 -0.55 -1.07 114.94 125.37 1rj8 s ASN 372 Ca -0.04 -0.82 -0.02 0.00 0.21 0.00 0.00 52.86 52.19 1rj8 s ASN 372 Cb -0.04 -2.13 -0.01 0.00 -0.55 0.00 0.00 41.25 38.52 1rj8 s ASN 372 CO -0.02 -0.39 2.44 0.23 -2.79 0.00 0.00 177.10 176.56 1rj8 n MET 373 N 5.12 1.50 -2.60 0.43 2.81 -0.73 -4.41 117.12 119.24 1rj8 n MET 373 Ca -0.11 -0.73 -0.35 0.00 -1.81 0.00 0.00 57.70 54.69 1rj8 n MET 373 Cb 0.47 -1.44 -0.04 0.00 -0.71 0.00 0.00 33.22 31.49 1rj8 n MET 373 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1rj8 s SER 374 N 1.50 6.68 0.54 7.83 0.01 -1.26 -0.01 113.70 128.99 1rj8 s SER 374 Ca 0.26 1.94 0.21 0.00 1.31 0.00 0.00 55.95 59.67 1rj8 s SER 374 Cb 0.15 -2.57 1.39 0.00 0.21 0.00 0.00 66.02 65.20 1rj8 s SER 374 CO -0.02 -0.54 2.11 0.07 0.41 0.00 0.00 173.24 175.27 1rj8 h LYS 375 N 2.15 0.00 0.00 12.44 2.10 -1.78 -2.00 116.57 129.48 1rj8 h LYS 375 Ca -0.49 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.08 1rj8 h LYS 375 Cb 1.21 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.53 1rj8 h LYS 375 CO 0.61 0.00 -1.77 0.72 -2.00 0.00 0.00 179.45 177.02 1rj8 n HIS 376 N -4.36 0.35 -0.04 0.07 8.25 -1.26 -4.20 115.22 114.02 1rj8 n HIS 376 Ca 0.01 0.11 -0.03 0.00 -0.26 0.00 0.00 57.72 57.54 1rj8 n HIS 376 Cb 0.25 -0.76 -0.14 0.00 1.12 0.00 0.00 29.99 30.46 1rj8 n HIS 376 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1rj8 n THR 377 N -2.51 1.09 -4.00 1.59 -2.24 -1.01 -4.85 114.28 102.34 1rj8 n THR 377 Ca -0.08 -0.74 -0.30 0.00 -2.27 0.00 0.00 64.05 60.65 1rj8 n THR 377 Cb 0.70 -0.49 -0.16 0.00 -2.10 0.00 0.00 70.33 68.27 1rj8 n THR 377 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rj8 s THR 378 N -2.81 1.56 0.26 4.28 2.01 -0.78 -3.78 115.64 116.37 1rj8 s THR 378 Ca -0.07 -0.81 -0.17 0.00 0.31 0.00 0.00 61.69 60.95 1rj8 s THR 378 Cb 0.08 -1.57 0.01 0.00 0.01 0.00 0.00 72.50 71.03 1rj8 s THR 378 CO 0.84 0.29 0.59 0.72 -0.69 0.00 0.00 174.62 176.37 1rj8 s PHE 379 N 1.46 0.08 -0.28 4.92 -0.12 -0.46 -1.56 117.98 122.01 1rj8 s PHE 379 Ca 0.02 -0.48 -0.08 0.00 -0.05 0.00 0.00 56.93 56.34 1rj8 s PHE 379 Cb -0.15 0.43 0.14 0.00 -0.63 0.00 0.00 43.02 42.81 1rj8 s PHE 379 CO -0.09 -1.09 0.60 0.12 -0.05 0.00 0.00 175.22 174.70 1rj8 s PHE 380 N -3.96 -1.30 0.25 3.49 5.36 -0.67 -0.69 117.98 120.45 1rj8 s PHE 380 Ca 0.16 2.04 -0.04 