#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bcm s HIS 259 N 0.00 3.55 0.13 4.31 4.02 -1.26 -4.76 115.29 121.28 1bcm s HIS 259 Ca 0.00 0.91 -0.18 0.00 1.02 0.00 0.00 55.06 56.81 1bcm s HIS 259 Cb 0.00 -2.50 -0.07 0.00 -1.02 0.00 0.00 32.58 28.99 1bcm s HIS 259 CO 0.00 0.26 0.59 -1.17 1.02 0.00 0.00 174.74 175.44 1bcm s LEU 260 N 0.30 4.43 0.20 0.89 2.96 -1.26 -5.09 118.68 121.11 1bcm s LEU 260 Ca 0.25 1.23 0.07 0.00 -0.22 0.00 0.00 54.13 55.46 1bcm s LEU 260 Cb -0.15 -3.16 -0.04 0.00 0.50 0.00 0.00 46.19 43.34 1bcm s LEU 260 CO 0.11 0.17 0.08 -1.81 -1.32 0.00 0.00 176.35 173.58 1bcm s ASP 261 N -1.43 5.11 0.34 3.68 1.01 -1.26 -5.05 116.67 119.07 1bcm s ASP 261 Ca 0.35 -0.33 -0.28 0.00 0.71 0.00 0.00 52.55 52.99 1bcm s ASP 261 Cb -0.17 -1.19 -0.10 0.00 1.01 0.00 0.00 42.92 42.46 1bcm s ASP 261 CO 0.20 0.04 1.33 0.00 0.21 0.00 0.00 175.17 176.95 1bcm s ALA 262 N -1.93 3.50 0.00 5.23 0.00 -1.26 -2.15 121.76 125.15 1bcm s ALA 262 Ca 0.30 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.57 1bcm s ALA 262 Cb -0.09 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1bcm s ALA 262 CO 0.22 -0.72 0.00 -1.33 0.00 0.00 0.00 175.76 173.93 1bcm n MET 263 N 0.71 0.00 -0.07 0.00 2.81 -1.26 -4.79 117.12 114.52 1bcm n MET 263 Ca 0.00 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.77 1bcm n MET 263 Cb 0.41 -1.63 -0.06 0.00 -0.71 0.00 0.00 33.22 31.24 1bcm n MET 263 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 1bcm h GLN 264 N 1.61 0.41 -4.69 0.03 4.15 -1.72 -3.42 115.11 111.47 1bcm h GLN 264 Ca 0.00 -0.19 -0.63 0.00 0.77 0.00 0.00 58.65 58.60 1bcm h GLN 264 Cb 0.00 -0.01 -0.37 0.00 0.21 0.00 0.00 27.48 27.32 1bcm h GLN 264 CO 0.00 0.73 -0.82 -0.46 -1.93 0.00 0.00 178.83 176.35 1bcm s TRP 265 N -4.49 2.60 -0.07 3.99 -0.00 -1.26 -0.77 118.94 118.93 1bcm s TRP 265 Ca -0.14 -1.71 0.03 0.00 -0.00 0.00 0.00 56.10 54.28 1bcm s TRP 265 Cb 0.06 -1.72 -0.02 0.00 -0.00 0.00 0.00 33.47 31.78 1bcm s TRP 265 CO 0.76 -0.77 -0.13 0.96 -0.00 0.00 0.00 176.95 177.77 1bcm s ILE 266 N 1.34 3.16 -0.10 5.86 -4.36 -0.53 -1.77 121.20 124.81 1bcm s ILE 266 Ca -0.01 -0.67 0.00 0.00 -0.26 0.00 0.00 60.65 59.70 1bcm s ILE 266 Cb -0.16 -2.26 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 1bcm s ILE 266 CO -0.08 0.58 -0.10 0.21 0.24 0.00 0.00 174.94 175.79 1bcm s ASN 267 N -0.55 4.33 -0.12 4.36 2.47 0.63 -1.48 114.94 124.59 1bcm s ASN 267 Ca 0.08 -0.18 -0.04 0.00 0.42 0.00 0.00 52.86 53.14 1bcm s ASN 267 Cb -0.12 -1.35 -0.03 0.00 -1.45 0.00 0.00 41.25 38.30 1bcm s ASN 267 CO 0.01 0.26 0.01 -0.83 -3.72 0.00 0.00 177.10 172.84 1bcm s GLY 268 N -0.21 1.86 -0.07 1.21 0.00 -0.27 0.19 107.32 110.04 1bcm s GLY 268 Ca 0.02 -0.78 -0.09 0.00 0.00 0.00 0.00 44.72 43.86 1bcm s GLY 268 CO 0.03 -0.34 0.24 -0.35 0.00 0.00 0.00 173.10 172.68 1bcm s ASP 269 N -0.41 -0.22 0.13 1.64 2.15 -0.46 -4.57 116.67 114.93 1bcm s ASP 269 Ca 0.08 0.36 0.01 0.00 0.43 0.00 0.00 52.55 53.43 1bcm s ASP 269 Cb -0.12 0.45 -0.04 0.00 -0.30 0.00 0.00 42.92 42.91 1bcm s ASP 269 CO 0.02 -0.17 0.28 -0.83 -0.17 0.00 0.00 175.17 174.30 1bcm s GLY 270 N -0.24 1.91 -0.04 2.66 0.00 -1.26 -0.80 107.32 109.54 1bcm s GLY 270 Ca -0.04 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 43.78 1bcm s GLY 270 CO 0.01 -0.90 -0.05 -0.47 0.00 0.00 0.00 173.10 171.69 1bcm s TYR 271 N -1.68 0.73 -0.31 1.90 5.04 0.81 -4.98 117.35 118.87 1bcm s TYR 271 Ca 0.36 -0.20 -0.12 0.00 -2.44 0.00 0.00 57.07 54.67 1bcm s TYR 271 Cb -0.12 -0.64 -0.03 0.00 0.35 0.00 0.00 41.96 41.52 1bcm s TYR 271 CO 0.28 -0.17 0.21 -1.17 -1.34 0.00 0.00 175.55 173.36 1bcm s LEU 272 N 0.82 4.25 0.34 6.97 2.96 -1.26 -1.03 118.68 131.73 1bcm s LEU 272 Ca -0.11 -0.21 -0.26 0.00 -0.22 0.00 0.00 54.13 53.33 1bcm s LEU 272 Cb -0.14 -2.13 -0.10 0.00 0.50 0.00 0.00 46.19 44.33 1bcm s LEU 272 CO 0.00 -0.14 0.99 -1.00 -1.32 0.00 0.00 176.35 174.89 1bcm s HIS 273 N 1.74 3.58 -0.73 5.38 3.76 -0.52 -4.97 115.29 123.53 1bcm s HIS 273 Ca 0.07 1.74 -0.02 0.00 -0.15 0.00 0.00 55.06 56.69 1bcm s HIS 273 Cb -0.17 -3.02 0.30 0.00 1.11 0.00 0.00 32.58 30.80 1bcm s HIS 273 CO 0.11 -0.10 2.18 0.09 -0.85 0.00 0.00 174.74 176.17 1bcm n ASN 274 N 0.50 7.31 -3.71 1.40 3.02 -1.26 -4.60 115.26 117.92 1bcm n ASN 274 Ca 0.02 -3.68 -0.13 0.00 -0.03 0.00 0.00 54.58 50.76 1bcm n ASN 274 Cb 0.49 -1.09 -0.14 0.00 -0.61 0.00 0.00 39.78 38.43 1bcm n ASN 274 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1bcm s VAL 275 N -4.38 -0.15 0.09 2.41 1.01 -1.26 -1.26 120.40 116.86 1bcm s VAL 275 Ca 0.54 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.43 1bcm s VAL 275 Cb 0.43 -0.37 -0.05 0.00 0.00 0.00 0.00 36.38 36.39 1bcm s VAL 275 CO -0.32 0.08 0.96 -0.36 0.00 0.00 0.00 175.10 175.46 1bcm s PHE 276 N 1.60 3.79 0.01 5.22 0.08 -1.00 -4.23 117.98 123.45 1bcm s PHE 276 Ca -0.06 1.78 0.03 0.00 0.12 0.00 0.00 56.93 58.80 1bcm s PHE 276 Cb -0.11 -3.06 -0.01 0.00 -0.57 0.00 0.00 43.02 39.27 1bcm s PHE 276 CO -0.08 0.18 -0.09 0.08 -0.10 0.00 0.00 175.22 175.21 1bcm s VAL 277 N 0.13 0.69 -0.67 -0.44 1.01 0.82 -2.23 120.40 119.71 1bcm s VAL 277 Ca 0.47 -0.55 -0.20 0.00 0.00 0.00 0.00 61.98 61.70 1bcm s VAL 277 Cb -0.23 -0.62 0.10 0.00 0.00 0.00 0.00 36.38 35.64 1bcm s VAL 277 CO 0.29 0.07 0.85 -0.60 0.00 0.00 0.00 175.10 175.71 1bcm s ARG 278 N -0.54 3.17 1.38 2.72 3.52 -0.32 0.03 118.95 128.90 1bcm s ARG 278 Ca 0.01 -1.29 -0.21 0.00 -0.13 0.00 0.00 55.73 54.11 1bcm s ARG 278 Cb -0.05 -4.36 0.35 0.00 -1.56 0.00 0.00 34.95 29.34 1bcm s ARG 278 CO 0.00 -1.65 0.95 -0.46 -0.81 0.00 0.00 175.30 173.33 1bcm s TRP 279 N 3.00 -0.26 0.44 5.12 -0.11 0.36 -2.09 118.94 125.39 1bcm s TRP 279 Ca 0.18 0.68 0.25 0.00 1.22 0.00 0.00 56.10 58.44 1bcm s TRP 279 Cb -0.18 -2.94 1.41 0.00 -1.50 0.00 0.00 33.47 30.25 1bcm s TRP 279 CO 0.04 -4.80 2.07 0.74 -4.62 0.00 0.00 176.95 170.39 1bcm h PHE 280 N -3.29 0.00 -0.63 5.86 0.04 -1.87 -0.92 116.94 116.13 1bcm h PHE 280 Ca -0.47 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.12 1bcm h PHE 280 Cb 1.34 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.38 1bcm h PHE 280 CO -2.62 0.12 0.23 0.27 -0.60 0.00 0.00 178.31 175.71 1bcm n ASN 281 N -3.78 4.40 0.00 2.17 6.94 -1.25 -3.43 115.26 120.32 1bcm n ASN 281 Ca -0.02 -3.02 0.00 0.00 -0.02 0.00 0.00 54.58 51.52 1bcm n ASN 281 Cb 0.22 -0.71 0.00 0.00 -2.36 0.00 0.00 39.78 36.93 1bcm n ASN 281 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1bcm n GLY 282 N -0.07 1.16 3.60 4.83 0.00 -0.35 -4.95 105.19 109.41 1bcm n GLY 282 Ca 0.34 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.82 1bcm n GLY 282 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bcm n ASP 283 N 1.28 1.49 -4.52 1.61 9.92 -1.26 -4.21 116.55 120.85 1bcm n ASP 283 Ca 0.00 1.12 -0.43 0.00 -0.53 0.00 0.00 54.79 54.96 1bcm n ASP 283 Cb 0.00 -1.14 -0.07 0.00 -0.64 0.00 0.00 41.12 39.27 1bcm n ASP 283 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1bcm s VAL 284 N 0.90 4.91 0.39 2.53 1.01 -1.26 -0.48 120.40 128.40 1bcm s VAL 284 Ca 0.88 0.11 0.05 0.00 0.00 0.00 0.00 61.98 63.03 1bcm s VAL 284 Cb -1.03 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 31.21 1bcm s VAL 284 CO 0.52 -0.47 0.20 0.27 0.00 0.00 0.00 175.10 175.61 1bcm s ILE 285 N 2.61 0.32 -0.27 2.22 -5.25 0.10 -4.88 121.20 116.06 1bcm s ILE 285 Ca 0.20 -2.00 -0.09 0.00 -0.99 0.00 0.00 60.65 57.78 1bcm s ILE 285 Cb -0.15 -2.36 -0.02 0.00 2.95 0.00 0.00 42.46 42.88 1bcm s ILE 285 CO 0.17 0.00 0.11 -0.13 -1.79 0.00 0.00 174.94 173.30 1bcm s ARG 286 N -3.57 3.58 0.35 0.37 0.52 -1.26 -0.13 118.95 118.81 1bcm s ARG 286 Ca 0.29 -0.54 -0.27 0.00 -0.52 0.00 0.00 55.73 54.69 1bcm s ARG 286 Cb 0.02 -3.45 -0.09 0.00 0.52 0.00 0.00 34.95 31.94 1bcm s ARG 286 CO 0.20 -0.27 1.14 -1.25 0.02 0.00 0.00 175.30 175.14 1bcm s PRO 287 N 1.63 4.29 -0.06 3.54 0.04 -1.26 -4.83 135.00 138.36 1bcm s PRO 287 Ca 0.06 1.80 0.00 0.00 0.04 0.00 0.00 61.00 62.91 1bcm s PRO 287 Cb -0.16 -2.85 -0.03 0.00 0.04 0.00 0.00 34.50 31.50 1bcm s PRO 287 CO 0.06 -0.10 -0.04 0.15 0.04 0.00 0.00 177.00 177.10 1bcm s LYS 288 N -2.01 2.79 -0.00 4.56 3.01 -0.57 -1.43 119.74 126.08 1bcm s LYS 288 Ca 0.52 -0.54 0.02 0.00 -1.01 0.00 0.00 55.97 54.97 1bcm s LYS 288 Cb -0.30 -2.64 -0.01 0.00 -1.01 0.00 0.00 37.83 33.86 1bcm s LYS 288 CO 0.39 0.66 -0.08 0.99 0.51 0.00 0.00 175.35 177.82 1bcm s THR 289 N -0.89 0.61 -0.18 2.17 2.01 -0.19 -1.32 115.64 117.85 1bcm s THR 289 Ca 0.14 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.72 1bcm s THR 289 Cb -0.11 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1bcm s THR 289 CO 0.03 0.14 0.00 0.86 -0.69 0.00 0.00 174.62 174.97 1bcm s TRP 290 N -0.24 3.07 0.07 4.92 -0.11 -0.83 -0.13 118.94 125.68 1bcm s TRP 290 Ca 0.02 -0.31 0.06 0.00 1.22 0.00 0.00 56.10 57.09 1bcm s TRP 290 Cb -0.03 -2.05 -0.04 0.00 -1.50 0.00 0.00 33.47 29.85 1bcm s TRP 290 CO -0.00 -0.11 -0.11 -0.06 -4.62 0.00 0.00 176.95 172.05 1bcm s PHE 291 N 0.70 2.73 -0.14 5.86 0.08 0.02 -2.25 117.98 124.97 1bcm s PHE 291 Ca -0.00 -0.15 0.01 0.00 0.12 0.00 0.00 56.93 56.91 1bcm s PHE 291 Cb -0.14 -1.48 -0.00 0.00 -0.57 0.00 0.00 43.02 40.83 1bcm s PHE 291 CO 0.02 0.38 -0.17 -1.58 -0.10 0.00 0.00 175.22 173.77 1bcm s TRP 292 N -1.10 2.73 -0.05 0.36 0.52 -0.81 -1.35 118.94 119.24 1bcm s TRP 292 Ca 0.19 -1.02 0.04 0.00 0.02 0.00 0.00 56.10 55.32 1bcm s TRP 292 Cb -0.11 -1.84 0.00 0.00 -1.15 0.00 0.00 33.47 30.37 1bcm s TRP 292 CO 0.10 -0.44 -0.17 -1.14 0.02 0.00 0.00 176.95 175.32 1bcm s GLN 293 N 0.67 1.88 -0.36 4.98 0.74 0.13 -1.18 119.66 126.53 1bcm s GLN 293 Ca -0.09 -0.59 -0.29 0.00 0.05 0.00 0.00 55.36 54.45 1bcm s GLN 293 Cb -0.16 -1.59 -0.00 0.00 1.10 0.00 0.00 33.01 32.37 1bcm s GLN 293 CO 0.02 0.18 1.49 0.34 -0.55 0.00 0.00 175.29 176.77 1bcm s ASP 294 N 0.22 6.30 0.30 6.67 2.15 -0.84 -0.27 116.67 131.20 1bcm s ASP 294 Ca -0.08 1.05 0.01 0.00 0.43 0.00 0.00 52.55 53.96 1bcm s ASP 294 Cb -0.13 -2.54 0.54 0.00 -0.30 0.00 0.00 42.92 40.49 1bcm s ASP 294 CO 0.03 -1.42 1.89 0.58 -0.17 0.00 0.00 175.17 176.08 1bcm h VAL 295 N 6.43 1.02 0.62 1.11 2.07 -1.69 0.22 116.25 126.03 1bcm h VAL 295 Ca -0.29 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 1bcm h VAL 295 Cb 1.12 -0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1bcm h VAL 295 CO 1.06 0.19 -0.30 0.50 0.02 0.00 0.00 177.57 179.04 1bcm h LYS 296 