#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fqs s TYR 364 N 0.00 3.45 0.21 1.45 2.02 -1.26 0.13 117.35 123.35 3fqs s TYR 364 Ca 0.00 0.70 0.07 0.00 -0.37 0.00 0.00 57.07 57.47 3fqs s TYR 364 Cb 0.00 -2.47 -0.04 0.00 -0.40 0.00 0.00 41.96 39.05 3fqs s TYR 364 CO 0.00 0.13 0.14 -0.51 -1.57 0.00 0.00 175.55 173.74 3fqs s LEU 365 N 0.80 3.71 -0.52 -1.29 1.43 0.68 -4.90 118.68 118.59 3fqs s LEU 365 Ca 0.20 -0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 52.81 3fqs s LEU 365 Cb -0.14 -2.28 0.04 0.00 0.03 0.00 0.00 46.19 43.83 3fqs s LEU 365 CO 0.07 0.01 0.89 -0.62 0.23 0.00 0.00 176.35 176.94 3fqs s ASP 366 N -3.48 6.37 0.43 2.29 -1.08 -1.26 -4.77 116.67 115.17 3fqs s ASP 366 Ca 0.32 -0.28 0.20 0.00 -0.52 0.00 0.00 52.55 52.26 3fqs s ASP 366 Cb -0.09 -2.42 1.15 0.00 -1.46 0.00 0.00 42.92 40.11 3fqs s ASP 366 CO 0.23 -1.13 1.85 -0.09 0.52 0.00 0.00 175.17 176.55 3fqs h ARG 367 N 9.20 0.33 0.00 4.34 9.65 -1.93 0.14 114.38 136.11 3fqs h ARG 367 Ca -0.26 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.54 3fqs h ARG 367 Cb 1.08 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.57 3fqs h ARG 367 CO 1.05 0.22 -0.32 1.57 2.80 0.00 0.00 179.97 185.29 3fqs h LYS 368 N 0.34 0.00 0.00 0.20 2.10 -2.02 -2.73 116.57 114.46 3fqs h LYS 368 Ca 0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.13 3fqs h LYS 368 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 3fqs h LYS 368 CO -0.17 0.32 0.00 1.28 -2.00 0.00 0.00 179.45 178.88 3fqs n LEU 369 N -3.46 0.00 -4.40 7.07 4.77 0.49 -4.78 117.00 116.68 3fqs n LEU 369 Ca 0.00 0.13 -0.34 0.00 -0.03 0.00 0.00 56.01 55.77 3fqs n LEU 369 Cb 0.49 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.32 3fqs n LEU 369 CO 0.36 -0.01 -0.39 -0.22 -1.33 0.00 0.00 177.39 175.80 3fqs s LEU 370 N -2.25 3.00 -0.16 2.23 2.96 -1.03 -2.07 118.68 121.35 3fqs s LEU 370 Ca 0.35 -0.27 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3fqs s LEU 370 Cb 0.19 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 3fqs s LEU 370 CO 0.37 0.10 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.54 3fqs s THR 371 N 0.74 3.50 -0.13 3.68 2.01 -0.12 -4.98 115.64 120.35 3fqs s THR 371 Ca -0.03 -0.49 -0.04 0.00 0.31 0.00 0.00 61.69 61.45 3fqs s THR 371 Cb -0.15 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.80 3fqs s THR 371 CO 0.02 0.49 0.00 -0.76 -0.69 0.00 0.00 174.62 173.68 3fqs s LEU 372 N 0.58 3.53 0.32 4.42 1.43 -1.26 -1.13 118.68 126.57 3fqs s LEU 372 Ca -0.05 0.05 -0.05 0.00 -1.03 0.00 0.00 54.13 53.05 3fqs s LEU 372 Cb -0.15 -1.84 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 3fqs s LEU 372 CO 0.03 0.27 0.60 -1.61 0.23 0.00 0.00 176.35 175.87 3fqs s GLU 373 N -0.25 3.63 0.00 1.70 2.02 -0.70 -4.99 118.70 120.12 3fqs s GLU 373 Ca 0.06 0.05 0.30 0.00 0.02 0.00 0.00 54.97 55.40 3fqs s GLU 373 Cb -0.12 -2.59 1.44 0.00 0.10 0.00 0.00 34.13 32.95 3fqs s GLU 373 CO 0.02 0.14 1.97 -0.40 0.02 0.00 0.00 175.26 177.01 3fqs n ASP 374 N -1.15 0.64 -4.65 -0.19 5.68 -1.26 -4.57 116.55 111.04 3fqs n ASP 374 Ca -0.01 -1.06 -0.43 0.00 -0.50 0.00 0.00 54.79 52.78 3fqs n ASP 374 Cb 0.54 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 40.48 3fqs n ASP 374 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3fqs s LYS 375 N -2.12 4.14 0.18 0.11 1.02 -1.26 -5.02 119.74 116.80 3fqs s LYS 375 Ca 0.40 1.40 -0.16 0.00 0.02 0.00 0.00 55.97 57.62 3fqs s LYS 375 Cb 0.21 -3.75 -0.07 0.00 -0.52 0.00 0.00 37.83 33.69 3fqs s LYS 375 CO 0.38 -0.81 0.62 -2.00 -0.92 0.00 0.00 175.35 172.62 3fqs s GLU 376 N 3.59 4.07 -0.07 1.68 2.12 -1.26 -3.09 118.70 125.74 3fqs s GLU 376 Ca 0.51 0.62 0.16 0.00 0.36 0.00 0.00 54.97 56.62 3fqs s GLU 376 Cb -0.17 -2.88 -0.24 0.00 0.26 0.00 0.00 34.13 31.10 3fqs s GLU 376 CO 0.14 0.43 0.25 1.28 -0.54 0.00 0.00 175.26 176.82 3fqs n LEU 377 N 0.69 0.00 -3.68 2.70 4.77 0.18 -4.94 117.00 116.73 3fqs n LEU 377 Ca -0.04 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.96 3fqs n LEU 377 Cb 0.52 0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.75 3fqs n LEU 377 CO 0.43 0.14 1.06 -0.83 -1.33 0.00 0.00 177.39 176.86 3fqs s GLY 378 N -4.30 -0.36 0.09 -0.72 0.00 -1.13 -4.97 107.32 95.93 3fqs s GLY 378 Ca -0.07 0.58 -0.03 0.00 0.00 0.00 0.00 44.72 45.20 3fqs s GLY 378 CO 0.68 0.98 0.06 -0.56 0.00 0.00 0.00 173.10 174.25 3fqs s SER 379 N -3.11 0.34 -0.01 1.64 0.01 -1.26 -2.27 113.70 109.04 3fqs s SER 379 Ca 0.17 -0.99 -0.12 0.00 1.31 0.00 0.00 55.95 56.32 3fqs s SER 379 Cb 0.04 0.27 0.04 0.00 0.21 0.00 0.00 66.02 66.58 3fqs s SER 379 CO -0.03 -0.68 0.54 0.61 0.41 0.00 0.00 173.24 174.08 3fqs n GLY 380 N 0.00 0.44 0.19 3.44 0.00 -0.66 -5.00 105.19 103.60 3fqs n GLY 380 Ca -0.11 -0.92 0.04 0.00 0.00 0.00 0.00 46.02 45.03 3fqs n GLY 380 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fqs h ASN 381 N 0.83 0.00 0.06 1.61 4.21 -2.03 -2.88 115.58 117.38 3fqs h ASN 381 Ca -0.09 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.40 3fqs h ASN 