#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1khu n LYS 269 N 0.00 0.01 -2.83 0.54 4.81 -1.26 0.57 118.16 119.99 1khu n LYS 269 Ca 0.00 0.01 -0.43 0.00 -0.87 0.00 0.00 58.31 57.01 1khu n LYS 269 Cb 0.00 -1.07 -0.01 0.00 0.02 0.00 0.00 35.03 33.97 1khu n LYS 269 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 1khu s HIS 270 N -2.00 3.18 -0.38 5.64 0.00 -1.20 -3.83 115.29 116.70 1khu s HIS 270 Ca 0.49 -1.74 0.25 0.00 -3.00 0.00 0.00 55.06 51.05 1khu s HIS 270 Cb -0.32 -4.43 0.56 0.00 -4.00 0.00 0.00 32.58 24.39 1khu s HIS 270 CO 0.74 -1.55 1.69 0.11 -1.00 0.00 0.00 174.74 174.73 1khu h TRP 271 N 7.87 0.00 -3.28 0.38 5.08 -1.88 -3.44 115.95 120.69 1khu h TRP 271 Ca 0.29 0.00 0.01 0.00 1.08 0.00 0.00 58.89 60.27 1khu h TRP 271 Cb 0.92 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 27.01 1khu h TRP 271 CO 1.20 0.00 0.07 0.00 -1.28 0.00 0.00 178.44 178.43 1khu s SER 273 N -2.95 0.45 -0.05 0.00 1.04 -0.78 -1.80 113.70 109.62 1khu s SER 273 Ca 0.15 -0.14 0.04 0.00 0.48 0.00 0.00 55.95 56.48 1khu s SER 273 Cb -0.03 -0.03 -0.00 0.00 0.10 0.00 0.00 66.02 66.06 1khu s SER 273 CO 0.06 -0.00 -0.16 -0.63 0.98 0.00 0.00 173.24 173.49 1khu s ILE 274 N -0.31 1.35 -0.08 -1.02 1.01 0.37 -0.67 121.20 121.85 1khu s ILE 274 Ca -0.01 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.01 1khu s ILE 274 Cb -0.03 -1.17 -0.02 0.00 0.01 0.00 0.00 42.46 41.25 1khu s ILE 274 CO -0.00 0.39 -0.16 -0.69 0.00 0.00 0.00 174.94 174.49 1khu s VAL 275 N 0.13 2.90 0.09 2.92 1.01 -0.25 -1.49 120.40 125.70 1khu s VAL 275 Ca -0.05 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.16 1khu s VAL 275 Cb -0.12 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1khu s VAL 275 CO 0.02 0.56 0.26 -0.47 0.00 0.00 0.00 175.10 175.48 1khu s TYR 276 N -0.26 3.50 0.04 5.22 5.04 -1.26 -0.74 117.35 128.90 1khu s TYR 276 Ca 0.01 0.31 -0.00 0.00 -2.44 0.00 0.00 57.07 54.95 1khu s TYR 276 Cb -0.13 -1.81 -0.03 0.00 0.35 0.00 0.00 41.96 40.34 1khu s TYR 276 CO 0.03 0.54 -0.03 0.71 -1.34 0.00 0.00 175.55 175.45 1khu s TYR 277 N -1.58 0.48 -0.30 4.97 2.02 0.12 -1.79 117.35 121.27 1khu s TYR 277 Ca 0.36 -0.88 -0.03 0.00 -0.37 0.00 0.00 57.07 56.16 1khu s TYR 277 Cb -0.13 -0.34 0.10 0.00 -0.40 0.00 0.00 41.96 41.19 1khu s TYR 277 CO 0.27 -0.29 0.12 -1.21 -1.57 0.00 0.00 175.55 172.87 1khu s GLU 278 N -3.11 0.38 8.00 -0.62 2.02 -0.17 -2.13 118.70 123.07 1khu s GLU 278 Ca 0.00 -0.74 0.00 0.00 0.02 0.00 0.00 54.97 54.25 1khu s GLU 278 Cb 0.02 -1.45 0.00 0.00 0.10 0.00 0.00 34.13 32.79 1khu s GLU 278 CO -0.07 -1.01 0.00 1.28 0.02 0.00 0.00 175.26 175.48 1khu n LEU 279 N 5.08 0.00 -0.21 1.80 4.77 -1.11 -2.34 117.00 124.99 1khu n LEU 279 Ca -0.04 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.06 1khu n LEU 279 Cb 0.42 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.72 1khu n LEU 279 CO 0.07 0.00 0.46 -0.46 -1.33 0.00 0.00 177.39 176.12 1khu n ASN 280 N 8.99 1.10 -4.78 -1.43 6.94 -1.20 -4.56 115.26 120.33 1khu n ASN 280 Ca 0.00 -0.88 -0.36 0.00 -0.02 0.00 0.00 54.58 53.32 1khu n ASN 280 Cb 0.00 0.33 -0.07 0.00 -2.36 0.00 0.00 39.78 37.68 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 -2.67 6.20 0.23 0.53 0.02 -0.99 -5.08 114.94 113.19 1khu s ASN 281 Ca 0.18 0.30 -0.30 0.00 -1.02 0.00 0.00 52.86 52.03 1khu s ASN 281 Cb 0.18 -2.05 -0.09 0.00 0.02 0.00 0.00 41.25 39.31 1khu s ASN 281 CO 0.61 0.27 1.11 -0.60 0.02 0.00 0.00 177.10 178.52 1khu s ARG 282 N -0.19 4.60 -0.09 -0.60 3.52 -1.26 -1.00 118.95 123.93 1khu s ARG 282 Ca 0.10 1.79 0.00 0.00 -0.13 0.00 0.00 55.73 57.49 1khu s ARG 282 Cb -0.11 -3.22 0.02 0.00 -1.56 0.00 0.00 34.95 30.07 1khu s ARG 282 CO 0.01 0.12 -0.08 0.08 -0.81 0.00 0.00 175.30 174.62 1khu s VAL 283 N -0.70 0.97 0.00 7.11 1.01 -0.74 -4.89 120.40 123.16 1khu s VAL 283 Ca 0.47 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1khu s VAL 283 Cb -0.31 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1khu s VAL 283 CO 0.38 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.44 1khu n GLY 284 N 4.65 -2.45 3.98 4.51 0.00 -1.26 -4.39 105.19 110.22 1khu n GLY 284 Ca -0.15 -1.69 -0.21 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.47 2.48 0.39 1.61 2.02 -1.26 -4.94 118.70 118.54 1khu s GLU 285 Ca 0.00 -0.90 -0.20 0.00 0.02 0.00 0.00 54.97 53.89 1khu s GLU 285 Cb 0.00 -2.51 -0.10 0.00 0.10 0.00 0.00 34.13 31.62 1khu s GLU 285 CO 0.00 -0.74 0.90 0.00 0.02 0.00 0.00 175.26 175.44 1khu s ALA 286 N -2.75 3.12 -0.12 5.21 0.00 -1.26 -4.72 121.76 121.24 1khu s ALA 286 Ca 0.58 0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.86 1khu s ALA 286 Cb -0.10 -3.07 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 1khu s ALA 286 CO 0.38 0.18 -0.06 0.12 0.00 0.00 0.00 175.76 176.39 1khu s PHE 287 N -2.08 2.98 -0.18 0.00 5.36 -0.56 -4.97 117.98 118.53 1khu s PHE 287 Ca 0.59 -0.21 -0.00 0.00 -0.96 0.00 0.00 56.93 56.35 1khu s PHE 287 Cb -0.10 -1.86 0.01 0.00 -0.34 0.00 0.00 43.02 40.73 1khu s PHE 287 CO 0.15 0.09 -0.15 -1.01 -1.46 0.00 0.00 175.22 172.85 1khu s HIS 288 N -0.09 2.82 0.11 10.12 3.76 -1.26 -0.48 115.29 130.28 1khu s HIS 288 Ca 0.01 -1.29 -0.31 0.00 -0.15 0.00 0.00 55.06 53.33 1khu s HIS 288 Cb -0.13 -1.96 -0.09 0.00 1.11 0.00 0.00 32.58 31.51 1khu s HIS 288 CO 0.03 -0.64 1.70 0.00 -0.85 0.00 0.00 174.74 174.98 1khu s ALA 289 N 1.20 3.74 -0.16 -1.40 0.00 -0.75 -4.83 121.76 119.56 1khu s ALA 289 Ca 0.02 1.34 0.17 0.00 0.00 0.00 0.00 51.96 53.49 1khu s ALA 289 Cb -0.14 -3.71 0.34 0.00 0.00 0.00 0.00 23.12 19.62 1khu s ALA 289 CO -0.07 -1.08 1.19 -1.13 0.00 0.00 0.00 175.76 174.68 1khu n SER 290 N 5.25 2.29 -3.52 0.00 3.41 -1.26 -3.27 113.62 116.53 1khu n SER 290 Ca 0.16 -3.30 -0.08 0.00 -0.26 0.00 0.00 58.87 55.39 1khu n SER 290 Cb 0.39 -0.47 -0.02 0.00 -0.26 0.00 0.00 64.21 63.85 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 -2.90 -0.34 0.00 4.04 1.04 0.19 -4.59 113.70 111.14 1khu s SER 291 Ca 0.34 0.05 0.20 0.00 0.48 0.00 0.00 55.95 57.02 1khu s SER 291 Cb 0.31 0.34 0.87 0.00 0.10 0.00 0.00 66.02 67.64 1khu s SER 291 CO 0.01 -0.54 1.62 0.35 0.98 0.00 0.00 173.24 175.66 1khu n THR 292 N -0.11 0.60 -3.95 2.02 -2.24 -1.26 -4.45 114.28 104.90 1khu n THR 292 Ca -0.08 0.15 -0.30 0.00 -2.27 0.00 0.00 64.05 61.55 1khu n THR 292 Cb 0.61 -0.82 -0.16 0.00 -2.10 0.00 0.00 70.33 67.87 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 -2.90 3.92 -0.04 3.42 