#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1khu n HIS 270 N 0.00 0.80 0.33 2.13 8.25 -1.21 -4.21 115.22 121.30 1khu n HIS 270 Ca 0.00 -1.23 0.14 0.00 -0.26 0.00 0.00 57.72 56.37 1khu n HIS 270 Cb 0.00 -1.18 0.40 0.00 1.12 0.00 0.00 29.99 30.32 1khu n HIS 270 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 1khu h TRP 271 N 7.71 0.00 -2.73 4.41 5.08 -1.89 -3.43 115.95 125.10 1khu h TRP 271 Ca 0.28 0.00 0.09 0.00 1.08 0.00 0.00 58.89 60.35 1khu h TRP 271 Cb 0.28 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.40 1khu h TRP 271 CO 1.71 0.00 0.39 0.00 -1.28 0.00 0.00 178.44 179.26 1khu s SER 273 N -3.09 0.08 0.01 0.00 1.04 -1.03 -2.54 113.70 108.16 1khu s SER 273 Ca 0.15 -0.22 0.03 0.00 0.48 0.00 0.00 55.95 56.40 1khu s SER 273 Cb -0.04 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.22 1khu s SER 273 CO 0.07 -0.25 -0.10 -0.63 0.98 0.00 0.00 173.24 173.30 1khu s ILE 274 N -1.02 0.82 -0.02 -1.02 1.01 0.71 -1.92 121.20 119.75 1khu s ILE 274 Ca -0.11 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 59.96 1khu s ILE 274 Cb -0.07 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.66 1khu s ILE 274 CO 0.00 0.08 -0.22 -0.69 0.00 0.00 0.00 174.94 174.12 1khu s VAL 275 N -0.53 1.74 -0.10 2.92 1.01 -0.86 -1.06 120.40 123.53 1khu s VAL 275 Ca 0.02 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1khu s VAL 275 Cb -0.05 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1khu s VAL 275 CO 0.00 0.49 -0.00 -0.47 0.00 0.00 0.00 175.10 175.12 1khu s TYR 276 N -0.43 3.14 0.02 5.22 5.04 -1.26 -1.65 117.35 127.43 1khu s TYR 276 Ca 0.06 0.13 0.02 0.00 -2.44 0.00 0.00 57.07 54.85 1khu s TYR 276 Cb -0.09 -1.81 -0.02 0.00 0.35 0.00 0.00 41.96 40.39 1khu s TYR 276 CO -0.00 0.40 -0.08 0.71 -1.34 0.00 0.00 175.55 175.24 1khu s TYR 277 N -0.70 0.70 -0.28 4.97 2.02 -0.11 -0.15 117.35 123.80 1khu s TYR 277 Ca 0.11 -0.31 0.03 0.00 -0.37 0.00 0.00 57.07 56.53 1khu s TYR 277 Cb -0.12 -0.43 0.07 0.00 -0.40 0.00 0.00 41.96 41.09 1khu s TYR 277 CO 0.02 -0.03 -0.05 -1.21 -1.57 0.00 0.00 175.55 172.71 1khu s GLU 278 N -0.91 1.89 6.87 -0.62 2.02 -0.15 -2.09 118.70 125.71 1khu s GLU 278 Ca -0.03 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 53.55 1khu s GLU 278 Cb -0.06 -2.89 0.00 0.00 0.10 0.00 0.00 34.13 31.28 1khu s GLU 278 CO 0.00 -0.68 0.00 1.28 0.02 0.00 0.00 175.26 175.88 1khu n LEU 279 N 4.44 0.00 -1.07 1.80 4.77 -0.82 -2.16 117.00 123.96 1khu n LEU 279 Ca -0.09 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1khu n LEU 279 Cb 0.42 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.74 1khu n LEU 279 CO 0.20 0.00 0.69 -0.46 -1.33 0.00 0.00 177.39 176.50 1khu n ASN 280 N 10.39 3.43 -4.51 -1.43 6.94 -1.24 -4.38 115.26 124.46 1khu n ASN 280 Ca 0.00 -1.96 -0.33 0.00 -0.02 0.00 0.00 54.58 52.27 1khu n ASN 280 Cb 0.00 -0.32 -0.12 0.00 -2.36 0.00 0.00 39.78 36.98 1khu n ASN 280 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1khu s ASN 281 N -1.17 4.33 0.01 0.53 0.02 -0.92 -5.09 114.94 112.65 1khu s ASN 281 Ca 0.37 -0.13 -0.30 0.00 -1.02 0.00 0.00 52.86 51.78 1khu s ASN 281 Cb 0.21 -1.11 -0.03 0.00 0.02 0.00 0.00 41.25 40.34 1khu s ASN 281 CO 0.28 0.33 1.02 -0.60 0.02 0.00 0.00 177.10 178.14 1khu s ARG 282 N -0.60 4.53 -0.09 -0.60 3.52 -1.26 -0.98 118.95 123.47 1khu s ARG 282 Ca 0.09 1.48 0.02 0.00 -0.13 0.00 0.00 55.73 57.19 1khu s ARG 282 Cb -0.11 -3.44 0.01 0.00 -1.56 0.00 0.00 34.95 29.84 1khu s ARG 282 CO 0.02 -0.09 -0.17 0.08 -0.81 0.00 0.00 175.30 174.33 1khu s VAL 283 N 1.04 1.54 0.00 7.11 1.01 0.78 -4.93 120.40 126.96 1khu s VAL 283 Ca 0.53 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.81 1khu s VAL 283 Cb -0.22 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.77 1khu s VAL 283 CO 0.28 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.44 1khu n GLY 284 N 3.92 -0.86 3.90 4.51 0.00 -1.26 -4.21 105.19 111.18 1khu n GLY 284 Ca -0.20 -1.67 -0.28 0.00 0.00 0.00 0.00 46.02 43.87 1khu n GLY 284 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1khu s GLU 285 N -1.94 3.38 0.30 1.61 2.02 -1.26 -4.87 118.70 117.95 1khu s GLU 285 Ca 0.00 0.32 -0.29 0.00 0.02 0.00 0.00 54.97 55.02 1khu s GLU 285 Cb 0.00 -2.25 -0.10 0.00 0.10 0.00 0.00 34.13 31.88 1khu s GLU 285 CO 0.00 -0.46 1.19 0.00 0.02 0.00 0.00 175.26 176.01 1khu s ALA 286 N -2.95 3.45 -0.10 5.21 0.00 -1.26 -4.82 121.76 121.29 1khu s ALA 286 Ca 0.51 1.06 -0.05 0.00 0.00 0.00 0.00 51.96 53.49 1khu s ALA 286 Cb -0.11 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1khu s ALA 286 CO 0.48 -0.38 0.10 0.12 0.00 0.00 0.00 175.76 176.08 1khu s PHE 287 N -1.15 3.45 -0.18 0.00 5.36 -0.23 -4.94 117.98 120.30 1khu s PHE 287 Ca 0.46 0.41 0.01 0.00 -0.96 0.00 0.00 56.93 56.85 1khu s PHE 287 Cb -0.35 -1.88 0.03 0.00 -0.34 0.00 0.00 43.02 40.48 1khu s PHE 287 CO 0.46 0.65 -0.16 -1.01 -1.46 0.00 0.00 175.22 173.71 1khu s HIS 288 N -1.02 2.57 0.08 10.12 3.76 -1.26 -0.20 115.29 129.34 1khu s HIS 288 Ca 0.16 -1.57 -0.31 0.00 -0.15 0.00 0.00 55.06 53.19 1khu s HIS 288 Cb -0.12 -1.77 -0.10 0.00 1.11 0.00 0.00 32.58 31.71 1khu s HIS 288 CO 0.05 -0.76 1.87 0.00 -0.85 0.00 0.00 174.74 175.05 1khu s ALA 289 N 1.35 3.69 -1.14 -1.40 0.00 -1.05 -4.83 121.76 118.38 1khu s ALA 289 Ca 0.03 1.38 0.12 0.00 0.00 0.00 0.00 51.96 53.49 1khu s ALA 289 Cb -0.14 -3.79 0.33 0.00 0.00 0.00 0.00 23.12 19.52 1khu s ALA 289 CO -0.11 -1.35 1.25 -1.13 0.00 0.00 0.00 175.76 174.42 1khu n SER 290 N 6.41 2.97 -3.75 0.00 3.41 -1.26 -3.33 113.62 118.07 1khu n SER 290 Ca 0.18 -1.95 -0.09 0.00 -0.26 0.00 0.00 58.87 56.75 1khu n SER 290 Cb 0.39 -0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 1khu n SER 290 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1khu s SER 291 N -1.01 0.01 0.08 4.04 1.04 -1.26 -4.10 113.70 112.50 1khu s SER 291 Ca 0.26 -0.96 0.28 0.00 0.48 0.00 0.00 55.95 56.00 1khu s SER 291 Cb 0.14 0.66 1.01 0.00 0.10 0.00 0.00 66.02 67.93 1khu s SER 291 CO 0.18 -1.27 1.82 0.35 0.98 0.00 0.00 173.24 175.30 1khu n THR 292 N -0.44 0.22 -4.00 2.02 -2.24 -1.26 -4.46 114.28 104.12 1khu n THR 292 Ca -0.03 -0.11 -0.33 0.00 -2.27 0.00 0.00 64.05 61.31 1khu n THR 292 Cb 0.61 -0.47 -0.15 0.00 -2.10 0.00 0.00 70.33 68.22 1khu n THR 292 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1khu s SER 293 N -3.58 4.44 -0.04 3.42 0.15 -1.26 -1.58 113.70 115.25 1khu s SER 293 Ca 0.12 -1.19 0.05 0.00 0.70 0.00 0.00 55.95 55.64 1khu s SER 293 Cb 0.16 -1.62 -0.01 0.00 -1.71 0.00 0.00 66.02 62.85 1khu s SER 293 CO 0.57 -0.18 -0.19 0.68 1.20 0.00 0.00 173.24 175.32 