381 Cb 0.49 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.68 3fqs h ASN 381 CO 0.13 0.38 -0.09 2.19 -1.29 0.00 0.00 177.43 178.75 3fqs h PHE 382 N 0.00 0.09 0.00 1.19 -0.00 -1.95 -3.42 116.94 112.84 3fqs h PHE 382 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.96 3fqs h PHE 382 Cb 0.75 -0.03 0.00 0.00 -0.00 0.00 0.00 35.95 36.67 3fqs h PHE 382 CO 0.00 0.19 0.00 0.41 -0.00 0.00 0.00 178.31 178.91 3fqs n GLY 383 N -1.15 0.46 3.28 6.09 0.00 -1.09 0.17 105.19 112.95 3fqs n GLY 383 Ca -0.02 -1.32 -0.19 0.00 0.00 0.00 0.00 46.02 44.49 3fqs n GLY 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fqs s THR 384 N -3.54 1.54 -0.20 2.61 -4.23 -0.60 -1.65 115.64 109.57 3fqs s THR 384 Ca 0.00 -1.85 -0.04 0.00 -1.18 0.00 0.00 61.69 58.62 3fqs s THR 384 Cb 0.00 -1.71 -0.02 0.00 1.34 0.00 0.00 72.50 72.12 3fqs s THR 384 CO 0.00 -0.40 -0.03 -0.69 -0.54 0.00 0.00 174.62 172.96 3fqs s VAL 385 N -2.22 3.62 0.22 2.29 1.01 -0.96 0.00 120.40 124.37 3fqs s VAL 385 Ca 0.13 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.79 3fqs s VAL 385 Cb -0.05 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.66 3fqs s VAL 385 CO 0.05 0.43 -0.20 -0.54 0.00 0.00 0.00 175.10 174.84 3fqs s LYS 386 N 1.14 1.49 0.36 2.72 1.02 0.10 0.51 119.74 127.09 3fqs s LYS 386 Ca 0.02 -1.60 -0.22 0.00 0.02 0.00 0.00 55.97 54.19 3fqs s LYS 386 Cb -0.15 -1.58 -0.10 0.00 -0.52 0.00 0.00 37.83 35.48 3fqs s LYS 386 CO 0.00 0.31 0.90 0.21 -0.92 0.00 0.00 175.35 175.85 3fqs s LYS 387 N -3.18 4.33 0.07 1.68 2.20 -1.18 -0.13 119.74 123.54 3fqs s LYS 387 Ca 0.23 1.11 -0.03 0.00 -0.36 0.00 0.00 55.97 56.92 3fqs s LYS 387 Cb -0.05 -2.51 0.01 0.00 -1.51 0.00 0.00 37.83 33.77 3fqs s LYS 387 CO 0.11 0.15 0.17 0.41 -0.36 0.00 0.00 175.35 175.83 3fqs n GLY 388 N -0.03 1.65 3.00 5.54 0.00 0.45 -1.71 105.19 114.10 3fqs n GLY 388 Ca 0.04 -1.04 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 3fqs n GLY 388 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fqs s TYR 389 N -7.09 0.73 -0.09 1.61 1.51 -0.28 0.35 117.35 114.08 3fqs s TYR 389 Ca 0.04 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 55.99 3fqs s TYR 389 Cb -0.01 -0.47 0.01 0.00 -0.11 0.00 0.00 41.96 41.37 3fqs s TYR 389 CO 0.02 -0.02 -0.19 -0.47 -1.11 0.00 0.00 175.55 173.79 3fqs s TYR 390 N -0.16 2.08 -0.52 2.71 5.04 0.12 -0.95 117.35 125.67 3fqs s TYR 390 Ca 0.03 -0.83 -0.28 0.00 -2.44 0.00 0.00 57.07 53.55 3fqs s TYR 390 Cb -0.03 -1.43 -0.00 0.00 0.35 0.00 0.00 41.96 40.84 3fqs s TYR 390 CO -0.00 -0.36 1.60 -1.14 -1.34 0.00 0.00 175.55 174.31 3fqs s GLN 391 N 0.49 3.16 0.00 4.97 2.00 -0.88 -0.54 119.66 128.87 3fqs s GLN 391 Ca -0.17 0.71 0.00 0.00 -2.00 0.00 0.00 55.36 53.91 3fqs s GLN 391 Cb -0.17 -4.20 0.00 0.00 0.80 0.00 0.00 33.01 29.44 3fqs s GLN 391 CO 0.06 -2.09 0.00 -1.33 -0.50 0.00 0.00 175.29 171.43 3fqs n MET 392 N 8.71 1.14 0.14 1.67 2.81 -0.20 -4.94 117.12 126.44 3fqs n MET 392 Ca 0.17 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 56.11 3fqs n MET 392 Cb 0.49 0.00 0.51 0.00 -0.71 0.00 0.00 33.22 33.51 3fqs n MET 392 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 3fqs h LYS 393 N 0.00 0.23 0.00 0.03 6.56 -2.03 -3.39 116.57 117.96 3fqs h LYS 393 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3fqs h LYS 393 Cb 0.00 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.61 3fqs h LYS 393 CO 0.00 0.21 0.00 1.17 -2.06 0.00 0.00 179.45 178.77 3fqs n LYS 394 N -4.44 0.00 -2.97 3.15 4.81 -1.26 -5.13 118.16 112.31 3fqs n LYS 394 Ca -0.01 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.24 3fqs n LYS 394 Cb 0.13 -0.30 0.02 0.00 0.02 0.00 0.00 35.03 34.90 3fqs n LYS 394 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 3fqs s VAL 395 N -1.00 3.28 -0.18 3.15 -7.23 -1.26 -5.11 120.40 112.06 3fqs s VAL 395 Ca 0.00 -0.80 -0.06 0.00 -1.81 0.00 0.00 61.98 59.32 3fqs s VAL 395 Cb 0.00 -3.17 -0.03 0.00 0.56 0.00 0.00 36.38 33.74 3fqs s VAL 395 CO 0.00 -0.09 0.01 -0.69 -0.31 0.00 0.00 175.10 174.02 3fqs s VAL 396 N -2.49 4.28 -0.17 1.32 1.01 -1.26 -1.03 120.40 122.05 3fqs s VAL 396 Ca 0.53 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 62.25 3fqs s VAL 396 Cb -0.10 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 3fqs s VAL 396 CO 0.35 0.46 -0.01 -0.75 0.00 0.00 0.00 175.10 175.15 3fqs s LYS 397 N 0.54 3.71 0.10 2.72 2.20 0.30 -4.92 119.74 124.39 3fqs s LYS 397 Ca 0.00 -0.49 -0.30 0.00 -0.36 0.00 0.00 55.97 54.81 3fqs s LYS 397 Cb -0.14 -2.99 -0.06 0.00 -1.51 0.00 0.00 37.83 33.12 3fqs s LYS 397 CO 0.02 0.20 1.20 0.99 -0.36 0.00 0.00 175.35 177.39 3fqs s THR 398 N 0.50 3.88 0.09 3.43 2.01 -1.26 0.12 115.64 124.41 3fqs s THR 398 Ca -0.02 1.42 0.05 0.00 0.31 0.00 0.00 61.69 63.45 3fqs s THR 398 Cb -0.14 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 3fqs s THR 398 CO 0.02 0.15 -0.12 0.68 -0.69 0.00 0.00 174.62 174.66 3fqs s VAL 399 N 0.70 1.06 -0.18 3.82 -7.23 0.15 -2.68 120.40 116.04 3fqs s VAL 399 Ca 0.57 -1.54 -0.08 