0.15 -1.26 -1.16 113.70 115.83 1khu s SER 293 Ca 0.12 -1.23 0.07 0.00 0.70 0.00 0.00 55.95 55.60 1khu s SER 293 Cb 0.13 -1.21 -0.01 0.00 -1.71 0.00 0.00 66.02 63.22 1khu s SER 293 CO 0.34 -0.24 -0.25 0.68 1.20 0.00 0.00 173.24 174.97 1khu s VAL 294 N 1.37 1.99 -0.16 4.45 -7.23 -1.04 -4.82 120.40 114.96 1khu s VAL 294 Ca -0.05 -1.05 -0.03 0.00 -1.81 0.00 0.00 61.98 59.03 1khu s VAL 294 Cb -0.19 -1.67 -0.02 0.00 0.56 0.00 0.00 36.38 35.06 1khu s VAL 294 CO -0.07 0.56 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.46 1khu s LEU 295 N -0.35 3.05 -0.33 1.32 1.43 -0.52 -2.00 118.68 121.28 1khu s LEU 295 Ca 0.02 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 52.83 1khu s LEU 295 Cb -0.12 -1.73 0.04 0.00 0.03 0.00 0.00 46.19 44.41 1khu s LEU 295 CO 0.01 0.13 0.09 -0.69 0.23 0.00 0.00 176.35 176.12 1khu s VAL 296 N 0.61 3.75 0.39 -1.59 1.01 -0.88 -0.33 120.40 123.36 1khu s VAL 296 Ca -0.04 -1.09 0.04 0.00 0.00 0.00 0.00 61.98 60.89 1khu s VAL 296 Cb -0.15 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1khu s VAL 296 CO 0.03 -0.14 0.08 1.51 0.00 0.00 0.00 175.10 176.58 1khu s ASP 297 N 1.40 2.89 -0.38 3.32 1.47 -0.89 -1.66 116.67 122.83 1khu s ASP 297 Ca -0.01 -1.54 0.05 0.00 1.18 0.00 0.00 52.55 52.22 1khu s ASP 297 Cb -0.19 0.24 0.63 0.00 -0.34 0.00 0.00 42.92 43.25 1khu s ASP 297 CO 0.02 -0.77 1.81 0.61 0.68 0.00 0.00 175.17 177.52 1khu n GLY 298 N -0.88 4.09 0.00 2.12 0.00 -0.48 0.43 105.19 110.47 1khu n GLY 298 Ca -0.06 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.79 0.00 -2.16 1.61 3.72 -1.26 -3.14 117.46 115.43 1khu n PHE 299 Ca 0.51 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.92 1khu n PHE 299 Cb 1.51 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 40.15 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 1.25 -2.83 4.37 -2.24 -1.26 0.54 114.28 114.10 1khu n THR 300 Ca 0.00 -2.42 -0.42 0.00 -2.27 0.00 0.00 64.05 58.94 1khu n THR 300 Cb 0.00 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 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 -2.85 6.87 0.58 3.42 2.15 -1.26 -4.79 116.67 120.79 1khu s ASP 301 Ca 0.37 1.06 0.36 0.00 0.43 0.00 0.00 52.55 54.76 1khu s ASP 301 Cb 0.38 -2.46 1.74 0.00 -0.30 0.00 0.00 42.92 42.27 1khu s ASP 301 CO -0.09 -0.59 2.13 1.55 -0.17 0.00 0.00 175.17 178.00 1khu h PRO 302 N 7.72 0.00 -6.10 4.34 0.13 -1.95 -3.40 132.00 132.73 1khu h PRO 302 Ca -0.22 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.33 1khu h PRO 302 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1khu h PRO 302 CO 0.91 0.03 1.40 -1.12 -0.23 0.00 0.00 178.00 178.99 1khu s SER 303 N -5.63 5.73 -0.04 1.44 0.01 -1.26 -4.75 113.70 109.19 1khu s SER 303 Ca -0.02 1.94 0.13 0.00 1.31 0.00 0.00 55.95 59.32 1khu s SER 303 Cb 0.11 -2.52 0.41 0.00 0.21 0.00 0.00 66.02 64.24 1khu s SER 303 CO 0.51 -1.74 1.34 -3.20 0.41 0.00 0.00 173.24 170.57 1khu n ASN 304 N 10.63 3.35 -0.72 2.44 4.05 -1.26 -4.53 115.26 129.22 1khu n ASN 304 Ca 0.27 -2.22 0.13 0.00 0.45 0.00 0.00 54.58 53.20 1khu n ASN 304 Cb 0.45 -0.34 0.33 0.00 1.23 0.00 0.00 39.78 41.44 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 2.24 0.00 1.20 6.94 -1.26 -4.60 115.26 120.26 1khu n ASN 305 Ca 0.16 -1.75 0.00 0.00 -0.02 0.00 0.00 54.58 52.97 1khu n ASN 305 Cb 0.57 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 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 0.73 0.00 -0.07 -3.83 0.00 -1.26 -4.86 118.16 108.87 1khu n LYS 306 Ca 0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.34 1khu n LYS 306 Cb 0.46 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.44 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 0.77 -2.82 -5.58 -1.24 -1.91 -3.38 115.58 101.42 1khu h ASN 307 Ca 0.00 -0.53 -0.59 0.00 0.71 0.00 0.00 56.30 55.89 1khu h ASN 307 Cb 0.00 -0.22 -0.08 0.00 0.73 0.00 0.00 38.32 38.75 1khu h ASN 307 CO 0.00 1.15 -0.60 -0.13 -1.29 0.00 0.00 177.43 176.56 1khu s ARG 308 N -4.13 2.75 -0.48 6.67 0.52 -1.26 -1.43 118.95 121.58 1khu s ARG 308 Ca -0.12 -0.92 0.03 0.00 -0.52 0.00 0.00 55.73 54.20 1khu s ARG 308 Cb 0.08 -2.57 0.14 0.00 0.52 0.00 0.00 34.95 33.12 1khu s ARG 308 CO 0.84 0.49 0.27 0.12 0.02 0.00 0.00 175.30 177.04 1khu s PHE 309 N -1.69 2.34 -0.17 -0.53 5.36 0.56 -4.66 117.98 119.18 1khu s PHE 309 Ca 0.30 -2.67 -0.28 0.00 -0.96 0.00 0.00 56.93 53.32 1khu s PHE 309 Cb -0.10 -2.11 -0.01 0.00 -0.34 0.00 0.00 43.02 40.47 1khu s PHE 309 CO 0.22 -0.75 0.95 0.00 -1.46 0.00 0.00 175.22 174.17 1khu n LEU 311 N 5.46 0.65 -0.25 0.00 4.32 0.17 -4.46 117.00 122.89 1khu n LEU 311 Ca 0.08 -0.09 -0.04 0.00 -0.02 0.00 0.00 56.01 55.94 1khu n LEU 311 Cb 0.48 -0.11 0.13 0.00 -1.62 0.00 0.00 43.42 42.29 1khu n LEU 311 CO 0.50 0.09 1.09 1.23 -1.22 0.00 0.00 177.39 179.09 1khu h GLY 312 N 4.70 1.18 2.00 -0.72 0.00 0.15 -2.98 103.07 107.40 1khu h GLY 312 Ca 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 1khu h GLY 312 CO 0.00 0.56 -0.20 0.17 0.00 0.00 0.00 176.54 177.08 1khu h LEU 313 N 1.09 0.00 -9.77 3.11 -0.00 -1.76 -3.46 115.31 104.51 1khu h LEU 313 Ca 0.26 0.00 -0.55 0.00 -0.00 0.00 0.00 57.88 57.59 1khu h LEU 313 Cb 0.14 0.00 0.09 0.00 -0.00 0.00 0.00 40.66 40.90 1khu h LEU 313 CO -0.03 0.20 0.73 0.18 -0.00 0.00 0.00 178.44 179.52 1khu n LEU 314 N -3.22 4.03 -4.93 0.17 4.77 -1.13 -5.02 117.00 111.67 1khu n LEU 314 Ca 0.02 1.17 -0.20 0.00 -0.03 0.00 0.00 56.01 56.97 1khu n LEU 314 Cb 0.51 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.04 1khu n LEU 314 CO 0.34 -0.10 -0.04 -0.44 -1.33 0.00 0.00 177.39 175.82 1khu s SER 315 N 0.17 5.83 -0.29 -1.43 0.01 -1.26 -5.06 113.70 111.66 1khu s SER 315 Ca 0.61 -0.20 0.01 0.00 1.31 0.00 0.00 55.95 57.68 1khu s SER 315 Cb -0.54 -1.36 0.20 0.00 0.21 0.00 0.00 66.02 64.52 1khu s SER 315 CO 0.55 -0.26 0.72 0.21 0.41 0.00 0.00 173.24 174.88 1khu s ASN 316 N -4.03 -1.28 0.64 2.44 3.04 -1.26 -4.56 114.94 109.94 1khu s ASN 316 Ca 0.39 0.14 0.35 0.00 0.04 0.00 0.00 52.86 53.78 1khu s ASN 316 Cb -0.08 1.81 1.92 0.00 -1.54 0.00 0.00 41.25 43.35 1khu s ASN 316 CO 0.28 -0.23 2.14 -0.37 -3.04 0.00 0.00 177.10 175.88 1khu h VAL 317 N 5.55 0.16 -0.48 -5.21 -1.51 -2.00 0.21 116.25 112.97 1khu h VAL 317 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 1khu h VAL 317 Cb 1.19 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 1khu h VAL 317 CO 0.08 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 