#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cwr s VAL 263 N 0.00 4.70 0.05 0.52 1.01 -1.26 -5.06 120.40 120.36 2cwr s VAL 263 Ca 0.00 1.85 0.03 0.00 0.00 0.00 0.00 61.98 63.87 2cwr s VAL 263 Cb 0.00 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 2cwr s VAL 263 CO 0.00 0.30 -0.00 -0.44 0.00 0.00 0.00 175.10 174.96 2cwr s SER 264 N 0.23 5.04 0.00 3.32 0.01 -1.26 -4.95 113.70 116.10 2cwr s SER 264 Ca 0.44 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.59 2cwr s SER 264 Cb -0.21 -1.25 0.00 0.00 0.21 0.00 0.00 66.02 64.77 2cwr s SER 264 CO 0.26 0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.74 2cwr n GLY 265 N 0.96 -1.85 3.33 3.44 0.00 -1.26 -2.83 105.19 106.98 2cwr n GLY 265 Ca -0.12 -1.13 -0.10 0.00 0.00 0.00 0.00 46.02 44.67 2cwr n GLY 265 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cwr s SER 266 N -0.91 -0.08 -0.03 1.61 1.04 -0.14 -5.00 113.70 110.18 2cwr s SER 266 Ca 0.00 -0.57 0.06 0.00 0.48 0.00 0.00 55.95 55.92 2cwr s SER 266 Cb 0.00 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.56 2cwr s SER 266 CO 0.00 -0.87 -0.20 -0.22 0.98 0.00 0.00 173.24 172.93 2cwr s LEU 267 N -2.87 2.01 0.04 2.42 0.20 -1.26 -1.01 118.68 118.20 2cwr s LEU 267 Ca 0.08 -0.39 0.03 0.00 0.69 0.00 0.00 54.13 54.55 2cwr s LEU 267 Cb 0.02 -1.08 -0.02 0.00 -0.43 0.00 0.00 46.19 44.68 2cwr s LEU 267 CO -0.07 0.22 -0.10 -1.83 -0.29 0.00 0.00 176.35 174.28 2cwr s GLU 268 N -0.28 0.69 -0.06 1.98 -1.05 -0.39 -5.01 118.70 114.58 2cwr s GLU 268 Ca 0.03 -0.67 -0.04 0.00 -0.15 0.00 0.00 54.97 54.14 2cwr s GLU 268 Cb -0.10 -0.61 0.02 0.00 -0.44 0.00 0.00 34.13 33.00 2cwr s GLU 268 CO 0.01 0.14 0.13 0.54 0.95 0.00 0.00 175.26 177.03 2cwr s VAL 269 N -0.94 -0.02 -0.21 1.83 0.11 -1.26 -0.68 120.40 119.23 2cwr s VAL 269 Ca -0.03 0.08 -0.09 0.00 -2.93 0.00 0.00 61.98 59.02 2cwr s VAL 269 Cb -0.08 -0.21 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 2cwr s VAL 269 CO 0.01 0.03 0.10 -0.75 -3.33 0.00 0.00 175.10 171.16 2cwr s LYS 270 N 0.55 4.00 -0.07 1.54 2.47 -0.14 -4.93 119.74 123.15 2cwr s LYS 270 Ca -0.04 -0.32 0.03 0.00 -1.56 0.00 0.00 55.97 54.08 2cwr s LYS 270 Cb -0.05 -3.33 -0.02 0.00 -1.46 0.00 0.00 37.83 32.96 2cwr s LYS 270 CO -0.02 0.18 -0.17 0.08 0.16 0.00 0.00 175.35 175.58 2cwr s VAL 271 N 0.66 2.78 -0.30 4.02 1.01 -1.26 -1.18 120.40 126.13 2cwr s VAL 271 Ca 0.05 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 2cwr s VAL 271 Cb -0.13 -2.09 0.10 0.00 0.00 0.00 0.00 36.38 34.26 2cwr s VAL 271 CO 0.01 0.57 0.09 0.21 0.00 0.00 0.00 175.10 175.99 2cwr s ASN 272 N -0.32 3.95 -0.16 3.32 2.47 -0.50 -4.97 114.94 118.72 2cwr s ASN 272 Ca 0.02 -1.58 -0.09 0.00 0.42 0.00 0.00 52.86 51.63 2cwr s ASN 272 Cb -0.13 -0.83 -0.05 0.00 -1.45 0.00 0.00 41.25 38.79 2cwr s ASN 272 CO 0.02 -0.41 0.15 -0.62 -3.72 0.00 0.00 177.10 172.53 2cwr s ASP 273 N 1.65 6.31 -0.17 -4.21 -1.08 -1.26 -0.61 116.67 117.30 2cwr s ASP 273 Ca 0.09 0.35 0.14 0.00 -0.52 0.00 0.00 52.55 52.61 2cwr s ASP 273 Cb -0.17 -2.10 0.38 0.00 -1.46 0.00 0.00 42.92 39.57 2cwr s ASP 273 CO -0.25 0.25 1.19 -2.67 0.52 0.00 0.00 175.17 174.22 2cwr n TRP 274 N 2.96 0.00 0.00 -5.34 2.14 0.52 -4.98 117.44 112.74 2cwr n TRP 274 Ca -0.17 -1.24 0.00 0.00 2.07 0.00 0.00 57.50 58.16 2cwr n TRP 