0.00 -1.81 0.00 0.00 61.98 59.12 3fqs s VAL 399 Cb -0.30 -1.28 -0.04 0.00 0.56 0.00 0.00 36.38 35.31 3fqs s VAL 399 CO 0.31 -0.43 0.08 0.00 -0.31 0.00 0.00 175.10 174.76 3fqs s ALA 400 N -1.99 3.49 -0.21 1.32 0.00 0.16 -0.41 121.76 124.12 3fqs s ALA 400 Ca 0.03 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.28 3fqs s ALA 400 Cb -0.06 -1.96 0.04 0.00 0.00 0.00 0.00 23.12 21.14 3fqs s ALA 400 CO 0.01 0.21 -0.13 0.08 0.00 0.00 0.00 175.76 175.93 3fqs s VAL 401 N 0.26 1.89 -0.31 0.00 1.01 0.81 -0.07 120.40 124.00 3fqs s VAL 401 Ca 0.05 -1.15 -0.27 0.00 0.00 0.00 0.00 61.98 60.61 3fqs s VAL 401 Cb -0.12 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.37 3fqs s VAL 401 CO -0.00 0.22 0.96 -0.75 0.00 0.00 0.00 175.10 175.53 3fqs s LYS 402 N 1.29 4.05 -0.21 2.72 2.20 0.40 -0.72 119.74 129.47 3fqs s LYS 402 Ca -0.01 0.92 0.00 0.00 -0.36 0.00 0.00 55.97 56.52 3fqs s LYS 402 Cb -0.16 -3.72 0.02 0.00 -1.51 0.00 0.00 37.83 32.46 3fqs s LYS 402 CO -0.09 -0.79 -0.14 0.42 -0.36 0.00 0.00 175.35 174.39 3fqs s ILE 403 N 3.34 2.40 0.47 5.43 1.01 0.10 -0.29 121.20 133.66 3fqs s ILE 403 Ca 0.40 -1.01 -0.23 0.00 0.00 0.00 0.00 60.65 59.81 3fqs s ILE 403 Cb -0.13 -2.13 -0.07 0.00 0.01 0.00 0.00 42.46 40.14 3fqs s ILE 403 CO 0.13 0.37 1.19 -0.76 0.00 0.00 0.00 174.94 175.87 3fqs s LEU 404 N 1.29 4.00 0.02 2.97 1.43 -0.41 -1.55 118.68 126.43 3fqs s LEU 404 Ca 0.02 2.37 -0.28 0.00 -1.03 0.00 0.00 54.13 55.21 3fqs s LEU 404 Cb -0.15 -4.23 -0.16 0.00 0.03 0.00 0.00 46.19 41.68 3fqs s LEU 404 CO -0.09 -0.99 1.19 0.50 0.23 0.00 0.00 176.35 177.19 3fqs h LYS 405 N 2.00 -0.92 0.01 1.70 3.64 0.15 -3.43 116.57 119.72 3fqs h LYS 405 Ca -0.50 0.06 -0.23 0.00 -1.27 0.00 0.00 60.65 58.71 3fqs h LYS 405 Cb 1.25 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 3fqs h LYS 405 CO 0.60 -0.60 -0.97 -1.00 -2.27 0.00 0.00 179.45 175.21 3fqs h PRO 411 N -1.21 0.44 -0.40 1.90 0.13 -2.06 -3.49 132.00 127.30 3fqs h PRO 411 Ca -0.10 -0.48 0.03 0.00 -0.87 0.00 0.00 66.00 64.58 3fqs h PRO 411 Cb 0.75 0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.99 3fqs h PRO 411 CO 0.16 1.14 0.21 0.00 -0.23 0.00 0.00 178.00 179.28 3fqs h ALA 412 N 0.69 0.50 -0.93 -0.56 0.00 -2.05 -2.60 119.26 114.31 3fqs h ALA 412 Ca -0.09 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.90 3fqs h ALA 412 Cb 1.61 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.26 3fqs h ALA 412 CO 0.17 -0.15 0.58 -0.07 0.00 0.00 0.00 179.25 179.79 3fqs h LEU 413 N 0.42 0.91 -0.37 0.00 4.07 -1.99 -0.83 115.31 117.52 3fqs h LEU 413 Ca 0.17 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.12 3fqs h LEU 413 Cb 0.06 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.62 3fqs h LEU 413 CO -0.11 0.57 0.12 0.50 -1.08 0.00 0.00 178.44 178.44 3fqs h LYS 414 N 1.04 0.57 -0.01 1.13 3.64 -1.91 -1.56 116.57 119.47 3fqs h LYS 414 Ca 0.41 -0.12 -0.13 0.00 -1.27 0.00 0.00 60.65 59.54 3fqs h LYS 414 Cb 0.22 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3fqs h LYS 414 CO -0.19 0.58 -0.62 -0.44 -2.27 0.00 0.00 179.45 176.51 3fqs h ASP 415 N 0.45 0.06 -0.31 4.20 3.32 -1.10 0.03 116.42 123.08 3fqs h ASP 415 Ca 0.12 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3fqs h ASP 415 Cb 0.24 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 3fqs h ASP 415 CO -0.01 0.66 0.16 -0.33 -1.72 0.00 0.00 179.24 178.01 3fqs h GLU 416 N 0.04 0.43 -0.26 3.56 5.08 -1.08 -1.14 114.58 121.22 3fqs h GLU 416 Ca -0.01 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3fqs h GLU 416 Cb 1.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 3fqs h GLU 416 CO 0.08 0.39 0.17 1.25 -1.00 0.00 0.00 179.01 179.90 3fqs h LEU 417 N 0.37 0.29 -0.94 1.33 5.85 -0.65 -0.69 115.31 120.88 3fqs h LEU 417 Ca 0.11 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.73 3fqs h LEU 417 Cb 0.08 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3fqs h LEU 417 CO -0.02 0.21 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.11 3fqs h LEU 418 N 0.35 0.63 -0.36 2.25 3.38 -0.98 0.47 115.31 121.05 3fqs h LEU 418 Ca 0.09 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 3fqs h LEU 418 Cb -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3fqs h LEU 418 CO -0.02 0.78 0.02 0.00 0.09 0.00 0.00 178.44 179.30 3fqs h ALA 419 N 1.28 0.48 -0.19 1.53 0.00 -0.97 0.12 119.26 121.51 3fqs h ALA 419 Ca 0.10 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.78 3fqs h ALA 419 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3fqs h ALA 419 CO 0.03 0.23 0.11 1.49 0.00 0.00 0.00 179.25 181.11 3fqs h GLU 420 N 0.44 0.22 -0.79 0.00 4.81 -0.91 -1.21 114.58 117.14 3fqs h GLU 420 Ca 0.10 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.35 3fqs h GLU 420 Cb 0.43 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.71 3fqs h GLU 420 CO 0.02 0.15 0.51 0.00 -0.73 0.00 0.00 179.01 178.95 3fqs h ALA 421 N 1.08 1.04 -0.02 2.92 0.00 -0.78 -2.03 119.26 121.46 3fqs h ALA 421 Ca 0.07 