1khu s VAL 294 N 1.21 1.57 -0.20 4.45 -7.23 -0.91 -4.76 120.40 114.52 1khu s VAL 294 Ca -0.05 -0.81 -0.04 0.00 -1.81 0.00 0.00 61.98 59.27 1khu s VAL 294 Cb -0.19 -1.33 -0.02 0.00 0.56 0.00 0.00 36.38 35.40 1khu s VAL 294 CO -0.04 0.45 -0.03 -0.76 -0.31 0.00 0.00 175.10 174.41 1khu s LEU 295 N -0.16 3.08 -0.52 1.32 1.43 0.12 -1.78 118.68 122.17 1khu s LEU 295 Ca 0.00 -0.28 -0.05 0.00 -1.03 0.00 0.00 54.13 52.77 1khu s LEU 295 Cb -0.11 -1.78 0.14 0.00 0.03 0.00 0.00 46.19 44.47 1khu s LEU 295 CO 0.01 0.04 0.35 -0.69 0.23 0.00 0.00 176.35 176.30 1khu s VAL 296 N 1.11 3.76 0.24 -1.59 1.01 -0.87 -0.03 120.40 124.03 1khu s VAL 296 Ca 0.02 -2.34 0.01 0.00 0.00 0.00 0.00 61.98 59.66 1khu s VAL 296 Cb -0.15 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1khu s VAL 296 CO 0.00 -0.79 0.08 -0.90 0.00 0.00 0.00 175.10 173.49 1khu n ASP 297 N 4.23 2.28 -1.37 3.32 5.68 -1.15 -2.18 116.55 127.37 1khu n ASP 297 Ca 0.01 -1.96 -0.08 0.00 -0.50 0.00 0.00 54.79 52.26 1khu n ASP 297 Cb 0.40 0.08 0.20 0.00 -1.14 0.00 0.00 41.12 40.67 1khu n ASP 297 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1khu n GLY 298 N 2.09 4.81 0.00 6.12 0.00 0.05 -1.08 105.19 117.18 1khu n GLY 298 Ca -0.06 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1khu n GLY 298 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1khu n PHE 299 N -1.11 0.00 -2.23 1.61 3.72 -1.26 -3.35 117.46 114.84 1khu n PHE 299 Ca 0.38 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.76 1khu n PHE 299 Cb 1.16 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.78 1khu n PHE 299 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1khu n THR 300 N 0.00 1.42 -2.66 4.37 -2.24 -1.26 -0.76 114.28 113.15 1khu n THR 300 Ca 0.00 -2.72 -0.43 0.00 -2.27 0.00 0.00 64.05 58.64 1khu n THR 300 Cb 0.00 0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.49 1khu n THR 300 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1khu s ASP 301 N -3.08 7.18 0.23 3.42 2.15 -1.26 -4.84 116.67 120.48 1khu s ASP 301 Ca 0.37 1.50 0.25 0.00 0.43 0.00 0.00 52.55 55.10 1khu s ASP 301 Cb 0.37 -2.55 0.91 0.00 -0.30 0.00 0.00 42.92 41.35 1khu s ASP 301 CO -0.07 -0.54 1.74 -0.81 -0.17 0.00 0.00 175.17 175.32 1khu n PRO 302 N 5.50 0.22 -2.12 4.34 -0.04 -1.26 -4.42 135.00 137.22 1khu n PRO 302 Ca 0.10 0.33 -0.43 0.00 -0.04 0.00 0.00 63.50 63.46 1khu n PRO 302 Cb 0.48 -1.84 -0.03 0.00 -0.04 0.00 0.00 33.50 32.07 1khu n PRO 302 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1khu s SER 303 N -4.34 6.69 -0.13 3.54 0.01 -1.26 -4.81 113.70 113.39 1khu s SER 303 Ca 0.07 2.01 0.15 0.00 1.31 0.00 0.00 55.95 59.50 1khu s SER 303 Cb 0.11 -2.53 0.43 0.00 0.21 0.00 0.00 66.02 64.24 1khu s SER 303 CO 0.48 -0.94 1.34 -3.20 0.41 0.00 0.00 173.24 171.33 1khu n ASN 304 N 7.21 3.42 -1.20 2.44 4.05 -1.26 -4.59 115.26 125.32 1khu n ASN 304 Ca 0.17 -2.81 0.10 0.00 0.45 0.00 0.00 54.58 52.48 1khu n ASN 304 Cb 0.44 -0.45 0.29 0.00 1.23 0.00 0.00 39.78 41.28 1khu n ASN 304 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 1khu n ASN 305 N -0.48 3.88 0.00 1.20 6.94 -1.26 -4.62 115.26 120.92 1khu n ASN 305 Ca 0.18 -2.15 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1khu n ASN 305 Cb 0.75 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.72 1khu n ASN 305 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1khu n LYS 306 N 1.15 0.00 0.14 -3.83 0.00 -1.26 -4.88 118.16 109.47 1khu n LYS 306 Ca 0.21 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.30 1khu n LYS 306 Cb 0.65 0.00 -0.15 0.00 -0.00 0.00 0.00 35.03 35.52 1khu n LYS 306 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.40 176.43 1khu h ASN 307 N 0.00 0.72 -3.05 -5.58 -1.24 -1.92 -3.37 115.58 101.15 1khu h ASN 307 Ca 0.00 -0.78 -0.62 0.00 0.71 0.00 0.00 56.30 55.62 1khu h ASN 307 Cb 0.00 -0.24 -0.10 0.00 0.73 0.00 0.00 38.32 38.71 1khu h ASN 307 CO 0.00 1.61 -0.63 -0.13 -1.29 0.00 0.00 177.43 176.99 1khu s ARG 308 N -2.62 2.65 -0.53 6.67 0.52 -1.26 -0.70 118.95 123.69 1khu s ARG 308 Ca -0.07 -0.89 0.04 0.00 -0.52 0.00 0.00 55.73 54.28 1khu s ARG 308 Cb 0.05 -2.55 0.15 0.00 0.52 0.00 0.00 34.95 33.12 1khu s ARG 308 CO 0.93 0.51 0.33 0.12 0.02 0.00 0.00 175.30 177.21 1khu s PHE 309 N -1.53 2.48 -0.14 -0.53 5.36 0.96 -4.67 117.98 119.91 1khu s PHE 309 Ca 0.28 -2.79 -0.29 0.00 -0.96 0.00 0.00 56.93 53.17 1khu s PHE 309 Cb -0.11 -2.10 -0.01 0.00 -0.34 0.00 0.00 43.02 40.46 1khu s PHE 309 CO 0.20 -0.71 1.04 0.00 -1.46 0.00 0.00 175.22 174.29 1khu n LEU 311 N 5.47 0.61 -0.22 0.00 4.32 -0.24 -4.44 117.00 122.51 1khu n LEU 311 Ca 0.10 0.25 -0.00 0.00 -0.02 0.00 0.00 56.01 56.33 1khu n LEU 311 Cb 0.48 0.00 0.11 0.00 -1.62 0.00 0.00 43.42 42.39 1khu n LEU 311 CO 0.52 -0.05 1.03 1.23 -1.22 0.00 0.00 177.39 178.90 1khu h GLY 312 N 3.94 0.92 1.54 -0.72 0.00 -0.94 -2.24 103.07 105.57 1khu h GLY 312 Ca -0.06 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.10 1khu h GLY 312 CO 0.01 0.04 0.00 1.47 0.00 0.00 0.00 176.54 178.06 1khu n LEU 313 N -4.92 0.00 -4.69 3.11 -0.00 -1.17 -4.83 117.00 104.49 1khu n LEU 313 Ca 0.09 0.27 -0.42 0.00 -0.00 0.00 0.00 56.01 55.94 1khu n LEU 313 Cb 0.25 -0.27 -0.03 0.00 -0.00 0.00 0.00 43.42 43.38 1khu n LEU 313 CO 0.24 -0.08 0.82 -0.76 -0.00 0.00 0.00 177.39 177.61 1khu s LEU 314 N -2.54 4.28 0.27 1.47 1.43 -0.85 -5.04 118.68 117.71 1khu s LEU 314 Ca 0.21 1.66 -0.08 0.00 -1.03 0.00 0.00 54.13 54.88 1khu s LEU 314 Cb 0.14 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.74 1khu s LEU 314 CO 0.31 -0.46 0.58 -0.44 0.23 0.00 0.00 176.35 176.57 1khu s SER 315 N 1.18 6.56 -0.20 2.29 0.01 -1.26 -5.04 113.70 117.24 1khu s SER 315 Ca 0.52 0.88 -0.04 0.00 1.31 0.00 0.00 55.95 58.62 1khu s SER 315 Cb -0.21 -2.21 0.10 0.00 0.21 0.00 0.00 66.02 63.91 1khu s SER 315 CO 0.21 -0.15 0.33 0.21 0.41 0.00 0.00 173.24 174.25 1khu s ASN 316 N -2.70 0.40 0.10 2.44 3.04 -1.26 -4.59 114.94 112.37 1khu s ASN 316 Ca 0.47 0.37 0.19 0.00 0.04 0.00 0.00 52.86 53.93 1khu s ASN 316 Cb -0.11 0.92 0.78 0.00 -1.54 0.00 0.00 41.25 41.30 1khu s ASN 316 CO 0.25 -0.28 1.58 1.33 -3.04 0.00 0.00 177.10 176.94 1khu n VAL 317 N 5.36 0.89 -0.45 -5.21 0.24 -1.26 -2.12 118.33 115.78 1khu n VAL 317 Ca -0.05 0.22 0.09 0.00 -2.04 0.00 0.00 64.34 62.56 1khu n VAL 317 Cb 0.50 -1.04 0.29 0.00 -1.47 0.00 0.00 33.84 32.12 1khu n VAL 317 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1khu n ASN 318 N -1.80 3.96 -4.76 -1.34 5.03 -1.26 -4.99 115.26 110.10 1khu n ASN 318 Ca 0.03 -2.22 -0.40 0.00 0.87 0.00 0.00 54.58 52.86 1khu n ASN 318 Cb 0.20 -0.46 -0.03 