177.01 1khu n ASN 318 N -3.27 3.00 -4.75 4.19 5.03 -1.26 -4.97 115.26 113.23 1khu n ASN 318 Ca -0.01 -1.96 -0.33 0.00 0.87 0.00 0.00 54.58 53.16 1khu n ASN 318 Cb 0.26 -0.31 0.08 0.00 -1.02 0.00 0.00 39.78 38.78 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 -1.37 2.32 0.15 3.52 3.52 0.73 -5.07 118.95 122.76 1khu s ARG 319 Ca 0.38 1.43 -0.09 0.00 -0.13 0.00 0.00 55.73 57.32 1khu s ARG 319 Cb 0.21 -1.89 -0.01 0.00 -1.56 0.00 0.00 34.95 31.70 1khu s ARG 319 CO 0.28 -1.63 0.27 0.54 -0.81 0.00 0.00 175.30 173.95 1khu s ASN 320 N -2.68 0.05 0.24 -2.12 6.03 -1.26 -5.04 114.94 110.16 1khu s ASN 320 Ca 0.67 -0.83 -0.11 0.00 -1.03 0.00 0.00 52.86 51.55 1khu s ASN 320 Cb -0.22 0.42 0.35 0.00 -3.03 0.00 0.00 41.25 38.77 1khu s ASN 320 CO 0.48 -0.87 1.47 -1.54 -2.03 0.00 0.00 177.10 174.60 1khu n SER 321 N -0.19 -0.46 0.01 3.54 3.41 -1.26 -0.52 113.62 118.15 1khu n SER 321 Ca -0.08 1.63 0.03 0.00 -0.26 0.00 0.00 58.87 60.19 1khu n SER 321 Cb 0.63 -0.44 0.40 0.00 -0.26 0.00 0.00 64.21 64.53 1khu n SER 321 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1khu h THR 322 N 0.00 1.13 0.06 6.66 1.03 -1.98 0.63 112.91 120.44 1khu h THR 322 Ca 0.40 -0.36 -0.20 0.00 -0.01 0.00 0.00 66.41 66.24 1khu h THR 322 Cb 0.63 0.66 0.02 0.00 -1.07 0.00 0.00 68.15 68.39 1khu h THR 322 CO -0.96 0.15 -0.82 0.40 -0.01 0.00 0.00 175.52 174.28 1khu h ILE 323 N 0.51 1.41 -0.80 0.00 2.04 -1.17 -2.30 117.51 117.20 1khu h ILE 323 Ca 0.13 -2.29 0.06 0.00 1.00 0.00 0.00 64.86 63.76 1khu h ILE 323 Cb 0.05 2.77 -0.06 0.00 -0.74 0.00 0.00 36.82 38.85 1khu h ILE 323 CO -0.02 0.67 0.49 -0.08 0.00 0.00 0.00 178.15 179.21 1khu h GLU 324 N -0.07 0.88 0.15 2.37 4.57 -0.49 0.21 114.58 122.19 1khu h GLU 324 Ca -0.12 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1khu h GLU 324 Cb 1.55 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 1khu h GLU 324 CO 0.16 0.58 -0.15 -0.97 -1.18 0.00 0.00 179.01 177.45 1khu h ASN 325 N 0.90 -0.40 -0.98 1.04 -0.00 0.28 -2.15 115.58 114.28 1khu h ASN 325 Ca 0.35 0.04 0.01 0.00 -0.00 0.00 0.00 56.30 56.69 1khu h ASN 325 Cb 0.15 0.14 -0.05 0.00 -0.00 0.00 0.00 38.32 38.56 1khu h ASN 325 CO -0.16 -0.23 0.64 0.74 -0.00 0.00 0.00 177.43 178.42 1khu h THR 326 N -0.33 1.26 -0.42 -3.57 2.02 -0.77 -2.06 112.91 109.03 1khu h THR 326 Ca 0.00 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1khu h THR 326 Cb 0.31 -0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.52 1khu h THR 326 CO -0.04 0.25 0.27 0.03 0.37 0.00 0.00 175.52 176.40 1khu h ARG 327 N 1.34 0.56 0.00 6.66 3.08 -0.32 -1.37 114.38 124.32 1khu h ARG 327 Ca 0.36 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1khu h ARG 327 Cb -0.14 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.79 1khu h ARG 327 CO -0.08 0.38 0.00 0.00 -1.07 0.00 0.00 179.97 179.20 1khu h ARG 328 N 0.57 0.00 -0.30 0.04 3.08 -0.71 -2.78 114.38 114.29 1khu h ARG 328 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1khu h ARG 328 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1khu h ARG 328 CO -0.03 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.59 1khu n HIS 329 N -2.68 0.52 -0.07 3.04 8.25 -0.52 -4.53 115.22 119.24 1khu n HIS 329 Ca -0.01 -0.59 -0.15 0.00 -0.26 0.00 0.00 57.72 56.71 1khu n HIS 329 Cb 0.11 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.08 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 1.79 1.29 0.00 1.59 2.04 -1.46 -3.39 117.51 119.36 1khu h ILE 330 Ca 0.00 -1.70 0.00 0.00 1.00 0.00 0.00 64.86 64.16 1khu h ILE 330 Cb 0.87 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 1khu h ILE 330 CO 0.05 0.55 0.00 0.61 0.00 0.00 0.00 178.15 179.36 1khu n GLY 331 N 0.40 3.35 0.00 5.37 0.00 -1.26 -0.31 105.19 112.74 1khu n GLY 331 Ca -0.05 0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 14.00 0.76 0.00 1.61 5.02 -1.26 -1.38 118.16 136.91 1khu n LYS 332 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1khu n LYS 332 Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 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 0.35 2.96 3.16 0.72 0.00 0.58 -4.28 105.19 108.67 1khu n GLY 333 Ca 0.06 0.23 -0.18 0.00 0.00 0.00 0.00 46.02 46.14 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 1.05 -0.28 1.61 0.11 -0.66 -1.17 120.40 121.05 1khu s VAL 334 Ca 0.00 -1.31 -0.02 0.00 -2.93 0.00 0.00 61.98 57.72 1khu s VAL 334 Cb 0.00 -1.05 0.04 0.00 -1.53 0.00 0.00 36.38 33.84 1khu s VAL 334 CO 0.00 -0.26 -0.02 -2.28 -3.33 0.00 0.00 175.10 169.21 1khu s HIS 335 N -1.37 3.17 -0.10 1.54 5.04 0.29 -2.08 115.29 121.78 1khu s HIS 335 Ca -0.02 -1.65 -0.13 0.00 -1.54 0.00 0.00 55.06 51.72 1khu s HIS 335 Cb -0.10 -2.10 -0.05 0.00 0.04 0.00 0.00 32.58 30.38 1khu s HIS 335 CO 0.02 -0.75 0.31 -0.51 -2.34 0.00 0.00 174.74 171.46 1khu s LEU 336 N 1.31 4.34 -0.04 8.88 1.43 -0.85 -0.38 118.68 133.38 1khu s LEU 336 Ca -0.02 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 53.73 1khu s LEU 336 Cb -0.18 -2.39 0.02 0.00 0.03 0.00 0.00 46.19 43.67 1khu s LEU 336 CO -0.02 0.22 -0.03 -0.47 0.23 0.00 0.00 176.35 176.27 1khu s TYR 337 N -0.25 0.59 -0.23 0.29 5.04 -0.08 -2.49 117.35 120.23 1khu s TYR 337 Ca 0.19 -0.13 -0.01 0.00 -2.44 0.00 0.00 57.07 54.68 1khu s TYR 337 Cb -0.14 -0.55 0.02 0.00 0.35 0.00 0.00 41.96 41.64 1khu s TYR 337 CO 0.07 -0.15 -0.10 -0.47 -1.34 0.00 0.00 175.55 173.56 1khu s TYR 338 N 0.82 3.00 -0.28 4.97 6.04 -0.31 0.19 117.35 131.79 1khu s TYR 338 Ca -0.10 -1.58 -0.22 0.00 0.04 0.00 0.00 57.07 55.21 1khu s TYR 338 Cb -0.13 -2.02 0.09 0.00 -1.04 0.00 0.00 41.96 38.86 1khu s TYR 338 CO -0.00 -0.74 0.78 0.54 -1.54 0.00 0.00 175.55 174.59 1khu s VAL 339 N 1.31 0.00 -1.25 3.14 0.11 -0.20 -4.78 120.40 118.73 1khu s VAL 339 Ca 0.01 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.00 1khu s VAL 339 Cb -0.16 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.70 1khu s VAL 339 CO -0.07 0.00 0.82 0.61 -3.33 0.00 0.00 175.10 173.13 1khu n GLY 340 N 3.15 -0.35 3.51 6.54 0.00 -1.26 -2.46 105.19 114.32 1khu n GLY 340 Ca -0.16 0.08 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.65 -0.51 3.50 -0.02 0.00 -1.26 -4.95 105.19 100.29 1khu n GLY 341 Ca -0.04 0.23 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 -6.24 0.70 -0.06 1.61 2.02 -1.03 -2.03 118.70 113.67 1khu s GLU 342 Ca 0.55 0.83 0.03 0.00 0.02 0.00 0.00 54.97 56.40 1khu s GLU 342 Cb -0.24 0.34 -0.03 0.00 0.10 0.00 