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 3fqs h ALA 421 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3fqs h ALA 421 CO -0.03 0.32 -0.36 -0.97 0.00 0.00 0.00 179.25 178.21 3fqs h ASN 422 N 0.99 0.05 -0.01 0.00 -1.24 -0.46 -0.55 115.58 114.35 3fqs h ASN 422 Ca 0.32 -0.02 -0.00 0.00 0.71 0.00 0.00 56.30 57.31 3fqs h ASN 422 Cb 0.01 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 39.04 3fqs h ASN 422 CO -0.11 0.41 -0.01 0.58 -1.29 0.00 0.00 177.43 177.01 3fqs h VAL 423 N 0.04 1.34 0.00 2.57 2.07 -0.84 -3.26 116.25 118.17 3fqs h VAL 423 Ca 0.00 -1.03 -0.07 0.00 0.82 0.00 0.00 66.70 66.42 3fqs h VAL 423 Cb 0.66 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 3fqs h VAL 423 CO 0.05 0.27 -0.33 0.24 0.02 0.00 0.00 177.57 177.82 3fqs h MET 424 N -0.39 0.00 0.00 1.57 2.86 -1.19 -1.75 114.93 116.03 3fqs h MET 424 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3fqs h MET 424 Cb 0.45 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 3fqs h MET 424 CO 0.00 0.33 -0.03 0.37 1.06 0.00 0.00 176.91 178.64 3fqs h GLN 425 N 0.00 0.00 0.00 1.72 4.15 -1.15 -2.25 115.11 117.58 3fqs h GLN 425 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3fqs h GLN 425 Cb 0.70 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3fqs h GLN 425 CO 0.04 0.03 -0.61 1.04 -1.93 0.00 0.00 178.83 177.40 3fqs n GLN 426 N -4.02 0.18 -4.24 1.69 6.02 -0.66 -4.94 117.38 111.40 3fqs n GLN 426 Ca -0.03 0.04 -0.35 0.00 -0.01 0.00 0.00 57.00 56.65 3fqs n GLN 426 Cb 0.12 -1.60 -0.08 0.00 1.02 0.00 0.00 30.24 29.69 3fqs n GLN 426 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3fqs s LEU 427 N -3.71 3.76 -0.36 1.08 1.43 -0.85 -5.07 118.68 114.98 3fqs s LEU 427 Ca 0.08 0.20 0.03 0.00 -1.03 0.00 0.00 54.13 53.41 3fqs s LEU 427 Cb 0.15 -1.93 0.16 0.00 0.03 0.00 0.00 46.19 44.60 3fqs s LEU 427 CO 0.72 0.37 0.40 -0.62 0.23 0.00 0.00 176.35 177.45 3fqs s ASP 428 N -1.05 0.78 -0.23 2.29 2.15 -1.26 -4.93 116.67 114.41 3fqs s ASP 428 Ca 0.15 -1.26 -0.23 0.00 0.43 0.00 0.00 52.55 51.64 3fqs s ASP 428 Cb -0.12 0.80 0.06 0.00 -0.30 0.00 0.00 42.92 43.37 3fqs s ASP 428 CO 0.04 -0.27 0.66 0.21 -0.17 0.00 0.00 175.17 175.64 3fqs s ASN 429 N 1.70 -0.68 0.55 -0.34 3.84 -1.26 -5.05 114.94 113.70 3fqs s ASN 429 Ca 0.15 1.28 0.25 0.00 0.21 0.00 0.00 52.86 54.75 3fqs s ASN 429 Cb -0.13 1.29 1.48 0.00 -0.55 0.00 0.00 41.25 43.33 3fqs s ASN 429 CO -0.10 -0.25 2.07 -0.65 -2.79 0.00 0.00 177.10 175.38 3fqs h PRO 430 N 4.96 0.00 -0.55 0.43 0.11 -1.99 -2.88 132.00 132.08 3fqs h PRO 430 Ca -0.28 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.60 3fqs h PRO 430 Cb 1.16 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.14 3fqs h PRO 430 CO 0.11 0.00 0.16 0.66 -0.21 0.00 0.00 178.00 178.72 3fqs n TYR 431 N -4.17 1.75 -3.82 0.65 4.01 -1.26 -4.86 117.16 109.46 3fqs n TYR 431 Ca 0.04 -1.43 -0.18 0.00 -0.16 0.00 0.00 57.90 56.16 3fqs n TYR 431 Cb 0.38 -0.59 -0.17 0.00 -0.31 0.00 0.00 39.34 38.65 3fqs n TYR 431 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3fqs s ILE 432 N -3.13 0.09 0.17 -0.72 1.01 -1.09 -1.24 121.20 116.29 3fqs s ILE 432 Ca 0.49 0.20 -0.33 0.00 0.00 0.00 0.00 60.65 61.00 3fqs s ILE 432 Cb 0.42 -0.25 -0.15 0.00 0.01 0.00 0.00 42.46 42.49 3fqs s ILE 432 CO 0.07 0.16 1.26 0.52 0.00 0.00 0.00 174.94 176.95 3fqs n VAL 433 N 4.57 0.67 -3.21 2.92 0.31 -0.35 -4.71 118.33 118.53 3fqs n VAL 433 Ca -0.18 -0.17 -0.37 0.00 -0.01 0.00 0.00 64.34 63.61 3fqs n VAL 433 Cb 0.50 -0.99 -0.06 0.00 -0.91 0.00 0.00 33.84 32.39 3fqs n VAL 433 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3fqs s ARG 434 N -0.13 4.17 -0.02 5.55 1.81 -1.26 -5.00 118.95 124.08 3fqs s ARG 434 Ca 0.75 0.74 -0.19 0.00 -1.72 0.00 0.00 55.73 55.31 3fqs s ARG 434 Cb -0.83 -2.99 -0.05 0.00 -0.45 0.00 0.00 34.95 30.63 3fqs s ARG 434 CO 0.50 0.48 0.53 1.41 -0.68 0.00 0.00 175.30 177.54 3fqs s MET 435 N -1.74 4.24 -0.04 3.54 -2.45 -1.26 -1.83 119.30 119.75 3fqs s MET 435 Ca 0.38 0.62 -0.08 0.00 -1.25 0.00 0.00 55.69 55.36 3fqs s MET 435 Cb -0.17 -3.32 -0.29 0.00 1.25 0.00 0.00 34.83 32.29 3fqs s MET 435 CO 0.20 0.42 0.69 0.82 1.05 0.00 0.00 175.02 178.20 3fqs h ILE 436 N 4.09 0.96 0.00 10.11 1.08 -1.03 -3.47 117.51 129.25 3fqs h ILE 436 Ca -0.46 -2.57 0.00 0.00 -0.39 0.00 0.00 64.86 61.44 3fqs h ILE 436 Cb 1.20 2.73 0.00 0.00 -3.07 0.00 0.00 36.82 37.68 3fqs h ILE 436 CO 0.68 0.84 0.00 0.61 -0.69 0.00 0.00 178.15 179.60 3fqs n GLY 437 N 1.82 -0.72 3.55 5.37 0.00 -1.05 -4.84 105.19 109.33 3fqs n GLY 437 Ca -0.23 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.26 3fqs n GLY 437 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fqs s ILE 438 N -2.93 1.57 -0.29 -0.61 -4.36 0.34 -1.44 121.20 113.47 3fqs s ILE 438 Ca 0.00 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.27 3fqs s ILE 438 Cb 0.00 -2.84 0.12 0.00 1.25 0.00 0.00 42.46 40.99 3fqs s ILE 438 CO 0.00 0.00 0.71 0.00 0.24 0.00 0.00 174.94 175.89 3fqs s GLU 440 N 2.50 3.94 0.00 0.00 2.12 -1.26 -0.21 