N 1.02 -0.80 0.00 1.57 3.64 -1.86 -3.34 116.57 116.79 1bcm h LYS 296 Ca 0.42 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1bcm h LYS 296 Cb 0.29 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1bcm h LYS 296 CO -0.18 -0.49 -0.82 1.79 -2.27 0.00 0.00 179.45 177.49 1bcm h THR 297 N -1.03 0.00 0.00 1.00 1.35 -1.93 -3.49 112.91 108.81 1bcm h THR 297 Ca -0.09 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1bcm h THR 297 Cb 0.69 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1bcm h THR 297 CO 0.14 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.95 1bcm n ARG 298 N -2.33 -0.03 -2.56 4.72 5.12 0.77 -4.77 116.66 117.57 1bcm n ARG 298 Ca 0.02 0.01 -0.42 0.00 -1.93 0.00 0.00 57.85 55.53 1bcm n ARG 298 Cb 0.48 -2.94 -0.03 0.00 -1.16 0.00 0.00 32.46 28.82 1bcm n ARG 298 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1bcm s LYS 299 N -0.04 4.49 -0.04 5.56 2.20 -1.25 -4.76 119.74 125.91 1bcm s LYS 299 Ca 0.00 1.60 -0.30 0.00 -0.36 0.00 0.00 55.97 56.91 1bcm s LYS 299 Cb 0.00 -3.41 -0.04 0.00 -1.51 0.00 0.00 37.83 32.88 1bcm s LYS 299 CO 0.00 -0.17 1.25 0.42 -0.36 0.00 0.00 175.35 176.49 1bcm s ILE 300 N 1.08 4.10 -0.10 5.43 1.09 -1.26 -1.98 121.20 129.56 1bcm s ILE 300 Ca 0.55 1.45 0.20 0.00 -1.10 0.00 0.00 60.65 61.76 1bcm s ILE 300 Cb -0.25 -3.93 -0.28 0.00 -1.06 0.00 0.00 42.46 36.94 1bcm s ILE 300 CO 0.28 0.00 0.42 0.18 -0.10 0.00 0.00 174.94 175.73 1bcm n LEU 301 N 5.18 0.12 -3.65 2.97 4.77 -0.32 -4.98 117.00 121.09 1bcm n LEU 301 Ca 0.11 0.05 -0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1bcm n LEU 301 Cb 0.46 0.14 -0.01 0.00 -2.33 0.00 0.00 43.42 41.68 1bcm n LEU 301 CO 0.56 0.14 0.97 -0.83 -1.33 0.00 0.00 177.39 176.90 1bcm s GLY 302 N -4.81 -0.36 0.06 -0.72 0.00 -1.23 -4.61 107.32 95.65 1bcm s GLY 302 Ca -0.08 0.63 -0.27 0.00 0.00 0.00 0.00 44.72 45.00 1bcm s GLY 302 CO 0.87 0.13 0.98 0.66 0.00 0.00 0.00 173.10 175.74 1bcm s TRP 303 N -2.65 -0.19 -0.17 1.90 -2.14 -1.25 -1.92 118.94 112.52 1bcm s TRP 303 Ca 0.13 -0.02 -0.09 0.00 2.66 0.00 0.00 56.10 58.78 1bcm s TRP 303 Cb 0.03 0.59 0.06 0.00 -3.10 0.00 0.00 33.47 31.05 1bcm s TRP 303 CO -0.03 -0.64 0.41 1.03 -2.66 0.00 0.00 176.95 175.06 1bcm s ARG 304 N -3.10 0.39 -0.03 3.25 1.81 -0.95 -4.69 118.95 115.63 1bcm s ARG 304 Ca 0.10 0.79 -0.02 0.00 -1.72 0.00 0.00 55.73 54.88 1bcm s ARG 304 Cb -0.01 -0.02 -0.04 0.00 -0.45 0.00 0.00 34.95 34.43 1bcm s ARG 304 CO -0.03 -0.16 0.11 0.00 -0.68 0.00 0.00 175.30 174.54 1bcm s ASP 306 N -1.59 -0.28 0.24 0.00 -1.08 -0.43 -5.01 116.67 108.52 1bcm s ASP 306 Ca 0.22 -0.49 -0.06 0.00 -0.52 0.00 0.00 52.55 51.70 1bcm s ASP 306 Cb -0.12 0.61 0.23 0.00 -1.46 0.00 0.00 42.92 42.18 1bcm s ASP 306 CO 0.12 -1.10 1.86 0.58 0.52 0.00 0.00 175.17 177.15 1bcm h VAL 307 N 2.15 1.26 -1.88 1.11 2.07 -1.90 -1.52 116.25 117.52 1bcm h VAL 307 Ca -0.27 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1bcm h VAL 307 Cb 1.26 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1bcm h VAL 307 CO 0.35 0.29 0.00 -1.54 0.02 0.00 0.00 177.57 176.69 1bcm n SER 308 N -4.33 0.93 -4.36 0.57 3.41 -1.26 -4.53 113.62 104.05 1bcm n SER 308 Ca 0.09 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.32 1bcm n SER 308 Cb 0.10 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.93 1bcm n SER 308 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1bcm s GLU 309 N 1.10 3.02 0.04 4.33 8.01 -1.26 -4.57 118.70 129.35 1bcm s GLU 309 Ca 0.00 -0.92 -0.15 0.00 0.01 0.00 0.00 54.97 53.91 1bcm s GLU 309 Cb 0.00 -3.49 0.03 0.00 -4.31 0.00 0.00 34.13 26.35 1bcm s GLU 309 CO 0.00 -0.52 0.34 0.54 0.01 0.00 0.00 175.26 175.63 1bcm s ASN 310 N 1.52 -0.18 0.59 -0.19 4.22 -1.26 -4.40 114.94 115.24 1bcm s ASN 310 Ca 0.02 -0.09 0.29 0.00 -2.14 0.00 0.00 52.86 50.94 1bcm s ASN 310 Cb -0.18 0.37 1.44 0.00 1.28 0.00 0.00 41.25 44.17 1bcm s ASN 310 CO 0.04 -0.61 1.85 -0.29 -2.04 0.00 0.00 177.10 176.06 1bcm h ILE 311 N 3.24 0.35 -0.34 0.54 2.10 0.69 -2.41 117.51 121.67 1bcm h ILE 311 Ca -0.31 0.00 0.03 0.00 1.08 0.00 0.00 64.86 65.65 1bcm h ILE 311 Cb 1.20 0.57 -0.03 0.00 -1.09 0.00 0.00 36.82 37.46 1bcm h ILE 311 CO 0.44 0.00 0.16 0.44 -1.08 0.00 0.00 178.15 178.12 1bcm h ASP 312 N 0.00 0.23 -0.76 2.19 5.19 -1.85 -0.65 116.42 120.77 1bcm h ASP 312 Ca 0.25 0.02 0.07 0.00 -0.62 0.00 0.00 57.03 56.75 1bcm h ASP 312 Cb 1.35 -0.02 -0.05 0.00 0.18 0.00 0.00 39.33 40.79 1bcm h ASP 312 CO -0.00 0.17 0.50 0.28 -3.12 0.00 0.00 179.24 177.07 1bcm h SER 313 N 0.34 0.70 0.29 6.45 0.02 -1.79 0.94 113.55 120.50 1bcm h SER 313 Ca 0.14 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1bcm h SER 313 Cb 0.07 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.46 1bcm h SER 313 CO -0.11 0.45 -0.14 0.40 -1.14 0.00 0.00 176.83 176.29 1bcm h ILE 314 N 0.79 0.69 -0.91 3.27 2.04 -1.42 0.05 117.51 122.02 1bcm h ILE 314 Ca 0.33 -0.70 0.12 0.00 1.00 0.00 0.00 64.86 65.61 1bcm h ILE 314 Cb 0.27 1.03 -0.08 0.00 -0.74 0.00 0.00 36.82 37.30 1bcm h ILE 314 CO -0.11 0.13 0.54 -0.09 0.00 0.00 0.00 178.15 178.61 1bcm h ARG 315 N -0.80 0.83 0.24 2.37 2.43 -0.70 0.15 114.38 118.89 1bcm h ARG 315 Ca -0.04 -0.05 -0.34 0.00 -0.81 0.00 0.00 59.98 58.74 1bcm h ARG 315 Cb 0.51 -0.19 0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1bcm h ARG 315 CO 0.07 0.55 -1.53 -0.07 -1.51 0.00 0.00 179.97 177.48 1bcm h LEU 316 N 0.85 0.79 -0.90 3.80 3.38 -0.86 -2.76 115.31 119.60 1bcm h LEU 316 Ca 0.45 -0.89 -0.00 0.00 0.09 0.00 0.00 57.88 57.53 1bcm h LEU 316 Cb 0.47 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1bcm h LEU 316 CO -0.27 1.71 0.56 0.77 0.09 0.00 0.00 178.44 181.30 1bcm h SER 317 N 0.14 1.07 -0.95 -0.43 4.64 -0.63 -1.04 113.55 116.36 1bcm h SER 317 Ca -0.27 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1bcm h SER 317 Cb 2.15 -0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 63.93 1bcm h SER 317 CO 0.26 0.81 0.60 0.15 -0.87 0.00 0.00 176.83 177.78 1bcm h PHE 318 N 1.24 1.23 -0.56 4.77 3.57 -1.03 -1.30 116.94 124.85 1bcm h PHE 318 Ca 0.33 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 1bcm h PHE 318 Cb -0.08 -0.41 -0.02 0.00 2.79 0.00 0.00 35.95 38.23 1bcm h PHE 318 CO -0.00 0.79 0.10 1.98 -2.23 0.00 0.00 178.31 178.95 1bcm h MET 319 N 1.30 0.89 -0.50 1.11 4.05 -0.94 -1.95 114.93 118.89 1bcm h MET 319 Ca 0.34 -0.21 -0.06 0.00 -0.28 0.00 0.00 59.70 59.50 1bcm h MET 319 Cb -0.10 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.56 1bcm h MET 319 CO -0.07 0.83 0.08 -0.44 0.23 0.00 0.00 176.91 177.54 1bcm h ASP 320 N 0.85 0.80 0.28 1.39 3.32 -0.21 -1.37 116.42 121.49 1bcm h ASP 320 Ca 0.18 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1bcm h ASP 320 Cb 0.37 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1bcm h ASP 320 CO 0.01 0.86 -0.14 0.58 -1.72 0.00 0.00 179.24 178.83 1bcm h VAL 321 N 0.71 0.72 -0.20 -1.35 2.07 -0.95 -2.16 116.25 115.10 1bcm h VAL 321 Ca 0.15 -0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.58 1bcm h VAL 321 Cb 0.40 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1bcm h VAL 321 CO 0.01 0.00 -0.26 -0.37 0.02 0.00 0.00 177.57 176.97 1bcm h VAL 322 N -0.38 1.26 -0.41 2.57 -1.51 -1.33 -0.36 116.25 116.10 1bcm h VAL 322 Ca -0.04 -1.24 -0.06 0.00 -1.23 0.00 0.00 66.70 64.14 1bcm h VAL 322 Cb 0.29 1.40 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 1bcm h VAL 322 CO 0.06 0.38 0.01 0.74 -1.23 0.00 0.00 177.57 177.54 1bcm h THR 323 N 0.33 1.22 0.08 7.19 2.02 -1.13 0.75 112.91 123.38 1bcm h THR 323 Ca 0.05 -0.88 -0.18 0.00 0.77 0.00 0.00 66.41 66.18 1bcm h THR 323 Cb 0.65 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1bcm h THR 323 CO 0.05 0.31 -0.86 -0.09 0.37 0.00 0.00 175.52 175.29 1bcm h ARG 324 N 0.61 0.18 -0.02 6.66 2.43 -1.03 -3.41 114.38 119.81 1bcm h ARG 324 Ca 0.13 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1bcm h ARG 324 Cb 0.37 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1bcm h ARG 324 CO 0.01 1.15 -0.11 0.66 -1.51 0.00 0.00 179.97 180.17 1bcm n TYR 325 N -4.21 0.00 -0.21 2.20 4.01 -0.17 -5.11 117.16 113.66 1bcm n TYR 325 Ca -0.18 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.58 1bcm n TYR 325 Cb 0.75 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.77 1bcm n TYR 325 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bcm n GLY 326 N 0.92 -1.77 3.35 2.72 0.00 0.26 -4.82 105.19 105.83 1bcm n GLY 326 Ca 0.08 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.26 1bcm n GLY 326 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bcm s ILE 327 N -1.79 4.14 1.01 -0.61 1.01 0.13 -4.72 121.20 120.38 1bcm s ILE 327 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 1bcm s ILE 327 Cb 0.00 -3.23 0.20 0.00 0.01 0.00 0.00 42.46 39.44 1bcm s ILE 327 CO 0.00 -0.06 1.08 -2.16 0.00 0.00 0.00 174.94 173.80 1bcm s PRO 328 N 1.50 0.30 0.07 2.79 0.04 -1.26 -1.15 135.00 137.29 1bcm s PRO 328 Ca 0.02 0.61 -0.36 0.00 0.04 0.00 0.00 61.00 61.30 1bcm s PRO 328 Cb -0.18 -1.71 -0.20 0.00 0.04 0.00 0.00 34.50 32.44 1bcm s PRO 328 CO 0.04 -2.84 1.59 1.49 0.04 0.00 0.00 177.00 177.32 1bcm h GLU 329 N -1.98 -1.14 -3.96 4.56 4.81 -1.93 -3.36 114.58 111.59 1bcm h GLU 329 Ca -0.55 0.08 -0.74 0.00 -0.13 0.00 0.00 59.36 58.02 1bcm h GLU 329 Cb 1.32 0.26 -0.30 0.00 0.63 0.00 0.00 28.75 30.66 1bcm h GLU 329 CO 0.56 -0.76 -0.25 0.34 -0.73 0.00 0.00 179.01 178.17 1bcm s ASP 330 N -4.16 5.87 -0.27 1.04 2.15 -1.26 -5.05 116.67 114.98 1bcm s ASP 330 Ca -0.19 -2.39 -0.12 0.00 0.43 0.00 0.00 52.55 50.28 1bcm s ASP 330 Cb 0.03 -2.03 -0.05 0.00 -0.30 0.00 0.00 42.92 40.57 1bcm s ASP 330 CO 0.61 -0.57 0.23 0.12 -0.17 0.00 0.00 175.17 175.39 1bcm s PHE 331 N 0.64 3.24 -0.05 -5.34 5.36 -1.26 -4.75 117.98 115.84 1bcm s PHE 331 Ca 0.12 0.22 0.06 0.00 -0.96 0.00 0.00 56.93 56.36 1bcm s PHE 331 Cb -0.20 -2.41 -0.02 0.00 -0.34 0.00 0.00 43.02 40.05 1bcm s PHE 331 CO -0.04 -0.14 -0.22 -1.01 -1.46 0.00 0.00 175.22 172.35 1bcm s HIS 332 N 1.71 2.48 -0.07 10.12 3.76 0.05 -0.64 115.29 132.70 1bcm s HIS 332 Ca 0.09 -0.51 0.02 0.00 -0.15 0.00 0.00 55.06 54.51 1bcm s HIS 332 Cb -0.16 -1.59 0.02 0.00 1.11 0.00 0.00 32.58 31.96 1bcm s HIS 332 CO 0.10 -0.08 -0.11 0.42 -0.85 0.00 0.00 174.74 174.22 1bcm s ILE 333 N -0.39 1.08 -0.09 0.60 1.01 -0.17 -1.45 121.20 121.79 1bcm s ILE 333 Ca 0.04 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.29 