0.00 -1.02 0.00 0.00 39.78 38.47 1khu n ASN 318 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1khu s ARG 319 N -1.41 4.44 0.39 3.52 3.52 -0.90 -5.05 118.95 123.47 1khu s ARG 319 Ca 0.43 1.94 0.05 0.00 -0.13 0.00 0.00 55.73 58.02 1khu s ARG 319 Cb 0.25 -3.05 -0.07 0.00 -1.56 0.00 0.00 34.95 30.53 1khu s ARG 319 CO 0.24 -0.02 0.03 0.54 -0.81 0.00 0.00 175.30 175.29 1khu s ASN 320 N -0.81 3.37 0.11 -2.12 6.03 -1.26 -5.02 114.94 115.24 1khu s ASN 320 Ca 0.48 -1.42 -0.29 0.00 -1.03 0.00 0.00 52.86 50.61 1khu s ASN 320 Cb -0.34 -0.16 -0.10 0.00 -3.03 0.00 0.00 41.25 37.61 1khu s ASN 320 CO 0.44 -0.56 1.48 0.77 -2.03 0.00 0.00 177.10 177.20 1khu h SER 321 N 1.84 -1.59 -0.99 3.54 4.64 -1.98 -1.25 113.55 117.75 1khu h SER 321 Ca -0.43 0.20 0.22 0.00 -0.47 0.00 0.00 61.79 61.32 1khu h SER 321 Cb 1.25 0.64 -0.12 0.00 -0.31 0.00 0.00 62.40 63.86 1khu h SER 321 CO 0.76 -0.38 0.58 0.00 -0.87 0.00 0.00 176.83 176.92 1khu h THR 322 N -0.41 0.59 -0.15 2.95 1.03 -1.98 0.51 112.91 115.45 1khu h THR 322 Ca 0.05 -0.22 -0.03 0.00 -0.01 0.00 0.00 66.41 66.21 1khu h THR 322 Cb 0.55 -0.09 -0.01 0.00 -1.07 0.00 0.00 68.15 67.53 1khu h THR 322 CO -0.47 0.11 -0.01 0.40 -0.01 0.00 0.00 175.52 175.55 1khu h ILE 323 N 0.63 1.26 -0.57 0.00 2.04 -1.76 -1.66 117.51 117.45 1khu h ILE 323 Ca 0.61 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.65 1khu h ILE 323 Cb 1.10 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 1khu h ILE 323 CO -0.45 0.26 0.38 -0.08 0.00 0.00 0.00 178.15 178.25 1khu h GLU 324 N -0.01 0.56 -0.42 2.37 4.57 0.38 0.30 114.58 122.33 1khu h GLU 324 Ca 0.04 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1khu h GLU 324 Cb 0.39 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 1khu h GLU 324 CO 0.01 0.37 0.12 -0.97 -1.18 0.00 0.00 179.01 177.36 1khu h ASN 325 N 0.58 0.63 0.12 1.04 -0.00 0.29 -2.60 115.58 115.63 1khu h ASN 325 Ca 0.24 -0.22 -0.12 0.00 -0.00 0.00 0.00 56.30 56.20 1khu h ASN 325 Cb 0.21 -0.16 -0.01 0.00 -0.00 0.00 0.00 38.32 38.36 1khu h ASN 325 CO -0.07 0.68 -0.42 0.74 -0.00 0.00 0.00 177.43 178.36 1khu h THR 326 N 0.55 1.31 -0.23 -3.57 2.02 -0.20 -2.90 112.91 109.88 1khu h THR 326 Ca 0.14 -1.57 -0.04 0.00 0.77 0.00 0.00 66.41 65.70 1khu h THR 326 Cb 0.28 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1khu h THR 326 CO -0.00 0.48 -0.04 0.03 0.37 0.00 0.00 175.52 176.36 1khu h ARG 327 N 0.31 0.36 0.00 6.66 3.08 -0.84 -1.70 114.38 122.26 1khu h ARG 327 Ca 0.03 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1khu h ARG 327 Cb 0.87 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1khu h ARG 327 CO 0.07 0.42 0.00 0.00 -1.07 0.00 0.00 179.97 179.39 1khu h ARG 328 N 0.35 0.00 -0.32 0.04 3.08 -1.25 -2.90 114.38 113.38 1khu h ARG 328 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1khu h ARG 328 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1khu h ARG 328 CO 0.01 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.63 1khu n HIS 329 N -2.65 0.41 -0.04 3.04 8.25 -0.64 -4.43 115.22 119.16 1khu n HIS 329 Ca 0.00 -0.24 -0.13 0.00 -0.26 0.00 0.00 57.72 57.10 1khu n HIS 329 Cb 0.21 -0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.24 1khu n HIS 329 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1khu h ILE 330 N 3.81 1.33 0.00 1.59 2.04 -1.47 -3.39 117.51 121.43 1khu h ILE 330 Ca 0.00 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 64.77 1khu h ILE 330 Cb 0.88 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 1khu h ILE 330 CO 0.00 0.31 0.00 0.61 0.00 0.00 0.00 178.15 179.07 1khu n GLY 331 N 0.04 3.72 0.00 5.37 0.00 -1.26 -1.38 105.19 111.68 1khu n GLY 331 Ca -0.07 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1khu n GLY 331 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1khu n LYS 332 N 13.84 0.55 0.00 1.61 5.02 -1.26 -0.77 118.16 137.15 1khu n LYS 332 Ca 0.00 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1khu n LYS 332 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1khu n LYS 332 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1khu n GLY 333 N 0.58 1.20 3.89 0.72 0.00 -0.48 -4.37 105.19 106.73 1khu n GLY 333 Ca 0.15 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 45.34 1khu n GLY 333 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1khu s VAL 334 N 0.00 5.03 -0.24 1.61 0.11 -0.92 -0.81 120.40 125.18 1khu s VAL 334 Ca 0.00 -0.77 -0.00 0.00 -2.93 0.00 0.00 61.98 58.28 1khu s VAL 334 Cb 0.00 -3.56 0.04 0.00 -1.53 0.00 0.00 36.38 31.33 1khu s VAL 334 CO 0.00 -0.05 -0.09 -2.28 -3.33 0.00 0.00 175.10 169.35 1khu s HIS 335 N -1.69 3.08 -0.23 1.54 5.04 0.85 -2.06 115.29 121.83 1khu s HIS 335 Ca 0.33 -1.78 -0.15 0.00 -1.54 0.00 0.00 55.06 51.92 1khu s HIS 335 Cb -0.11 -2.01 -0.04 0.00 0.04 0.00 0.00 32.58 30.46 1khu s HIS 335 CO 0.26 -0.78 0.39 -0.51 -2.34 0.00 0.00 174.74 171.76 1khu s LEU 336 N 1.26 4.11 -0.15 8.88 1.43 -0.73 -1.13 118.68 132.34 1khu s LEU 336 Ca -0.02 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.53 1khu s LEU 336 Cb -0.17 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.59 1khu s LEU 336 CO -0.06 -0.11 -0.18 -0.47 0.23 0.00 0.00 176.35 175.76 1khu s TYR 337 N 1.58 2.48 -0.23 0.29 5.04 0.73 -2.15 117.35 125.09 1khu s TYR 337 Ca 0.17 -1.37 -0.07 0.00 -2.44 0.00 0.00 57.07 53.37 1khu s TYR 337 Cb -0.15 -1.74 -0.03 0.00 0.35 0.00 0.00 41.96 40.39 1khu s TYR 337 CO 0.08 -0.69 0.05 -0.47 -1.34 0.00 0.00 175.55 173.19 1khu s TYR 338 N 1.21 3.08 -0.28 4.97 6.04 -0.61 0.12 117.35 131.87 1khu s TYR 338 Ca 0.01 -0.40 -0.25 0.00 0.04 0.00 0.00 57.07 56.47 1khu s TYR 338 Cb -0.14 -2.19 0.11 0.00 -1.04 0.00 0.00 41.96 38.71 1khu s TYR 338 CO -0.09 -0.30 0.98 0.54 -1.54 0.00 0.00 175.55 175.14 1khu s VAL 339 N 1.38 0.00 -1.47 3.14 0.11 -0.44 -4.78 120.40 118.34 1khu s VAL 339 Ca 0.05 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.05 1khu s VAL 339 Cb -0.15 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.73 1khu s VAL 339 CO 0.03 0.00 0.52 0.61 -3.33 0.00 0.00 175.10 172.93 1khu n GLY 340 N 2.32 -0.51 2.34 6.54 0.00 -1.26 -1.55 105.19 113.06 1khu n GLY 340 Ca -0.13 0.11 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1khu n GLY 340 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1khu n GLY 341 N -1.38 0.82 2.96 -0.02 0.00 -1.26 -5.00 105.19 101.32 1khu n GLY 341 Ca -0.09 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.38 1khu n GLY 341 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1khu s GLU 342 N -2.14 0.45 -0.09 1.61 2.02 -0.60 -2.35 118.70 117.60 1khu s GLU 342 