274 Cb 0.53 -0.21 0.00 0.00 -0.81 0.00 0.00 31.31 30.82 2cwr n TRP 274 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2cwr n GLY 275 N -1.00 1.97 0.05 -1.67 0.00 -1.26 -4.50 105.19 98.78 2cwr n GLY 275 Ca 0.16 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.73 2cwr n GLY 275 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cwr n SER 276 N 4.04 0.48 -3.22 1.61 3.41 -1.26 -4.05 113.62 114.63 2cwr n SER 276 Ca 0.00 0.38 -0.09 0.00 -0.26 0.00 0.00 58.87 58.90 2cwr n SER 276 Cb 0.00 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2cwr n SER 276 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2cwr s GLY 277 N -3.32 0.44 -0.15 5.00 0.00 -1.26 -1.87 107.32 106.15 2cwr s GLY 277 Ca 0.11 -0.77 -0.27 0.00 0.00 0.00 0.00 44.72 43.79 2cwr s GLY 277 CO 0.60 -0.38 0.66 0.00 0.00 0.00 0.00 173.10 173.99 2cwr s ALA 278 N -2.83 -1.68 -0.13 3.20 0.00 -0.23 -0.36 121.76 119.74 2cwr s ALA 278 Ca 0.17 1.58 -0.05 0.00 0.00 0.00 0.00 51.96 53.66 2cwr s ALA 278 Cb -0.04 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 2cwr s ALA 278 CO 0.12 -0.34 0.05 -2.00 0.00 0.00 0.00 175.76 173.59 2cwr s GLU 279 N -0.40 3.49 -0.23 0.00 2.12 0.22 -0.86 118.70 123.03 2cwr s GLU 279 Ca -0.05 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 54.95 2cwr s GLU 279 Cb -0.03 -3.04 0.04 0.00 0.26 0.00 0.00 34.13 31.36 2cwr s GLU 279 CO 0.05 0.53 -0.12 0.71 -0.54 0.00 0.00 175.26 175.89 2cwr s TYR 280 N -0.38 3.07 -0.40 5.30 1.51 0.39 -1.41 117.35 125.43 2cwr s TYR 280 Ca 0.09 -1.90 -0.10 0.00 -1.01 0.00 0.00 57.07 54.15 2cwr s TYR 280 Cb -0.12 -1.97 0.05 0.00 -0.11 0.00 0.00 41.96 39.81 2cwr s TYR 280 CO 0.02 -0.82 0.23 -0.51 -1.11 0.00 0.00 175.55 173.37 2cwr s ASP 281 N 1.22 5.70 -0.08 2.29 -0.00 -0.33 -1.38 116.67 124.09 2cwr s ASP 281 Ca -0.02 -1.24 -0.07 0.00 -0.00 0.00 0.00 52.55 51.21 2cwr s ASP 281 Cb -0.17 -2.01 -0.04 0.00 -0.00 0.00 0.00 42.92 40.70 2cwr s ASP 281 CO -0.07 -0.46 0.19 -0.69 -0.00 0.00 0.00 175.17 174.13 2cwr s VAL 282 N 1.50 5.43 -0.06 -1.27 1.01 0.87 -0.96 120.40 126.90 2cwr s VAL 282 Ca 0.02 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.26 2cwr s VAL 282 Cb -0.21 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.72 2cwr s VAL 282 CO 0.05 0.56 -0.08 -0.89 0.00 0.00 0.00 175.10 174.74 2cwr s THR 283 N -1.09 0.86 -0.22 3.92 2.01 0.14 -1.57 115.64 119.69 2cwr s THR 283 Ca 0.18 -0.29 -0.06 0.00 0.31 0.00 0.00 61.69 61.83 2cwr s THR 283 Cb -0.13 -0.84 -0.02 0.00 0.01 0.00 0.00 72.50 71.52 2cwr s THR 283 CO 0.08 0.30 0.03 -0.76 -0.69 0.00 0.00 174.62 173.58 2cwr s LEU 284 N 0.97 3.31 -0.60 4.42 1.43 0.13 -1.27 118.68 127.07 2cwr s LEU 284 Ca -0.09 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.66 2cwr s LEU 284 Cb -0.15 -1.86 0.15 0.00 0.03 0.00 0.00 46.19 44.37 2cwr s LEU 284 CO 0.00 0.02 0.52 0.20 0.23 0.00 0.00 176.35 177.32 2cwr s ASN 285 N 1.29 6.13 0.24 2.29 0.01 -0.18 -1.92 114.94 122.80 2cwr s ASN 285 Ca 0.04 -2.15 0.06 0.00 -0.71 0.00 0.00 52.86 50.10 2cwr s ASN 285 Cb -0.15 -2.12 -0.03 0.00 0.41 0.00 0.00 41.25 39.36 2cwr s ASN 285 CO 0.02 -0.70 0.23 -0.76 -1.51 0.00 0.00 177.10 174.38 2cwr s LEU 286 N 1.01 3.94 -0.12 0.60 1.43 0.34 -0.97 118.68 124.91 2cwr s LEU 286 Ca 0.09 -0.16 0.08 0.00 -1.03 0.00 0.00 54.13 53.10 