1bcm s ILE 333 Cb -0.12 -1.01 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 1bcm s ILE 333 CO 0.02 0.35 -0.18 -0.89 0.00 0.00 0.00 174.94 174.24 1bcm s THR 334 N 0.88 2.68 -0.38 2.92 2.01 -0.55 -0.95 115.64 122.25 1bcm s THR 334 Ca -0.11 -0.82 0.01 0.00 0.31 0.00 0.00 61.69 61.09 1bcm s THR 334 Cb -0.15 -2.07 0.15 0.00 0.01 0.00 0.00 72.50 70.44 1bcm s THR 334 CO 0.01 0.55 0.25 -0.63 -0.69 0.00 0.00 174.62 174.12 1bcm s ILE 335 N 0.04 0.39 -0.22 1.82 1.01 -0.50 -1.11 121.20 122.63 1bcm s ILE 335 Ca -0.07 -2.10 -0.28 0.00 0.00 0.00 0.00 60.65 58.20 1bcm s ILE 335 Cb -0.15 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 1bcm s ILE 335 CO 0.05 -1.05 2.00 -0.62 0.00 0.00 0.00 174.94 175.32 1bcm s ASP 336 N 0.67 5.80 -0.33 3.58 -1.08 -1.26 -4.35 116.67 119.70 1bcm s ASP 336 Ca 0.22 1.78 0.12 0.00 -0.52 0.00 0.00 52.55 54.15 1bcm s ASP 336 Cb -0.16 -2.52 0.46 0.00 -1.46 0.00 0.00 42.92 39.24 1bcm s ASP 336 CO -0.05 -1.71 1.10 -3.20 0.52 0.00 0.00 175.17 171.83 1bcm n ASN 337 N 10.45 3.44 0.02 -0.34 5.15 -1.00 -4.22 115.26 128.76 1bcm n ASN 337 Ca 0.25 -3.17 -0.12 0.00 -0.60 0.00 0.00 54.58 50.95 1bcm n ASN 337 Cb 0.45 -0.44 -0.14 0.00 -0.53 0.00 0.00 39.78 39.12 1bcm n ASN 337 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 1bcm h THR 338 N 3.17 1.08 -0.49 -0.44 1.35 -1.89 -3.31 112.91 112.38 1bcm h THR 338 Ca 0.15 -2.83 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 1bcm h THR 338 Cb 1.22 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 70.25 1bcm h THR 338 CO 0.61 0.71 0.00 0.54 -0.25 0.00 0.00 175.52 177.13 1bcm n ARG 339 N -3.26 3.80 -0.57 4.72 1.74 -1.26 -4.89 116.66 116.94 1bcm n ARG 339 Ca -0.15 -2.45 0.00 0.00 -0.77 0.00 0.00 57.85 54.48 1bcm n ARG 339 Cb 1.03 -1.99 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 1bcm n ARG 339 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bcm n GLY 340 N 0.68 1.22 0.13 -0.13 0.00 -1.25 -4.93 105.19 100.91 1bcm n GLY 340 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.20 1bcm n GLY 340 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bcm h ALA 341 N 0.00 -0.35 0.00 4.61 0.00 -1.84 -1.63 119.26 120.05 1bcm h ALA 341 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1bcm h ALA 341 Cb 0.00 0.91 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1bcm h ALA 341 CO 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.81 1bcm n ALA 342 N -2.89 2.00 -0.13 0.00 0.00 -1.26 -4.23 120.51 113.99 1bcm n ALA 342 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.37 1bcm n ALA 342 Cb 0.09 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.54 1bcm n ALA 342 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1bcm h ASN 343 N 0.03 -1.00 -0.28 0.00 2.35 -1.67 -1.98 115.58 113.03 1bcm h ASN 343 Ca 0.00 0.19 -0.17 0.00 -0.55 0.00 0.00 56.30 55.77 1bcm h ASN 343 Cb 0.01 0.49 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 1bcm h ASN 343 CO 0.00 -0.30 -0.48 0.11 -1.65 0.00 0.00 177.43 175.11 1bcm h LYS 344 N -0.21 0.85 -0.85 0.81 1.57 -1.82 -3.23 116.57 113.69 1bcm h LYS 344 Ca 0.19 -0.50 0.05 0.00 -1.87 0.00 0.00 60.65 58.52 1bcm h LYS 344 Cb 0.52 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 1bcm h LYS 344 CO -0.56 1.14 0.54 -1.49 -0.57 0.00 0.00 179.45 178.51 1bcm h TRP 345 N 0.67 1.00 0.00 -1.35 4.06 -1.68 -2.44 115.95 116.21 1bcm h TRP 345 Ca 0.03 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.01 1bcm h TRP 345 Cb 1.07 -0.33 0.00 0.00 -1.00 0.00 0.00 29.16 28.90 1bcm h TRP 345 CO 0.06 0.55 0.00 1.28 -3.56 0.00 0.00 178.44 176.77 1bcm n LEU 346 N -4.59 2.51 -4.26 -4.49 4.77 -0.77 0.21 117.00 110.38 1bcm n LEU 346 Ca 0.11 -1.25 -0.25 0.00 -0.03 0.00 0.00 56.01 54.59 1bcm n LEU 346 Cb 0.13 -0.47 -0.14 0.00 -2.33 0.00 0.00 43.42 40.61 1bcm n LEU 346 CO 0.32 0.43 -0.52 -0.89 -1.33 0.00 0.00 177.39 175.40 1bcm s THR 347 N -0.11 1.69 0.46 -5.08 2.01 -0.92 -4.89 115.64 108.79 1bcm s THR 347 Ca 0.00 -1.29 -0.01 0.00 0.31 0.00 0.00 61.69 60.70 1bcm s THR 347 Cb 0.00 -1.48 -0.01 0.00 0.01 0.00 0.00 72.50 71.02 1bcm s THR 347 CO 0.00 0.14 0.70 -0.83 -0.69 0.00 0.00 174.62 173.94 1bcm s GLY 348 N -1.37 1.56 0.69 4.40 0.00 -1.26 -1.68 107.32 109.67 1bcm s GLY 348 Ca 0.07 -0.98 0.02 0.00 0.00 0.00 0.00 44.72 43.83 1bcm s GLY 348 CO 0.02 -0.80 0.95 -0.32 0.00 0.00 0.00 173.10 172.96 1bcm s GLY 349 N -4.21 1.75 0.52 0.20 0.00 -1.26 -4.96 107.32 99.35 1bcm s GLY 349 Ca 0.49 -1.87 -0.21 0.00 0.00 0.00 0.00 44.72 43.13 1bcm s GLY 349 CO 0.39 -1.31 1.17 0.00 0.00 0.00 0.00 173.10 173.35 1bcm s ALA 350 N -3.04 2.79 0.43 3.20 0.00 -1.26 -4.87 121.76 119.02 1bcm s ALA 350 Ca 0.66 0.93 0.31 0.00 0.00 0.00 0.00 51.96 53.86 1bcm s ALA 350 Cb -0.05 -3.40 1.69 0.00 0.00 0.00 0.00 23.12 21.36 1bcm s ALA 350 CO 0.43 -0.83 1.94 -1.00 0.00 0.00 0.00 175.76 176.30 1bcm h PRO 351 N 1.51 0.00 -0.73 0.00 0.13 -1.92 0.17 132.00 131.16 1bcm h PRO 351 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1bcm h PRO 351 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1bcm h PRO 351 CO 0.58 0.00 0.03 0.27 -0.23 0.00 0.00 178.00 178.65 1bcm n ASN 352 N -2.73 4.21 0.29 1.44 6.94 -1.26 -2.58 115.26 121.58 1bcm n ASN 352 Ca -0.02 -2.67 0.16 0.00 -0.02 0.00 0.00 54.58 52.03 1bcm n ASN 352 Cb 0.22 -0.64 0.87 0.00 -2.36 0.00 0.00 39.78 37.88 1bcm n ASN 352 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 1bcm h ARG 353 N 2.62 0.00 -0.03 -3.83 0.11 -0.87 -1.57 114.38 110.80 1bcm h ARG 353 Ca 0.03 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.09 1bcm h ARG 353 Cb 1.57 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.64 1bcm h ARG 353 CO 0.37 0.05 -0.37 0.66 0.10 0.00 0.00 179.97 180.78 1bcm n TYR 354 N -3.55 0.10 0.00 4.08 4.01 -1.26 -2.15 117.16 118.39 1bcm n TYR 354 Ca -0.02 -1.41 0.00 0.00 -0.16 0.00 0.00 57.90 56.31 1bcm n TYR 354 Cb 0.17 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 1bcm n TYR 354 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1bcm n ARG 355 N -1.17 0.00 -1.21 -0.72 3.00 -0.59 -2.52 116.66 113.44 1bcm n ARG 355 Ca 0.20 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.74 1bcm n ARG 355 Cb 0.71 0.00 0.12 0.00 0.00 0.00 0.00 32.46 33.29 1bcm n ARG 355 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 1bcm s PHE 356 N 0.00 2.41 0.11 -0.14 -0.71 -1.24 -4.50 117.98 113.91 1bcm s PHE 356 Ca 0.00 1.40 -0.24 0.00 -1.04 0.00 0.00 56.93 57.05 1bcm s PHE 356 Cb 0.00 -3.11 -0.07 0.00 -1.21 0.00 0.00 43.02 38.63 1bcm s PHE 356 CO 0.00 -2.15 0.74 0.15 -1.34 0.00 0.00 175.22 172.62 1bcm s LYS 357 N -4.91 4.49 0.14 1.99 -0.14 -1.25 -4.21 119.74 115.85 1bcm s LYS 357 Ca 0.62 1.06 0.09 0.00 -1.36 0.00 0.00 55.97 56.38 1bcm s LYS 357 Cb -0.18 -3.29 -0.04 0.00 -1.68 0.00 0.00 37.83 32.64 1bcm s LYS 357 CO 0.57 0.48 -0.14 0.08 -0.76 0.00 0.00 175.35 175.58 1bcm s VAL 358 N -0.76 3.05 0.39 3.17 1.01 -1.06 -0.56 120.40 125.64 1bcm s VAL 358 Ca 0.36 -1.55 -0.24 0.00 0.00 0.00 0.00 61.98 60.55 1bcm s VAL 358 Cb -0.22 -2.45 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 1bcm s VAL 358 CO 0.24 0.01 1.01 -0.54 0.00 0.00 0.00 175.10 175.82 1bcm s LYS 359 N -2.44 4.26 -1.05 2.72 1.02 0.66 -4.78 119.74 120.13 1bcm s LYS 359 Ca 0.21 1.40 -0.21 0.00 0.02 0.00 0.00 55.97 57.39 1bcm s LYS 359 Cb -0.10 -2.53 0.07 0.00 -0.52 0.00 0.00 37.83 34.75 1bcm s LYS 359 CO 0.13 -0.03 1.43 -2.00 -0.92 0.00 0.00 175.35 173.96 1bcm s GLU 360 N -2.52 3.66 0.00 1.68 -6.30 -1.26 -4.80 118.70 109.16 1bcm s GLU 360 Ca 0.57 -1.39 0.00 0.00 -2.50 0.00 0.00 54.97 51.65 1bcm s GLU 360 Cb -0.19 -5.30 0.00 0.00 0.00 0.00 0.00 34.13 28.64 1bcm s GLU 360 CO 0.24 -2.13 0.00 -3.47 0.02 0.00 0.00 175.26 169.92 1bcm n ASP 361 N 8.33 0.00 -3.15 -1.70 -0.08 -1.26 -5.11 116.55 113.58 1bcm n ASP 361 Ca 0.34 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.65 1bcm n ASP 361 Cb 0.50 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.96 1bcm n ASP 361 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1bcm s ASP 362 N -1.00 -1.40 0.55 1.67 2.15 -1.26 -5.03 116.67 112.34 1bcm s ASP 362 Ca 0.00 -0.01 0.24 0.00 0.43 0.00 0.00 52.55 53.20 1bcm s ASP 362 Cb 0.00 1.86 1.52 0.00 -0.30 0.00 0.00 42.92 46.00 1bcm s ASP 362 CO 0.00 -0.24 2.17 1.55 -0.17 0.00 0.00 175.17 178.49 1bcm h PRO 363 N 7.62 0.00 -0.81 4.34 0.13 -1.99 -2.32 132.00 138.96 1bcm h PRO 363 Ca -0.01 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.19 1bcm h PRO 363 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 1bcm h PRO 363 CO 0.10 0.03 0.48 0.87 -0.23 0.00 0.00 178.00 179.26 1bcm h LYS 364 N 0.00 0.83 0.00 0.86 1.57 -1.99 0.75 116.57 118.60 1bcm h LYS 364 Ca -0.00 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1bcm h LYS 364 Cb 0.07 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1bcm h LYS 364 CO 0.00 0.55 -0.04 0.78 -0.57 0.00 0.00 179.45 180.18 1bcm h GLY 365 N 0.86 0.00 0.61 3.86 0.00 -1.86 -2.92 103.07 103.63 1bcm h GLY 365 Ca 0.37 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.62 1bcm h GLY 365 CO -0.20 0.00 -0.29 1.41 0.00 0.00 0.00 176.54 177.46 1bcm h LEU 366 N 0.00 0.33 -1.29 3.11 3.38 -0.89 -3.04 115.31 116.91 1bcm h LEU 366 Ca -0.00 -0.68 0.13 0.00 0.09 0.00 0.00 57.88 57.42 1bcm h LEU 366 Cb 0.55 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.13 1bcm h LEU 366 CO 0.01 0.96 0.56 -0.26 0.09 0.00 0.00 178.44 179.80 1bcm h PHE 367 N -0.28 0.82 -0.17 1.13 0.04 -1.13 -2.51 116.94 114.85 1bcm h PHE 367 Ca -0.02 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.62 1bcm h PHE 367 Cb 0.97 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.86 1bcm h PHE 367 CO 0.14 0.33 -0.45 -0.07 -0.60 0.00 0.00 178.31 177.66 1bcm h LEU 368 N 0.72 0.70 -2.07 1.54 3.38 -1.58 -2.31 115.31 115.69 1bcm h LEU 368 Ca 0.43 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1bcm h LEU 368 Cb 0.64 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1bcm h LEU 368 CO -0.19 1.15 0.00 -0.07 0.09 0.00 0.00 178.44 179.42 1bcm h LEU 369 N 0.27 0.00 -0.52 1.67 3.38 -1.33 -1.21 115.31 117.57 1bcm h LEU 369 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1bcm h LEU 369 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1bcm h LEU 369 CO 0.10 0.00 -0.24 0.23 0.09 0.00 0.00 178.44 178.61 1bcm n MET 370 N -2.89 0.89 0.00 1.13 2.81 -1.10 -4.93 117.12 113.02 1bcm n MET 370 Ca -0.01 -0.52 0.00 0.00 -1.81 0.00 0.00 57.70 55.36 1bcm n MET 370 Cb 0.16 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 1bcm n MET 370 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bcm n GLY 371 N 1.33 1.12 3.85 3.03 0.00 -0.46 -5.09 105.19 108.98 1bcm n GLY 371 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1bcm n GLY 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bcm s ALA 372 N -2.00 3.43 -0.31 4.61 0.00 -0.87 -4.27 121.76 122.34 1bcm s ALA 372 Ca 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 51.96 51.93 1bcm s ALA 372 Cb 0.00 -2.66 0.07 0.00 0.00 0.00 0.00 23.12 20.53 1bcm s ALA 372 CO 0.00 0.39 0.00 0.15 0.00 0.00 0.00 175.76 176.30 1bcm s LYS 373 N -2.64 2.13 0.37 0.00 1.02 0.19 -4.44 119.74 116.37 1bcm s LYS 373 Ca 0.48 -1.48 -0.19 0.00 0.02 0.00 0.00 55.97 54.80 1bcm s LYS 373 Cb -0.12 -3.15 -0.10 0.00 -0.52 0.00 0.00 37.83 33.94 1bcm s LYS 373 CO 0.19 -0.73 0.85 -1.64 -0.92 0.00 0.00 175.35 173.11 1bcm s MET 374 N 1.12 4.17 -0.02 1.68 -1.94 -1.26 -0.99 119.30 122.06 1bcm s MET 374 Ca -0.01 0.94 0.00 0.00 -1.71 0.00 0.00 55.69 54.91 1bcm s MET 374 Cb -0.20 -2.37 0.02 0.00 2.01 0.00 0.00 34.83 34.29 1bcm s MET 374 CO -0.04 0.09 0.00 -1.01 -0.01 0.00 0.00 175.02 174.05 1bcm s HIS 375 N -2.02 0.22 -0.35 -0.03 3.76 -0.12 -4.92 115.29 111.82 1bcm s HIS 375 Ca 0.57 0.02 0.08 0.00 -0.15 0.00 0.00 55.06 55.58 1bcm s HIS 375 Cb -0.11 -0.30 0.73 0.00 1.11 0.00 0.00 32.58 34.01 1bcm s HIS 375 CO 0.16 -0.09 1.82 0.91 -0.85 0.00 0.00 174.74 176.69 1bcm n TRP 376 N 3.87 2.57 -4.41 1.40 7.02 -1.26 -1.40 117.44 125.22 1bcm n TRP 376 Ca -0.24 -1.30 -0.22 0.00 -1.02 0.00 0.00 57.50 54.72 1bcm n TRP 376 Cb 0.52 -0.74 -0.08 0.00 -2.42 0.00 0.00 31.31 28.60 1bcm n TRP 376 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1bcm s THR 377 N -3.00 0.36 -2.83 -0.99 -4.23 -1.26 -2.37 115.64 101.31 1bcm s THR 377 Ca 0.55 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.30 1bcm s THR 377 Cb 0.44 -2.42 0.29 0.00 1.34 0.00 0.00 72.50 72.16 1bcm s THR 377 CO 0.13 0.00 1.38 -1.54 -0.54 0.00 0.00 174.62 174.05 1bcm n SER 378 N -1.32 2.70 -4.43 3.99 3.41 -1.26 -4.23 113.62 112.48 1bcm n SER 378 Ca -0.01 -1.89 -0.31 0.00 -0.26 0.00 0.00 58.87 56.40 1bcm n SER 378 Cb 0.64 -0.03 -0.13 0.00 -0.26 0.00 0.00 64.21 64.43 1bcm n SER 378 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bcm s VAL 379 N -1.95 2.70 -0.71 -3.33 1.01 -1.26 0.38 120.40 117.24 1bcm s VAL 379 Ca 0.31 -1.05 -0.18 0.00 0.00 0.00 0.00 61.98 61.07 1bcm s VAL 379 Cb 0.20 -2.08 0.13 0.00 0.00 0.00 0.00 36.38 34.64 1bcm s VAL 379 CO 0.31 0.46 0.80 -0.69 0.00 0.00 0.00 175.10 175.98 1bcm s VAL 380 N -0.81 4.97 -0.19 2.92 1.01 -1.25 -4.99 120.40 122.06 1bcm s VAL 380 Ca 0.13 -1.43 -0.42 0.00 0.00 0.00 0.00 61.98 60.26 1bcm s VAL 380 Cb -0.10 -4.55 -0.18 0.00 0.00 0.00 0.00 36.38 31.55 1bcm s VAL 380 CO 0.03 -1.18 1.43 0.00 0.00 0.00 0.00 175.10 175.37 1bcm n ALA 381 N 5.87 -1.70 -0.25 5.51 0.00 -1.26 -2.13 120.51 126.55 1bcm n ALA 381 Ca 0.02 0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1bcm n ALA 381 Cb 0.45 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1bcm n ALA 381 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bcm n GLY 382 N 3.03 0.64 3.07 0.00 0.00 -1.26 -5.06 105.19 105.61 1bcm n GLY 382 Ca 0.24 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.10 1bcm n GLY 382 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bcm s LYS 383 N -0.73 0.64 -0.48 1.61 1.02 -0.90 -5.04 119.74 115.85 1bcm s LYS 383 Ca 0.00 -0.64 -0.06 0.00 0.02 0.00 0.00 55.97 55.30 1bcm s LYS 383 Cb 0.00 -0.54 -0.09 0.00 -0.52 0.00 0.00 37.83 36.67 1bcm s LYS 383 CO 0.00 0.13 3.13 0.41 -0.92 0.00 0.00 175.35 178.10 1bcm n GLY 384 N 1.93 3.83 0.09 -3.33 0.00 -1.26 -4.36 105.19 102.09 1bcm n GLY 384 Ca -0.19 -1.56 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 1bcm n GLY 384 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1bcm n TRP 385 N 1.98 0.74 0.00 1.61 8.01 -1.26 -4.93 117.44 123.59 1bcm n TRP 385 Ca 0.51 0.26 0.00 0.00 -1.31 0.00 0.00 57.50 56.96 1bcm n TRP 385 Cb 0.65 -1.13 0.00 0.00 -2.01 0.00 0.00 31.31 28.81 1bcm n TRP 385 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bcm n GLY 386 N 1.64 -1.17 3.97 6.99 0.00 -1.26 -4.99 105.19 110.37 1bcm n GLY 386 Ca -0.22 -1.94 -0.21 0.00 0.00 0.00 0.00 46.02 43.65 1bcm n GLY 386 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1bcm s GLN 387 N 0.00 3.44 -0.05 1.61 -2.07 -1.26 -3.96 119.66 117.37 1bcm s GLN 387 Ca 0.00 -0.71 -0.26 0.00 -1.82 0.00 0.00 55.36 52.57 1bcm s GLN 387 Cb 0.00 -2.86 -0.21 0.00 -1.09 0.00 0.00 33.01 28.85 1bcm s GLN 387 CO 0.00 0.39 1.11 0.00 -1.32 0.00 0.00 175.29 175.47 1bcm h ALA 388 N 1.11 -0.03 -2.58 2.60 0.00 -0.46 -3.45 119.26 116.44 1bcm h ALA 388 Ca -0.52 -0.29 -0.52 0.00 0.00 0.00 0.00 54.91 53.58 1bcm h ALA 388 Cb 1.23 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1bcm h ALA 388 CO 0.61 -0.21 0.53 0.15 0.00 0.00 0.00 179.25 180.32 1bcm s LYS 389 N -3.73 4.51 1.00 0.00 -0.14 -1.26 -4.91 119.74 115.21 1bcm s LYS 389 Ca -0.16 1.77 -0.15 0.00 -1.36 0.00 0.00 55.97 56.06 1bcm s LYS 389 Cb 0.01 -3.30 0.19 0.00 -1.68 0.00 0.00 37.83 33.05 1bcm s LYS 389 CO 0.65 -0.10 1.19 -1.25 -0.76 0.00 0.00 175.35 175.08 1bcm s PRO 390 N 0.25 0.39 -0.05 -1.68 0.04 -1.26 -5.05 135.00 127.63 1bcm s PRO 390 Ca 0.54 -0.04 -0.01 0.00 0.04 0.00 0.00 61.00 61.53 1bcm s PRO 390 Cb -0.30 -1.78 -0.00 0.00 0.04 0.00 0.00 34.50 32.45 1bcm s PRO 390 CO 0.33 -2.64 -0.03 -0.39 0.04 0.00 0.00 177.00 174.31 1bcm h VAL 391 N -1.81 0.00 -2.35 -0.36 -1.51 -1.98 -3.43 116.25 104.81 1bcm h VAL 391 Ca -0.47 -0.48 -0.56 0.00 -1.23 0.00 0.00 66.70 63.97 1bcm h VAL 391 Cb 1.29 0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 30.43 1bcm h VAL 391 CO 0.47 0.00 1.36 -0.70 -1.23 0.00 0.00 177.57 177.47 1bcm s GLU 392 N -1.37 3.07 0.65 5.19 2.56 -1.26 -4.83 118.70 122.71 1bcm s GLU 392 Ca -0.02 1.40 0.31 0.00 0.00 0.00 0.00 54.97 56.66 1bcm s GLU 392 Cb 0.00 -4.29 1.71 0.00 2.00 0.00 0.00 34.13 33.55 1bcm s GLU 392 CO 0.03 -2.17 2.00 0.07 -0.56 0.00 0.00 175.26 174.63 1bcm h ARG 393 N 14.20 0.00 -0.01 4.30 0.11 -1.99 -1.37 114.38 129.62 1bcm h ARG 393 Ca -0.33 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.73 1bcm h ARG 393 Cb 1.19 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.27 1bcm h ARG 393 CO 1.06 0.00 -0.08 0.00 0.10 0.00 0.00 179.97 181.05 1bcm h ALA 394 N 1.49 1.85 -0.00 0.08 0.00 -1.91 -1.41 119.26 119.36 1bcm h ALA 394 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1bcm h ALA 394 Cb 0.63 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1bcm h ALA 394 CO -0.00 0.11 -0.02 1.19 0.00 0.00 0.00 179.25 180.53 1bcm n PHE 395 N -4.44 0.00 -2.53 0.00 3.72 -0.52 -3.82 117.46 109.88 1bcm n PHE 395 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1bcm n PHE 395 Cb 0.16 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.59 1bcm n PHE 395 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bcm n GLY 396 N 1.15 2.23 0.30 1.37 0.00 -0.53 -4.95 105.19 104.75 1bcm n GLY 396 Ca 0.19 -2.08 0.01 0.00 0.00 0.00 0.00 46.02 44.14 1bcm n GLY 396 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1bcm h VAL 397 N 0.03 1.17 -0.00 1.61 2.07 -1.89 -2.25 116.25 116.99 1bcm h VAL 397 Ca 0.00 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1bcm h VAL 397 Cb 0.00 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1bcm h VAL 397 CO 0.00 0.21 0.04 1.23 0.02 0.00 0.00 177.57 179.07 1bcm h GLY 398 N 0.78 0.00 1.41 2.17 0.00 -1.90 -0.64 103.07 104.90 1bcm h GLY 398 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1bcm h GLY 398 CO -0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.13 1bcm n GLY 399 N -1.13 -1.08 0.01 4.60 0.00 -0.84 -3.19 105.19 103.57 1bcm n GLY 399 Ca -0.03 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1bcm n GLY 399 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bcm n LEU 400 N -1.21 0.09 -0.12 0.99 4.77 -0.25 -3.51 117.00 117.76 1bcm n LEU 400 Ca 0.15 0.51 -0.06 0.00 -0.03 0.00 0.00 56.01 56.58 1bcm n LEU 400 Cb 0.18 -0.48 0.12 0.00 -2.33 0.00 0.00 43.42 40.91 1bcm n LEU 400 CO 0.19 -0.05 0.83 -0.08 -1.33 0.00 0.00 177.39 176.95 1bcm h GLU 401 N 0.00 0.84 -0.54 3.23 4.81 -1.76 0.13 114.58 121.29 1bcm h GLU 401 Ca 0.00 -0.25 -0.07 0.00 -0.13 0.00 0.00 59.36 58.90 1bcm h GLU 401 Cb 0.50 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1bcm h GLU 401 CO 0.00 0.87 0.05 1.49 -0.73 0.00 0.00 179.01 180.69 1bcm h GLU 402 N 0.77 0.91 0.00 1.92 4.81 -1.83 0.41 114.58 121.58 1bcm h GLU 402 Ca 0.14 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1bcm h GLU 402 Cb 0.53 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1bcm h GLU 402 CO 0.03 0.91 -0.57 0.66 -0.73 0.00 0.00 179.01 179.31 1bcm n TYR 403 N -4.33 0.50 0.00 0.92 4.01 -1.10 -4.19 117.16 112.96 1bcm n TYR 403 Ca 0.02 0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 1bcm n TYR 403 Cb 0.29 -0.62 0.00 0.00 -0.31 0.00 0.00 39.34 38.70 1bcm n TYR 403 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1bcm n VAL 404 N -2.03 0.00 -0.25 -0.72 0.31 0.42 -4.16 118.33 111.90 1bcm n VAL 404 Ca 0.04 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.41 1bcm n VAL 404 Cb 0.42 -0.80 0.27 0.00 -0.91 0.00 0.00 33.84 32.82 1bcm n VAL 404 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1bcm h ASP 405 N 0.00 0.83 -0.33 4.52 5.19 -1.57 -0.58 116.42 124.48 1bcm h ASP 405 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1bcm h ASP 405 Cb 0.00 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 39.33 1bcm h ASP 405 CO 0.00 0.55 0.00 0.29 -3.12 0.00 0.00 179.24 176.96 1bcm n LYS 406 N -4.47 1.79 -1.94 3.56 5.02 0.14 -4.81 118.16 117.46 1bcm n LYS 406 Ca 0.12 -1.20 -0.41 0.00 -2.02 0.00 0.00 58.31 54.79 1bcm n LYS 406 Cb 0.17 -1.27 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 1bcm n LYS 406 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1bcm s HIS 407 N -1.56 2.86 0.22 2.13 2.46 -0.23 -4.90 115.29 116.28 1bcm s HIS 407 Ca 0.22 1.09 -0.08 0.00 0.47 0.00 0.00 55.06 56.77 1bcm s HIS 407 Cb 0.12 -3.89 0.36 0.00 -0.13 0.00 0.00 32.58 29.03 1bcm s HIS 407 CO 0.15 -2.76 1.70 -1.35 -2.47 0.00 0.00 174.74 170.00 1bcm h PRO 408 N 4.15 0.25 0.00 2.88 0.11 -1.91 -0.78 132.00 136.70 1bcm h PRO 408 