118.70 125.78 3fqs s GLU 440 Ca -0.07 -0.34 0.00 0.00 0.36 0.00 0.00 54.97 54.93 3fqs s GLU 440 Cb -0.09 -3.52 0.00 0.00 0.26 0.00 0.00 34.13 30.77 3fqs s GLU 440 CO -0.19 -0.07 0.00 0.00 -0.54 0.00 0.00 175.26 174.46 3fqs n ALA 441 N 4.67 0.00 -0.27 6.30 0.00 -1.26 -4.96 120.51 124.98 3fqs n ALA 441 Ca -0.15 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.29 3fqs n ALA 441 Cb 0.52 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.17 3fqs n ALA 441 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3fqs h GLU 442 N 0.00 1.11 -4.62 0.00 3.07 -2.02 -3.44 114.58 108.68 3fqs h GLU 442 Ca 0.00 -0.07 -0.32 0.00 -0.50 0.00 0.00 59.36 58.47 3fqs h GLU 442 Cb 0.00 -0.25 -0.13 0.00 -0.84 0.00 0.00 28.75 27.53 3fqs h GLU 442 CO 0.00 0.74 -0.51 -1.12 -1.40 0.00 0.00 179.01 176.72 3fqs s SER 443 N -6.28 0.78 0.16 1.42 0.01 -1.26 -5.11 113.70 103.42 3fqs s SER 443 Ca -0.12 -1.51 -0.30 0.00 1.31 0.00 0.00 55.95 55.33 3fqs s SER 443 Cb 0.18 0.48 -0.07 0.00 0.21 0.00 0.00 66.02 66.82 3fqs s SER 443 CO 0.80 -0.98 1.16 0.26 0.41 0.00 0.00 173.24 174.88 3fqs s TRP 444 N -3.79 3.50 -0.03 2.43 0.52 -1.26 -4.49 118.94 115.81 3fqs s TRP 444 Ca 0.38 1.48 0.03 0.00 0.02 0.00 0.00 56.10 58.01 3fqs s TRP 444 Cb 0.04 -3.36 0.00 0.00 -1.15 0.00 0.00 33.47 29.00 3fqs s TRP 444 CO 0.18 -0.96 -0.12 -1.64 0.02 0.00 0.00 176.95 174.43 3fqs s MET 445 N -0.06 1.31 -0.26 4.98 -1.94 0.70 -1.28 119.30 122.75 3fqs s MET 445 Ca 0.52 -0.43 -0.01 0.00 -1.71 0.00 0.00 55.69 54.06 3fqs s MET 445 Cb -0.31 -1.17 0.03 0.00 2.01 0.00 0.00 34.83 35.39 3fqs s MET 445 CO 0.35 0.16 -0.06 -1.17 -0.01 0.00 0.00 175.02 174.29 3fqs s LEU 446 N 0.14 3.31 -0.31 -0.03 2.96 0.60 -1.51 118.68 123.84 3fqs s LEU 446 Ca -0.04 -0.99 -0.11 0.00 -0.22 0.00 0.00 54.13 52.78 3fqs s LEU 446 Cb -0.10 -1.65 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 3fqs s LEU 446 CO 0.01 -0.15 0.18 -0.69 -1.32 0.00 0.00 176.35 174.38 3fqs s VAL 447 N 1.29 4.92 0.26 1.68 1.01 -0.52 -0.45 120.40 128.58 3fqs s VAL 447 Ca -0.02 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.83 3fqs s VAL 447 Cb -0.17 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 3fqs s VAL 447 CO -0.04 0.11 -0.12 -0.04 0.00 0.00 0.00 175.10 175.00 3fqs s MET 448 N 1.68 1.53 0.40 2.72 -1.94 0.90 -0.37 119.30 124.22 3fqs s MET 448 Ca 0.06 -1.73 -0.26 0.00 -1.71 0.00 0.00 55.69 52.05 3fqs s MET 448 Cb -0.17 -1.33 -0.09 0.00 2.01 0.00 0.00 34.83 35.26 3fqs s MET 448 CO 0.08 0.16 1.27 -1.83 -0.01 0.00 0.00 175.02 174.70 3fqs s GLU 449 N -3.64 3.98 -0.16 2.03 -1.05 -0.76 0.39 118.70 119.50 3fqs s GLU 449 Ca 0.27 2.09 -0.23 0.00 -0.15 0.00 0.00 54.97 56.95 3fqs s GLU 449 Cb 0.00 -2.74 -0.02 0.00 -0.44 0.00 0.00 34.13 30.93 3fqs s GLU 449 CO 0.11 -0.46 0.74 1.41 0.95 0.00 0.00 175.26 178.02 3fqs s MET 450 N -2.25 4.30 -0.56 -4.83 -2.45 -1.09 -4.34 119.30 108.08 3fqs s MET 450 Ca 0.57 0.86 -0.20 0.00 -1.25 0.00 0.00 55.69 55.67 3fqs s MET 450 Cb -0.36 -3.55 0.07 0.00 1.25 0.00 0.00 34.83 32.24 3fqs s MET 450 CO 0.47 -0.21 0.74 0.00 1.05 0.00 0.00 175.02 177.06 3fqs s ALA 451 N 1.78 3.33 0.38 4.11 0.00 -1.26 -4.98 121.76 125.11 3fqs s ALA 451 Ca 0.35 -1.82 0.08 0.00 0.00 0.00 0.00 51.96 50.56 3fqs s ALA 451 Cb -0.17 -3.52 0.75 0.00 0.00 0.00 0.00 23.12 20.19 3fqs s ALA 451 CO 0.13 -2.26 1.93 0.93 0.00 0.00 0.00 175.76 176.49 3fqs h GLU 452 N 9.17 0.35 -0.00 0.00 4.39 -1.76 -2.94 114.58 123.79 3fqs h GLU 452 Ca -0.28 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.35 3fqs h GLU 452 Cb 1.09 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 3fqs h GLU 452 CO 1.05 0.41 -0.26 1.28 -1.16 0.00 0.00 179.01 180.34 3fqs n LEU 453 N -4.31 0.59 0.00 1.33 4.32 -0.63 -5.05 117.00 113.26 3fqs n LEU 453 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 3fqs n LEU 453 Cb 0.23 -0.22 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 3fqs n LEU 453 CO 0.38 0.12 0.00 0.61 -1.22 0.00 0.00 177.39 177.28 3fqs n GLY 454 N 1.39 -1.91 3.77 -0.72 0.00 -1.11 -4.75 105.19 101.85 3fqs n GLY 454 Ca 0.10 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.34 3fqs n GLY 454 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3fqs s PRO 455 N 0.00 4.27 0.23 1.61 0.02 -1.26 -0.74 135.00 139.13 3fqs s PRO 455 Ca 0.00 2.09 -0.06 0.00 0.02 0.00 0.00 61.00 63.05 3fqs s PRO 455 Cb 0.00 -2.97 0.32 0.00 0.02 0.00 0.00 34.50 31.87 3fqs s PRO 455 CO 0.00 -0.21 1.82 1.25 -0.33 0.00 0.00 177.00 179.53 3fqs h LEU 456 N 3.19 0.68 0.02 -5.54 5.85 -0.43 -1.76 115.31 117.32 3fqs h LEU 456 Ca -0.49 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 3fqs h LEU 456 Cb 1.23 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3fqs h LEU 456 CO 0.65 0.42 -0.01 -0.55 -0.34 0.00 0.00 178.44 178.61 3fqs h ASN 457 N 0.81 -0.02 -0.61 1.25 -1.07 -1.84 -2.13 115.58 111.98 3fqs h ASN 457 Ca 0.36 -0.15 -0.01 0.00 0.07 0.00 0.00 56.30 56.56 3fqs h ASN 457 Cb 0.24 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.46 3fqs h