2cwr s LEU 286 Cb -0.23 -2.47 0.44 0.00 0.03 0.00 0.00 46.19 43.95 2cwr s LEU 286 CO -0.02 -0.04 1.17 -0.90 0.23 0.00 0.00 176.35 176.80 2cwr n ASP 287 N -1.17 3.48 0.00 2.29 5.75 -1.13 -4.73 116.55 121.05 2cwr n ASP 287 Ca -0.08 -2.48 0.00 0.00 -0.01 0.00 0.00 54.79 52.22 2cwr n ASP 287 Cb 0.57 -0.59 0.00 0.00 -1.03 0.00 0.00 41.12 40.08 2cwr n ASP 287 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2cwr n GLY 288 N 0.37 -0.95 3.63 6.12 0.00 -1.26 -5.04 105.19 108.06 2cwr n GLY 288 Ca 0.15 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 2cwr n GLY 288 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cwr s GLN 289 N -1.15 3.98 0.05 1.61 -0.21 -1.26 -3.83 119.66 118.84 2cwr s GLN 289 Ca 0.00 -0.33 -0.02 0.00 0.02 0.00 0.00 55.36 55.03 2cwr s GLN 289 Cb 0.00 -3.30 -0.03 0.00 1.00 0.00 0.00 33.01 30.68 2cwr s GLN 289 CO 0.00 0.19 -0.01 0.71 -2.12 0.00 0.00 175.29 174.06 2cwr s TYR 290 N 0.61 0.43 -1.22 0.91 1.51 -0.02 -5.00 117.35 114.57 2cwr s TYR 290 Ca 0.05 -0.90 -0.09 0.00 -1.01 0.00 0.00 57.07 55.12 2cwr s TYR 290 Cb -0.13 -0.32 0.21 0.00 -0.11 0.00 0.00 41.96 41.61 2cwr s TYR 290 CO 0.01 -0.35 1.67 -3.47 -1.11 0.00 0.00 175.55 172.30 2cwr n ASP 291 N 0.43 5.43 -4.32 2.29 4.64 -1.26 -4.57 116.55 119.19 2cwr n ASP 291 Ca -0.16 -3.15 -0.29 0.00 -1.38 0.00 0.00 54.79 49.81 2cwr n ASP 291 Cb 0.60 -1.44 0.25 0.00 -1.04 0.00 0.00 41.12 39.48 2cwr n ASP 291 CO 0.00 0.00 0.00 -1.66 -0.82 0.00 0.00 177.20 174.72 2cwr s TRP 292 N -0.21 1.11 -0.03 -0.67 1.48 -1.26 -4.86 118.94 114.51 2cwr s TRP 292 Ca 0.38 0.98 -0.01 0.00 -1.06 0.00 0.00 56.10 56.39 2cwr s TRP 292 Cb 0.05 -3.11 0.02 0.00 -1.16 0.00 0.00 33.47 29.27 2cwr s TRP 292 CO 0.02 -3.93 0.05 0.99 -4.06 0.00 0.00 176.95 170.02 2cwr s THR 293 N -2.55 -0.04 -0.17 0.66 2.01 -0.77 -4.15 115.64 110.63 2cwr s THR 293 Ca 0.68 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.84 2cwr s THR 293 Cb -0.21 -0.10 0.03 0.00 0.01 0.00 0.00 72.50 72.23 2cwr s THR 293 CO 0.62 0.06 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.81 2cwr s VAL 294 N 0.80 1.53 -0.16 3.82 1.01 -0.22 -0.23 120.40 126.94 2cwr s VAL 294 Ca -0.06 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 2cwr s VAL 294 Cb -0.09 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.71 2cwr s VAL 294 CO -0.03 0.31 0.23 -0.54 0.00 0.00 0.00 175.10 175.07 2cwr s LYS 295 N 1.48 4.13 -0.15 2.72 1.02 0.50 -0.60 119.74 128.84 2cwr s LYS 295 Ca 0.02 -0.01 0.02 0.00 0.02 0.00 0.00 55.97 56.02 2cwr s LYS 295 Cb -0.14 -3.39 0.02 0.00 -0.52 0.00 0.00 37.83 33.79 2cwr s LYS 295 CO -0.09 0.34 -0.20 0.08 -0.92 0.00 0.00 175.35 174.56 2cwr s VAL 296 N 0.19 1.95 -0.34 3.17 1.01 0.15 -0.71 120.40 125.82 2cwr s VAL 296 Ca 0.14 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 61.08 2cwr s VAL 296 Cb -0.12 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2cwr s VAL 296 CO 0.03 0.52 0.35 -0.75 0.00 0.00 0.00 175.10 175.25 2cwr s LYS 297 N 1.08 3.60 0.45 2.72 2.20 -0.03 -0.70 119.74 129.06 2cwr s LYS 297 Ca -0.01 -0.39 -0.19 0.00 -0.36 0.00 0.00 55.97 55.01 2cwr s LYS 297 Cb -0.14 -3.79 -0.10 0.00 -1.51 0.00 0.00 37.83 32.29 2cwr s LYS 297 CO -0.07 -0.49 0.95 -0.51 -0.36 0.00 0.00 175.35 174.86 2cwr s LEU 298 N 2.00 3.86 0.78 5.43 1.43 -0.58 -0.53 118.68 131.08 2cwr s LEU 298 Ca 0.12 1.63 -0.11 0.00 -1.03 0.00 0.00 54.13 54.73 2cwr s LEU 298 Cb -0.16 -4.50 0.06 0.00 0.03 0.00 0.00 46.19 41.61 2cwr s LEU 298 CO 0.11 -0.42 1.09 0.00 0.23 0.00 0.00 176.35 177.37 2cwr s ALA 299 N -2.30 2.30 0.19 4.21 0.00 -0.26 -4.65 121.76 121.25 2cwr s ALA 299 Ca 0.61 -0.11 -0.33 0.00 0.00 0.00 0.00 51.96 52.13 2cwr s ALA 299 Cb -0.09 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 19.75 2cwr s ALA 299 CO 0.18 -1.66 1.42 -2.30 0.00 0.00 0.00 175.76 173.40 2cwr n PRO 300 N -3.40 1.87 -0.91 0.00 -0.02 -1.26 -1.65 135.00 129.63 2cwr n PRO 300 Ca 0.07 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 2cwr n PRO 300 Cb 0.55 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2cwr n PRO 300 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cwr n GLY 301 N 2.52 0.43 3.87 -1.23 0.00 -1.26 -4.51 105.19 105.02 2cwr n GLY 301 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 2cwr n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwr s ALA 302 N -2.13 3.70 0.04 4.61 0.00 -0.66 -4.49 121.76 122.83 2cwr s ALA 302 Ca 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 51.96 51.56 2cwr s ALA 302 Cb 0.00 -2.30 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 2cwr s ALA 302 CO 0.00 0.56 0.05 0.95 0.00 0.00 0.00 175.76 177.32 2cwr s THR 303 N -1.49 0.15 -0.20 0.00 -4.23 0.14 -4.81 115.64 105.20 2cwr s THR 303 Ca 0.36 -1.22 -0.26 0.00 -1.18 0.00 0.00 61.69 59.39 2cwr s THR 303 Cb -0.13 -0.93 -0.01 0.00 1.34 0.00 0.00 72.50 72.76 2cwr s THR 303 CO 0.19 -0.68 0.86 -0.69 -0.54 0.00 0.00 174.62 173.77 2cwr s VAL 304 N -2.73 4.84 0.01 2.29 1.01 -1.26 -0.40 120.40 124.15 2cwr s VAL 304 Ca -0.04 1.67 -0.06 0.00 0.00 0.00 0.00 61.98 63.54 2cwr s VAL 304 Cb -0.00 -4.15 -0.29 0.00 0.00 0.00 0.00 36.38 31.93 2cwr s VAL 304 CO -0.05 -0.04 0.90 1.23 0.00 0.00 0.00 175.10 177.14 2cwr h GLY 305 N 8.77 0.37 -2.48 4.51 0.00 -1.18 -3.48 103.07 109.58 2cwr h GLY 305 Ca -0.26 -0.94 0.11 0.00 0.00 0.00 0.00 47.33 46.25 2cwr h GLY 305 CO 0.87 0.82 0.38 -1.35 0.00 0.00 0.00 176.54 177.26 2cwr s SER 306 N -7.15 -0.27 0.24 0.19 1.04 -1.24 -5.00 113.70 101.51 2cwr s SER 306 Ca -0.09 -0.35 -0.21 0.00 0.48 0.00 0.00 55.95 55.78 2cwr s SER 306 Cb 0.06 0.55 0.03 0.00 0.10 0.00 0.00 66.02 66.77 2cwr s SER 306 CO 0.87 -0.99 0.67 0.72 0.98 0.00 0.00 173.24 175.49 2cwr s PHE 307 N -3.49 -0.26 0.04 5.02 -0.71 -1.26 -1.26 117.98 116.06 2cwr s PHE 307 Ca 0.09 -0.12 -0.17 0.00 -1.04 0.00 0.00 56.93 55.69 2cwr s PHE 307 Cb -0.03 0.63 0.03 0.00 -1.21 0.00 0.00 43.02 42.45 2cwr s PHE 307 CO 0.00 -1.11 0.38 1.67 -1.34 0.00 0.00 175.22 174.83 2cwr s TRP 308 N -3.87 -0.23 -1.56 3.49 -2.14 -0.43 -4.91 118.94 109.29 2cwr s TRP 308 Ca 0.09 0.17 0.00 0.00 2.66 0.00 0.00 56.10 59.01 2cwr s TRP 308 Cb -0.04 0.19 0.00 0.00 -3.10 0.00 0.00 33.47 30.51 2cwr s TRP 308 CO 0.01 -0.55 0.00 0.43 -2.66 0.00 0.00 176.95 174.18 2cwr n SER 309 N 0.54 -4.84 -3.69 -2.66 7.64 -1.26 -2.63 113.62 106.71 2cwr n SER 309 Ca -0.19 0.36 -0.09 0.00 1.01 0.00 0.00 58.87 59.97 2cwr n SER 309 Cb 0.60 -3.64 -0.02 0.00 -1.01 0.00 0.00 64.21 60.14 2cwr n SER 309 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cwr s ALA 310 N -2.52 -1.39 0.12 -0.43 0.00 -1.26 -3.86 121.76 