0.00 -0.96 0.00 0.00 56.93 58.14 1rj8 s PHE 380 Cb -0.03 0.66 -0.02 0.00 -0.34 0.00 0.00 43.02 43.29 1rj8 s PHE 380 CO 0.07 -0.69 0.30 0.20 -1.46 0.00 0.00 175.22 173.64 1rj8 s GLY 381 N 2.84 1.28 0.03 13.12 0.00 -0.38 -0.79 107.32 123.42 1rj8 s GLY 381 Ca 0.01 -1.48 -0.18 0.00 0.00 0.00 0.00 44.72 43.07 1rj8 s GLY 381 CO -0.18 -1.13 0.41 0.00 0.00 0.00 0.00 173.10 172.20 1rj8 s ALA 382 N -3.88 -1.02 -0.12 3.20 0.00 -0.28 -1.26 121.76 118.40 1rj8 s ALA 382 Ca 0.33 0.37 -0.00 0.00 0.00 0.00 0.00 51.96 52.66 1rj8 s ALA 382 Cb 0.03 0.28 0.02 0.00 0.00 0.00 0.00 23.12 23.46 1rj8 s ALA 382 CO 0.14 -0.42 -0.08 0.42 0.00 0.00 0.00 175.76 175.82 1rj8 s ILE 383 N -2.22 1.09 -0.76 0.00 1.01 0.90 -1.61 121.20 119.61 1rj8 s ILE 383 Ca -0.07 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 59.99 1rj8 s ILE 383 Cb -0.01 -1.10 0.04 0.00 0.01 0.00 0.00 42.46 41.39 1rj8 s ILE 383 CO -0.01 0.37 1.27 -0.60 0.00 0.00 0.00 174.94 175.98 1rj8 s ARG 384 N 1.68 3.22 0.07 2.79 3.52 -0.31 -0.42 118.95 129.51 1rj8 s ARG 384 Ca 0.05 -0.37 -0.20 0.00 -0.13 0.00 0.00 55.73 55.08 1rj8 s ARG 384 Cb -0.13 -4.29 -0.11 0.00 -1.56 0.00 0.00 34.95 28.86 1rj8 s ARG 384 CO -0.09 -2.13 1.51 -0.07 -0.81 0.00 0.00 175.30 173.72 1rj8 h LEU 385 N 12.87 0.29 0.00 -0.88 3.38 -1.41 -3.18 115.31 126.38 1rj8 h LEU 385 Ca -0.24 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1rj8 h LEU 385 Cb 1.05 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1rj8 h LEU 385 CO 1.28 0.51 0.00 0.61 0.09 0.00 0.00 178.44 180.93 1rj8 n GLY 386 N -0.35 2.20 3.78 0.83 0.00 -1.24 -4.68 105.19 105.73 1rj8 n GLY 386 Ca -0.05 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 1rj8 n GLY 386 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rj8 s GLU 387 N 2.02 1.68 0.16 1.61 0.41 -1.26 -2.46 118.70 120.86 1rj8 s GLU 387 Ca 0.00 0.60 -0.06 0.00 -0.41 0.00 0.00 54.97 55.09 1rj8 s GLU 387 Cb 0.00 -1.88 -0.06 0.00 -1.78 0.00 0.00 34.13 30.42 1rj8 s GLU 387 CO 0.00 -1.89 0.41 0.00 -0.49 0.00 0.00 175.26 173.29 1rj8 s ALA 388 N -3.13 3.74 -2.00 5.21 0.00 -1.26 -3.55 121.76 120.76 1rj8 s ALA 388 Ca 0.62 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.12 1rj8 s ALA 388 Cb -0.15 -2.20 0.21 0.00 0.00 0.00 0.00 23.12 20.98 1rj8 s ALA 388 CO 0.55 0.63 0.69 -2.30 0.00 0.00 0.00 175.76 175.33