0.00 34.13 34.30 1khu s GLU 342 CO 0.69 -0.08 -0.13 0.14 0.02 0.00 0.00 175.26 175.89 1khu s VAL 343 N 0.31 3.19 0.25 2.63 -7.23 -0.88 -1.03 120.40 117.64 1khu s VAL 343 Ca -0.00 -0.67 0.12 0.00 -1.81 0.00 0.00 61.98 59.62 1khu s VAL 343 Cb -0.04 -2.27 -0.05 0.00 0.56 0.00 0.00 36.38 34.58 1khu s VAL 343 CO 0.01 0.59 -0.21 -0.31 -0.31 0.00 0.00 175.10 174.87 1khu s TYR 344 N -0.67 2.28 -0.07 2.82 2.02 0.13 -1.51 117.35 122.35 1khu s TYR 344 Ca 0.10 -0.34 -0.00 0.00 -0.37 0.00 0.00 57.07 56.46 1khu s TYR 344 Cb -0.11 -1.03 0.02 0.00 -0.40 0.00 0.00 41.96 40.44 1khu s TYR 344 CO 0.01 0.64 -0.04 0.00 -1.57 0.00 0.00 175.55 174.59 1khu s ALA 345 N -2.25 0.91 -0.12 3.71 0.00 0.08 -0.90 121.76 123.19 1khu s ALA 345 Ca 0.27 -0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.00 1khu s ALA 345 Cb -0.06 -0.68 -0.01 0.00 0.00 0.00 0.00 23.12 22.38 1khu s ALA 345 CO 0.13 -0.26 -0.17 -2.00 0.00 0.00 0.00 175.76 173.46 1khu s GLU 346 N 1.46 3.25 -0.61 0.00 2.12 0.49 -1.57 118.70 123.85 1khu s GLU 346 Ca -0.02 -0.76 -0.20 0.00 0.36 0.00 0.00 54.97 54.35 1khu s GLU 346 Cb -0.13 -2.51 0.09 0.00 0.26 0.00 0.00 34.13 31.84 1khu s GLU 346 CO -0.04 0.19 0.79 0.00 -0.54 0.00 0.00 175.26 175.66 1khu h LEU 348 N 10.43 0.00-10.25 0.00 4.07 -1.54 0.42 115.31 118.44 1khu h LEU 348 Ca -0.29 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.14 1khu h LEU 348 Cb 1.08 0.00 0.19 0.00 1.08 0.00 0.00 40.66 43.02 1khu h LEU 348 CO 1.13 0.39 0.25 -0.55 -1.08 0.00 0.00 178.44 178.58 1khu s SER 349 N -6.01 3.04 0.37 -0.43 0.15 -0.32 -4.62 113.70 105.88 1khu s SER 349 Ca 0.01 2.25 0.20 0.00 0.70 0.00 0.00 55.95 59.10 1khu s SER 349 Cb 0.08 -2.57 0.52 0.00 -1.71 0.00 0.00 66.02 62.33 1khu s SER 349 CO 0.77 -3.03 1.65 0.44 1.20 0.00 0.00 173.24 174.27 1khu h ASP 350 N -1.65 0.00 -2.85 5.45 3.32 -1.82 -3.40 116.42 115.47 1khu h ASP 350 Ca -0.44 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.15 1khu h ASP 350 Cb 1.28 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.86 1khu h ASP 350 CO 0.42 0.35 -0.07 -0.44 -1.72 0.00 0.00 179.24 177.78 1khu s SER 351 N -6.34 5.87 1.03 6.45 0.01 -1.26 -4.63 113.70 114.83 1khu s SER 351 Ca 0.02 0.36 -0.15 0.00 1.31 0.00 0.00 55.95 57.49 1khu s SER 351 Cb 0.09 -1.61 0.21 0.00 0.21 0.00 0.00 66.02 64.92 1khu s SER 351 CO 0.69 -0.69 1.14 -0.44 0.41 0.00 0.00 173.24 174.35 1khu s SER 352 N -4.21 2.41 -0.02 2.44 0.01 -1.26 -4.29 113.70 108.79 1khu s SER 352 Ca 0.48 0.81 -0.03 0.00 1.31 0.00 0.00 55.95 58.53 1khu s SER 352 Cb -0.10 -1.24 0.00 0.00 0.21 0.00 0.00 66.02 64.90 1khu s SER 352 CO 0.39 -3.22 0.07 -0.63 0.41 0.00 0.00 173.24 170.25 1khu s ILE 353 N -3.20 0.03 -0.09 1.44 1.01 -0.62 -1.56 121.20 118.22 1khu s ILE 353 Ca 0.68 -0.25 0.04 0.00 0.00 0.00 0.00 60.65 61.12 1khu s ILE 353 Cb -0.13 -0.18 0.00 0.00 0.01 0.00 0.00 42.46 42.16 1khu s ILE 353 CO 0.55 -0.14 -0.22 -0.36 0.00 0.00 0.00 174.94 174.78 1khu s PHE 354 N -0.41 2.31 0.01 3.97 0.40 -0.85 0.10 117.98 123.51 1khu s PHE 354 Ca -0.05 -0.89 0.07 0.00 -0.60 0.00 0.00 56.93 55.47 1khu s PHE 354 Cb -0.03 -1.55 -0.02 0.00 0.51 0.00 0.00 43.02 41.92 1khu s PHE 354 CO 0.00 -0.36 -0.23 0.08 0.70 0.00 0.00 175.22 175.42 1khu s VAL 355 N 0.32 1.81 -0.37 -0.44 1.01 0.26 -1.51 120.40 121.48 1khu s VAL 355 Ca -0.16 -1.09 0.03 0.00 0.00 0.00 0.00 61.98 60.77 1khu s VAL 355 Cb -0.17 -1.53 0.11 0.00 0.00 0.00 0.00 36.38 34.79 1khu s VAL 355 CO 0.07 0.41 0.11 -1.58 0.00 0.00 0.00 175.10 174.11 1khu s GLN 356 N -0.80 1.41 -0.20 2.72 0.74 0.17 0.23 119.66 123.93 1khu s GLN 356 Ca 0.09 -1.86 0.01 0.00 0.05 0.00 0.00 55.36 53.65 1khu s GLN 356 Cb -0.09 -2.94 0.04 0.00 1.10 0.00 0.00 33.01 31.12 1khu s GLN 356 CO 0.00 -0.99 -0.12 0.45 -0.55 0.00 0.00 175.29 174.08 1khu s SER 357 N 0.80 3.49 0.15 6.67 0.15 -1.26 -2.48 113.70 121.23 1khu s SER 357 Ca 0.12 -0.92 -0.16 0.00 0.70 0.00 0.00 55.95 55.69 1khu s SER 357 Cb -0.20 -1.31 0.02 0.00 -1.71 0.00 0.00 66.02 62.82 1khu s SER 357 CO -0.09 -0.13 1.81 0.03 1.20 0.00 0.00 173.24 176.06 1khu h ARG 358 N 7.94 0.52 -0.51 5.44 3.08 -1.83 0.28 114.38 129.29 1khu h ARG 358 Ca -0.29 -0.03 0.08 0.00 0.07 0.00 0.00 59.98 59.81 1khu h ARG 358 Cb 1.10 -0.12 -0.07 0.00 0.08 0.00 0.00 29.97 30.96 1khu h ARG 358 CO 0.49 0.34 0.13 -0.97 -1.07 0.00 0.00 179.97 178.90 1khu h ASN 359 N 0.54 0.07 0.04 7.04 -1.24 -1.85 0.14 115.58 120.32 1khu h ASN 359 Ca 0.15 0.08 -0.00 0.00 0.71 0.00 0.00 56.30 57.24 1khu h ASN 359 Cb -0.05 0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1khu h ASN 359 CO -0.04 0.06 -0.02 0.00 -1.29 0.00 0.00 177.43 176.15 1khu h ASN 361 N -0.31 0.00 0.09 0.00 -0.26 0.32 -0.25 115.58 115.17 1khu h ASN 361 Ca -0.00 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.59 1khu h ASN 361 Cb 0.29 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.55 1khu h ASN 361 CO 0.01 0.00 -0.69 0.22 -1.06 0.00 0.00 177.43 175.91 1khu h TYR 362 N 0.00 0.35 -0.02 1.19 5.03 -0.48 0.22 116.97 123.26 1khu h TYR 362 Ca 0.17 -0.26 0.01 0.00 2.58 0.00 0.00 58.73 61.23 1khu h TYR 362 Cb 0.93 -0.01 -0.00 0.00 1.55 0.00 0.00 36.73 39.20 1khu h TYR 362 CO 0.00 1.27 0.03 1.25 -1.32 0.00 0.00 178.16 179.39 1khu h HIS 363 N -0.57 0.00 -0.00 -3.82 2.76 -0.37 -1.60 115.15 111.55 1khu h HIS 363 Ca -0.13 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.04 1khu h HIS 363 Cb 1.46 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.42 1khu h HIS 363 CO 0.21 0.00 -0.61 0.72 -1.30 0.00 0.00 177.93 176.95 1khu n HIS 364 N -3.58 0.00 -1.20 5.26 8.25 -0.64 -4.99 115.22 118.32 1khu n HIS 364 Ca -0.03 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.42 1khu n HIS 364 Cb 0.11 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.21 1khu n HIS 364 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1khu n GLY 365 N 1.30 0.49 3.92 -1.41 0.00 -0.60 -5.04 105.19 103.85 1khu n GLY 365 Ca 0.04 -0.