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1bcm h PRO 408 Cb 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1bcm h PRO 408 CO 0.72 0.17 0.19 0.00 -0.21 0.00 0.00 178.00 178.86 1bcm n ALA 409 N -2.64 0.71 -0.72 -0.75 0.00 -1.26 -1.02 120.51 114.83 1bcm n ALA 409 Ca 0.11 0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.67 1bcm n ALA 409 Cb 0.38 -0.81 0.07 0.00 0.00 0.00 0.00 19.45 19.08 1bcm n ALA 409 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bcm n LEU 410 N -1.74 1.98 -0.17 0.00 4.77 -0.30 -4.85 117.00 116.69 1bcm n LEU 410 Ca -0.01 -2.43 0.15 0.00 -0.03 0.00 0.00 56.01 53.69 1bcm n LEU 410 Cb 0.20 -0.23 0.49 0.00 -2.33 0.00 0.00 43.42 41.56 1bcm n LEU 410 CO 0.03 0.57 1.21 0.00 -1.33 0.00 0.00 177.39 177.88 1bcm h ALA 411 N 0.00 2.08 -0.20 -1.18 0.00 -1.06 -2.52 119.26 116.39 1bcm h ALA 411 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1bcm h ALA 411 Cb 0.83 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1bcm h ALA 411 CO 0.00 -0.28 -0.51 0.78 0.00 0.00 0.00 179.25 179.23 1bcm h GLY 412 N 0.44 0.60 0.84 0.00 0.00 -1.88 -3.22 103.07 99.85 1bcm h GLY 412 Ca 0.37 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1bcm h GLY 412 CO -0.12 0.60 -0.50 0.00 0.00 0.00 0.00 176.54 176.52 1bcm n ALA 413 N -2.51 3.56 -1.66 3.60 0.00 -1.04 -4.90 120.51 117.55 1bcm n ALA 413 Ca -0.03 -0.37 -0.44 0.00 0.00 0.00 0.00 53.44 52.60 1bcm n ALA 413 Cb 0.58 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.89 1bcm n ALA 413 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1bcm n TYR 414 N -1.39 2.42 0.06 0.00 9.36 -0.98 -2.36 117.16 124.27 1bcm n TYR 414 Ca 0.06 -0.24 0.07 0.00 3.32 0.00 0.00 57.90 61.11 1bcm n TYR 414 Cb 0.34 -2.75 -0.05 0.00 -0.63 0.00 0.00 39.34 36.25 1bcm n TYR 414 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1bcm n THR 415 N 5.57 0.81 -0.52 2.97 -2.24 -0.39 -4.98 114.28 115.49 1bcm n THR 415 Ca 0.22 -0.61 0.07 0.00 -2.27 0.00 0.00 64.05 61.46 1bcm n THR 415 Cb 0.37 -0.47 -0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1bcm n THR 415 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bcm n GLY 416 N 1.28 -1.59 3.62 3.38 0.00 -1.24 -4.59 105.19 106.05 1bcm n GLY 416 Ca -0.05 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 44.15 1bcm n GLY 416 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1bcm s PRO 417 N -1.58 3.70 -0.31 1.61 0.02 -1.26 -4.86 135.00 132.32 1bcm s PRO 417 Ca 0.00 1.41 -0.08 0.00 0.02 0.00 0.00 61.00 62.35 1bcm s PRO 417 Cb 0.00 -4.03 0.19 0.00 0.02 0.00 0.00 34.50 30.68 1bcm s PRO 417 CO 0.00 -1.41 0.98 -0.80 -0.33 0.00 0.00 177.00 175.44 1bcm s ASN 418 N 4.22 -0.58 0.28 2.53 -0.87 -1.26 -5.04 114.94 114.22 1bcm s ASN 418 Ca 0.68 -0.01 0.02 0.00 -1.57 0.00 0.00 52.86 51.97 1bcm s ASN 418 Cb -0.21 1.21 0.59 0.00 -0.02 0.00 0.00 41.25 42.83 1bcm s ASN 418 CO 0.29 -0.10 1.79 1.55 -2.57 0.00 0.00 177.10 178.07 1bcm h PRO 419 N 6.97 0.76 -5.91 -0.60 0.13 -1.98 -3.34 132.00 128.03 1bcm h PRO 419 Ca -0.07 -0.05 -0.60 0.00 -0.87 0.00 0.00 66.00 64.42 1bcm h PRO 419 Cb 1.19 -0.17 -0.12 0.00 0.13 0.00 0.00 31.00 32.03 1bcm h PRO 419 CO -0.06 0.50 0.67 -0.65 -0.23 0.00 0.00 178.00 178.24 1bcm s GLN 420 N -5.94 3.28 -0.31 0.86 1.11 -1.26 -4.87 119.66 112.53 1bcm s GLN 420 Ca -0.12 -0.34 -0.08 0.00 0.01 0.00 0.00 55.36 54.83 1bcm s GLN 420 Cb 0.23 -4.11 0.19 0.00 -1.01 0.00 0.00 33.01 28.31 1bcm s GLN 420 CO 0.79 -1.68 0.97 0.00 0.01 0.00 0.00 175.29 175.39 1bcm s ALA 421 N 4.34 -3.89 0.58 6.09 0.00 -1.25 -5.17 121.76 122.44 1bcm s ALA 421 Ca 0.30 1.23 -0.15 0.00 0.00 0.00 0.00 51.96 53.35 1bcm s ALA 421 Cb -0.12 -2.86 -0.05 0.00 0.00 0.00 0.00 23.12 20.09 1bcm s ALA 421 CO 0.17 -2.20 1.02 0.15 0.00 0.00 0.00 175.76 174.91 1bcm s LYS 422 N 2.58 3.59 0.57 0.00 1.02 -1.26 -4.92 119.74 121.31 1bcm s LYS 422 Ca 0.21 1.00 0.30 0.00 0.02 0.00 0.00 55.97 57.50 1bcm s LYS 422 Cb -0.01 -2.08 1.46 0.00 -0.52 0.00 0.00 37.83 36.68 1bcm s LYS 422 CO -0.20 -0.58 1.87 -1.35 -0.92 0.00 0.00 175.35 174.18 1bcm h PRO 423 N 0.39 0.00 0.00 -1.68 0.11 -1.95 -3.37 132.00 125.50 1bcm h PRO 423 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1bcm h PRO 423 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1bcm h PRO 423 CO 0.60 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.14 1bcm n ASP 424 N -3.91 0.00 -0.34 -2.05 9.92 -1.26 0.18 116.55 119.09 1bcm n ASP 424 Ca 0.13 0.00 0.17 0.00 -0.53 0.00 0.00 54.79 54.55 1bcm n ASP 424 Cb 0.81 0.00 0.39 0.00 -0.64 0.00 0.00 41.12 41.68 1bcm n ASP 424 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 1bcm h ASN 425 N 0.00 0.66 -0.19 -2.24 -0.00 -2.01 -2.52 115.58 109.29 1bcm h ASN 425 Ca 0.00 0.10 -0.08 0.00 -0.00 0.00 0.00 56.30 56.32 1bcm h ASN 425 Cb 0.00 -0.01 -0.05 0.00 -0.00 0.00 0.00 38.32 38.26 1bcm h ASN 425 CO 0.00 0.18 0.11 -1.22 -0.00 0.00 0.00 177.43 176.49 1bcm n TYR 426 N -4.76 0.60 -0.12 0.67 4.01 0.48 -4.25 117.16 113.79 1bcm n TYR 426 Ca 0.25 -0.63 -0.04 0.00 -0.16 0.00 0.00 57.90 57.32 1bcm n TYR 426 Cb 0.70 -0.35 0.17 0.00 -0.31 0.00 0.00 39.34 39.55 1bcm n TYR 426 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1bcm h GLY 427 N 3.72 0.87 0.00 2.72 0.00 -1.21 -2.75 103.07 106.42 1bcm h GLY 427 Ca 0.10 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1bcm h GLY 427 CO 0.20 0.51 -0.23 2.09 0.00 0.00 0.00 176.54 179.12 1bcm n ASP 428 N -4.24 0.98 0.20 0.19 5.75 -1.26 -4.53 116.55 113.63 1bcm n ASP 428 Ca 0.03 -0.41 0.09 0.00 -0.01 0.00 0.00 54.79 54.48 1bcm n ASP 428 Cb 0.27 1.01 0.24 0.00 -1.03 0.00 0.00 41.12 41.61 1bcm n ASP 428 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1bcm h ARG 429 N 0.00 0.00 -6.39 0.11 2.47 -1.73 -3.46 114.38 105.37 1bcm h ARG 429 Ca 0.00 0.00 -0.62 0.00 -1.26 0.00 0.00 59.98 58.10 1bcm h ARG 429 Cb 0.02 0.00 0.05 0.00 -1.65 0.00 0.00 29.97 28.39 1bcm h ARG 429 CO 0.00 0.22 0.76 0.00 0.56 0.00 0.00 179.97 181.51 1bcm n ALA 430 N -2.17 0.61 -1.89 0.04 0.00 -1.04 -4.02 120.51 112.03 1bcm n ALA 430 Ca 0.02 0.44 -0.40 0.00 0.00 0.00 0.00 53.44 53.49 1bcm n ALA 430 Cb 0.55 -2.29 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 1bcm n ALA 430 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1bcm s VAL 431 N 1.40 3.99 0.16 0.00 1.01 -0.95 -4.63 120.40 121.38 1bcm s VAL 431 Ca 0.83 1.88 -0.31 0.00 0.00 0.00 0.00 61.98 64.39 1bcm s VAL 431 Cb -0.77 -4.20 -0.09 0.00 0.00 0.00 0.00 36.38 31.32 1bcm s VAL 431 CO 0.44 0.40 1.40 1.51 0.00 0.00 0.00 175.10 178.84 1bcm s ASP 432 N -0.73 6.79 0.25 3.32 -4.77 -1.26 -1.18 116.67 119.09 1bcm s ASP 432 Ca 0.44 2.42 -0.02 0.00 -3.30 0.00 0.00 52.55 52.10 1bcm s ASP 432 Cb -0.27 -2.60 0.52 0.00 -1.09 0.00 0.00 42.92 39.48 1bcm s ASP 432 CO 0.34 -0.65 1.29 0.00 0.70 0.00 0.00 175.17 176.85 1bcm n ALA 433 N 3.41 0.33 -0.35 2.11 0.00 -0.89 -0.25 120.51 124.87 1bcm n ALA 433 Ca 0.10 0.89 0.03 0.00 0.00 0.00 0.00 53.44 54.46 1bcm n ALA 433 Cb 0.42 -0.60 0.18 0.00 0.00 0.00 0.00 19.45 19.44 1bcm n ALA 433 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bcm h GLU 434 N 0.00 1.04 -0.11 0.00 4.81 -1.91 -0.78 114.58 117.63 1bcm h GLU 434 Ca 0.46 -0.06 -0.22 0.00 -0.13 0.00 0.00 59.36 59.41 1bcm h GLU 434 Cb 0.85 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 30.00 1bcm h GLU 434 CO -0.81 0.69 -0.79 1.25 -0.73 0.00 0.00 179.01 178.62 1bcm h LEU 435 N 1.07 0.79 0.81 1.64 5.85 -1.00 -2.73 115.31 121.74 1bcm h LEU 435 Ca 0.43 -0.53 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1bcm h LEU 435 Cb 0.23 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.03 1bcm h LEU 435 CO -0.19 1.31 -0.43 0.15 -0.34 0.00 0.00 178.44 178.94 1bcm h PHE 436 N 0.44 -1.12 -0.93 1.25 3.57 -0.91 -0.46 116.94 118.78 1bcm h PHE 436 Ca -0.05 -0.02 0.23 0.00 3.53 0.00 0.00 57.97 61.66 1bcm h PHE 436 Cb 1.41 0.38 -0.12 0.00 2.79 0.00 0.00 35.95 40.40 1bcm h PHE 436 CO 0.07 -0.67 0.46 -0.07 -2.23 0.00 0.00 178.31 175.87 1bcm h LEU 437 N -1.14 0.44 -0.34 0.59 3.38 -1.26 0.49 115.31 117.48 1bcm h LEU 437 Ca -0.11 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1bcm h LEU 437 Cb 0.89 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1bcm h LEU 437 CO 0.16 0.03 0.18 0.50 0.09 0.00 0.00 178.44 179.40 1bcm h LYS 438 N 0.46 0.48 -0.13 1.13 3.64 -1.23 -1.21 116.57 119.72 1bcm h LYS 438 Ca 0.59 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.84 1bcm h LYS 438 Cb 1.12 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.83 1bcm h LYS 438 CO -0.51 0.42 -0.21 1.15 -2.27 0.00 0.00 179.45 178.03 1bcm h THR 439 N 0.42 1.21 0.48 1.00 2.02 0.15 -2.38 112.91 115.82 1bcm h THR 439 Ca 0.12 -0.97 -0.02 0.00 0.77 0.00 0.00 66.41 66.31 1bcm h THR 439 Cb 0.08 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1bcm h THR 439 CO -0.02 0.30 -0.23 0.25 0.37 0.00 0.00 175.52 176.19 1bcm h LEU 440 N 0.20 -0.54 -1.13 2.58 6.46 0.08 0.62 115.31 123.58 1bcm h LEU 440 Ca 0.04 -0.06 0.14 0.00 -0.12 0.00 0.00 57.88 57.88 1bcm h LEU 440 Cb 0.49 0.14 -0.08 0.00 -0.73 0.00 0.00 40.66 40.47 1bcm h LEU 440 CO 0.03 -0.27 0.61 0.00 -0.62 0.00 0.00 178.44 178.19 1bcm h ALA 441 N -0.38 1.68 -0.27 1.25 0.00 -1.06 -1.44 119.26 119.05 1bcm h ALA 441 Ca -0.07 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1bcm h ALA 441 Cb 0.57 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1bcm h ALA 441 CO 0.11 0.05 -0.43 0.93 0.00 0.00 0.00 179.25 179.91 1bcm h GLU 442 N 0.83 0.77 0.61 0.00 5.08 -1.21 -2.73 114.58 117.92 1bcm h GLU 442 Ca 0.49 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1bcm h GLU 442 Cb 0.67 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1bcm h GLU 442 CO -0.26 1.09 -0.42 0.78 -1.00 0.00 0.00 179.01 179.20 1bcm h GLY 443 N 0.51 -1.10 0.12 -3.84 0.00 0.12 -1.17 103.07 97.71 1bcm h GLY 443 Ca 0.02 0.47 0.20 0.00 0.00 0.00 0.00 47.33 48.02 1bcm h GLY 443 CO 0.10 -0.38 0.61 -2.08 0.00 0.00 0.00 176.54 174.79 1bcm h VAL 444 N -0.99 0.68 0.00 4.60 2.07 -1.39 0.40 116.25 121.63 1bcm h VAL 444 Ca -0.07 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1bcm h VAL 444 Cb 0.81 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1bcm h VAL 444 CO 0.05 0.13 -0.47 0.00 0.02 0.00 0.00 177.57 177.30 1bcm h ALA 445 N 1.64 1.03 0.09 1.67 0.00 -1.19 -2.20 119.26 120.30 1bcm h ALA 445 Ca 0.57 -0.42 -0.27 0.00 0.00 0.00 0.00 54.91 54.79 1bcm h ALA 445 Cb 0.99 