Ca 0.00 -0.21 -0.01 0.00 0.02 0.00 0.00 54.97 54.77 1khu s GLU 342 Cb 0.00 -0.43 -0.03 0.00 0.10 0.00 0.00 34.13 33.77 1khu s GLU 342 CO 0.00 0.12 -0.03 0.14 0.02 0.00 0.00 175.26 175.51 1khu s VAL 343 N -0.15 4.00 0.10 2.63 -7.23 0.50 -1.33 120.40 118.93 1khu s VAL 343 Ca 0.02 -0.36 0.09 0.00 -1.81 0.00 0.00 61.98 59.93 1khu s VAL 343 Cb -0.02 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1khu s VAL 343 CO -0.00 0.58 -0.22 -0.31 -0.31 0.00 0.00 175.10 174.84 1khu s TYR 344 N -0.62 2.44 -0.11 2.82 2.02 0.32 -0.58 117.35 123.65 1khu s TYR 344 Ca 0.10 -0.31 0.03 0.00 -0.37 0.00 0.00 57.07 56.51 1khu s TYR 344 Cb -0.12 -1.34 -0.00 0.00 -0.40 0.00 0.00 41.96 40.10 1khu s TYR 344 CO 0.02 0.33 -0.22 0.00 -1.57 0.00 0.00 175.55 174.11 1khu s ALA 345 N -1.05 2.27 -0.10 3.71 0.00 -0.01 -0.19 121.76 126.38 1khu s ALA 345 Ca 0.16 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.18 1khu s ALA 345 Cb -0.10 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 22.13 1khu s ALA 345 CO 0.07 0.28 -0.13 -2.00 0.00 0.00 0.00 175.76 173.99 1khu s GLU 346 N 0.34 1.93 -0.80 0.00 2.12 -0.29 -1.28 118.70 120.72 1khu s GLU 346 Ca -0.17 -0.46 -0.22 0.00 0.36 0.00 0.00 54.97 54.48 1khu s GLU 346 Cb -0.18 -1.68 0.07 0.00 0.26 0.00 0.00 34.13 32.61 1khu s GLU 346 CO 0.08 -0.07 1.15 0.00 -0.54 0.00 0.00 175.26 175.88 1khu h LEU 348 N 11.68 0.00-10.29 0.00 4.07 -1.25 1.18 115.31 120.69 1khu h LEU 348 Ca -0.09 -0.10 -0.51 0.00 0.08 0.00 0.00 57.88 57.26 1khu h LEU 348 Cb 1.04 0.00 0.16 0.00 1.08 0.00 0.00 40.66 42.95 1khu h LEU 348 CO 1.22 0.05 0.25 -0.55 -1.08 0.00 0.00 178.44 178.34 1khu s SER 349 N -4.76 3.49 0.11 -0.43 0.15 -0.31 -4.56 113.70 107.39 1khu s SER 349 Ca 0.06 1.88 0.27 0.00 0.70 0.00 0.00 55.95 58.86 1khu s SER 349 Cb 0.11 -2.46 0.88 0.00 -1.71 0.00 0.00 66.02 62.83 1khu s SER 349 CO 0.70 -2.69 1.74 0.47 1.20 0.00 0.00 173.24 174.66 1khu n ASP 350 N -3.95 0.49 -4.77 5.45 8.00 -1.26 -4.31 116.55 116.19 1khu n ASP 350 Ca 0.09 0.42 -0.24 0.00 0.71 0.00 0.00 54.79 55.78 1khu n ASP 350 Cb 0.53 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.10 1khu n ASP 350 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1khu s SER 351 N -3.82 5.30 1.30 -2.24 0.01 -1.26 -4.74 113.70 108.24 1khu s SER 351 Ca 0.11 -0.30 -0.20 0.00 1.31 0.00 0.00 55.95 56.88 1khu s SER 351 Cb 0.15 -1.29 0.32 0.00 0.21 0.00 0.00 66.02 65.42 1khu s SER 351 CO 0.60 0.01 1.02 -0.44 0.41 0.00 0.00 173.24 174.84 1khu s SER 352 N -3.54 0.02 0.03 2.44 0.01 -1.26 -4.44 113.70 106.96 1khu s SER 352 Ca 0.32 0.81 -0.05 0.00 1.31 0.00 0.00 55.95 58.34 1khu s SER 352 Cb -0.08 -1.16 -0.01 0.00 0.21 0.00 0.00 66.02 64.98 1khu s SER 352 CO 0.23 -4.70 0.07 -0.63 0.41 0.00 0.00 173.24 168.63 1khu s ILE 353 N -2.63 0.13 -0.07 1.44 1.01 -1.00 -2.08 121.20 118.00 1khu s ILE 353 Ca 0.70 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 60.30 1khu s ILE 353 Cb -0.13 -0.79 0.01 0.00 0.01 0.00 0.00 42.46 41.56 1khu s ILE 353 CO 0.58 -0.59 -0.15 -0.36 0.00 0.00 0.00 174.94 174.42 1khu s PHE 354 N -2.40 1.68 -0.06 3.97 0.40 -0.76 0.09 117.98 120.91 1khu s PHE 354 Ca -0.07 -0.65 0.05 0.00 -0.60 0.00 0.00 56.93 55.67 1khu s PHE 354 Cb -0.03 -1.20 -0.01 0.00 0.51 0.00 0.00 43.02 42.30 1khu s PHE 354 CO -0.04 -0.31 -0.22 0.08 0.70 0.00 0.00 175.22 175.43 1khu s VAL 355 N 0.61 1.82 -0.24 -0.44 1.01 0.26 -1.80 120.40 121.63 1khu s VAL 355 Ca -0.15 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1khu s VAL 355 Cb -0.16 -1.56 0.03 0.00 0.00 0.00 0.00 36.38 34.69 1khu s VAL 355 CO 0.05 0.51 -0.08 -1.58 0.00 0.00 0.00 175.10 173.99 1khu s GLN 356 N 0.02 2.77 -0.22 2.72 0.74 -0.21 0.83 119.66 126.31 1khu s GLN 356 Ca -0.07 -1.01 -0.03 0.00 0.05 0.00 0.00 55.36 54.30 1khu s GLN 356 Cb -0.14 -2.92 0.10 0.00 1.10 0.00 0.00 33.01 31.15 1khu s GLN 356 CO 0.04 -0.40 0.23 0.45 -0.55 0.00 0.00 175.29 175.06 1khu s SER 357 N 1.29 1.58 0.17 6.67 0.15 -1.26 -2.59 113.70 119.70 1khu s SER 357 Ca -0.00 -0.38 -0.19 0.00 0.70 0.00 0.00 55.95 56.07 1khu s SER 357 Cb -0.17 0.35 0.09 0.00 -1.71 0.00 0.00 66.02 64.58 1khu s SER 357 CO -0.06 -0.34 1.64 0.03 1.20 0.00 0.00 173.24 175.71 1khu h ARG 358 N 8.31 -0.12 -0.51 5.44 3.08 -1.84 0.21 114.38 128.96 1khu h ARG 358 Ca -0.17 0.01 0.10 0.00 0.07 0.00 0.00 59.98 59.99 1khu h ARG 358 Cb 1.13 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.11 1khu h ARG 358 CO 0.30 -0.08 -0.20 -0.97 -1.07 0.00 0.00 179.97 177.95 1khu h ASN 359 N -0.12 -0.70 -0.80 7.04 -1.24 -1.87 0.31 115.58 118.20 1khu h ASN 359 Ca 0.19 0.18 0.01 0.00 0.71 0.00 0.00 56.30 57.38 1khu h ASN 359 Cb 0.42 0.40 -0.04 0.00 0.73 0.00 0.00 38.32 39.83 1khu h ASN 359 CO -0.47 -0.23 0.52 0.00 -1.29 0.00 0.00 177.43 175.97 1khu h ASN 361 N 1.09 0.61 0.17 0.00 -0.26 0.90 -2.06 115.58 116.03 1khu h ASN 361 Ca 0.29 -0.12 -0.01 0.00 -0.56 0.00 0.00 56.30 55.90 1khu h ASN 361 Cb -0.11 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 36.99 1khu h ASN 361 CO -0.06 0.67 -0.08 0.22 -1.06 0.00 0.00 177.43 177.12 1khu h TYR 362 N 0.62 -0.21 -0.91 1.19 5.03 0.10 0.12 116.97 122.90 1khu h TYR 362 Ca 0.13 -0.01 0.11 0.00 2.58 0.00 0.00 58.73 61.55 1khu h TYR 362 Cb 0.36 0.07 -0.07 0.00 1.55 0.00 0.00 36.73 38.64 1khu h TYR 362 CO 0.02 0.11 0.59 1.25 -1.32 0.00 0.00 178.16 178.80 1khu h HIS 363 N -0.55 0.97 0.00 -3.82 2.76 -1.05 -1.66 115.15 111.79 1khu h HIS 363 Ca -0.02 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1khu h HIS 363 Cb 0.42 -0.31 0.00 0.00 1.55 0.00 0.00 27.41 29.07 1khu h HIS 363 CO 0.03 0.41 -0.69 0.45 -1.30 0.00 0.00 177.93 176.83 1khu h HIS 364 N 0.87 0.00 0.00 5.26 3.86 -1.34 -3.48 115.15 120.32 1khu h HIS 364 Ca 0.44 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.65 1khu h HIS 364 Cb 0.