ASN 457 CO -0.20 0.14 0.34 0.11 0.07 0.00 0.00 177.43 177.90 3fqs h LYS 458 N -0.18 0.87 0.24 4.14 1.79 -1.84 -1.00 116.57 120.60 3fqs h LYS 458 Ca -0.00 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 3fqs h LYS 458 Cb 0.17 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 30.64 3fqs h LYS 458 CO 0.00 0.64 -0.13 -0.92 -1.08 0.00 0.00 179.45 177.96 3fqs h TYR 459 N 0.88 -0.35 -0.13 -1.35 3.20 -1.19 -1.65 116.97 116.38 3fqs h TYR 459 Ca 0.22 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.99 3fqs h TYR 459 Cb 0.03 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3fqs h TYR 459 CO 0.01 -0.21 -0.37 -0.07 -1.64 0.00 0.00 178.16 175.87 3fqs h LEU 460 N -0.35 0.28 -0.68 2.82 3.38 -1.07 0.17 115.31 119.87 3fqs h LEU 460 Ca -0.03 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3fqs h LEU 460 Cb 0.28 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 3fqs h LEU 460 CO 0.04 0.64 0.45 1.56 0.09 0.00 0.00 178.44 181.21 3fqs h GLN 461 N 0.24 0.88 0.00 1.13 4.20 -0.95 -3.03 115.11 117.58 3fqs h GLN 461 Ca 0.03 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3fqs h GLN 461 Cb 0.76 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.35 3fqs h GLN 461 CO 0.06 0.58 -0.31 1.04 -0.67 0.00 0.00 178.83 179.53 3fqs n GLN 462 N -4.63 0.03 -3.49 1.46 6.02 -0.63 -4.43 117.38 111.71 3fqs n GLN 462 Ca 0.06 0.01 -0.27 0.00 -0.01 0.00 0.00 57.00 56.80 3fqs n GLN 462 Cb 0.03 -1.53 -0.10 0.00 1.02 0.00 0.00 30.24 29.67 3fqs n GLN 462 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3fqs n ASN 463 N -1.58 0.65 0.00 1.08 3.02 0.54 -4.97 115.26 114.00 3fqs n ASN 463 Ca 0.06 -2.67 0.13 0.00 -0.03 0.00 0.00 54.58 52.07 3fqs n ASN 463 Cb 0.35 -0.62 0.71 0.00 -0.61 0.00 0.00 39.78 39.61 3fqs n ASN 463 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3fqs n ARG 464 N 2.36 0.63 -0.27 3.52 1.74 -1.23 -2.66 116.66 120.75 3fqs n ARG 464 Ca 0.27 0.02 0.10 0.00 -0.77 0.00 0.00 57.85 57.47 3fqs n ARG 464 Cb 0.45 -1.50 0.25 0.00 -1.02 0.00 0.00 32.46 30.64 3fqs n ARG 464 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3fqs n HIS 465 N -1.12 0.71 -1.72 -1.55 8.25 -1.26 -4.95 115.22 113.58 3fqs n HIS 465 Ca 0.16 -0.42 -0.42 0.00 -0.26 0.00 0.00 57.72 56.77 3fqs n HIS 465 Cb 0.13 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.22 3fqs n HIS 465 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3fqs n VAL 466 N 1.31 0.83 -1.92 1.59 0.31 -1.09 -4.96 118.33 114.40 3fqs n VAL 466 Ca 0.20 -0.21 -0.29 0.00 -0.01 0.00 0.00 64.34 64.02 3fqs n VAL 466 Cb 0.56 -1.86 0.06 0.00 -0.91 0.00 0.00 33.84 31.69 3fqs n VAL 466 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3fqs s LYS 467 N -0.20 2.55 0.06 5.55 -0.14 -1.26 -4.93 119.74 121.37 3fqs s LYS 467 Ca 0.67 0.31 -0.21 0.00 -1.36 0.00 0.00 55.97 55.38 3fqs s LYS 467 Cb -0.53 -2.01 -0.12 0.00 -1.68 0.00 0.00 37.83 33.49 3fqs s LYS 467 CO 0.46 -1.22 1.51 0.22 -0.76 0.00 0.00 175.35 175.56 3fqs h ASP 468 N -0.77 0.26 -0.66 2.83 3.58 -1.97 -2.58 116.42 117.11 3fqs h ASP 468 Ca -0.45 -0.29 0.14 0.00 0.42 0.00 0.00 57.03 56.85 3fqs h ASP 468 Cb 1.28 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 42.22 3fqs h ASP 468 CO 0.64 0.48 0.45 0.50 -2.88 0.00 0.00 179.24 178.44 3fqs h LYS 469 N 0.02 0.26 0.07 0.28 3.64 -1.97 -1.87 116.57 117.01 3fqs h LYS 469 Ca 0.05 -0.02 -0.26 0.00 -1.27 0.00 0.00 60.65 59.14 3fqs h LYS 469 Cb 0.34 -0.06 0.01 0.00 -0.41 0.00 0.00 32.23 32.12 3fqs h LYS 469 CO 0.01 0.17 -1.11 -0.97 -2.27 0.00 0.00 179.45 175.28 3fqs h ASN 470 N 0.27 0.66 -0.28 4.20 -0.00 -1.88 -0.53 115.58 118.02 3fqs h ASN 470 Ca 0.32 -0.59 -0.06 0.00 -0.00 0.00 0.00 56.30 55.96 3fqs h ASN 470 Cb 0.87 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.97 3fqs h ASN 470 CO -0.07 1.41 -0.07 0.40 -0.00 0.00 0.00 177.43 179.10 3fqs h ILE 471 N 0.23 1.28 -0.39 2.57 2.04 -1.07 -2.12 117.51 120.04 3fqs h ILE 471 Ca -0.13 -1.09 0.05 0.00 1.00 0.00 0.00 64.86 64.69 3fqs h ILE 471 Cb 1.78 1.41 -0.04 0.00 -0.74 0.00 0.00 36.82 39.23 3fqs h ILE 471 CO 0.20 0.35 0.13 0.40 0.00 0.00 0.00 178.15 179.23 3fqs h ILE 472 N 0.30 0.88 -0.66 -0.67 2.04 -1.32 -0.80 117.51 117.27 3fqs h ILE 472 Ca 0.07 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 65.93 3fqs h ILE 472 Cb 0.54 0.57 -0.07 0.00 -0.74 0.00 0.00 36.82 37.12 3fqs h ILE 472 CO 0.03 0.05 0.29 -0.08 0.00 0.00 0.00 178.15 178.44 3fqs h GLU 473 N 0.29 0.48 -0.06 2.37 4.81 -1.01 0.33 114.58 121.79 3fqs h GLU 473 Ca 0.18 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 3fqs h GLU 473 Cb 0.16 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3fqs h GLU 473 CO -0.19 0.32 -0.11 -0.07 -0.73 0.00 0.00 179.01 178.23 3fqs h LEU 474 N 0.50 0.19 -1.27 1.64 3.38 -0.85 -1.98 115.31 116.93 3fqs h LEU 474 Ca 0.33 -0.56 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 3fqs h LEU 474 Cb 0.38 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3fqs h LEU 474 CO -0.29 0.72 -0.25 -0.37 0.09 0.00 0.00 178.44 