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.72 1bcm h ALA 445 CO -0.35 0.58 -1.15 0.52 0.00 0.00 0.00 179.25 178.85 1bcm h MET 446 N 0.00 0.45 0.07 0.00 2.86 0.94 -2.35 114.93 116.90 1bcm h MET 446 Ca -0.00 -0.60 0.01 0.00 -2.06 0.00 0.00 59.70 57.04 1bcm h MET 446 Cb 0.94 0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.78 1bcm h MET 446 CO 0.06 1.25 -0.13 0.35 1.06 0.00 0.00 176.91 179.50 1bcm h PHE 447 N 0.20 -0.33 0.00 -0.22 3.04 -0.68 -0.81 116.94 118.14 1bcm h PHE 447 Ca -0.14 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.78 1bcm h PHE 447 Cb 1.83 0.14 -0.01 0.00 2.56 0.00 0.00 35.95 40.47 1bcm h PHE 447 CO 0.08 -0.19 -0.19 -0.91 -2.02 0.00 0.00 178.31 175.08 1bcm h ASN 448 N -0.25 0.00 0.85 0.41 2.35 -1.44 -3.17 115.58 114.33 1bcm h ASN 448 Ca 0.02 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.72 1bcm h ASN 448 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1bcm h ASN 448 CO -0.08 0.19 -1.19 0.00 -1.65 0.00 0.00 177.43 174.70 1bcm n ALA 449 N -2.50 2.36 -1.66 -0.83 0.00 -0.89 -1.54 120.51 115.45 1bcm n ALA 449 Ca -0.02 -0.35 -0.51 0.00 0.00 0.00 0.00 53.44 52.56 1bcm n ALA 449 Cb 0.25 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 1bcm n ALA 449 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1bcm n ARG 450 N -2.72 1.63 -1.95 0.00 3.00 -0.35 -4.80 116.66 111.48 1bcm n ARG 450 Ca -0.03 0.59 -0.18 0.00 -0.00 0.00 0.00 57.85 58.22 1bcm n ARG 450 Cb 0.64 -2.32 0.10 0.00 0.00 0.00 0.00 32.46 30.88 1bcm n ARG 450 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1bcm n THR 451 N 3.94 0.00 -1.38 5.15 -2.24 -1.26 -4.18 114.28 114.30 1bcm n THR 451 Ca 0.21 -1.09 -0.13 0.00 -2.27 0.00 0.00 64.05 60.77 1bcm n THR 451 Cb 0.22 -1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 67.25 1bcm n THR 451 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bcm n GLY 452 N -0.97 1.38 3.65 3.38 0.00 -0.56 -4.90 105.19 107.17 1bcm n GLY 452 Ca 0.13 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1bcm n GLY 452 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bcm s ARG 453 N -3.07 3.95 -1.52 1.61 1.81 -0.88 -4.35 118.95 116.50 1bcm s ARG 453 Ca 0.00 2.44 -0.10 0.00 -1.72 0.00 0.00 55.73 56.34 1bcm s ARG 453 Cb 0.00 -4.18 -0.01 0.00 -0.45 0.00 0.00 34.95 30.30 1bcm s ARG 453 CO 0.00 -1.17 2.64 0.39 -0.68 0.00 0.00 175.30 176.48 1bcm n GLU 454 N 7.74 3.62 -4.21 3.54 1.02 -1.26 -0.59 120.64 130.48 1bcm n GLU 454 Ca 0.21 -2.55 -0.27 0.00 -0.02 0.00 0.00 57.16 54.53 1bcm n GLU 454 Cb 0.42 -2.90 -0.06 0.00 -0.02 0.00 0.00 31.44 28.88 1bcm n GLU 454 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1bcm s THR 455 N 1.86 1.91 0.02 2.62 -4.23 -1.26 -4.77 115.64 111.79 1bcm s THR 455 Ca 0.60 -1.72 -0.25 0.00 -1.18 0.00 0.00 61.69 59.15 1bcm s THR 455 Cb 0.17 -2.63 -0.18 0.00 1.34 0.00 0.00 72.50 71.20 1bcm s THR 455 CO -0.07 0.00 1.42 -0.08 -0.54 0.00 0.00 174.62 175.35 1bcm h GLU 456 N 1.26 -0.07 -0.70 3.99 4.81 -1.99 0.43 114.58 122.31 1bcm h GLU 456 Ca -0.42 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 58.93 1bcm h GLU 456 Cb 1.28 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.59 1bcm h GLU 456 CO 0.68 0.23 0.30 0.52 -0.73 0.00 0.00 179.01 180.01 1bcm h MET 457 N -0.38 0.48 0.04 1.92 2.86 -1.94 -3.05 114.93 114.87 1bcm h MET 457 Ca -0.01 -0.03 -0.30 0.00 -2.06 0.00 0.00 59.70 57.30 1bcm h MET 457 Cb 0.33 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 1bcm h MET 457 CO 0.01 0.32 -1.68 0.00 1.06 0.00 0.00 176.91 176.63 1bcm n GLY 459 N 1.64 -0.42 2.41 0.00 0.00 0.15 -2.06 105.19 106.91 1bcm n GLY 459 Ca -0.18 0.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 1bcm n GLY 459 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bcm n GLY 460 N -1.76 1.25 1.47 -0.02 0.00 0.24 -4.73 105.19 101.64 1bcm n GLY 460 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1bcm n GLY 460 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1bcm n LYS 461 N -2.38 0.00 -1.67 1.61 5.02 -0.88 -4.42 118.16 115.44 1bcm n LYS 461 Ca -0.19 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.80 1bcm n LYS 461 Cb 0.62 -0.28 0.10 0.00 -0.02 0.00 0.00 35.03 35.45 1bcm n LYS 461 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1bcm s LEU 462 N -6.96 2.44 0.26 -0.35 1.43 -0.97 -1.49 118.68 113.04 1bcm s LEU 462 Ca 0.00 1.06 0.07 0.00 -1.03 0.00 0.00 54.13 54.23 1bcm s LEU 462 Cb 0.00 -3.59 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 1bcm s LEU 462 CO 0.00 -2.04 0.22 -0.94 0.23 0.00 0.00 176.35 173.83 1bcm s SER 463 N -4.16 5.55 0.44 2.29 1.04 -1.26 -2.07 113.70 115.53 1bcm s SER 463 Ca 0.62 -0.26 0.18 0.00 0.48 0.00 0.00 55.95 56.96 1bcm s SER 463 Cb -0.13 -1.38 1.11 0.00 0.10 0.00 0.00 66.02 65.72 1bcm s SER 463 CO 0.52 -0.08 1.91 -0.26 0.98 0.00 0.00 173.24 176.31 1bcm h PHE 464 N 1.43 0.43 -0.46 5.02 0.04 -1.71 0.28 116.94 121.98 1bcm h PHE 464 Ca -0.48 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.19 1bcm h PHE 464 Cb 1.24 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 1bcm h PHE 464 CO 0.54 0.15 -0.13 -0.44 -0.60 0.00 0.00 178.31 177.83 1bcm h ASP 465 N 0.36 0.91 -0.03 2.17 3.32 -1.63 -1.98 116.42 119.54 1bcm h ASP 465 Ca 0.39 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 1bcm h ASP 465 Cb 1.00 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1bcm h ASP 465 CO -0.12 1.07 0.01 0.44 -1.72 0.00 0.00 179.24 178.92 1bcm h ASP 466 N 0.74 0.04 -0.46 6.45 3.32 -1.25 -1.70 116.42 123.56 1bcm h ASP 466 Ca 0.11 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1bcm h ASP 466 Cb 0.69 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 1bcm h ASP 466 CO 0.05 0.17 0.09 -0.37 -1.72 0.00 0.00 179.24 177.46 1bcm h VAL 467 N -0.10 1.23 -0.47 -1.35 -1.51 -1.43 -2.20 116.25 110.42 1bcm h VAL 467 Ca 0.01 -0.87 -0.09 0.00 -1.23 0.00 0.00 66.70 64.52 1bcm h VAL 467 Cb 0.14 0.73 -0.02 0.00 -2.13 0.00 0.00 31.29 30.02 1bcm h VAL 467 CO -0.00 0.32 -0.05 0.15 -1.23 0.00 0.00 177.57 176.75 1bcm h PHE 468 N 0.78 0.95 -0.60 5.19 3.57 -1.17 0.87 116.94 126.54 1bcm h PHE 468 Ca 0.17 -0.19 0.02 0.00 3.53 0.00 0.00 57.97 61.50 1bcm h PHE 468 Cb 0.34 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 1bcm h PHE 468 CO 0.02 0.93 0.39 1.49 -2.23 0.00 0.00 178.31 178.90 1bcm h GLU 469 N 0.71 0.75 0.55 1.11 4.81 -1.10 0.35 114.58 121.77 1bcm h GLU 469 Ca 0.13 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1bcm h GLU 469 Cb 0.58 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 29.80 1bcm h GLU 469 CO 0.03 0.50 -0.27 -0.09 -0.73 0.00 0.00 179.01 178.46 1bcm h ARG 470 N 0.78 -0.72 -0.16 1.92 2.43 -1.21 -2.94 114.38 114.48 1bcm h ARG 470 Ca 0.23 0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.36 1bcm h ARG 470 Cb -0.04 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 1bcm h ARG 470 CO -0.07 -0.44 -0.23 0.93 -1.51 0.00 0.00 179.97 178.65 1bcm h GLU 471 N -0.84 0.44 -0.02 0.20 4.39 -0.73 -3.22 114.58 114.80 1bcm h GLU 471 Ca -0.08 -0.26 0.01 0.00 0.34 0.00 0.00 59.36 59.37 1bcm h GLU 471 Cb 0.61 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1bcm h GLU 471 CO 0.12 0.84 0.04 -0.92 -1.16 0.00 0.00 179.01 177.94 1bcm h TYR 472 N 0.07 0.00 0.00 4.33 3.20 -0.38 -1.07 116.97 123.13 1bcm h TYR 472 Ca 0.02 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 1bcm h TYR 472 Cb 0.80 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 1bcm h TYR 472 CO 0.09 0.00 -0.02 0.00 -1.64 0.00 0.00 178.16 176.59 1bcm h ALA 473 N 1.95 1.11 0.00 1.82 0.00 -1.52 -2.59 119.26 120.03 1bcm h ALA 473 Ca 0.01 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 1bcm h ALA 473 Cb 0.08 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1bcm h ALA 473 CO -0.00 0.03 -1.55 -0.09 0.00 0.00 0.00 179.25 177.64 1bcm h ARG 474 N 0.00 0.00 -6.54 0.00 2.43 -1.37 -3.47 114.38 105.43 1bcm h ARG 474 Ca -0.00 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 58.64 1bcm h ARG 474 Cb 0.17 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1bcm h ARG 474 CO 0.00 0.51 0.84 0.99 -1.51 0.00 0.00 179.97 180.80 1bcm s THR 475 N -2.68 3.02 -0.32 0.20 2.01 -0.98 -4.99 115.64 111.90 1bcm s THR 475 Ca -0.03 0.68 -0.19 0.00 0.31 0.00 0.00 61.69 62.46 1bcm s THR 475 Cb 0.08 -3.44 -0.01 0.00 0.01 0.00 0.00 72.50 69.14 1bcm s THR 475 CO 0.82 0.04 0.54 -0.63 -0.69 0.00 0.00 174.62 174.70 1bcm s ILE 476 N 1.44 5.00 0.40 1.82 1.09 -1.26 -5.04 121.20 124.65 1bcm s ILE 476 Ca 0.68 0.59 0.04 0.00 -1.10 0.00 0.00 60.65 60.86 1bcm s ILE 476 Cb -0.40 -3.94 -0.05 0.00 -1.06 0.00 0.00 42.46 37.01 1bcm s ILE 476 CO 0.31 -0.13 0.05 0.68 -0.10 0.00 0.00 174.94 175.75 1bcm s VAL 477 N 2.44 1.22 -0.06 2.92 -7.23 -1.26 -3.06 120.40 115.37 1bcm s VAL 477 Ca 0.21 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.40 1bcm s VAL 477 Cb -0.15 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.20 1bcm s VAL 477 CO 0.12 0.00 -0.09 -0.13 -0.31 0.00 0.00 175.10 174.69 1bcm s ARG 478 N -3.81 1.35 0.15 4.82 0.52 -0.30 -4.87 118.95 116.82 1bcm s ARG 478 Ca 0.27 -0.29 -0.30 0.00 -0.52 0.00 0.00 55.73 54.89 1bcm s ARG 478 Cb 0.06 -1.18 -0.07 0.00 0.52 0.00 0.00 34.95 34.28 1bcm s ARG 478 CO 0.13 -0.02 1.03 0.15 0.02 0.00 0.00 175.30 176.61 1bcm s LYS 479 N 0.77 4.66 0.70 3.54 -0.14 -1.26 0.22 119.74 128.22 1bcm s LYS 479 Ca -0.13 1.59 -0.15 0.00 -1.36 0.00 0.00 55.97 55.91 1bcm s LYS 479 Cb -0.15 -3.32 0.02 0.00 -1.68 0.00 0.00 37.83 32.70 1bcm s LYS 479 CO 0.02 0.16 1.17 -1.25 -0.76 0.00 0.00 175.35 174.70 1bcm s PRO 480 N -0.25 2.43 0.84 -1.68 0.04 -1.26 -4.94 135.00 130.17 1bcm s PRO 480 Ca 0.48 1.63 -0.12 0.00 0.04 0.00 0.00 61.00 63.02 1bcm s PRO 480 Cb -0.27 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.49 1bcm s PRO 480 CO 0.32 -1.58 1.14 0.95 0.04 0.00 0.00 177.00 177.87 1bcm s THR 481 N -2.09 2.31 0.40 1.26 -4.23 -1.26 -4.90 115.64 107.12 1bcm s THR 481 Ca 0.72 0.10 0.17 0.00 -1.18 0.00 0.00 61.69 61.50 1bcm s THR 481 Cb -0.26 -2.96 0.18 0.00 1.34 0.00 0.00 72.50 70.80 1bcm s THR 481 CO 0.43 -0.13 1.95 -0.33 -0.54 0.00 0.00 174.62 176.00 1bcm h GLU 482 N -1.20 0.00 0.03 3.99 4.39 -2.00 -2.32 114.58 117.48 1bcm h GLU 482 Ca -0.48 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 58.97 1bcm h GLU 482 Cb 1.31 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.97 1bcm h GLU 482 CO 0.63 0.24 -1.03 0.93 -1.16 0.00 0.00 179.01 178.61 1bcm