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.96 1khu h HIS 364 CO -0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1khu n GLY 365 N 1.32 0.75 3.55 2.45 0.00 0.19 -5.06 105.19 108.38 1khu n GLY 365 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1khu n GLY 365 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1khu s PHE 366 N -2.62 0.13 0.23 1.61 2.99 0.10 -4.97 117.98 115.44 1khu s PHE 366 Ca 0.00 0.44 -0.28 0.00 0.00 0.00 0.00 56.93 57.09 1khu s PHE 366 Cb 0.00 -3.40 -0.09 0.00 0.00 0.00 0.00 43.02 39.53 1khu s PHE 366 CO 0.00 -4.15 0.89 -1.58 -0.00 0.00 0.00 175.22 170.39 1khu s HIS 367 N -2.92 3.94 0.28 0.36 5.65 -1.26 -4.61 115.29 116.72 1khu s HIS 367 Ca 0.71 1.82 0.07 0.00 0.25 0.00 0.00 55.06 57.92 1khu s HIS 367 Cb -0.09 -2.91 0.82 0.00 -1.18 0.00 0.00 32.58 29.22 1khu s HIS 367 CO 0.56 0.45 1.31 -2.30 -0.65 0.00 0.00 174.74 174.11 1khu n PRO 368 N 1.42 -0.06 -0.02 2.88 -0.02 -1.26 0.41 135.00 138.35 1khu n PRO 368 Ca -0.03 1.22 0.12 0.00 -2.02 0.00 0.00 63.50 62.79 1khu n PRO 368 Cb 0.48 -2.02 0.63 0.00 -0.02 0.00 0.00 33.50 32.57 1khu n PRO 368 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1khu n THR 369 N -5.08 0.04 -1.67 3.45 -2.24 -1.26 -4.49 114.28 103.03 1khu n THR 369 Ca 0.24 -0.11 -0.45 0.00 -2.27 0.00 0.00 64.05 61.46 1khu n THR 369 Cb 0.80 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1khu n THR 369 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1khu n THR 370 N -0.46 0.90 -3.83 4.28 -1.04 0.16 -4.92 114.28 109.38 1khu n THR 370 Ca 0.18 -0.22 -0.36 0.00 -2.04 0.00 0.00 64.05 61.61 1khu n THR 370 Cb 0.18 -1.46 -0.13 0.00 -1.82 0.00 0.00 70.33 67.10 1khu n THR 370 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1khu s VAL 371 N -0.01 3.75 -0.23 12.58 1.01 -1.26 -4.36 120.40 131.88 1khu s VAL 371 Ca 0.69 -0.48 -0.13 0.00 0.00 0.00 0.00 61.98 62.06 1khu s VAL 371 Cb -0.66 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1khu s VAL 371 CO 0.49 0.31 0.29 0.00 0.00 0.00 0.00 175.10 176.19 1khu s LYS 373 N 1.36 4.59 -0.42 0.00 2.20 -1.26 0.92 119.74 127.12 1khu s LYS 373 Ca 0.13 1.27 0.01 0.00 -0.36 0.00 0.00 55.97 57.03 1khu s LYS 373 Cb -0.14 -3.39 0.11 0.00 -1.51 0.00 0.00 37.83 32.89 1khu s LYS 373 CO 0.07 0.17 0.17 0.42 -0.36 0.00 0.00 175.35 175.82 1khu s ILE 374 N 0.24 2.78 0.92 5.43 1.01 0.11 -4.95 121.20 126.74 1khu s ILE 374 Ca 0.44 -2.46 -0.13 0.00 0.00 0.00 0.00 60.65 58.50 1khu s ILE 374 Cb -0.21 -2.95 0.04 0.00 0.01 0.00 0.00 42.46 39.34 1khu s ILE 374 CO 0.26 -0.69 0.53 -2.65 0.00 0.00 0.00 174.94 172.40 1khu n PRO 375 N 4.11 -0.23 -1.65 2.79 -0.02 -1.26 -2.38 135.00 136.35 1khu n PRO 375 Ca 0.03 -0.02 -0.44 0.00 -2.02 0.00 0.00 63.50 61.05 1khu n PRO 375 Cb 0.40 -1.93 -0.04 0.00 -0.02 0.00 0.00 33.50 31.91 1khu n PRO 375 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1khu n SER 376 N -1.62 3.82 0.00 2.55 2.88 -1.26 -1.60 113.62 118.40 1khu n SER 376 Ca 0.08 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.41 1khu n SER 376 Cb 0.53 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 1khu n SER 376 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1khu n GLY 377 N 4.77 0.75 4.03 0.46 0.00 0.41 -5.03 105.19 110.58 1khu n GLY 377 Ca 0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 1khu n GLY 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1khu s SER 379 N -4.74 -0.00 -0.13 0.00 0.15 -1.26 -2.34 113.70 105.38 1khu s SER 379 Ca 0.64 -0.07 -0.06 0.00 0.70 0.00 0.00 55.95 57.16 1khu s SER 379 Cb -0.05 0.21 0.06 0.00 -1.71 0.00 0.00 66.02 64.53 1khu s SER 379 CO 0.41 -0.23 0.29 -0.22 1.20 0.00 0.00 173.24 174.69 1khu s LEU 380 N -0.82 0.07 -0.14 3.45 2.96 -0.40 -5.00 118.68 118.81 1khu s LEU 380 Ca -0.09 0.64 -0.29 0.00 -0.22 0.00 0.00 54.13 54.16 1khu s LEU 380 Cb -0.05 0.87 -0.03 0.00 0.50 0.00 0.00 46.19 47.48 1khu s LEU 380 CO 0.01 -0.19 1.43 -0.75 -1.32 0.00 0.00 176.35 175.52 1khu s LYS 381 N 1.67 4.17 0.00 1.98 2.20 -1.26 -0.83 119.74 127.66 1khu s LYS 381 Ca -0.06 1.82 0.15 0.00 -0.36 0.00 0.00 55.97 57.52 1khu s LYS 381 Cb -0.11 -3.87 0.03 0.00 -1.51 0.00 0.00 37.83 32.37 1khu s LYS 381 CO -0.10 -0.82 0.85 0.44 -0.36 0.00 0.00 175.35 175.37 1khu n ILE 382 N 5.53 0.00 -3.64 5.43 -5.35 0.25 -4.93 119.36 116.66 1khu n ILE 382 Ca 0.15 -0.38 -0.14 0.00 -0.27 0.00 0.00 62.75 62.12 1khu n ILE 382 Cb 0.44 1.21 -0.07 0.00 -1.74 0.00 0.00 39.64 39.48 1khu n ILE 382 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 1khu s PHE 383 N -1.67 -0.78 -0.28 4.28 5.36 -1.00 -4.07 117.98 119.81 1khu s PHE 383 Ca 0.14 1.89 -0.03 0.00 -0.96 0.00 0.00 56.93 57.96 1khu s PHE 383 Cb 0.12 0.28 0.09 0.00 -0.34 0.00 0.00 43.02 43.17 1khu s PHE 383 CO 0.33 -0.38 0.11 1.21 -1.46 0.00 0.00 175.22 175.04 1khu s ASN 384 N 0.42 3.48 0.45 6.13 2.47 -1.26 -0.37 114.94 126.26 1khu s ASN 384 Ca -0.00 -1.27 0.22 0.00 0.42 0.00 0.00 52.86 52.23 1khu s ASN 384 Cb -0.05 -0.47 1.05 0.00 -1.45 0.00 0.00 41.25 40.33 1khu s ASN 384 CO 0.00 -0.42 1.91 -0.55 -3.72 0.00 0.00 177.10 174.32 1khu h ASN 385 N 8.33 0.00 -0.59 -4.21 7.08 -1.87 -2.69 115.58 121.64 1khu h ASN 385 Ca -0.18 0.00 0.08 0.00 -3.08 0.00 0.00 56.30 53.12 1khu h ASN 385 Cb 1.03 0.00 -0.06 0.00 -2.08 0.00 0.00 38.32 37.21 1khu h ASN 385 CO 0.42 0.24 0.25 -0.61 -2.08 0.00 0.00 177.43 175.66 1khu h GLN 386 N 0.00 0.45 0.00 4.14 -0.00 -1.96 1.37 115.11 119.11 1khu h GLN 386 Ca -0.00 -0.03 -0.12 0.00 -0.00 0.00 0.00 58.65 58.50 1khu h GLN 386 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 27.95 1khu h GLN 386 CO 0.03 0.30 -0.59 0.93 0.00 0.00 0.00 178.83 179.50 1khu h GLU 387 N 0.46 0.00 -0.25 1.69 5.08 -1.88 -2.31 114.58 117.37 1khu h GLU 387 Ca 0.28 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.48 1khu h GLU 387 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1khu h GLU 387 CO -0.25 0.59 -0.49 0.35 -1.00 0.00 0.00 179.01 178.20 1khu h PHE 388 N 0.00 0.99 -0.99 4.33 3.04 -0.54 -0.66 116.94 123.11 1khu h PHE 388 Ca -0.01 -0.36 0.03 0.00 3.98 0.00 0.00 57.97 61.62 1khu h PHE 388 Cb 1.09 -0.18 -0.06 0.00 2.56 0.00 0.00 35.95 39.36 1khu h PHE 388 CO 0.00 1.16 0.65 0.00 -2.02 0.00 0.00 178.31 178.10 1khu h ALA 389 N 0.65 1.30 -0.37 2.41 0.00 0.18 0.12 119.26 123.54 1khu h ALA 389 Ca 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1khu h ALA 389 Cb 1.10 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1khu h ALA 389 CO 0.11 0.56 0.20 0.37 0.00 0.00 0.00 179.25 180.50 1khu h GLN 390 N 1.27 0.52 -0.79 0.00 4.15 -1.10 -0.73 115.11 118.44 1khu h GLN 390 Ca 0.39 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.73 1khu h GLN 390 Cb -0.03 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.52 1khu h GLN 390 CO -0.12 0.43 0.43 -0.07 -1.93 0.00 0.00 178.83 177.58 1khu h LEU 391 N 0.48 0.99 -0.58 -2.39 -0.00 -0.19 -1.33 115.31 112.28 1khu h LEU 391 Ca 0.13 -0.10 -0.02 0.00 -0.00 0.00 0.00 57.88 57.90 1khu h LEU 391 Cb 0.06 -0.25 -0.03 0.00 -0.00 0.00 0.00 40.66 40.44 1khu h LEU 391 CO -0.02 0.80 0.30 0.25 -0.00 0.00 0.00 178.44 179.77 1khu h LEU 392 N 1.10 0.75 -0.08 1.67 5.85 -0.43 -2.75 115.31 121.41 1khu h LEU 392 Ca 0.28 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1khu h LEU 392 Cb 0.03 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 1khu h LEU 392 CO -0.04 0.65 0.03 0.00 -0.34 0.00 0.00 178.44 178.73 1khu h ALA 393 N 