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.07 3.03 0.27 1.61 2.99 0.71 -5.01 117.98 119.51 1khu s PHE 366 Ca 0.00 0.52 -0.29 0.00 0.00 0.00 0.00 56.93 57.16 1khu s PHE 366 Cb 0.00 -3.05 -0.09 0.00 0.00 0.00 0.00 43.02 39.88 1khu s PHE 366 CO 0.00 -1.22 1.18 -1.58 -0.00 0.00 0.00 175.22 173.60 1khu s HIS 367 N -3.17 3.41 0.25 0.36 5.65 -1.26 -4.58 115.29 115.95 1khu s HIS 367 Ca 0.58 1.55 -0.04 0.00 0.25 0.00 0.00 55.06 57.40 1khu s HIS 367 Cb -0.11 -3.42 0.49 0.00 -1.18 0.00 0.00 32.58 28.36 1khu s HIS 367 CO 0.45 -1.06 1.35 -2.30 -0.65 0.00 0.00 174.74 172.53 1khu n PRO 368 N 1.44 -0.07 0.00 2.88 -0.02 -1.26 -0.11 135.00 137.86 1khu n PRO 368 Ca 0.01 1.33 0.13 0.00 -2.02 0.00 0.00 63.50 62.94 1khu n PRO 368 Cb 0.44 -2.03 0.74 0.00 -0.02 0.00 0.00 33.50 32.63 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 -5.35 0.06 -1.61 3.45 -2.24 -1.26 -4.54 114.28 102.79 1khu n THR 369 Ca 0.16 0.01 -0.50 0.00 -2.27 0.00 0.00 64.05 61.46 1khu n THR 369 Cb 0.51 -0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 68.09 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 -1.08 0.23 -3.92 4.28 -1.04 0.85 -4.98 114.28 108.61 1khu n THR 370 Ca 0.17 -0.06 -0.35 0.00 -2.04 0.00 0.00 64.05 61.78 1khu n THR 370 Cb 0.12 -0.98 -0.10 0.00 -1.82 0.00 0.00 70.33 67.55 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 0.39 4.76 -0.17 12.58 1.01 -1.26 -4.42 120.40 133.29 1khu s VAL 371 Ca 0.80 -0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.69 1khu s VAL 371 Cb -0.87 -3.17 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1khu s VAL 371 CO 0.46 0.42 0.01 0.00 0.00 0.00 0.00 175.10 175.99 1khu s LYS 373 N 0.47 4.33 -0.28 0.00 2.20 -1.26 0.92 119.74 126.12 1khu s LYS 373 Ca -0.01 0.82 0.02 0.00 -0.36 0.00 0.00 55.97 56.45 1khu s LYS 373 Cb -0.14 -3.30 0.07 0.00 -1.51 0.00 0.00 37.83 32.95 1khu s LYS 373 CO 0.02 0.48 -0.07 0.42 -0.36 0.00 0.00 175.35 175.84 1khu s ILE 374 N -0.61 2.32 0.56 5.43 1.01 0.29 -4.95 121.20 125.25 1khu s ILE 374 Ca 0.32 -1.71 -0.19 0.00 0.00 0.00 0.00 60.65 59.07 1khu s ILE 374 Cb -0.20 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 1khu s ILE 374 CO 0.20 -0.14 1.12 -2.84 0.00 0.00 0.00 174.94 173.28 1khu s PRO 375 N 1.09 3.28 -0.15 2.79 0.02 -1.26 -1.58 135.00 139.18 1khu s PRO 375 Ca -0.05 1.55 -0.40 0.00 0.02 0.00 0.00 61.00 62.11 1khu s PRO 375 Cb -0.20 -2.00 -0.18 0.00 0.02 0.00 0.00 34.50 32.14 1khu s PRO 375 CO -0.05 -0.90 1.47 0.45 -0.33 0.00 0.00 177.00 177.64 1khu n SER 376 N -1.50 1.51 0.00 2.53 2.88 -1.26 -0.20 113.62 117.57 1khu n SER 376 Ca 0.11 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.78 1khu n SER 376 Cb 0.51 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.90 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 3.14 2.42 2.66 0.46 0.00 0.15 -5.03 105.19 108.99 1khu n GLY 377 Ca 0.24 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.07 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 -4.18 -0.26 -0.15 0.00 0.15 -1.26 -2.48 113.70 105.52 1khu s SER 379 Ca 0.50 0.02 -0.19 0.00 0.70 0.00 0.00 55.95 56.97 1khu s SER 379 Cb -0.02 0.40 0.05 0.00 -1.71 0.00 0.00 66.02 64.74 1khu s SER 379 CO 0.34 -0.62 0.51 -0.22 1.20 0.00 0.00 173.24 174.46 1khu s LEU 380 N -1.86 0.05 -0.28 3.45 2.96 -0.61 -5.00 118.68 117.40 1khu s LEU 380 Ca -0.07 0.88 -0.25 0.00 -0.22 0.00 0.00 54.13 54.47 1khu s LEU 380 Cb -0.02 1.80 0.00 0.00 0.50 0.00 0.00 46.19 48.47 1khu s LEU 380 CO -0.01 -0.27 0.86 -0.75 -1.32 0.00 0.00 176.35 174.86 1khu s LYS 381 N -0.11 4.07 0.00 1.98 2.20 -1.26 -0.74 119.74 125.88 1khu s LYS 381 Ca -0.03 0.82 0.19 0.00 -0.36 0.00 0.00 55.97 56.59 1khu s LYS 381 Cb -0.03 -3.69 0.18 0.00 -1.51 0.00 0.00 37.83 32.77 1khu s LYS 381 CO 0.02 -0.65 1.12 0.44 -0.36 0.00 0.00 175.35 175.92 1khu n ILE 382 N 5.47 0.08 -3.62 5.43 -5.35 -0.57 -4.89 119.36 115.92 1khu n ILE 382 Ca 0.06 -0.54 -0.10 0.00 -0.27 0.00 0.00 62.75 61.90 1khu n ILE 382 Cb 0.48 1.32 -0.06 0.00 -1.74 0.00 0.00 39.64 39.63 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 -1.51 -0.46 -0.10 4.28 5.36 -1.19 -3.84 117.98 120.52 1khu s PHE 383 Ca 0.23 1.02 -0.02 0.00 -0.96 0.00 0.00 56.93 57.20 1khu s PHE 383 Cb 0.16 0.39 0.03 0.00 -0.34 0.00 0.00 43.02 43.26 1khu s PHE 383 CO 0.24 -0.28 0.00 1.21 -1.46 0.00 0.00 175.22 174.93 1khu s ASN 384 N -0.21 1.95 0.07 6.13 2.47 -1.26 -2.06 114.94 122.03 1khu s ASN 384 Ca 0.01 -0.28 -0.26 0.00 0.42 0.00 0.00 52.86 52.75 1khu s ASN 384 Cb -0.03 -0.52 -0.17 0.00 -1.45 0.00 0.00 41.25 39.08 1khu s ASN 384 CO -0.03 -0.21 1.64 0.78 -3.72 0.00 0.00 177.10 175.56 1khu h ASN 385 N 8.29 -0.25 -0.92 -4.21 4.21 -1.78 -1.79 115.58 119.14 1khu h ASN 385 Ca -0.20 -0.03 0.16 0.00 1.21 0.00 0.00 56.30 57.44 1khu h ASN 385 Cb 1.12 0.06 -0.10 0.00 -1.12 0.00 0.00 38.32 38.29 1khu h ASN 385 CO 0.29 -0.13 0.51 -0.61 -1.29 0.00 0.00 177.43 176.21 1khu h GLN 386 N -0.35 0.68 0.41 0.81 -0.00 -1.96 1.02 115.11 115.72 1khu h GLN 386 Ca -0.03 -0.04 -0.02 0.00 -0.00 0.00 0.00 58.65 58.56 1khu h GLN 386 Cb 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 27.48 27.60 1khu h GLN 386 CO 0.05 0.45 -0.20 0.93 0.00 0.00 0.00 178.83 180.06 1khu h GLU 387 N 0.70 -0.53 -0.74 1.69 5.08 -1.88 -1.13 114.58 117.77 1khu h GLU 387 Ca 0.51 0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.88 1khu h GLU 387 Cb 0.75 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 1khu h GLU 387 CO -0.37 -0.33 0.35 0.35 -1.00 0.00 0.00 179.01 178.02 1khu h PHE 388 N -0.60 1.07 -0.93 4.33 3.04 -0.21 -1.36 116.94 122.28 1khu h PHE 388 Ca -0.06 -0.05 0.04 0.00 3.98 0.00 0.00 57.97 61.88 1khu h PHE 388 Cb 0.45 -0.33 -0.05 0.00 2.56 0.00 0.00 35.95 38.57 1khu h PHE 388 CO -0.04 0.79 0.61 0.00 -2.02 0.00 0.00 178.31 177.65 1khu h ALA 389 N 1.17 1.23 -0.31 2.41 0.00 0.11 0.22 119.26 124.10 1khu h ALA 389 Ca 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1khu h ALA 389 Cb 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1khu h ALA 389 CO -0.03 0.48 0.13 0.37 0.00 0.00 0.00 179.25 180.20 1khu h GLN 390 N 1.17 0.47 -0.33 0.00 4.15 -0.62 0.95 115.11 120.90 1khu h GLN 390 Ca 0.37 -0.08 -0.04 0.00 0.77 0.00 0.00 58.65 59.68 1khu h GLN 390 Cb 0.01 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 1khu h GLN 390 CO -0.12 0.46 0.05 -0.07 -1.93 0.00 0.00 178.83 177.22 1khu h LEU 391 N 0.36 0.45 -0.48 -2.39 -0.00 -0.47 0.68 115.31 113.47 1khu h LEU 391 Ca 0.11 -0.07 -0.10 0.00 -0.00 0.00 0.00 57.88 57.82 1khu h LEU 391 Cb 0.16 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 40.69 1khu h LEU 391 CO -0.01 0.48 -0.08 0.25 -0.00 0.00 0.00 178.44 179.08 1khu h LEU 392 N 0.48 0.91 0.01 1.67 5.85 0.08 -3.09 115.31 121.23 1khu h LEU 392 Ca 0.11 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1khu h LEU 392 Cb 0.23 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.01 1khu h LEU 392 CO 0.00 1.05 -0.01 0.00 -0.34 0.00 0.00 178.44 