h GLU 483 N 0.00 0.49 -0.72 2.33 4.39 -1.99 -2.54 114.58 116.54 1bcm h GLU 483 Ca -0.00 -0.57 -0.01 0.00 0.34 0.00 0.00 59.36 59.12 1bcm h GLU 483 Cb 0.46 0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.25 1bcm h GLU 483 CO 0.03 1.20 0.41 1.96 -1.16 0.00 0.00 179.01 181.45 1bcm h GLN 484 N 0.26 1.00 -0.37 2.33 4.20 -1.81 -0.90 115.11 119.81 1bcm h GLN 484 Ca -0.11 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.42 1bcm h GLN 484 Cb 1.69 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 29.25 1bcm h GLN 484 CO 0.19 0.72 -0.06 0.87 -0.67 0.00 0.00 178.83 179.87 1bcm h LYS 485 N 1.01 0.71 0.00 1.46 1.57 -1.40 -3.04 116.57 116.87 1bcm h LYS 485 Ca 0.26 -0.26 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1bcm h LYS 485 Cb 0.01 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1bcm h LYS 485 CO -0.04 0.84 -0.47 0.00 -0.57 0.00 0.00 179.45 179.20 1bcm h ARG 486 N 0.51 0.00 0.00 3.15 3.08 -1.12 -2.63 114.38 117.37 1bcm h ARG 486 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1bcm h ARG 486 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1bcm h ARG 486 CO 0.03 0.47 0.00 -1.33 -1.07 0.00 0.00 179.97 178.07 1bcm n MET 487 N -3.75 0.22 0.10 0.04 2.81 -0.37 -2.13 117.12 114.03 1bcm n MET 487 Ca -0.01 0.38 0.12 0.00 -1.81 0.00 0.00 57.70 56.38 1bcm n MET 487 Cb 0.53 -1.87 0.10 0.00 -0.71 0.00 0.00 33.22 31.26 1bcm n MET 487 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1bcm h LEU 488 N 0.00 0.00-10.39 4.03 3.38 -1.36 -3.47 115.31 107.50 1bcm h LEU 488 Ca 0.00 -0.09 -0.48 0.00 0.09 0.00 0.00 57.88 57.40 1bcm h LEU 488 Cb 0.45 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.33 1bcm h LEU 488 CO 0.00 0.04 0.29 -0.76 0.09 0.00 0.00 178.44 178.10 1bcm s LEU 489 N -4.97 2.29 0.11 1.67 1.43 -0.91 -4.80 118.68 113.50 1bcm s LEU 489 Ca 0.03 1.31 -0.30 0.00 -1.03 0.00 0.00 54.13 54.14 1bcm s LEU 489 Cb 0.11 -3.77 -0.06 0.00 0.03 0.00 0.00 46.19 42.50 1bcm s LEU 489 CO 0.74 -2.41 1.14 -0.76 0.23 0.00 0.00 176.35 175.29 1bcm s LEU 490 N -6.04 4.42 -0.40 1.79 1.43 -0.81 -4.82 118.68 114.24 1bcm s LEU 490 Ca 0.63 2.03 -0.24 0.00 -1.03 0.00 0.00 54.13 55.51 1bcm s LEU 490 Cb -0.16 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.49 1bcm s LEU 490 CO 0.55 -0.35 0.82 -2.16 0.23 0.00 0.00 176.35 175.44 1bcm s PRO 491 N 0.44 3.62 0.40 1.29 0.04 -1.26 -1.92 135.00 137.61 1bcm s PRO 491 Ca 0.54 0.18 -0.06 0.00 0.04 0.00 0.00 61.00 61.70 1bcm s PRO 491 Cb -0.29 -3.86 -0.05 0.00 0.04 0.00 0.00 34.50 30.34 1bcm s PRO 491 CO 0.32 -0.99 0.70 0.00 0.04 0.00 0.00 177.00 177.07 1bcm s ALA 492 N 3.28 3.47 0.61 8.56 0.00 0.43 -0.24 121.76 137.87 1bcm s ALA 492 Ca 0.32 -0.47 -0.16 0.00 0.00 0.00 0.00 51.96 51.65 1bcm s ALA 492 Cb -0.12 -2.51 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 1bcm s ALA 492 CO 0.20 -0.08 1.09 -1.21 0.00 0.00 0.00 175.76 175.75 1bcm s GLU 493 N -4.17 3.12 0.28 0.00 2.02 0.28 -4.11 118.70 116.11 1bcm s GLU 493 Ca 0.47 1.34 -0.30 0.00 0.02 0.00 0.00 54.97 56.49 1bcm s GLU 493 Cb -0.10 -2.00 -0.13 0.00 0.10 0.00 0.00 34.13 32.01 1bcm s GLU 493 CO 0.37 -0.99 1.46 0.00 0.02 0.00 0.00 175.26 176.12 1bcm n ALA 494 N -2.07 1.69 -2.56 5.21 0.00 -1.26 -4.61 120.51 116.91 1bcm n ALA 494 Ca 0.10 0.39 -0.24 0.00 0.00 0.00 0.00 53.44 53.69 1bcm n ALA 494 Cb 0.52 -2.34 -0.08 0.00 0.00 0.00 0.00 19.45 17.54 1bcm n ALA 494 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1bcm s VAL 495 N -0.20 2.91 -0.41 0.00 -7.23 -0.68 -4.92 120.40 109.87 1bcm s VAL 495 Ca 0.65 -2.07 -0.21 0.00 -1.81 0.00 0.00 61.98 58.53 1bcm s VAL 495 Cb -0.58 -2.67 0.02 0.00 0.56 0.00 0.00 36.38 33.71 1bcm s VAL 495 CO 0.51 -0.33 0.66 0.20 -0.31 0.00 0.00 175.10 175.83 1bcm s ASN 496 N -3.64 6.37 -0.20 4.85 0.02 -1.26 -1.29 114.94 119.79 1bcm s ASN 496 Ca 0.32 -0.15 -0.27 0.00 -1.02 0.00 0.00 52.86 51.73 1bcm s ASN 496 Cb -0.04 -2.33 -0.00 0.00 0.02 0.00 0.00 41.25 38.90 1bcm s ASN 496 CO 0.18 -0.74 0.95 -0.69 0.02 0.00 0.00 177.10 176.82 1bcm s VAL 497 N 2.85 4.77 0.94 1.60 1.01 0.24 -4.67 120.40 127.14 1bcm s VAL 497 Ca 0.24 1.86 -0.12 0.00 0.00 0.00 0.00 61.98 63.96 1bcm s VAL 497 Cb -0.14 -4.24 0.15 0.00 0.00 0.00 0.00 36.38 32.16 1bcm s VAL 497 CO 0.18 -0.08 1.09 -0.94 0.00 0.00 0.00 175.10 175.35 1bcm s SER 498 N 1.20 3.05 0.62 3.32 1.04 0.01 -4.71 113.70 118.23 1bcm s SER 498 Ca 0.42 1.54 0.40 0.00 0.48 0.00 0.00 55.95 58.79 1bcm s SER 498 Cb -0.16 -2.21 2.00 0.00 0.10 0.00 0.00 66.02 65.75 1bcm s SER 498 CO 0.10 -2.91 2.21 0.08 0.98 0.00 0.00 173.24 173.70 1bcm h ARG 499 N -1.74 0.00 0.00 4.02 -0.00 -1.94 -0.92 114.38 113.80 1bcm h ARG 499 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.47 1bcm h ARG 499 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.26 1bcm h ARG 499 CO 0.53 0.00 0.00 0.36 -0.00 0.00 0.00 179.97 180.86 1bcm n LYS 500 N -3.09 0.71 -2.41 0.08 0.00 -1.26 -4.81 118.16 107.37 1bcm n LYS 500 Ca -0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1bcm n LYS 500 Cb 0.17 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.70 1bcm n LYS 500 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bcm n GLY 501 N 0.89 0.84 3.18 2.58 0.00 -0.35 -4.90 105.19 107.43 1bcm n GLY 501 Ca 0.18 -0.71 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 1bcm n GLY 501 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bcm s GLU 502 N -4.82 0.68 0.17 1.61 -1.05 -1.24 -1.98 118.70 112.07 1bcm s GLU 502 Ca 0.00 -0.60 -0.06 0.00 -0.15 0.00 0.00 54.97 54.16 1bcm s GLU 502 Cb -0.00 0.28 -0.02 0.00 -0.44 0.00 0.00 34.13 33.95 1bcm s GLU 502 CO 0.00 -0.20 0.22 -0.59 0.95 0.00 0.00 175.26 175.65 1bcm s PHE 503 N -2.46 0.64 0.05 4.83 -0.71 -0.96 -0.81 117.98 118.55 1bcm s PHE 503 Ca -0.06 -0.98 0.05 0.00 -1.04 0.00 0.00 56.93 54.90 1bcm s PHE 503 Cb -0.02 -0.22 -0.04 0.00 -1.21 0.00 0.00 43.02 41.54 1bcm s PHE 503 CO -0.03 -0.69 -0.10 0.99 -1.34 0.00 0.00 175.22 174.05 1bcm s THR 504 N -4.03 3.37 -0.14 -4.49 2.01 -1.26 -1.63 115.64 109.48 1bcm s THR 504 Ca 0.23 -1.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.19 1bcm s THR 504 Cb 0.05 -2.49 0.04 0.00 0.01 0.00 0.00 72.50 70.10 1bcm s THR 504 CO 0.03 0.29 0.01 -0.76 -0.69 0.00 0.00 174.62 173.50 1bcm s LEU 505 N -1.69 0.96 -1.05 4.42 1.43 -0.43 -4.96 118.68 117.37 1bcm s LEU 505 Ca 0.18 -0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 52.61 1bcm s LEU 505 Cb -0.11 -0.57 0.09 0.00 0.03 0.00 0.00 46.19 45.63 1bcm s LEU 505 CO 0.09 -0.24 1.39 -1.59 0.23 0.00 0.00 176.35 176.24 1bcm s LYS 506 N 1.88 3.69 0.31 1.70 -2.85 -1.26 -1.72 119.74 121.49 1bcm s LYS 506 Ca 0.02 -1.57 -0.28 0.00 -1.00 0.00 0.00 55.97 53.14 1bcm s LYS 506 Cb -0.15 -5.23 -0.09 0.00 -2.06 0.00 0.00 37.83 30.30 1bcm s LYS 506 CO -0.07 -2.05 1.11 0.08 0.10 0.00 0.00 175.35 174.52 1bcm s VAL 507 N 3.89 3.45 0.00 1.79 1.01 -0.06 -3.67 120.40 126.82 1bcm s VAL 507 Ca 0.43 1.39 0.00 0.00 0.00 0.00 0.00 61.98 63.80 1bcm s VAL 507 Cb -0.01 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1bcm s VAL 507 CO -0.06 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1bcm n GLY 508 N 1.01 1.05 7.00 4.51 0.00 -1.05 -1.76 105.19 115.96 1bcm n GLY 508 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1bcm n GLY 508 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bcm n GLY 509 N 0.00 1.69 0.31 -0.02 0.00 -1.26 -2.48 105.19 103.42 1bcm n GLY 509 Ca 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.00 1bcm n GLY 509 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bcm n SER 510 N 10.30 1.11 -4.82 1.61 3.41 -0.91 -4.79 113.62 119.52 1bcm n SER 510 Ca 0.00 -1.07 -0.22 0.00 -0.26 0.00 0.00 58.87 57.32 1bcm n SER 510 Cb 0.00 0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 1bcm n SER 510 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1bcm s LEU 511 N -2.31 3.62 0.21 1.04 1.43 -1.04 -3.82 118.68 117.81 1bcm s LEU 511 Ca 0.30 -0.45 -0.31 0.00 -1.03 0.00 0.00 54.13 52.65 1bcm s LEU 511 Cb 0.20 -2.19 -0.10 0.00 0.03 0.00 0.00 46.19 44.13 1bcm s LEU 511 CO 0.45 -0.23 1.48 -0.75 0.23 0.00 0.00 176.35 177.53 1bcm s LYS 512 N -3.92 4.25 0.54 1.70 2.20 -1.22 -4.34 119.74 118.95 1bcm s LYS 512 Ca 0.38 2.31 -0.21 0.00 -0.36 0.00 0.00 55.97 58.08 1bcm s LYS 512 Cb -0.06 -3.13 -0.05 0.00 -1.51 0.00 0.00 37.83 33.08 1bcm s LYS 512 CO 0.25 -0.49 1.29 0.20 -0.36 0.00 0.00 175.35 176.25 1bcm s GLY 513 N 0.68 2.84 -0.16 5.54 0.00 -1.26 -4.38 107.32 110.58 1bcm s GLY 513 Ca 0.63 1.20 -0.33 0.00 0.00 0.00 0.00 44.72 46.22 1bcm s GLY 513 CO 0.38 1.68 1.15 0.00 0.00 0.00 0.00 173.10 176.32 1bcm s ALA 514 N -1.40 -2.02 -0.50 3.20 0.00 -0.72 -4.97 121.76 115.35 1bcm s ALA 514 Ca 0.72 1.52 0.04 0.00 0.00 0.00 0.00 51.96 54.23 1bcm s ALA 514 Cb -0.36 -0.13 0.13 0.00 0.00 0.00 0.00 23.12 22.76 1bcm s ALA 514 CO 0.42 -0.58 0.25 0.21 0.00 0.00 0.00 175.76 176.07 1bcm s LYS 515 N -2.39 1.82 0.27 0.00 2.36 -1.26 -0.88 119.74 119.66 1bcm s LYS 515 Ca 0.08 -2.47 -0.19 0.00 -2.55 0.00 0.00 55.97 50.83 1bcm s LYS 515 Cb -0.01 -3.11 -0.09 0.00 -1.05 0.00 0.00 37.83 33.57 1bcm s LYS 515 CO -0.05 -1.11 0.77 -0.80 1.55 0.00 0.00 175.35 175.70 1bcm s ASN 516 N -0.12 7.02 -0.11 1.43 0.01 -0.70 -4.92 114.94 117.56 1bcm s ASN 516 Ca 0.17 1.46 0.02 0.00 -0.71 0.00 0.00 52.86 53.79 1bcm s ASN 516 Cb -0.25 -2.44 0.02 0.00 0.41 0.00 0.00 41.25 38.98 1bcm s ASN 516 CO -0.00 -0.06 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.69 1bcm s VAL 517 N -1.68 1.45 0.38 1.60 1.01 -1.26 -1.32 120.40 120.57 1bcm s VAL 517 Ca 0.48 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.93 1bcm s VAL 517 Cb -0.15 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1bcm s VAL 517 CO 0.20 0.43 0.20 -0.31 0.00 0.00 0.00 175.10 175.62 1bcm s TYR 518 N 1.03 2.69 -0.07 5.22 2.02 -0.65 -0.42 117.35 127.16 1bcm s TYR 518 Ca -0.06 -0.46 -0.30 0.00 -0.37 0.00 0.00 57.07 55.87 1bcm s TYR 518 Cb -0.15 -1.84 0.07 0.00 -0.40 0.00 0.00 41.96 39.64 1bcm s TYR 518 CO -0.02 0.20 0.70 -0.47 -1.57 0.00 0.00 175.55 174.39 1bcm s TYR 519 N -2.48 -0.65 -0.29 2.71 5.04 -0.98 -2.27 117.35 118.42 1bcm s TYR 519 Ca 0.41 1.17 -0.14 0.00 -2.44 0.00 0.00 57.07 56.06 1bcm s TYR 519 Cb -0.01 0.40 0.13 0.00 0.35 0.00 0.00 41.96 42.83 1bcm s TYR 519 CO 0.24 -0.58 0.82 1.21 -1.34 0.00 0.00 175.55 175.90 1bcm s ASN 520 N -1.05 -0.80 0.24 4.32 2.47 -0.84 -3.13 114.94 116.15 1bcm