1.13 0.10 -0.11 1.25 0.00 -0.75 -1.49 119.26 119.41 1khu h ALA 393 Ca 0.20 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1khu h ALA 393 Cb 0.08 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1khu h ALA 393 CO -0.03 -0.31 0.23 1.96 0.00 0.00 0.00 179.25 181.10 1khu h GLN 394 N -0.03 0.00 -0.01 0.00 4.20 -1.08 0.21 115.11 118.40 1khu h GLN 394 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1khu h GLN 394 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1khu h GLN 394 CO -0.00 0.00 -0.46 -1.13 -0.67 0.00 0.00 178.83 176.57 1khu n SER 395 N -3.35 1.69 -0.71 1.46 3.41 -0.98 -4.46 113.62 110.69 1khu n SER 395 Ca 0.00 -1.34 0.53 0.00 -0.26 0.00 0.00 58.87 57.80 1khu n SER 395 Cb 0.32 0.54 0.82 0.00 -0.26 0.00 0.00 64.21 65.63 1khu n SER 395 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 1khu h VAL 396 N 1.82 0.00 -1.99 -3.33 3.04 0.11 -2.72 116.25 113.17 1khu h VAL 396 Ca 0.00 0.00 -0.47 0.00 -1.01 0.00 0.00 66.70 65.22 1khu h VAL 396 Cb 0.62 0.00 -0.32 0.00 -2.01 0.00 0.00 31.29 29.58 1khu h VAL 396 CO 0.00 0.00 -0.84 0.54 -1.01 0.00 0.00 177.57 176.26 1khu s ASN 397 N -3.85 0.67 0.00 3.17 2.20 -1.26 -4.85 114.94 111.01 1khu s ASN 397 Ca -0.05 -2.65 0.00 0.00 -0.94 0.00 0.00 52.86 49.22 1khu s ASN 397 Cb 0.27 0.22 0.00 0.00 -2.00 0.00 0.00 41.25 39.73 1khu s ASN 397 CO 0.89 -0.14 0.41 1.57 -2.94 0.00 0.00 177.10 176.88 1khu n HIS 398 N 2.94 0.00 0.00 1.54 -0.00 -1.03 -5.13 115.22 113.55 1khu n HIS 398 Ca 0.26 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.44 1khu n HIS 398 Cb 0.50 0.23 0.00 0.00 -0.12 0.00 0.00 29.99 30.60 1khu n HIS 398 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1khu n GLY 399 N 0.00 3.14 0.16 1.57 0.00 -1.26 -4.56 105.19 104.23 1khu n GLY 399 Ca 0.00 -1.61 0.01 0.00 0.00 0.00 0.00 46.02 44.42 1khu n GLY 399 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1khu h PHE 400 N 0.00 0.00 -0.09 1.61 3.04 -1.96 -2.55 116.94 117.00 1khu h PHE 400 Ca 0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1khu h PHE 400 Cb 0.00 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 1khu h PHE 400 CO 0.00 0.50 0.03 1.49 -2.02 0.00 0.00 178.31 178.31 1khu h GLU 401 N 0.00 0.13 0.00 1.11 4.81 -1.99 0.99 114.58 119.63 1khu h GLU 401 Ca -0.01 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1khu h GLU 401 Cb 0.95 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.30 1khu h GLU 401 CO 0.07 0.28 -0.48 1.79 -0.73 0.00 0.00 179.01 179.94 1khu h THR 402 N -0.04 1.12 0.08 0.32 1.35 -1.78 -2.21 112.91 111.75 1khu h THR 402 Ca 0.03 -1.77 -0.28 0.00 -0.55 0.00 0.00 66.41 63.84 1khu h THR 402 Cb 0.20 2.02 0.02 0.00 -1.73 0.00 0.00 68.15 68.66 1khu h THR 402 CO -0.00 0.47 -1.15 1.62 -0.25 0.00 0.00 175.52 176.21 1khu h VAL 403 N 0.00 1.33 -0.30 6.82 3.04 -1.33 -3.09 116.25 122.71 1khu h VAL 403 Ca -0.00 -2.48 -0.01 0.00 -1.01 0.00 0.00 66.70 63.20 1khu h VAL 403 Cb 0.98 2.60 -0.02 0.00 -2.01 0.00 0.00 31.29 32.85 1khu h VAL 403 CO 0.06 0.75 0.15 0.22 -1.01 0.00 0.00 177.57 177.74 1khu h TYR 404 N 0.27 0.40 -0.30 3.17 -0.00 -0.67 -2.01 116.97 117.82 1khu h TYR 404 Ca -0.15 -0.00 0.01 0.00 -0.00 0.00 0.00 58.73 58.59 1khu h TYR 404 Cb 1.81 -0.13 -0.02 0.00 -0.00 0.00 0.00 36.73 38.40 1khu h TYR 404 CO 0.10 0.30 0.20 0.93 -0.00 0.00 0.00 178.16 179.69 1khu h GLU 405 N 0.41 0.35 0.00 1.82 4.39 -1.32 -2.24 114.58 118.01 1khu h GLU 405 Ca 0.11 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1khu h GLU 405 Cb 0.04 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1khu h GLU 405 CO -0.02 0.23 0.00 1.28 -1.16 0.00 0.00 179.01 179.35 1khu n LEU 406 N -4.49 0.00 -0.35 1.33 4.77 -0.76 -1.87 117.00 115.64 1khu n LEU 406 Ca 0.02 0.45 -0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1khu n LEU 406 Cb 0.10 -0.45 0.11 0.00 -2.33 0.00 0.00 43.42 40.85 1khu n LEU 406 CO 0.35 -0.40 1.26 0.74 -1.33 0.00 0.00 177.39 178.01 1khu h THR 407 N 0.00 1.21 -0.76 -5.08 2.02 -1.56 -1.88 112.91 106.85 1khu h THR 407 Ca 0.00 -0.42 0.13 0.00 0.77 0.00 0.00 66.41 66.89 1khu h THR 407 Cb 0.06 -0.13 -0.09 0.00 -1.74 0.00 0.00 68.15 66.25 1khu h THR 407 CO 0.00 0.22 0.34 0.11 0.37 0.00 0.00 175.52 176.57 1khu h LYS 408 N 1.23 0.51 -0.68 6.66 1.57 -1.61 0.78 116.57 125.04 1khu h LYS 408 Ca 0.35 -0.03 0.18 0.00 -1.87 0.00 0.00 60.65 59.28 1khu h LYS 408 Cb -0.09 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 1khu h LYS 408 CO -0.09 0.34 0.47 0.52 -0.57 0.00 0.00 179.45 180.12 1khu h MET 409 N 0.53 0.12 0.00 3.15 2.86 -1.52 -0.67 114.93 119.38 1khu h MET 409 Ca 0.40 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 58.04 1khu h MET 409 Cb 0.56 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1khu h MET 409 CO -0.35 0.08 0.00 0.00 1.06 0.00 0.00 176.91 177.69 1khu s THR 411 N -3.20 3.57 0.00 0.00 -4.23 -0.26 -0.32 115.64 111.20 1khu s THR 411 Ca 0.07 -1.03 0.03 0.00 -1.18 0.00 0.00 61.69 59.58 1khu s THR 411 Cb 0.11 -2.63 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 1khu s THR 411 CO 0.45 0.22 -0.09 -0.63 -0.54 0.00 0.00 174.62 174.03 1khu s ILE 412 N -1.14 0.73 0.06 2.99 1.01 0.20 -4.70 121.20 120.35 1khu s ILE 412 Ca 0.20 -0.50 0.07 0.00 0.00 0.00 0.00 60.65 60.43 1khu s ILE 412 Cb -0.11 -0.63 -0.03 0.00 0.01 0.00 0.00 42.46 41.70 1khu s ILE 412 CO 0.12 0.13 -0.20 -0.13 0.00 0.00 0.00 174.94 174.85 1khu s ARG 413 N -0.42 1.28 -0.25 2.79 0.52 -1.07 0.25 118.95 122.05 1khu s ARG 413 Ca 0.02 -1.00 -0.20 0.00 -0.52 0.00 0.00 55.73 54.03 1khu s ARG 413 Cb -0.04 -1.44 0.07 0.00 0.52 0.00 0.00 34.95 34.06 1khu s ARG 413 CO -0.00 0.36 0.65 0.00 0.02 0.00 0.00 175.30 176.33 1khu s MET 414 N -1.41 0.72 0.37 3.54 0.23 -0.77 -1.04 119.30 120.94 1khu s MET 414 Ca 0.07 1.01 0.08 0.00 -1.03 0.00 0.00 55.69 55.82 1khu s MET 414 Cb -0.09 0.27 -0.02 0.00 -1.53 0.00 0.00 34.83 33.45 1khu s MET 414 CO 0.03 -0.12 0.34 -1.54 -2.03 0.00 0.00 175.02 171.70 1khu s SER 415 N 0.86 5.21 -0.03 -1.18 1.04 -0.74 -1.14 113.70 117.71 1khu s SER 415 Ca -0.04 -0.59 0.01 0.00 0.48 0.00 0.00 55.95 55.81 1khu s SER 415 Cb -0.05 -0.80 -0.03 0.00 0.10 0.00 0.00 66.02 65.23 1khu s SER 415 CO -0.07 -0.49 -0.02 -0.36 0.98 0.00 0.00 173.24 173.28 1khu s PHE 416 N -2.37 3.04 0.00 5.02 0.08 0.14 -1.82 117.98 122.06 1khu s PHE 416 Ca 0.44 0.07 0.00 0.00 0.12 0.00 0.00 56.93 57.57 1khu s PHE 416 Cb -0.05 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.71 1khu s PHE 416 CO 0.27 0.43 0.00 0.28 -0.10 0.00 0.00 175.22 176.10 1khu n VAL 417 N 1.71 0.00 -3.23 -0.44 0.31 -0.88 -4.64 118.33 111.16 1khu n VAL 417 Ca -0.16 