179.14 1khu h ALA 393 N 0.90 -0.02 0.00 1.25 0.00 -0.05 -2.88 119.26 118.47 1khu h ALA 393 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1khu h ALA 393 Cb 0.63 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1khu h ALA 393 CO 0.04 -0.39 0.00 1.04 0.00 0.00 0.00 179.25 179.94 1khu n GLN 394 N -4.98 0.00 0.00 0.00 6.02 0.16 -1.77 117.38 116.81 1khu n GLN 394 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1khu n GLN 394 Cb 0.14 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1khu n GLN 394 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1khu n SER 395 N -0.81 0.08 -0.26 1.08 3.41 -1.14 -4.85 113.62 111.12 1khu n SER 395 Ca 0.00 -1.03 0.13 0.00 -0.26 0.00 0.00 58.87 57.71 1khu n SER 395 Cb 0.00 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.35 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 2.32 0.80 -2.20 -3.33 3.04 -1.13 -2.67 116.25 113.08 1khu h VAL 396 Ca 0.00 -0.22 -0.59 0.00 -1.01 0.00 0.00 66.70 64.89 1khu h VAL 396 Cb 0.84 0.11 -0.42 0.00 -2.01 0.00 0.00 31.29 29.81 1khu h VAL 396 CO 0.00 0.12 -0.69 -0.46 -1.01 0.00 0.00 177.57 175.53 1khu n ASN 397 N -4.56 3.54 0.00 3.17 0.23 -1.26 -4.68 115.26 111.70 1khu n ASN 397 Ca 0.18 -3.44 0.00 0.00 -0.53 0.00 0.00 54.58 50.79 1khu n ASN 397 Cb 0.51 -0.63 0.00 0.00 -2.08 0.00 0.00 39.78 37.59 1khu n ASN 397 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 1khu n HIS 398 N 0.48 0.00 0.00 -2.53 -0.00 -1.01 -5.14 115.22 107.03 1khu n HIS 398 Ca 0.29 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.47 1khu n HIS 398 Cb 0.43 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.30 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 0.02 3.89 0.38 1.57 0.00 -1.26 -4.87 105.19 104.93 1khu n GLY 399 Ca 0.00 -0.52 0.15 0.00 0.00 0.00 0.00 46.02 45.65 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 0.83 -0.03 1.61 3.04 -1.93 0.74 116.94 121.20 1khu h PHE 400 Ca 0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 1khu h PHE 400 Cb 0.00 -0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.26 1khu h PHE 400 CO 0.00 0.22 0.02 1.49 -2.02 0.00 0.00 178.31 178.02 1khu h GLU 401 N 0.62 0.04 0.00 1.11 4.81 -1.99 0.09 114.58 119.26 1khu h GLU 401 Ca 0.52 -0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.64 1khu h GLU 401 Cb 0.98 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1khu h GLU 401 CO -0.27 0.04 -0.51 1.79 -0.73 0.00 0.00 179.01 179.33 1khu h THR 402 N 0.03 1.01 0.02 0.32 1.35 -1.51 -2.91 112.91 111.22 1khu h THR 402 Ca 0.01 -2.02 -0.20 0.00 -0.55 0.00 0.00 66.41 63.65 1khu h THR 402 Cb 0.01 2.21 -0.01 0.00 -1.73 0.00 0.00 68.15 68.63 1khu h THR 402 CO -0.00 0.50 -0.92 1.62 -0.25 0.00 0.00 175.52 176.46 1khu h VAL 403 N 0.00 1.54 -0.25 6.82 3.04 -0.73 -3.12 116.25 123.55 1khu h VAL 403 Ca -0.01 -2.81 -0.10 0.00 -1.01 0.00 0.00 66.70 62.78 1khu h VAL 403 Cb 1.17 2.58 -0.01 0.00 -2.01 0.00 0.00 31.29 33.02 1khu h VAL 403 CO 0.07 0.81 -0.27 0.22 -1.01 0.00 0.00 177.57 177.39 1khu h TYR 404 N 0.07 0.55 0.00 3.17 -0.00 -0.94 -2.61 116.97 117.20 1khu h TYR 404 Ca -0.04 -0.12 -0.01 0.00 -0.00 0.00 0.00 58.73 58.56 1khu h TYR 404 Cb 1.58 -0.13 -0.00 0.00 -0.00 0.00 0.00 36.73 38.18 1khu h TYR 404 CO 0.02 0.71 -0.04 0.93 -0.00 0.00 0.00 178.16 179.78 1khu h GLU 405 N 0.43 0.00 0.00 1.82 4.39 -1.44 -1.83 114.58 117.94 1khu h GLU 405 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1khu h GLU 405 Cb 0.69 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1khu h GLU 405 CO 0.05 0.04 0.00 1.28 -1.16 0.00 0.00 179.01 179.22 1khu n LEU 406 N -3.47 0.08 -0.14 1.33 4.77 -0.98 -2.24 117.00 116.35 1khu n LEU 406 Ca -0.02 0.53 -0.08 0.00 -0.03 0.00 0.00 56.01 56.41 1khu n LEU 406 Cb 0.15 -0.53 0.01 0.00 -2.33 0.00 0.00 43.42 40.72 1khu n LEU 406 CO 0.26 -0.41 1.06 0.74 -1.33 0.00 0.00 177.39 177.70 1khu h THR 407 N 0.00 1.11 -0.48 -5.08 2.02 -1.51 -1.02 112.91 107.95 1khu h THR 407 Ca 0.00 -0.20 0.14 0.00 0.77 0.00 0.00 66.41 67.12 1khu h THR 407 Cb 0.15 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1khu h THR 407 CO 0.00 0.11 0.42 0.11 0.37 0.00 0.00 175.52 176.52 1khu h LYS 408 N 0.59 0.00 0.00 6.66 1.57 -1.68 0.76 116.57 124.47 1khu h LYS 408 Ca 0.16 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.88 1khu h LYS 408 Cb -0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1khu h LYS 408 CO -0.03 0.00 -0.28 0.52 -0.57 0.00 0.00 179.45 179.09 1khu h MET 409 N 0.00 0.00 -0.06 3.15 2.86 -1.34 -3.12 114.93 116.42 1khu h MET 409 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1khu h MET 409 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 1khu h MET 409 CO -0.00 0.28 0.00 0.00 1.06 0.00 0.00 176.91 178.25 1khu s THR 411 N -1.93 2.24 0.00 0.00 -4.23 -1.18 -1.53 115.64 109.02 1khu s THR 411 Ca 0.36 -1.44 0.03 0.00 -1.18 0.00 0.00 61.69 59.47 1khu s THR 411 Cb 0.18 -1.90 -0.01 0.00 1.34 0.00 0.00 72.50 72.11 1khu s THR 411 CO 0.29 0.31 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.95 1khu s ILE 412 N -0.87 0.83 -0.06 2.99 1.01 -0.70 -4.68 121.20 119.71 1khu s ILE 412 Ca 0.13 -0.57 0.05 0.00 0.00 0.00 0.00 60.65 60.25 1khu s ILE 412 Cb -0.10 -0.72 -0.00 0.00 0.01 0.00 0.00 42.46 41.65 1khu s ILE 412 CO 0.03 0.14 -0.21 -0.13 0.00 0.00 0.00 174.94 174.78 1khu s ARG 413 N -0.48 2.32 -0.05 2.79 0.52 -1.03 -0.75 118.95 122.26 1khu s ARG 413 Ca 0.03 -0.75 -0.06 0.00 -0.52 0.00 0.00 55.73 54.43 1khu s ARG 413 Cb -0.05 -1.91 0.01 0.00 0.52 0.00 0.00 34.95 33.52 1khu s ARG 413 CO -0.00 0.25 0.16 0.00 0.02 0.00 0.00 175.30 175.73 1khu s MET 414 N 0.11 0.23 0.17 3.54 0.23 -0.92 0.43 119.30 123.08 1khu s MET 414 Ca -0.08 0.15 0.11 0.00 -1.03 0.00 0.00 55.69 54.84 1khu s MET 414 Cb -0.14 0.11 -0.04 0.00 -1.53 0.00 0.00 34.83 33.22 1khu s MET 414 CO 0.04 -0.03 -0.25 -1.54 -2.03 0.00 0.00 175.02 171.21 1khu s SER 415 N -0.10 3.43 0.01 -1.18 1.04 -0.57 -1.34 113.70 114.99 1khu s SER 415 Ca -0.02 -0.80 -0.18 0.00 0.48 0.00 0.00 55.95 55.43 1khu s SER 415 Cb -0.02 -0.26 -0.06 0.00 0.10 0.00 0.00 66.02 65.78 1khu s SER 415 CO 0.00 0.15 0.52 -0.36 0.98 0.00 0.00 173.24 174.53 1khu s PHE 416 N -1.42 3.71 0.00 5.02 0.08 -0.14 -2.01 117.98 123.23 1khu s PHE 416 Ca 0.18 1.13 0.00 0.00 0.12 0.00 0.00 56.93 58.36 1khu s PHE 416 Cb -0.09 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 39.88 1khu s PHE 416 CO 0.08 0.48 0.00 0.28 -0.10 0.00 0.00 175.22 