s ASN 520 Ca -0.10 1.18 -0.09 0.00 0.42 0.00 0.00 52.86 54.28 1bcm s ASN 520 Cb -0.00 1.64 0.40 0.00 -1.45 0.00 0.00 41.25 41.83 1bcm s ASN 520 CO 0.09 -0.18 1.61 -0.03 -3.72 0.00 0.00 177.10 174.87 1bcm h MET 521 N 7.12 0.04 -0.73 0.43 1.85 -1.92 -0.90 114.93 120.82 1bcm h MET 521 Ca -0.23 -0.00 0.21 0.00 -0.61 0.00 0.00 59.70 59.07 1bcm h MET 521 Cb 1.16 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 33.15 1bcm h MET 521 CO 0.14 0.03 0.89 0.00 -0.40 0.00 0.00 176.91 177.56 1bcm h ALA 522 N 1.76 2.56 -0.05 0.39 0.00 -1.96 0.27 119.26 122.23 1bcm h ALA 522 Ca 0.40 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.19 1bcm h ALA 522 Cb 0.68 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1bcm h ALA 522 CO -0.75 -1.26 -0.41 -0.07 0.00 0.00 0.00 179.25 176.76 1bcm h LEU 523 N 0.00 0.10 0.02 0.00 3.38 -1.49 -2.44 115.31 114.89 1bcm h LEU 523 Ca 0.35 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.17 1bcm h LEU 523 Cb 2.11 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 42.85 1bcm h LEU 523 CO -0.00 0.51 -0.44 0.24 0.09 0.00 0.00 178.44 178.83 1bcm h MET 524 N 0.08 0.26 -0.01 1.13 2.86 -0.63 -3.28 114.93 115.35 1bcm h MET 524 Ca 0.01 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1bcm h MET 524 Cb 0.77 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.52 1bcm h MET 524 CO 0.06 1.04 0.01 -0.91 1.06 0.00 0.00 176.91 178.17 1bcm h ASN 525 N -0.39 0.00 -2.82 1.22 2.35 -1.55 -3.41 115.58 110.97 1bcm h ASN 525 Ca -0.06 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.23 1bcm h ASN 525 Cb 1.22 0.00 0.03 0.00 0.05 0.00 0.00 38.32 39.62 1bcm h ASN 525 CO 0.09 0.00 -0.06 0.00 -1.65 0.00 0.00 177.43 175.81 1bcm s ALA 526 N -4.80 3.72 -0.45 -0.83 0.00 -0.92 -4.98 121.76 113.50 1bcm s ALA 526 Ca -0.05 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 50.88 1bcm s ALA 526 Cb 0.16 -2.18 0.52 0.00 0.00 0.00 0.00 23.12 21.62 1bcm s ALA 526 CO 0.59 -0.47 1.87 0.41 0.00 0.00 0.00 175.76 178.16 1bcm n GLY 527 N -2.17 4.54 3.68 0.00 0.00 -1.26 -4.90 105.19 105.07 1bcm n GLY 527 Ca 0.03 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 1bcm n GLY 527 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bcm s VAL 528 N -3.25 4.02 -0.26 1.61 0.11 -1.26 -4.90 120.40 116.47 1bcm s VAL 528 Ca 0.51 1.32 -0.10 0.00 -2.93 0.00 0.00 61.98 60.79 1bcm s VAL 528 Cb 0.42 -3.85 -0.12 0.00 -1.53 0.00 0.00 36.38 31.30 1bcm s VAL 528 CO 0.06 -0.05 -0.31 0.29 -3.33 0.00 0.00 175.10 171.77 1bcm n LYS 529 N 5.88 0.56 -5.15 1.54 4.76 -1.26 -4.79 118.16 119.70 1bcm n LYS 529 Ca 0.13 0.22 -0.32 0.00 -2.87 0.00 0.00 58.31 55.47 1bcm n LYS 529 Cb 0.45 -1.43 -0.15 0.00 -1.84 0.00 0.00 35.03 32.05 1bcm n LYS 529 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1bcm s LYS 530 N -2.48 2.27 0.04 1.97 1.02 -1.26 0.80 119.74 122.11 1bcm s LYS 530 Ca -0.35 -0.84 0.04 0.00 0.02 0.00 0.00 55.97 54.84 1bcm s LYS 530 Cb 0.13 -2.17 -0.02 0.00 -0.52 0.00 0.00 37.83 35.25 1bcm s LYS 530 CO 0.48 0.58 -0.13 0.54 -0.92 0.00 0.00 175.35 175.90 1bcm s VAL 531 N -0.64 1.00 -0.12 3.17 0.11 -0.41 -4.37 120.40 119.14 1bcm s VAL 531 Ca 0.10 -1.02 -0.13 0.00 -2.93 0.00 0.00 61.98 58.00 1bcm s VAL 531 Cb -0.10 -0.93 -0.05 0.00 -1.53 0.00 0.00 36.38 33.77 1bcm s VAL 531 CO -0.00 -0.08 0.30 -0.69 -3.33 0.00 0.00 175.10 171.30 1bcm s VAL 532 N -0.95 5.27 -0.21 2.04 1.01 -0.04 -1.68 120.40 125.83 1bcm s VAL 532 Ca -0.01 0.58 -0.06 0.00 0.00 0.00 0.00 61.98 62.50 1bcm s VAL 532 Cb -0.08 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 1bcm s VAL 532 CO 0.01 0.46 0.01 -0.69 0.00 0.00 0.00 175.10 174.90 1bcm s VAL 533 N -0.06 4.00 -0.25 2.92 1.01 -1.26 -0.90 120.40 125.86 1bcm s VAL 533 Ca 0.18 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 1bcm s VAL 533 Cb -0.14 -2.83 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1bcm s VAL 533 CO 0.06 0.41 0.09 -0.13 0.00 0.00 0.00 175.10 175.53 1bcm s ARG 534 N 1.19 3.72 0.33 2.72 0.52 -0.14 -0.43 118.95 126.86 1bcm s ARG 534 Ca 0.03 -0.45 0.03 0.00 -0.52 0.00 0.00 55.73 54.83 1bcm s ARG 534 Cb -0.14 -3.38 -0.05 0.00 0.52 0.00 0.00 34.95 31.90 1bcm s ARG 534 CO 0.02 -0.17 0.11 -0.59 0.02 0.00 0.00 175.30 174.68 1bcm s PHE 535 N 1.60 1.75 -0.15 -0.53 -0.71 -0.81 -1.66 117.98 117.48 1bcm s PHE 535 Ca 0.06 -1.17 -0.00 0.00 -1.04 0.00 0.00 56.93 54.78 1bcm s PHE 535 Cb -0.15 -1.08 0.03 0.00 -1.21 0.00 0.00 43.02 40.61 1bcm s PHE 535 CO 0.05 -0.25 -0.09 0.34 -1.34 0.00 0.00 175.22 173.93 1bcm s ASP 536 N -3.45 2.63 0.35 1.98 -1.08 -1.26 -1.92 116.67 113.92 1bcm s ASP 536 Ca 0.33 -0.52 0.16 0.00 -0.52 0.00 0.00 52.55 52.00 1bcm s ASP 536 Cb 0.06 -0.99 1.17 0.00 -1.46 0.00 0.00 42.92 41.70 1bcm s ASP 536 CO 0.15 -0.13 1.61 -0.65 0.52 0.00 0.00 175.17 176.67 1bcm h PRO 537 N 8.11 0.10 -0.45 4.34 0.11 -1.99 0.30 132.00 142.51 1bcm h PRO 537 Ca -0.30 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.73 1bcm h PRO 537 Cb 1.12 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1bcm h PRO 537 CO 0.44 0.07 -0.03 1.96 -0.21 0.00 0.00 178.00 180.23 1bcm h GLN 538 N 0.10 0.76 -0.13 1.05 4.20 -2.00 -3.13 115.11 115.96 1bcm h GLN 538 Ca 0.77 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 59.27 1bcm h GLN 538 Cb 1.90 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.60 1bcm h GLN 538 CO -0.74 0.79 0.00 1.04 -0.67 0.00 0.00 178.83 179.25 1bcm n GLN 539 N -4.21 2.01 -0.15 1.46 1.13 1.00 -4.47 117.38 114.15 1bcm n GLN 539 Ca 0.02 -1.49 0.28 0.00 -1.94 0.00 0.00 57.00 53.87 1bcm n GLN 539 Cb 0.31 -1.46 0.70 0.00 0.11 0.00 0.00 30.24 29.90 1bcm n GLN 539 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1bcm h LEU 540 N 3.31 0.00 -0.32 1.08 3.38 -1.37 0.55 115.31 121.94 1bcm h LEU 540 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bcm h LEU 540 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1bcm h LEU 540 CO 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.44 1bcm n HIS 541 N -3.85 0.00 0.08 1.13 1.44 -1.26 -4.54 115.22 108.22 1bcm n HIS 541 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.89 1bcm n HIS 541 Cb 1.06 -0.14 0.00 0.00 0.12 0.00 0.00 29.99 31.03 1bcm n HIS 541 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 1bcm n SER 542 N -0.80 0.68 -4.14 4.39 7.64 0.17 -4.72 113.62 116.85 1bcm n SER 542 Ca 0.16 0.24 -0.11 0.00 1.01 0.00 0.00 58.87 60.16 1bcm n SER 542 Cb 0.27 -0.10 -0.10 0.00 -1.01 0.00 0.00 64.21 63.27 1bcm n SER 542 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1bcm s THR 543 N -2.00 0.64 0.06 0.44 2.01 -0.14 -0.46 115.64 116.18 1bcm s THR 543 Ca 0.00 -1.67 -0.08 0.00 0.31 0.00 0.00 61.69 60.25 1bcm s THR 543 Cb 0.00 -1.35 -0.00 0.00 0.01 0.00 0.00 72.50 71.16 1bcm s THR 543 CO 0.00 -0.72 0.17 0.68 -0.69 0.00 0.00 174.62 174.05 1bcm s VAL 544 N -2.93 0.13 -0.13 3.82 -7.23 -0.97 -4.27 120.40 108.83 1bcm s VAL 544 Ca 0.05 -1.06 -0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1bcm s VAL 544 Cb 0.01 -1.07 -0.02 0.00 0.56 0.00 0.00 36.38 35.85 1bcm s VAL 544 CO -0.03 -0.59 -0.10 -0.31 -0.31 0.00 0.00 175.10 173.76 1bcm s TYR 545 N -3.05 2.88 -0.15 2.82 2.02 -0.66 -1.77 117.35 119.44 1bcm s TYR 545 Ca -0.01 -0.48 -0.09 0.00 -0.37 0.00 0.00 57.07 56.12 1bcm s TYR 545 Cb 0.01 -1.87 -0.05 0.00 -0.40 0.00 0.00 41.96 39.66 1bcm s TYR 545 CO -0.07 -0.11 0.15 0.00 -1.57 0.00 0.00 175.55 173.96 1bcm s TYR 547 N -0.32 1.06 0.73 0.00 1.51 -0.08 -1.05 117.35 119.21 1bcm s TYR 547 Ca 0.12 -0.32 -0.15 0.00 -1.01 0.00 0.00 57.07 55.71 1bcm s TYR 547 Cb -0.12 -0.64 0.04 0.00 -0.11 0.00 0.00 41.96 41.13 1bcm s TYR 547 CO 0.02 0.01 1.24 0.99 -1.11 0.00 0.00 175.55 176.69 1bcm s THR 548 N -0.74 2.09 0.56 -0.71 2.01 0.11 -0.86 115.64 118.10 1bcm s THR 548 Ca 0.01 0.04 0.28 0.00 0.31 0.00 0.00 61.69 62.33 1bcm s THR 548 Cb -0.07 -2.70 0.40 0.00 0.01 0.00 0.00 72.50 70.14 1bcm s THR 548 CO 0.01 -0.02 1.95 0.25 -0.69 0.00 0.00 174.62 176.11 1bcm h LEU 549 N -0.24 0.00 0.00 4.42 5.85 -1.90 0.17 115.31 123.62 1bcm h LEU 549 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1bcm h LEU 549 Cb 1.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1bcm h LEU 549 CO 0.49 0.00 -0.97 -0.90 -0.34 0.00 0.00 178.44 176.72 1bcm n ASP 550 N -4.04 0.75 0.00 1.25 5.68 -1.26 -4.98 116.55 113.94 1bcm n ASP 550 Ca 0.10 0.20 0.00 0.00 -0.50 0.00 0.00 54.79 54.59 1bcm n ASP 550 Cb 0.67 0.50 0.00 0.00 -1.14 0.00 0.00 41.12 41.15 1bcm n ASP 550 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bcm n GLY 551 N 1.24 0.56 3.62 6.12 0.00 0.05 -5.12 105.19 111.66 1bcm n GLY 551 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1bcm n GLY 551 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bcm s ARG 552 N 0.00 4.06 0.31 1.61 0.52 -1.26 -4.78 118.95 119.41 1bcm s ARG 552 Ca 0.00 0.09 -0.29 0.00 -0.52 0.00 0.00 55.73 55.02 1bcm s ARG 552 Cb 0.00 -3.63 -0.13 0.00 0.52 0.00 0.00 34.95 31.71 1bcm s ARG 552 CO 0.00 -0.23 1.24 0.34 0.02 0.00 0.00 175.30 176.67 1bcm n PHE 553 N 5.15 1.98 -0.04 -0.53 7.35 -1.26 0.10 117.46 130.20 1bcm n PHE 553 Ca -0.08 0.57 -0.09 0.00 -0.76 0.00 0.00 57.45 57.09 1bcm n PHE 553 Cb 0.51 -2.38 -0.03 0.00 0.35 0.00 0.00 39.48 37.93 1bcm n PHE 553 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1bcm n ILE 554 N 0.60 0.59 -1.15 -2.13 5.41 -0.21 -4.80 119.36 117.67 1bcm n ILE 554 Ca 0.07 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.74 1bcm n ILE 554 Cb 0.34 -1.65 0.00 0.00 -0.71 0.00 0.00 39.64 37.62 1bcm n ILE 554 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1bcm s GLU 556 N -1.48 3.32 -0.21 0.00 2.12 -1.26 -0.48 118.70 120.70 1bcm s GLU 556 Ca 0.00 -0.69 -0.15 0.00 0.36 0.00 0.00 54.97 54.49 1bcm s GLU 556 Cb 0.00 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 1bcm s GLU 556 CO 0.00 -0.31 0.35 0.00 -0.54 0.00 0.00 175.26 174.75 1bcm s ALA 557 N 1.53 3.57 0.65 6.30 0.00 -0.73 -4.87 121.76 128.21 1bcm s ALA 557 Ca 0.04 -0.63 -0.08 0.00 0.00 0.00 0.00 51.96 51.30 1bcm s ALA 557 Cb -0.16 -2.57 0.02 0.00 0.00 0.00 0.00 23.12 20.41 1bcm s ALA 557 CO 0.01 -0.30 0.99 -1.21 0.00 0.00 0.00 175.76 175.25 1bcm s GLU 558 N 1.31 2.73 -0.20 0.00 2.02 -1.18 -2.28 118.70 121.10 1bcm s GLU 558 Ca 0.16 0.09 -0.13 0.00 0.02 0.00 0.00 54.97 55.11 1bcm s GLU 558 Cb -0.15 -2.17 -0.05 0.00 0.10 0.00 0.00 34.13 31.87 1bcm s GLU 558 CO 0.07 -0.93 0.27 0.00 0.02 0.00 0.00 175.26 174.69