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.75 1khu n VAL 417 Cb 0.53 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.38 1khu n VAL 417 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1khu s LYS 418 N 0.00 3.32 1.04 5.55 -0.14 -1.26 -4.79 119.74 123.46 1khu s LYS 418 Ca 0.00 -0.45 -0.12 0.00 -1.36 0.00 0.00 55.97 54.04 1khu s LYS 418 Cb 0.00 -3.91 0.21 0.00 -1.68 0.00 0.00 37.83 32.45 1khu s LYS 418 CO 0.00 -0.83 1.07 0.20 -0.76 0.00 0.00 175.35 175.04 1khu s GLY 419 N 1.85 1.60 0.25 -3.33 0.00 -1.26 -4.84 107.32 101.60 1khu s GLY 419 Ca 0.17 0.08 -0.18 0.00 0.00 0.00 0.00 44.72 44.79 1khu s GLY 419 CO 0.15 0.67 0.61 0.66 0.00 0.00 0.00 173.10 175.19 1khu s TRP 420 N -2.62 -0.02 0.00 1.90 -2.14 -1.26 -4.74 118.94 110.07 1khu s TRP 420 Ca 0.67 -0.39 0.00 0.00 2.66 0.00 0.00 56.10 59.04 1khu s TRP 420 Cb -0.23 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.64 1khu s TRP 420 CO 0.61 -1.10 0.00 0.41 -2.66 0.00 0.00 176.95 174.21 1khu n GLY 421 N -0.41 -1.56 3.56 3.67 0.00 0.99 -4.68 105.19 106.75 1khu n GLY 421 Ca -0.05 -1.32 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 1khu n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1khu n ALA 422 N 1.78 -1.99 -0.89 4.61 0.00 -1.26 -2.21 120.51 120.55 1khu n ALA 422 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1khu n ALA 422 Cb 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.36 1khu n ALA 422 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1khu n GLU 423 N -4.64 -0.04 -4.11 0.00 -0.58 -1.26 -4.92 120.64 105.09 1khu n GLU 423 Ca 0.07 0.01 -0.12 0.00 -0.42 0.00 0.00 57.16 56.70 1khu n GLU 423 Cb 0.53 -3.04 -0.06 0.00 -0.57 0.00 0.00 31.44 28.29 1khu n GLU 423 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1khu s TYR 424 N -3.12 0.92 -0.09 -0.32 2.02 -0.94 -4.96 117.35 110.86 1khu s TYR 424 Ca 0.00 -1.16 -0.01 0.00 -0.37 0.00 0.00 57.07 55.53 1khu s TYR 424 Cb 0.00 -0.18 -0.01 0.00 -0.40 0.00 0.00 41.96 41.37 1khu s TYR 424 CO 0.00 -0.93 0.05 1.25 -1.57 0.00 0.00 175.55 174.36 1khu h HIS 425 N 2.30 -0.04 -2.32 2.71 -0.00 -1.90 -3.45 115.15 112.46 1khu h HIS 425 Ca -0.29 -0.00 -0.61 0.00 -0.00 0.00 0.00 60.37 59.46 1khu h HIS 425 Cb 1.25 0.01 0.08 0.00 -0.00 0.00 0.00 27.41 28.75 1khu h HIS 425 CO 0.82 -0.03 0.49 0.54 -0.00 0.00 0.00 177.93 179.76 1khu n ARG 426 N -4.59 1.67 -0.10 5.26 1.74 -1.26 -4.83 116.66 114.56 1khu n ARG 426 Ca -0.01 0.60 -0.17 0.00 -0.77 0.00 0.00 57.85 57.50 1khu n ARG 426 Cb 0.02 -2.20 -0.08 0.00 -1.02 0.00 0.00 32.46 29.17 1khu n ARG 426 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1khu n GLN 427 N 2.05 0.46 -3.25 5.56 1.13 -1.26 -0.01 117.38 122.06 1khu n GLN 427 Ca 0.14 0.14 -0.35 0.00 -1.94 0.00 0.00 57.00 54.99 1khu n GLN 427 Cb 0.28 -1.32 -0.06 0.00 0.11 0.00 0.00 30.24 29.26 1khu n GLN 427 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1khu s ASP 428 N -6.27 6.88 0.49 1.08 -1.08 -1.26 -2.93 116.67 113.58 1khu s ASP 428 Ca -0.27 1.20 0.31 0.00 -0.52 0.00 0.00 52.55 53.27 1khu s ASP 428 Cb 0.08 -2.34 1.14 0.00 -1.46 0.00 0.00 42.92 40.34 1khu s ASP 428 CO 0.41 0.02 1.89 1.62 0.52 0.00 0.00 175.17 179.63 1khu h VAL 429 N 2.60 0.00 -0.06 1.11 3.04 -1.96 -1.67 116.25 119.32 1khu h VAL 429 Ca -0.48 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 64.64 1khu h VAL 429 Cb 1.19 1.54 0.00 0.00 -2.01 0.00 0.00 31.29 32.00 1khu h VAL 429 CO 0.66 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 177.57 1khu n THR 430 N -2.98 0.11 0.55 3.17 -2.24 -1.26 -2.05 114.28 109.58 1khu n THR 430 Ca 0.01 -0.09 0.06 0.00 -2.27 0.00 0.00 64.05 61.76 1khu n THR 430 Cb 0.34 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.50 1khu n THR 430 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1khu n SER 431 N -0.26 1.03 -4.90 3.42 2.88 -0.63 -3.69 113.62 111.48 1khu n SER 431 Ca 0.02 -1.02 -0.32 0.00 -1.33 0.00 0.00 58.87 56.23 1khu n SER 431 Cb 0.09 0.69 -0.05 0.00 -0.75 0.00 0.00 64.21 64.20 1khu n SER 431 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1khu s THR 432 N -1.80 5.25 -0.39 2.46 -4.23 -0.87 -4.97 115.64 111.09 1khu s THR 432 Ca 0.08 -0.05 0.26 0.00 -1.18 0.00 0.00 61.69 60.79 1khu s THR 432 Cb 0.10 -3.62 0.34 0.00 1.34 0.00 0.00 72.50 70.66 1khu s THR 432 CO 0.38 0.13 1.72 1.55 -0.54 0.00 0.00 174.62 177.86 1khu h PRO 433 N 3.12 0.00 -2.07 3.99 0.13 -1.90 -2.17 132.00 133.09 1khu h PRO 433 Ca -0.46 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.33 1khu h PRO 433 Cb 1.17 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 31.98 1khu h PRO 433 CO 0.72 0.00 -0.65 0.00 -0.23 0.00 0.00 178.00 177.85 1khu s TRP 435 N 2.10 0.44 0.32 0.00 1.48 -0.89 0.24 118.94 122.63 1khu s TRP 435 Ca 0.12 -0.60 0.06 0.00 -1.06 0.00 0.00 56.10 54.61 1khu s TRP 435 Cb -0.14 -0.29 -0.06 0.00 -1.16 0.00 0.00 33.47 31.81 1khu s TRP 435 CO -0.24 -0.18 -0.00 0.96 -4.06 0.00 0.00 176.95 173.42 1khu s ILE 436 N -1.84 1.52 -0.05 0.66 -4.36 -0.30 -0.93 121.20 115.91 1khu s ILE 436 Ca -0.10 -2.06 0.02 0.00 -0.26 0.00 0.00 60.65 58.25 1khu s ILE 436 Cb -0.07 -2.67 0.02 0.00 1.25 0.00 0.00 42.46 40.99 1khu s ILE 436 CO -0.02 -0.14 -0.08 -0.70 0.24 0.00 0.00 174.94 174.25 1khu s GLU 437 N -3.79 1.20 -0.16 0.37 2.12 -0.66 -1.85 118.70 115.94 1khu s GLU 437 Ca 0.33 -0.24 -0.01 0.00 0.36 0.00 0.00 54.97 55.41 1khu s GLU 437 Cb 0.07 -1.08 -0.01 0.00 0.26 0.00 0.00 34.13 33.36 1khu s GLU 437 CO 0.14 -0.03 -0.10 0.42 -0.54 0.00 0.00 175.26 175.15 1khu s ILE 438 N 0.80 3.21 -0.25 -3.70 1.01 0.71 -2.02 121.20 120.95 1khu s ILE 438 Ca -0.13 -0.59 -0.08 0.00 0.00 0.00 0.00 60.65 59.85 1khu s ILE 438 Cb -0.15 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 1khu s ILE 438 CO 0.02 0.50 0.10 -1.00 0.00 0.00 0.00 174.94 174.55 1khu s HIS 439 N 0.64 3.12 -0.51 3.97 3.76 -0.81 0.61 115.29 126.07 1khu s HIS 439 Ca -0.06 -0.29 -0.23 0.00 -0.15 0.00 0.00 55.06 54.33 1khu s HIS 439 Cb -0.15 -2.26 0.04 0.00 1.11 0.00 0.00 32.58 31.31 1khu s HIS 439 CO 0.03 -0.30 0.84 -0.51 -0.85 0.00 0.00 174.74 173.94 1khu s LEU 440 N 1.61 4.31 0.14 0.89 2.01 0.56 -2.47 118.68 125.72 1khu s LEU 440 Ca 0.06 -0.38 -0.17 0.00 0.01 0.00 0.00 54.13 53.64 1khu s LEU 440 Cb -0.15 -2.80 -0.02 0.00 0.01 0.00 0.00 46.19 43.23 1khu s LEU 440 CO 0.05 -1.07 1.78 0.45 1.01 0.00 0.00 176.35 178.56 1khu h HIS 441 N 9.16 0.43 0.52 0.29 3.86 -1.78 -1.35 115.15 126.27 1khu h HIS 441 Ca -0.26 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.93 1khu h HIS 441 Cb 1.08 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 1khu h HIS 441 