175.96 1khu n VAL 417 N 2.30 0.00 -2.88 -0.44 0.31 -0.60 -4.66 118.33 112.35 1khu n VAL 417 Ca -0.10 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.82 1khu n VAL 417 Cb 0.51 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.40 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 4.39 0.65 5.55 -0.14 -1.26 -4.73 119.74 124.20 1khu s LYS 418 Ca 0.00 1.09 -0.08 0.00 -1.36 0.00 0.00 55.97 55.62 1khu s LYS 418 Cb 0.00 -3.52 0.14 0.00 -1.68 0.00 0.00 37.83 32.78 1khu s LYS 418 CO 0.00 -0.17 0.88 0.41 -0.76 0.00 0.00 175.35 175.71 1khu n GLY 419 N 3.23 -0.61 3.53 -3.33 0.00 -1.26 -4.81 105.19 101.94 1khu n GLY 419 Ca 0.04 -1.82 -0.11 0.00 0.00 0.00 0.00 46.02 44.13 1khu n GLY 419 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1khu s TRP 420 N -2.78 -0.40 0.00 1.61 -2.14 -1.26 -4.70 118.94 109.26 1khu s TRP 420 Ca 0.53 0.49 0.00 0.00 2.66 0.00 0.00 56.10 59.77 1khu s TRP 420 Cb -0.02 0.49 0.00 0.00 -3.10 0.00 0.00 33.47 30.84 1khu s TRP 420 CO 0.36 -0.49 0.00 0.41 -2.66 0.00 0.00 176.95 174.57 1khu n GLY 421 N 0.25 -1.75 3.51 3.67 0.00 0.60 -4.81 105.19 106.66 1khu n GLY 421 Ca -0.11 -2.08 -0.43 0.00 0.00 0.00 0.00 46.02 43.40 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 0.02 -1.08 0.00 4.61 0.00 -1.26 -1.26 120.51 121.53 1khu n ALA 422 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1khu n ALA 422 Cb 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 17.58 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 0.64 0.00 -4.27 0.00 -0.58 -1.26 -4.99 120.64 110.18 1khu n GLU 423 Ca 0.12 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.62 1khu n GLU 423 Cb 0.35 -0.87 -0.07 0.00 -0.57 0.00 0.00 31.44 30.28 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 -1.75 2.76 -0.07 -0.32 2.02 -0.39 -5.05 117.35 114.55 1khu s TYR 424 Ca 0.00 -0.20 -0.25 0.00 -0.37 0.00 0.00 57.07 56.25 1khu s TYR 424 Cb 0.00 -1.23 -0.21 0.00 -0.40 0.00 0.00 41.96 40.12 1khu s TYR 424 CO 0.00 0.60 0.96 1.25 -1.57 0.00 0.00 175.55 176.80 1khu h HIS 425 N 1.89 -0.04 -2.58 2.71 -0.00 -1.91 -3.43 115.15 111.78 1khu h HIS 425 Ca -0.45 -0.00 -0.56 0.00 -0.00 0.00 0.00 60.37 59.36 1khu h HIS 425 Cb 1.24 0.01 0.07 0.00 -0.00 0.00 0.00 27.41 28.74 1khu h HIS 425 CO 0.66 0.60 0.84 0.54 -0.00 0.00 0.00 177.93 180.57 1khu n ARG 426 N -4.78 2.38 -0.09 5.26 1.74 -1.26 -4.87 116.66 115.04 1khu n ARG 426 Ca -0.09 0.86 -0.11 0.00 -0.77 0.00 0.00 57.85 57.74 1khu n ARG 426 Cb 0.33 -2.63 -0.10 0.00 -1.02 0.00 0.00 32.46 29.04 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 3.16 0.88 -3.87 5.56 1.13 -1.26 -0.29 117.38 122.69 1khu n GLN 427 Ca 0.15 0.07 -0.22 0.00 -1.94 0.00 0.00 57.00 55.05 1khu n GLN 427 Cb 0.32 -1.39 -0.05 0.00 0.11 0.00 0.00 30.24 29.23 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 -5.51 4.99 0.18 1.08 3.68 -1.26 -3.52 116.67 116.30 1khu s ASP 428 Ca -0.19 -0.67 0.25 0.00 2.13 0.00 0.00 52.55 54.07 1khu s ASP 428 Cb 0.06 -0.78 0.90 0.00 -1.45 0.00 0.00 42.92 41.65 1khu s ASP 428 CO 0.52 -0.41 1.77 0.55 0.13 0.00 0.00 175.17 177.73 1khu n VAL 429 N -1.33 0.58 1.14 1.11 3.14 -1.26 -2.67 118.33 119.04 1khu n VAL 429 Ca -0.01 -0.10 0.12 0.00 -2.96 0.00 0.00 64.34 61.39 1khu n VAL 429 Cb 0.61 -0.72 0.61 0.00 -1.06 0.00 0.00 33.84 33.27 1khu n VAL 429 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1khu n THR 430 N -2.10 0.23 0.18 1.55 -2.24 -1.26 -3.20 114.28 107.44 1khu n THR 430 Ca 0.05 0.06 0.11 0.00 -2.27 0.00 0.00 64.05 61.99 1khu n THR 430 Cb 0.36 -0.66 -0.16 0.00 -2.10 0.00 0.00 70.33 67.77 1khu n THR 430 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1khu n SER 431 N -1.29 0.21 -4.77 3.42 7.64 -1.09 -3.22 113.62 114.52 1khu n SER 431 Ca 0.11 -0.19 -0.39 0.00 1.01 0.00 0.00 58.87 59.41 1khu n SER 431 Cb 0.19 1.80 -0.04 0.00 -1.01 0.00 0.00 64.21 65.15 1khu n SER 431 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1khu s THR 432 N -3.41 3.64 0.20 0.44 -4.23 -1.19 -4.88 115.64 106.20 1khu s THR 432 Ca -0.05 1.49 0.26 0.00 -1.18 0.00 0.00 61.69 62.20 1khu s THR 432 Cb 0.14 -3.89 0.26 0.00 1.34 0.00 0.00 72.50 70.36 1khu s THR 432 CO 0.90 0.24 1.89 1.55 -0.54 0.00 0.00 174.62 178.66 1khu h PRO 433 N 3.34 0.00 -2.97 3.99 0.13 -1.90 -2.93 132.00 131.66 1khu h PRO 433 Ca -0.47 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.25 1khu h PRO 433 Cb 1.21 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.95 1khu h PRO 433 CO 0.65 0.19 -0.72 0.00 -0.23 0.00 0.00 178.00 177.89 1khu s TRP 435 N 2.19 0.50 0.05 0.00 1.48 -0.91 -0.97 118.94 121.28 1khu s TRP 435 Ca 0.03 -0.84 -0.01 0.00 -1.06 0.00 0.00 56.10 54.22 1khu s TRP 435 Cb -0.15 -0.04 -0.03 0.00 -1.16 0.00 0.00 33.47 32.08 1khu s TRP 435 CO -0.09 -0.81 -0.01 0.96 -4.06 0.00 0.00 176.95 172.94 1khu s ILE 436 N -4.01 0.19 -0.07 0.66 -4.36 -0.45 0.10 121.20 113.27 1khu s ILE 436 Ca 0.22 -1.59 0.03 0.00 -0.26 0.00 0.00 60.65 59.05 1khu s ILE 436 Cb 0.02 -1.28 0.01 0.00 1.25 0.00 0.00 42.46 42.46 1khu s ILE 436 CO 0.05 -0.88 -0.16 -0.70 0.24 0.00 0.00 174.94 173.49 1khu s GLU 437 N -3.45 2.06 -0.20 0.37 2.12 0.08 -2.17 118.70 117.51 1khu s GLU 437 Ca 0.03 -0.58 -0.02 0.00 0.36 0.00 0.00 54.97 54.75 1khu s GLU 437 Cb 0.04 -1.67 -0.00 0.00 0.26 0.00 0.00 34.13 32.76 1khu s GLU 437 CO -0.08 0.12 -0.09 0.42 -0.54 0.00 0.00 175.26 175.09 1khu s ILE 438 N 0.41 3.03 -0.20 -3.70 1.01 0.07 -1.09 121.20 120.73 1khu s ILE 438 Ca -0.13 -0.62 -0.11 0.00 0.00 0.00 0.00 60.65 59.80 1khu s ILE 438 Cb -0.15 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 1khu s ILE 438 CO 0.05 0.46 0.16 -1.00 0.00 0.00 0.00 174.94 174.61 1khu s HIS 439 N 1.26 3.41 -0.46 3.97 3.76 0.15 -1.72 115.29 125.66 1khu s HIS 439 Ca 0.03 0.36 -0.18 0.00 -0.15 0.00 0.00 55.06 55.12 1khu s HIS 439 Cb -0.14 -2.20 0.04 0.00 1.11 0.00 0.00 32.58 31.39 1khu s HIS 439 CO -0.04 0.27 0.52 -0.51 -0.85 0.00 0.00 174.74 174.13 1khu s LEU 440 N 0.43 4.95 0.15 0.89 2.01 -0.58 -1.86 118.68 124.67 1khu s LEU 440 Ca 0.09 -0.80 -0.15 0.00 0.01 0.00 0.00 54.13 53.28 1khu s LEU 440 Cb -0.11 -2.42 0.02 0.00 0.01 0.00 0.00 46.19 43.68 1khu s LEU 440 CO -0.01 -0.72 1.74 0.45 1.01 0.00 0.00 176.35 178.82 1khu h HIS 441 N 8.84 0.62 -0.01 0.29 3.86 -0.77 -2.13 115.15 125.84 1khu h HIS 441 Ca -0.27 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 58.93 1khu h HIS 441 Cb 1.10 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 29.36 1khu