112.42 2cwr s ALA 310 Ca 0.00 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.02 2cwr s ALA 310 Cb 0.00 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.93 2cwr s ALA 310 CO 0.00 -0.94 0.12 -0.80 0.00 0.00 0.00 175.76 174.14 2cwr s ASN 311 N -2.85 5.60 -0.00 0.00 0.02 0.75 -4.84 114.94 113.62 2cwr s ASN 311 Ca 0.07 -0.04 0.06 0.00 -1.02 0.00 0.00 52.86 51.93 2cwr s ASN 311 Cb -0.04 -1.50 -0.02 0.00 0.02 0.00 0.00 41.25 39.71 2cwr s ASN 311 CO -0.01 0.12 -0.18 -0.75 0.02 0.00 0.00 177.10 176.31 2cwr s LYS 312 N -2.75 1.38 -0.09 -0.60 2.20 -1.26 -1.78 119.74 116.83 2cwr s LYS 312 Ca 0.30 -0.67 0.01 0.00 -0.36 0.00 0.00 55.97 55.25 2cwr s LYS 312 Cb -0.11 -1.35 0.02 0.00 -1.51 0.00 0.00 37.83 34.87 2cwr s LYS 312 CO 0.23 0.37 -0.11 -1.14 -0.36 0.00 0.00 175.35 174.34 2cwr s GLN 313 N -0.56 1.68 0.01 4.03 0.74 -0.31 -4.98 119.66 120.27 2cwr s GLN 313 Ca 0.06 -0.37 0.06 0.00 0.05 0.00 0.00 55.36 55.17 2cwr s GLN 313 Cb -0.07 -1.53 -0.02 0.00 1.10 0.00 0.00 33.01 32.49 2cwr s GLN 313 CO -0.00 -0.10 -0.19 -2.00 -0.55 0.00 0.00 175.29 172.45 2cwr s GLU 314 N 1.11 1.41 0.00 1.67 2.12 -1.26 0.15 118.70 123.90 2cwr s GLU 314 Ca -0.06 -0.76 0.00 0.00 0.36 0.00 0.00 54.97 54.52 2cwr s GLU 314 Cb -0.14 -1.41 0.00 0.00 0.26 0.00 0.00 34.13 32.83 2cwr s GLU 314 CO -0.02 0.38 0.00 0.41 -0.54 0.00 0.00 175.26 175.49 2cwr n GLY 315 N 2.32 5.01 3.55 -1.50 0.00 -0.04 -5.02 105.19 109.51 2cwr n GLY 315 Ca -0.16 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 2cwr n GLY 315 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cwr s ASN 316 N 1.09 4.44 0.00 1.61 0.02 -1.26 -2.97 114.94 117.86 2cwr s ASN 316 Ca 0.00 0.90 0.00 0.00 -1.02 0.00 0.00 52.86 52.74 2cwr s ASN 316 Cb 0.00 -2.51 0.00 0.00 0.02 0.00 0.00 41.25 38.76 2cwr s ASN 316 CO 0.00 -2.96 0.00 0.61 0.02 0.00 0.00 177.10 174.77 2cwr n GLY 317 N 6.07 0.15 3.21 0.66 0.00 -1.26 -4.97 105.19 109.05 2cwr n GLY 317 Ca 0.37 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 2cwr n GLY 317 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2cwr s TYR 318 N -1.35 1.52 -0.01 1.61 2.02 -1.16 -1.52 117.35 118.46 2cwr s TYR 318 Ca 0.00 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.33 2cwr s TYR 318 Cb 0.00 -0.88 0.00 0.00 -0.40 0.00 0.00 41.96 40.68 2cwr s TYR 318 CO 0.00 0.09 -0.05 0.08 -1.57 0.00 0.00 175.55 174.10 2cwr s VAL 319 N -0.96 0.44 -0.15 0.71 1.01 0.12 -0.86 120.40 120.71 2cwr s VAL 319 Ca 0.04 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2cwr s VAL 319 Cb -0.09 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 35.91 2cwr s VAL 319 CO 0.02 0.14 -0.18 -0.63 0.00 0.00 0.00 175.10 174.46 2cwr s ILE 320 N 0.11 1.80 -0.12 2.22 1.01 0.12 0.31 121.20 126.66 2cwr s ILE 320 Ca -0.01 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 2cwr s ILE 320 Cb -0.05 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 2cwr s ILE 320 CO -0.00 0.50 0.01 -0.36 0.00 0.00 0.00 174.94 175.09 2cwr s PHE 321 N 1.19 3.17 0.12 3.97 0.08 0.23 -1.16 117.98 125.58 2cwr s PHE 321 Ca 0.00 0.11 0.05 0.00 0.12 0.00 0.00 56.93 57.20 2cwr s PHE 321 Cb -0.14 -1.87 -0.04 0.00 -0.57 0.00 0.00 43.02 40.40 2cwr s PHE 321 CO -0.08 0.34 -0.11 0.95 -0.10 0.00 0.00 175.22 176.22 2cwr s THR 322 N -0.47 1.13 0.47 0.64 -4.23 -0.73 -1.05 115.64 111.39 2cwr s THR 322 Ca 0.09 -1.78 -0.21 0.00 -1.18 0.00 0.00 61.69 58.61 2cwr s THR 322 Cb -0.12 -1.55 -0.09 0.00 1.34 0.00 0.00 72.50 72.09 2cwr s THR 322 CO 0.02 -0.57 1.03 -2.16 -0.54 0.00 0.00 174.62 172.41 2cwr s PRO 323 N -3.01 3.87 0.62 3.99 0.04 -1.26 -0.18 135.00 139.07 2cwr s PRO 323 Ca 0.10 1.36 -0.10 0.00 0.04 0.00 0.00 61.00 62.40 2cwr s PRO 323 Cb -0.02 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.35 2cwr s PRO 323 CO 0.01 -0.37 0.99 0.14 0.04 0.00 0.00 177.00 177.81 2cwr s VAL 324 N -1.96 4.30 0.32 -0.36 -7.23 -1.25 -4.66 120.40 109.56 2cwr s VAL 324 Ca 0.66 0.56 0.09 0.00 -1.81 0.00 0.00 61.98 61.48 2cwr s VAL 324 Cb -0.16 -3.72 0.38 0.00 0.56 0.00 0.00 36.38 33.44 2cwr s VAL 324 CO 0.20 -0.89 1.51 -1.54 -0.31 0.00 0.00 175.10 174.08 2cwr n SER 325 N -2.72 0.06 -0.27 4.85 3.41 -1.26 -1.36 113.62 116.33 2cwr n SER 325 Ca 0.05 1.62 0.14 0.00 -0.26 0.00 0.00 58.87 60.42 2cwr n SER 325 Cb 0.55 -0.67 0.55 0.00 -0.26 0.00 0.00 64.21 64.39 2cwr n SER 325 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 2cwr n TRP 326 N -5.33 0.00 -1.99 7.33 4.27 -1.26 -4.40 117.44 116.05 2cwr n TRP 326 Ca 0.28 0.00 -0.34 0.00 -3.89 0.00 0.00 57.50 53.55 2cwr n TRP 326 Cb 0.93 -0.08 0.03 0.00 -1.36 0.00 0.00 31.31 30.83 2cwr n TRP 326 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2cwr n ASN 327 N -0.48 6.48 -0.97 -0.67 4.05 -0.47 -4.71 115.26 118.49 2cwr n ASN 327 Ca 0.16 -3.79 0.11 0.00 0.45 0.00 0.00 54.58 51.52 2cwr n ASN 327 Cb 0.31 -0.80 0.26 0.00 1.23 0.00 0.00 39.78 40.77 2cwr n ASN 327 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2cwr n LYS 328 N -0.60 2.27 0.00 1.20 5.02 -1.26 -4.70 118.16 120.09 2cwr n LYS 328 Ca 0.50 -1.91 0.00 0.00 -2.02 0.00 0.00 58.31 54.88 2cwr n LYS 328 Cb 0.50 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 2cwr n LYS 328 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cwr n GLY 329 N 1.39 -0.67 0.29 0.72 0.00 -1.26 -0.84 105.19 104.81 2cwr n GLY 329 Ca 0.18 -2.19 0.15 0.00 0.00 0.00 0.00 46.02 44.17 2cwr n GLY 329 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cwr h PRO 330 N 4.35 0.00 -3.76 1.61 0.13 -1.87 -3.45 132.00 129.01 2cwr h PRO 330 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 2cwr h PRO 330 Cb 0.00 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 30.76 2cwr h PRO 330 CO 0.00 0.06 -0.49 0.99 -0.23 0.00 0.00 178.00 178.33 2cwr s THR 331 N -4.27 3.25 0.06 1.56 2.01 -1.26 -0.50 115.64 116.49 2cwr s THR 331 Ca -0.03 -2.87 -0.10 0.00 0.31 0.00 0.00 61.69 59.00 2cwr s THR 331 Cb 0.13 -3.18 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 2cwr s THR 331 CO 0.54 -0.81 0.38 0.00 -0.69 0.00 0.00 174.62 174.04 2cwr s ALA 332 N 0.13 3.74 -0.01 7.40 0.00 -0.81 -4.91 121.76 127.31 2cwr s ALA 332 Ca 0.15 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.73 2cwr s ALA 332 Cb -0.22 -2.24 -0.00 0.00 0.00 0.00 0.00 23.12 20.66 2cwr s ALA 332 CO -0.03 0.57 -0.06 0.95 0.00 0.00 0.00 175.76 177.19 2cwr s THR 333 N -1.35 0.48 0.29 0.00 -4.23 -1.26 0.19 115.64 109.75 2cwr s THR 333 Ca 0.31 -0.24 -0.19 0.00 -1.18 0.00 0.00 61.69 60.39 2cwr s THR 333 Cb -0.14 -0.42 0.02 0.00 1.34 0.00 0.00 72.50 73.30 2cwr s THR 333 CO 0.17 0.15 0.70 0.72 -0.54 0.00 0.00 