CO 0.85 0.30 -0.44 0.78 0.86 0.00 0.00 177.93 180.28 1khu h GLY 442 N 0.43 -1.20 0.11 2.45 0.00 -1.85 0.28 103.07 103.29 1khu h GLY 442 Ca 0.12 0.54 0.14 0.00 0.00 0.00 0.00 47.33 48.13 1khu h GLY 442 CO -0.02 -0.38 0.25 -2.55 0.00 0.00 0.00 176.54 173.84 1khu h PRO 443 N -0.93 0.37 -0.74 4.80 0.11 -1.93 0.07 132.00 133.75 1khu h PRO 443 Ca -0.07 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1khu h PRO 443 Cb 0.79 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 31.78 1khu h PRO 443 CO -0.01 0.25 0.37 -0.07 -0.21 0.00 0.00 178.00 178.33 1khu h LEU 444 N 0.38 0.95 -0.15 2.35 3.38 -0.94 -1.03 115.31 120.25 1khu h LEU 444 Ca 0.40 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.21 1khu h LEU 444 Cb 0.62 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1khu h LEU 444 CO -0.42 0.79 -0.14 -0.61 0.09 0.00 0.00 178.44 178.15 1khu h GLN 445 N 1.05 0.37 -0.65 1.13 4.15 0.11 -1.78 115.11 119.49 1khu h GLN 445 Ca 0.26 -0.19 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 1khu h GLN 445 Cb 0.09 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.75 1khu h GLN 445 CO -0.04 0.74 0.31 -1.49 -1.93 0.00 0.00 178.83 176.42 1khu h TRP 446 N 0.01 0.91 0.00 3.99 6.55 -0.93 -0.27 115.95 126.20 1khu h TRP 446 Ca 0.03 -0.03 -0.05 0.00 0.95 0.00 0.00 58.89 59.78 1khu h TRP 446 Cb 0.66 -0.29 -0.01 0.00 -0.86 0.00 0.00 29.16 28.67 1khu h TRP 446 CO 0.08 0.66 -0.25 1.25 -1.05 0.00 0.00 178.44 179.13 1khu h LEU 447 N 0.91 0.00 -0.29 -4.49 5.85 -1.06 -2.66 115.31 113.57 1khu h LEU 447 Ca 0.23 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.79 1khu h LEU 447 Cb 0.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1khu h LEU 447 CO -0.03 0.25 -0.44 -0.78 -0.34 0.00 0.00 178.44 177.10 1khu h ASP 448 N 0.00 0.89 -0.85 1.25 1.82 -0.15 -1.34 116.42 118.04 1khu h ASP 448 Ca -0.00 -0.52 0.12 0.00 -0.39 0.00 0.00 57.03 56.25 1khu h ASP 448 Cb 0.49 -0.25 -0.09 0.00 0.68 0.00 0.00 39.33 40.16 1khu h ASP 448 CO 0.03 1.23 0.46 0.11 -1.61 0.00 0.00 179.24 179.46 1khu h LYS 449 N 0.57 0.68 0.06 0.28 6.56 -1.05 -2.08 116.57 121.59 1khu h LYS 449 Ca 0.03 -0.04 -0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1khu h LYS 449 Cb 1.04 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.55 1khu h LYS 449 CO 0.10 0.45 -0.03 0.28 -2.06 0.00 0.00 179.45 178.20 1khu h VAL 450 N 0.71 1.19 -0.77 0.50 2.07 -1.45 -2.63 116.25 115.87 1khu h VAL 450 Ca 0.44 -1.54 0.17 0.00 0.82 0.00 0.00 66.70 66.58 1khu h VAL 450 Cb 0.53 2.10 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 1khu h VAL 450 CO -0.31 0.35 0.52 -0.07 0.02 0.00 0.00 177.57 178.07 1khu h LEU 451 N -0.86 0.34 0.05 2.57 3.38 -1.14 0.75 115.31 120.39 1khu h LEU 451 Ca -0.01 0.02 -0.26 0.00 0.09 0.00 0.00 57.88 57.72 1khu h LEU 451 Cb 0.63 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.36 1khu h LEU 451 CO 0.01 0.16 -1.06 0.71 0.09 0.00 0.00 178.44 178.36 1khu h THR 452 N 0.35 1.30 -0.30 0.22 1.35 -1.47 0.40 112.91 114.77 1khu h THR 452 Ca 0.38 -2.31 -0.04 0.00 -0.55 0.00 0.00 66.41 63.89 1khu h THR 452 Cb 0.97 2.55 -0.02 0.00 -1.73 0.00 0.00 68.15 69.92 1khu h THR 452 CO -0.11 0.70 0.00 1.56 -0.25 0.00 0.00 175.52 177.43 1khu h GLN 453 N 0.27 0.46 0.00 4.72 4.20 -0.83 -0.36 115.11 123.56 1khu h GLN 453 Ca -0.15 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.48 1khu h GLN 453 Cb 1.73 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.44 1khu h GLN 453 CO 0.21 0.48 -0.41 -1.33 -0.67 0.00 0.00 178.83 177.11 1khu n MET 454 N -4.31 0.01 0.00 1.46 2.81 0.14 -4.99 117.12 112.24 1khu n MET 454 Ca 0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1khu n MET 454 Cb 0.22 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 1khu n MET 454 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1khu n GLY 455 N 1.49 0.00 0.35 3.03 0.00 0.14 -4.74 105.19 105.46 1khu n GLY 455 Ca 0.06 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.25 1khu n GLY 455 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1khu h SER 456 N 0.00 0.00 -3.03 1.61 0.87 -1.89 -3.43 113.55 107.68 1khu h SER 456 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1khu h SER 456 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1khu h SER 456 CO 0.00 0.00 0.00 -0.81 -0.53 0.00 0.00 176.83 175.49 1khu n PRO 457 N -4.39 1.71 -3.61 2.24 -0.04 -1.26 -5.15 135.00 124.49 1khu n PRO 457 Ca 0.07 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.50 1khu n PRO 457 Cb 0.48 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.88 1khu n PRO 457 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1khu s HIS 458 N 1.25 -0.75 0.00 0.54 2.46 -1.26 -5.07 115.29 112.47 1khu s HIS 458 Ca 0.00 1.44 0.00 0.00 0.47 0.00 0.00 55.06 56.97 1khu s HIS 458 Cb 0.00 0.45 0.00 0.00 -0.13 0.00 0.00 32.58 32.90 1khu s HIS 458 CO 0.00 -0.37 0.00 0.09 -2.47 0.00 0.00 174.74 171.99 1khu n ASN 459 N 4.15 0.00 0.00 9.88 3.02 -1.26 -5.11 115.26 125.94 1khu n ASN 459 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 1khu n ASN 459 Cb 0.57 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 1khu n ASN 459 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1khu n PRO 460 N 0.00 0.00 -4.25 3.52 -0.02 -1.26 -4.69 135.00 128.31 1khu n PRO 460 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.32 1khu n PRO 460 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.39 1khu n PRO 460 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1khu s ILE 461 N -4.54 0.00 0.55 4.25 -0.00 -1.26 -5.15 121.20 115.05 1khu s ILE 461 Ca 0.00 -2.00 -0.12 0.00 -0.00 0.00 0.00 60.65 58.53 1khu s ILE 461 Cb 0.00 -2.50 -0.05 0.00 -0.00 0.00 0.00 42.46 39.91 1khu s ILE 461 CO 0.00 0.00 0.96 -0.55 -0.00 0.00 0.00 174.94 175.35 1khu s SER 462 N -3.28 6.39 0.00 4.36 0.15 -1.26 -4.97 113.70 115.08 1khu s SER 462 Ca 0.40 1.38 0.16 0.00 0.70 0.00 0.00 55.95 58.60 1khu s SER 462 Cb 0.04 -2.44 -0.03 0.00 -1.71 0.00 0.00 66.02 61.88 1khu s SER 462 CO 0.21 -0.70 0.83 -1.54 1.20 0.00 0.00 173.24 173.24 1khu n SER 463 N -2.18 1.50 -0.07 5.45 3.41 -1.26 -4.63 113.62 115.84 1khu n SER 463 Ca 0.05 -1.25 -0.11 0.00 -0.26 0.00 0.00 58.87 57.31 1khu n SER 463 Cb 0.54 0.56 -0.06 0.00 -0.26 0.00 0.00 64.21 64.99 1khu n SER 463 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1khu n VAL 464 N -0.32 0.76 1.95 -3.33 0.31 -1.26 -5.34 118.33 111.09 1khu n VAL 464 Ca 0.06 -0.26 0.16 0.00 -0.01 0.00 0.00 64.34 64.29 1khu n VAL 464 Cb 0.33 -1.16 0.91 0.00 -0.91 0.00 0.00 33.84 33.01 1khu n VAL 464 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97