h HIS 441 CO 0.68 0.49 -0.20 0.78 0.86 0.00 0.00 177.93 180.54 1khu h GLY 442 N 0.57 -1.31 0.20 2.45 0.00 -1.87 0.35 103.07 103.45 1khu h GLY 442 Ca 0.15 0.63 0.14 0.00 0.00 0.00 0.00 47.33 48.26 1khu h GLY 442 CO -0.02 -0.43 0.39 -2.55 0.00 0.00 0.00 176.54 173.93 1khu h PRO 443 N -0.24 0.54 -0.62 4.80 0.11 -1.91 -1.36 132.00 133.32 1khu h PRO 443 Ca 0.01 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.06 1khu h PRO 443 Cb 0.26 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 31.22 1khu h PRO 443 CO -0.14 0.36 0.30 -0.07 -0.21 0.00 0.00 178.00 178.24 1khu h LEU 444 N 0.56 0.79 -0.02 2.35 3.38 -1.06 -0.26 115.31 121.04 1khu h LEU 444 Ca 0.45 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 1khu h LEU 444 Cb 0.65 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1khu h LEU 444 CO -0.38 0.67 -0.02 -0.61 0.09 0.00 0.00 178.44 178.20 1khu h GLN 445 N 0.88 0.06 -0.65 1.13 4.15 0.14 -0.94 115.11 119.87 1khu h GLN 445 Ca 0.22 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.62 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 -0.03 0.51 0.43 -1.49 -1.93 0.00 0.00 178.83 176.32 1khu h TRP 446 N -0.39 0.82 -0.15 3.99 6.55 -1.21 0.25 115.95 125.80 1khu h TRP 446 Ca 0.00 0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.90 1khu h TRP 446 Cb 0.50 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.51 1khu h TRP 446 CO 0.09 0.51 0.10 1.25 -1.05 0.00 0.00 178.44 179.34 1khu h LEU 447 N 0.88 0.02 0.25 -4.49 5.85 -0.96 -1.83 115.31 115.03 1khu h LEU 447 Ca 0.24 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1khu h LEU 447 Cb -0.10 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1khu h LEU 447 CO -0.05 0.01 -0.12 -0.78 -0.34 0.00 0.00 178.44 177.16 1khu h ASP 448 N 0.02 -0.29 -1.30 1.25 -0.00 0.87 -0.97 116.42 116.01 1khu h ASP 448 Ca 0.07 -0.19 0.38 0.00 -0.00 0.00 0.00 57.03 57.28 1khu h ASP 448 Cb 0.24 0.07 -0.08 0.00 -0.00 0.00 0.00 39.33 39.57 1khu h ASP 448 CO -0.00 0.05 0.90 0.11 -0.00 0.00 0.00 179.24 180.30 1khu h LYS 449 N -0.66 0.10 0.06 0.28 6.56 -0.37 -0.89 116.57 121.65 1khu h LYS 449 Ca -0.03 -0.01 -0.25 0.00 -1.06 0.00 0.00 60.65 59.30 1khu h LYS 449 Cb 0.46 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.08 1khu h LYS 449 CO 0.06 0.06 -1.30 0.28 -2.06 0.00 0.00 179.45 176.49 1khu h VAL 450 N 0.10 0.99 -0.09 0.50 2.07 -1.29 -3.36 116.25 115.17 1khu h VAL 450 Ca 0.67 -2.29 0.03 0.00 0.82 0.00 0.00 66.70 65.93 1khu h VAL 450 Cb 2.39 2.54 -0.00 0.00 -1.52 0.00 0.00 31.29 34.69 1khu h VAL 450 CO -0.14 0.56 0.08 -0.07 0.02 0.00 0.00 177.57 178.02 1khu h LEU 451 N -0.61 0.00 -1.69 2.57 3.38 -0.17 -1.83 115.31 116.96 1khu h LEU 451 Ca -0.31 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.75 1khu h LEU 451 Cb 1.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.28 1khu h LEU 451 CO -0.06 0.00 0.56 0.74 0.09 0.00 0.00 178.44 179.77 1khu h THR 452 N 0.00 0.17 -1.96 0.22 2.02 -1.35 -3.05 112.91 108.97 1khu h THR 452 Ca 0.04 0.00 -0.77 0.00 0.77 0.00 0.00 66.41 66.46 1khu h THR 452 Cb 0.21 0.51 -0.19 0.00 -1.74 0.00 0.00 68.15 66.94 1khu h THR 452 CO -0.00 0.00 1.56 0.00 0.37 0.00 0.00 175.52 177.45 1khu n GLN 453 N -3.28 3.75 0.00 6.66 1.13 -0.69 -4.82 117.38 120.13 1khu n GLN 453 Ca 0.06 -3.85 0.00 0.00 -1.94 0.00 0.00 57.00 51.27 1khu n GLN 453 Cb 0.70 -2.84 0.00 0.00 0.11 0.00 0.00 30.24 28.21 1khu n GLN 453 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1khu n MET 454 N 3.58 0.00 -3.42 -1.09 0.00 -1.15 -5.01 117.12 110.02 1khu n MET 454 Ca 0.36 0.00 -0.17 0.00 0.00 0.00 0.00 57.70 57.88 1khu n MET 454 Cb 0.37 0.00 0.09 0.00 0.00 0.00 0.00 33.22 33.67 1khu n MET 454 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1khu n GLY 455 N 3.15 -0.44 3.34 3.17 0.00 -1.26 -4.94 105.19 108.21 1khu n GLY 455 Ca 0.00 0.15 -0.46 0.00 0.00 0.00 0.00 46.02 45.71 1khu n GLY 455 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1khu s SER 456 N -4.26 7.02 0.00 1.61 0.15 -1.26 -4.85 113.70 112.11 1khu s SER 456 Ca 0.05 -3.10 0.19 0.00 0.70 0.00 0.00 55.95 53.79 1khu s SER 456 Cb -0.01 -2.21 0.96 0.00 -1.71 0.00 0.00 66.02 63.05 1khu s SER 456 CO 0.73 -0.45 1.59 -2.65 1.20 0.00 0.00 173.24 173.67 1khu n PRO 457 N 3.41 0.27 -1.16 5.44 -0.02 -1.26 -4.87 135.00 136.81 1khu n PRO 457 Ca 0.18 0.11 -0.37 0.00 -2.02 0.00 0.00 63.50 61.40 1khu n PRO 457 Cb 0.44 -1.50 0.03 0.00 -0.02 0.00 0.00 33.50 32.45 1khu n PRO 457 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1khu n HIS 458 N -1.29 -3.30 -3.52 6.00 -0.00 -1.26 -2.83 115.22 109.02 1khu n HIS 458 Ca 0.09 0.27 -0.22 0.00 0.46 0.00 0.00 57.72 58.32 1khu n HIS 458 Cb 0.15 -1.64 -0.06 0.00 -0.12 0.00 0.00 29.99 28.32 1khu n HIS 458 CO 0.00 0.00 0.00 0.27 0.46 0.00 0.00 176.34 177.07 1khu n ASN 459 N 2.29 -0.03 -4.49 0.26 6.94 -1.26 -4.75 115.26 114.22 1khu n ASN 459 Ca 0.05 -0.77 -0.48 0.00 -0.02 0.00 0.00 54.58 53.35 1khu n ASN 459 Cb 0.51 -0.97 -0.06 0.00 -2.36 0.00 0.00 39.78 36.90 1khu n ASN 459 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 1khu n PRO 460 N -3.00 1.32 -1.12 -0.53 -0.04 -1.13 -4.93 135.00 125.57 1khu n PRO 460 Ca -0.10 0.36 -0.10 0.00 -0.04 0.00 0.00 63.50 63.61 1khu n PRO 460 Cb 0.37 -2.69 0.06 0.00 -0.04 0.00 0.00 33.50 31.20 1khu n PRO 460 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1khu n ILE 461 N 7.37 0.00 -3.28 0.52 -6.64 -1.26 -5.09 119.36 110.98 1khu n ILE 461 Ca 0.38 -0.52 -0.34 0.00 -1.77 0.00 0.00 62.75 60.50 1khu n ILE 461 Cb 0.29 -1.45 -0.06 0.00 -1.44 0.00 0.00 39.64 36.99 1khu n ILE 461 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 1khu s SER 462 N -2.74 6.78 0.00 7.28 0.15 -1.26 -4.97 113.70 118.94 1khu s SER 462 Ca 0.28 1.13 0.23 0.00 0.70 0.00 0.00 55.95 58.29 1khu s SER 462 Cb -0.01 -2.31 0.24 0.00 -1.71 0.00 0.00 66.02 62.22 1khu s SER 462 CO 0.19 -0.04 1.26 -1.54 1.20 0.00 0.00 173.24 174.30 1khu n SER 463 N 0.19 3.02 -0.02 5.45 3.41 -1.26 -4.59 113.62 119.82 1khu n SER 463 Ca -0.01 -1.95 -0.04 0.00 -0.26 0.00 0.00 58.87 56.61 1khu n SER 463 Cb 0.52 -0.06 -0.01 0.00 -0.26 0.00 0.00 64.21 64.40 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 1.32 0.95 1.01 -3.33 0.31 -1.26 -5.39 118.33 111.93 1khu n VAL 464 Ca 0.15 0.27 0.08 0.00 -0.01 0.00 0.00 64.34 64.82 1khu n VAL 464 Cb 0.57 -1.79 0.48 0.00 -0.91 0.00 0.00 33.84 32.19 1khu n VAL 464 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97