178.34 3fqs h VAL 475 N -0.33 1.22 -0.56 1.22 -1.51 -1.07 -1.09 116.25 114.14 3fqs h VAL 475 Ca 0.00 -1.05 -0.09 0.00 -1.23 0.00 0.00 66.70 64.34 3fqs h VAL 475 Cb 0.69 1.42 -0.02 0.00 -2.13 0.00 0.00 31.29 31.25 3fqs h VAL 475 CO 0.02 0.31 -0.00 -0.74 -1.23 0.00 0.00 177.57 175.94 3fqs h HIS 476 N 0.17 1.03 -0.44 5.19 -0.00 -0.93 -1.36 115.15 118.80 3fqs h HIS 476 Ca 0.03 -0.16 -0.01 0.00 -0.00 0.00 0.00 60.37 60.22 3fqs h HIS 476 Cb 0.53 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.65 3fqs h HIS 476 CO 0.01 0.92 0.22 1.96 -0.00 0.00 0.00 177.93 181.04 3fqs h GLN 477 N 0.88 0.61 -0.35 5.26 4.20 -0.44 -1.89 115.11 123.39 3fqs h GLN 477 Ca 0.16 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.68 3fqs h GLN 477 Cb 0.52 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 3fqs h GLN 477 CO 0.03 0.47 -0.32 0.28 -0.67 0.00 0.00 178.83 178.62 3fqs h VAL 478 N 0.62 1.28 -0.00 -0.54 2.07 -0.81 -2.15 116.25 116.71 3fqs h VAL 478 Ca 0.16 -1.46 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 3fqs h VAL 478 Cb 0.05 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3fqs h VAL 478 CO -0.02 0.48 -0.29 0.77 0.02 0.00 0.00 177.57 178.53 3fqs h SER 479 N 0.64 0.01 -0.16 0.57 4.64 -0.51 0.01 113.55 118.75 3fqs h SER 479 Ca 0.07 -0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.28 3fqs h SER 479 Cb 0.85 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3fqs h SER 479 CO 0.07 0.30 -0.31 0.24 -0.87 0.00 0.00 176.83 176.26 3fqs h MET 480 N 0.01 0.49 -0.69 4.77 2.07 -1.10 0.22 114.93 120.69 3fqs h MET 480 Ca -0.00 -0.32 0.03 0.00 -2.07 0.00 0.00 59.70 57.35 3fqs h MET 480 Cb 0.51 0.04 -0.05 0.00 -1.87 0.00 0.00 31.60 30.24 3fqs h MET 480 CO 0.04 0.92 0.43 0.78 1.07 0.00 0.00 176.91 180.15 3fqs h GLY 481 N 0.11 1.00 1.53 8.32 0.00 -1.09 -1.96 103.07 110.98 3fqs h GLY 481 Ca 0.01 -0.32 -0.18 0.00 0.00 0.00 0.00 47.33 46.84 3fqs h GLY 481 CO 0.07 0.26 -0.67 -0.33 0.00 0.00 0.00 176.54 175.87 3fqs h MET 482 N 0.83 0.48 -0.69 4.80 2.86 -0.90 -2.02 114.93 120.28 3fqs h MET 482 Ca 0.28 -0.36 0.06 0.00 -2.06 0.00 0.00 59.70 57.63 3fqs h MET 482 Cb 0.05 0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.71 3fqs h MET 482 CO -0.12 0.98 0.39 -0.22 1.06 0.00 0.00 176.91 179.00 3fqs h LYS 483 N 0.34 0.69 -0.94 1.72 3.64 -0.38 0.02 116.57 121.66 3fqs h LYS 483 Ca -0.02 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3fqs h LYS 483 Cb 1.23 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.85 3fqs h LYS 483 CO 0.12 0.46 0.61 -0.92 -2.27 0.00 0.00 179.45 177.44 3fqs h TYR 484 N 0.71 1.20 -0.15 1.91 3.20 -1.08 -1.34 116.97 121.43 3fqs h TYR 484 Ca 0.31 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 62.02 3fqs h TYR 484 Cb 0.18 -0.40 -0.00 0.00 1.54 0.00 0.00 36.73 38.04 3fqs h TYR 484 CO -0.07 0.77 -0.62 1.25 -1.64 0.00 0.00 178.16 177.85 3fqs h LEU 485 N 1.28 0.59 -0.48 2.82 5.85 -0.81 -0.51 115.31 124.04 3fqs h LEU 485 Ca 0.34 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 3fqs h LEU 485 Cb -0.12 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 3fqs h LEU 485 CO -0.07 1.06 0.20 -0.08 -0.34 0.00 0.00 178.44 179.21 3fqs h GLU 486 N 0.38 0.72 -0.56 1.25 4.81 -0.86 -1.69 114.58 118.63 3fqs h GLU 486 Ca -0.01 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.07 3fqs h GLU 486 Cb 1.17 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 3fqs h GLU 486 CO 0.11 0.63 0.25 0.93 -0.73 0.00 0.00 179.01 180.21 3fqs h GLU 487 N 0.64 0.79 -0.00 1.92 5.08 -1.01 -1.87 114.58 120.13 3fqs h GLU 487 Ca 0.16 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3fqs h GLU 487 Cb 0.18 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3fqs h GLU 487 CO -0.01 0.63 -0.02 0.43 -1.00 0.00 0.00 179.01 179.04 3fqs n SER 488 N -4.35 0.13 -3.68 1.42 7.64 -0.22 -4.93 113.62 109.62 3fqs n SER 488 Ca 0.05 -0.62 -0.24 0.00 1.01 0.00 0.00 58.87 59.07 3fqs n SER 488 Cb 0.14 -0.12 0.06 0.00 -1.01 0.00 0.00 64.21 63.28 3fqs n SER 488 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3fqs n ASN 489 N -1.06 -4.43 -4.56 6.43 5.03 -0.70 -4.90 115.26 111.06 3fqs n ASN 489 Ca 0.19 -0.66 -0.33 0.00 0.87 0.00 0.00 54.58 54.65 3fqs n ASN 489 Cb 0.20 -4.58 -0.11 0.00 -1.02 0.00 0.00 39.78 34.26 3fqs n ASN 489 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3fqs s PHE 490 N -3.37 2.85 -0.17 3.10 0.40 -0.72 -1.25 117.98 118.82 3fqs s PHE 490 Ca 0.42 -0.06 -0.06 0.00 -0.60 0.00 0.00 56.93 56.64 3fqs s PHE 490 Cb -0.20 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.67 3fqs s PHE 490 CO 0.77 0.32 0.03 0.08 0.70 0.00 0.00 175.22 177.13 3fqs s VAL 491 N -0.90 4.54 -0.06 -0.44 1.01 -0.29 -4.34 120.40 119.92 3fqs s VAL 491 Ca 0.15 -0.13 -0.22 0.00 0.00 0.00 0.00 61.98 61.78 3fqs s VAL 491 Cb -0.11 -3.02 -0.17 0.00 0.00 0.00 0.00 36.38 33.07 3fqs s VAL 491 CO 0.05 0.48 0.89 -0.74 0.00 0.00 0.00 175.10 175.77 3fqs h HIS 492 N 6.62 -0.14 0.00 5.22 2.76 -1.91 -1.48 115.15 126.22 3fqs h HIS 492 Ca -0.36 