174.62 175.81 2cwr s PHE 334 N -0.01 -0.09 0.28 3.99 -0.12 -0.61 -4.83 117.98 116.59 2cwr s PHE 334 Ca 0.01 -0.38 -0.20 0.00 -0.05 0.00 0.00 56.93 56.31 2cwr s PHE 334 Cb -0.04 0.65 0.02 0.00 -0.63 0.00 0.00 43.02 43.02 2cwr s PHE 334 CO -0.00 -1.24 0.69 0.20 -0.05 0.00 0.00 175.22 174.82 2cwr s GLY 335 N -2.95 -0.02 0.17 1.99 0.00 -1.08 -0.09 107.32 105.34 2cwr s GLY 335 Ca 0.13 -0.37 -0.22 0.00 0.00 0.00 0.00 44.72 44.26 2cwr s GLY 335 CO 0.08 -0.15 0.59 -0.11 0.00 0.00 0.00 173.10 173.51 2cwr s PHE 336 N -3.93 -0.45 -0.07 1.90 -0.12 -0.48 -1.32 117.98 113.51 2cwr s PHE 336 Ca 0.12 0.20 0.04 0.00 -0.05 0.00 0.00 56.93 57.24 2cwr s PHE 336 Cb -0.05 0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 42.86 2cwr s PHE 336 CO 0.07 -0.88 -0.20 0.42 -0.05 0.00 0.00 175.22 174.58 2cwr s ILE 337 N -3.78 2.50 -0.09 -4.49 1.01 -0.39 -0.46 121.20 115.49 2cwr s ILE 337 Ca 0.03 -0.91 0.04 0.00 0.00 0.00 0.00 60.65 59.81 2cwr s ILE 337 Cb -0.01 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.50 2cwr s ILE 337 CO -0.10 0.57 -0.24 -0.69 0.00 0.00 0.00 174.94 174.48 2cwr s VAL 338 N -0.24 2.12 0.00 2.92 1.01 -0.04 -0.55 120.40 125.62 2cwr s VAL 338 Ca -0.00 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 60.99 2cwr s VAL 338 Cb -0.13 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 2cwr s VAL 338 CO 0.03 0.56 -0.01 0.20 0.00 0.00 0.00 175.10 175.88 2cwr s ASN 339 N 0.22 5.01 0.00 3.32 0.02 0.46 -1.06 114.94 122.91 2cwr s ASN 339 Ca -0.15 -0.04 0.00 0.00 -1.02 0.00 0.00 52.86 51.65 2cwr s ASN 339 Cb -0.17 -1.27 0.00 0.00 0.02 0.00 0.00 41.25 39.83 2cwr s ASN 339 CO 0.08 0.28 0.00 0.61 0.02 0.00 0.00 177.10 178.08 2cwr n GLY 340 N 1.40 -1.06 3.73 0.66 0.00 -0.78 -0.69 105.19 108.45 2cwr n GLY 340 Ca -0.15 -0.94 -0.36 0.00 0.00 0.00 0.00 46.02 44.58 2cwr n GLY 340 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2cwr s PRO 341 N -0.89 2.43 0.37 1.61 0.02 -1.26 -4.59 135.00 132.69 2cwr s PRO 341 Ca 0.00 1.93 -0.27 0.00 0.02 0.00 0.00 61.00 62.68 2cwr s PRO 341 Cb 0.00 -1.85 -0.11 0.00 0.02 0.00 0.00 34.50 32.56 2cwr s PRO 341 CO 0.00 -1.66 1.28 0.94 -0.33 0.00 0.00 177.00 177.23 2cwr n GLN 342 N -2.18 2.04 0.00 5.54 7.27 -1.26 -4.73 117.38 124.07 2cwr n GLN 342 Ca 0.15 0.72 0.00 0.00 0.07 0.00 0.00 57.00 57.94 2cwr n GLN 342 Cb 0.49 -2.35 0.00 0.00 2.41 0.00 0.00 30.24 30.79 2cwr n GLN 342 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2cwr n GLY 343 N 0.79 1.16 3.66 1.69 0.00 -1.26 -5.00 105.19 106.22 2cwr n GLY 343 Ca 0.05 -2.23 -0.48 0.00 0.00 0.00 0.00 46.02 43.36 2cwr n GLY 343 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2cwr n ASP 344 N 0.00 2.81 0.15 1.61 8.00 -1.26 -4.86 116.55 122.99 2cwr n ASP 344 Ca 0.00 1.07 0.08 0.00 0.71 0.00 0.00 54.79 56.66 2cwr n ASP 344 Cb 0.00 -1.35 0.06 0.00 -0.02 0.00 0.00 41.12 39.81 2cwr n ASP 344 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2cwr h LYS 345 N 6.21 0.00 -5.64 -1.24 1.79 -1.95 -3.43 116.57 112.32 2cwr h LYS 345 Ca -0.46 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.48 2cwr h LYS 345 Cb 1.28 0.00 -0.28 0.00 -1.58 0.00 0.00 32.23 31.64 2cwr h LYS 345 CO 0.88 0.15 -0.83 0.08 -1.08 0.00 0.00 179.45 178.65 2cwr s VAL 346 N -3.16 1.35 -0.19 0.50 1.01 -1.26 -1.11 120.40 117.54 2cwr s VAL 346 Ca 0.03 -0.80 0.18 0.00 0.00 0.00 0.00 61.98 61.39 2cwr s VAL 346 Cb 0.07 -1.14 -0.25 0.00 0.00 0.00 0.00 36.38 35.06 2cwr s VAL 346 CO 0.74 0.32 0.08 -0.62 0.00 0.00 0.00 175.10 175.62 2cwr n GLU 347 N 2.49 0.72 -3.66 2.72 1.02 0.32 -4.81 120.64 119.44 2cwr n GLU 347 Ca -0.15 -0.02 -0.14 0.00 -0.02 0.00 0.00 57.16 56.83 2cwr n GLU 347 Cb 0.54 -1.52 -0.08 0.00 -0.02 0.00 0.00 31.44 30.36 2cwr n GLU 347 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2cwr s GLU 348 N -2.52 0.73 -0.18 3.49 2.12 -1.14 -4.98 118.70 116.22 2cwr s GLU 348 Ca -0.10 0.64 -0.02 0.00 0.36 0.00 0.00 54.97 55.84 2cwr s GLU 348 Cb 0.06 0.35 0.06 0.00 0.26 0.00 0.00 34.13 34.86 2cwr s GLU 348 CO 0.83 -0.12 0.03 0.42 -0.54 0.00 0.00 175.26 175.87 2cwr s ILE 349 N -0.05 0.56 -0.06 -3.70 1.01 -1.26 -0.85 121.20 116.85 2cwr s ILE 349 Ca -0.03 -0.52 0.04 0.00 0.00 0.00 0.00 60.65 60.14 2cwr s ILE 349 Cb -0.04 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.42 2cwr s ILE 349 CO 0.02 -0.15 -0.16 -0.89 0.00 0.00 0.00 174.94 173.76 2cwr s THR 350 N 1.85 1.40 -0.09 2.92 2.01 0.11 -4.97 115.64 118.86 2cwr s THR 350 Ca -0.00 -0.67 -0.18 0.00 0.31 0.00 0.00 61.69 61.14 2cwr s THR 350 Cb -0.17 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2cwr s THR 350 CO -0.08 0.41 0.49 -0.22 -0.69 0.00 0.00 174.62 174.54 2cwr s LEU 351 N 0.30 4.31 0.03 4.42 2.96 -1.26 -0.37 118.68 129.08 2cwr s LEU 351 Ca -0.10 0.89 0.05 0.00 -0.22 0.00 0.00 54.13 54.75 2cwr s LEU 351 Cb -0.14 -2.73 -0.02 0.00 0.50 0.00 0.00 46.19 43.80 2cwr s LEU 351 CO 0.04 0.04 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.35 2cwr s GLU 352 N 0.36 0.98 -0.04 1.98 2.02 0.68 -1.06 118.70 123.62 2cwr s GLU 352 Ca 0.27 -0.74 -0.02 0.00 0.02 0.00 0.00 54.97 54.51 2cwr s GLU 352 Cb -0.16 -0.99 0.03 0.00 0.10 0.00 0.00 34.13 33.11 2cwr s GLU 352 CO 0.12 0.25 0.07 0.42 0.02 0.00 0.00 175.26 176.14 2cwr s ILE 353 N -0.78 -0.11 -1.48 -1.63 1.01 -0.32 -1.84 121.20 116.04 2cwr s ILE 353 Ca 0.02 0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.97 2cwr s ILE 353 Cb -0.08 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.24 2cwr s ILE 353 CO 0.01 0.13 0.34 0.59 0.00 0.00 0.00 174.94 176.01 2cwr n ASN 354 N 4.81 -5.59 -0.04 3.58 5.03 -1.26 -1.71 115.26 120.07 2cwr n ASN 354 Ca -0.14 -0.17 -0.01 0.00 0.87 0.00 0.00 54.58 55.14 2cwr n ASN 354 Cb 0.50 -4.51 -0.00 0.00 -1.02 0.00 0.00 39.78 34.75 2cwr n ASN 354 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2cwr n GLY 355 N -1.28 0.42 3.20 7.41 0.00 -1.26 -5.02 105.19 108.66 2cwr n GLY 355 Ca -0.15 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 2cwr n GLY 355 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cwr s GLN 356 N -0.72 2.96 0.24 1.61 -0.21 -0.69 -5.09 119.66 117.75 2cwr s GLN 356 Ca 0.00 -0.85 -0.30 0.00 0.02 0.00 0.00 55.36 54.23 2cwr s GLN 356 Cb 0.00 -2.25 -0.10 0.00 1.00 0.00 0.00 33.01 31.65 2cwr s GLN 356 CO 0.00 0.15 1.51 0.08 -2.12 0.00 0.00 175.29 174.91 2cwr s VAL 357 N 0.40 2.51 -2.34 1.09 1.01 -1.26 -1.18 120.40 120.63 2cwr s VAL 357 Ca -0.18 0.41 0.29 0.00 0.00 0.00 0.00 61.98 62.51 2cwr s VAL 357 Cb -0.18 -3.26 0.66 0.00 0.00 0.00 0.00 36.38 33.60 2cwr s VAL 357 CO 0.08 0.06 1.90 -0.38 0.00 0.00 0.00 175.10 176.75