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.81 3fqs h HIS 492 Cb 1.17 0.05 0.00 0.00 1.55 0.00 0.00 27.41 30.18 3fqs h HIS 492 CO 0.56 0.36 0.00 0.54 -1.30 0.00 0.00 177.93 178.09 3fqs n ARG 493 N -4.87 -0.44 -1.85 5.26 1.74 -1.26 -3.18 116.66 112.06 3fqs n ARG 493 Ca -0.08 0.11 -0.02 0.00 -0.77 0.00 0.00 57.85 57.09 3fqs n ARG 493 Cb 0.28 -3.51 0.02 0.00 -1.02 0.00 0.00 32.46 28.23 3fqs n ARG 493 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3fqs n ASP 494 N -0.22 -0.32 -4.59 0.55 2.03 -1.26 -4.98 116.55 107.76 3fqs n ASP 494 Ca 0.00 -2.06 -0.43 0.00 0.52 0.00 0.00 54.79 52.82 3fqs n ASP 494 Cb 0.11 0.16 -0.02 0.00 -0.72 0.00 0.00 41.12 40.65 3fqs n ASP 494 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3fqs s LEU 495 N -1.72 3.53 0.12 -2.67 2.96 -1.26 -4.79 118.68 114.84 3fqs s LEU 495 Ca 0.14 0.46 -0.12 0.00 -0.22 0.00 0.00 54.13 54.38 3fqs s LEU 495 Cb 0.25 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.59 3fqs s LEU 495 CO -0.08 -1.45 0.31 0.00 -1.32 0.00 0.00 176.35 173.81 3fqs s ALA 496 N 5.20 -0.52 0.43 5.97 0.00 -1.26 -4.57 121.76 127.01 3fqs s ALA 496 Ca 0.52 -0.40 0.11 0.00 0.00 0.00 0.00 51.96 52.19 3fqs s ALA 496 Cb -0.10 0.64 0.97 0.00 0.00 0.00 0.00 23.12 24.63 3fqs s ALA 496 CO 0.29 -0.60 2.03 0.00 0.00 0.00 0.00 175.76 177.48 3fqs h ALA 497 N 2.53 1.87 -0.02 0.00 0.00 -1.92 -0.46 119.26 121.26 3fqs h ALA 497 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3fqs h ALA 497 Cb 1.23 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3fqs h ALA 497 CO 0.50 0.06 0.02 0.07 0.00 0.00 0.00 179.25 179.90 3fqs h ARG 498 N 0.45 0.00 -0.66 0.00 0.11 -1.95 -1.94 114.38 110.39 3fqs h ARG 498 Ca 0.20 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.28 3fqs h ARG 498 Cb 0.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.30 3fqs h ARG 498 CO -0.05 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.11 3fqs n ASN 499 N -3.79 4.34 -4.45 0.08 3.02 -0.19 -4.72 115.26 109.55 3fqs n ASN 499 Ca -0.03 -2.26 -0.38 0.00 -0.03 0.00 0.00 54.58 51.89 3fqs n ASN 499 Cb 0.10 -0.52 -0.12 0.00 -0.61 0.00 0.00 39.78 38.63 3fqs n ASN 499 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3fqs s VAL 500 N -1.49 4.53 -0.05 2.41 1.01 -0.73 -0.61 120.40 125.47 3fqs s VAL 500 Ca 0.49 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 3fqs s VAL 500 Cb 0.29 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 3fqs s VAL 500 CO 0.27 0.20 0.00 -0.76 0.00 0.00 0.00 175.10 174.81 3fqs s LEU 501 N 1.62 3.55 -0.18 3.92 1.43 0.43 -0.02 118.68 129.44 3fqs s LEU 501 Ca 0.05 0.08 -0.10 0.00 -1.03 0.00 0.00 54.13 53.13 3fqs s LEU 501 Cb -0.16 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 3fqs s LEU 501 CO 0.05 0.34 0.15 -0.76 0.23 0.00 0.00 176.35 176.36 3fqs s LEU 502 N -1.18 4.24 -0.14 1.79 1.43 0.08 -1.06 118.68 123.84 3fqs s LEU 502 Ca 0.16 0.30 -0.15 0.00 -1.03 0.00 0.00 54.13 53.42 3fqs s LEU 502 Cb -0.11 -2.12 -0.25 0.00 0.03 0.00 0.00 46.19 43.73 3fqs s LEU 502 CO 0.06 0.21 0.42 0.58 0.23 0.00 0.00 176.35 177.84 3fqs h VAL 503 N 4.56 0.89 -4.35 -1.59 2.07 -0.92 -1.66 116.25 115.25 3fqs h VAL 503 Ca -0.43 -2.32 -0.29 0.00 0.82 0.00 0.00 66.70 64.48 3fqs h VAL 503 Cb 1.16 2.53 -0.15 0.00 -1.52 0.00 0.00 31.29 33.32 3fqs h VAL 503 CO 0.73 0.66 -0.61 0.42 0.02 0.00 0.00 177.57 178.79 3fqs s THR 504 N -2.47 0.17 0.40 2.57 -4.23 -1.15 -4.45 115.64 106.47 3fqs s THR 504 Ca -0.23 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.58 3fqs s THR 504 Cb 0.05 -2.54 0.30 0.00 1.34 0.00 0.00 72.50 71.66 3fqs s THR 504 CO 0.72 0.00 1.92 -0.61 -0.54 0.00 0.00 174.62 176.11 3fqs h GLN 505 N 2.52 0.00 -0.05 3.99 4.15 -2.01 -1.54 115.11 122.18 3fqs h GLN 505 Ca -0.36 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.05 3fqs h GLN 505 Cb 1.25 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.93 3fqs h GLN 505 CO 0.55 0.00 -0.08 0.72 -1.93 0.00 0.00 178.83 178.09 3fqs n HIS 506 N -2.69 0.16 -3.41 3.99 8.25 -1.26 -4.94 115.22 115.32 3fqs n HIS 506 Ca -0.02 -1.08 -0.14 0.00 -0.26 0.00 0.00 57.72 56.22 3fqs n HIS 506 Cb 0.21 -0.20 -0.10 0.00 1.12 0.00 0.00 29.99 31.02 3fqs n HIS 506 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3fqs s TYR 507 N -2.94 -0.56 0.02 4.41 6.04 -0.58 -4.95 117.35 118.78 3fqs s TYR 507 Ca 0.35 0.34 0.02 0.00 0.04 0.00 0.00 57.07 57.81 3fqs s TYR 507 Cb 0.31 -0.24 -0.04 0.00 -1.04 0.00 0.00 41.96 40.95 3fqs s TYR 507 CO 0.02 -0.75 0.02 0.00 -1.54 0.00 0.00 175.55 173.30 3fqs s ALA 508 N 2.43 3.35 0.03 3.97 0.00 -1.26 -0.21 121.76 130.05 3fqs s ALA 508 Ca 0.10 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.12 3fqs s ALA 508 Cb -0.15 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 3fqs s ALA 508 CO -0.20 0.67 -0.09 0.15 0.00 0.00 0.00 175.76 176.29 3fqs s LYS 509 N -1.74 0.60 0.04 0.00 1.02 -0.23 -4.64 119.74 114.80 3fqs s LYS 509 Ca 0.21 -0.57 -0.25 0.00 0.02 0.00 0.00 55.97 55.38 3fqs s LYS 509 Cb -0.12 -0.50 -0.05 0.00 -0.52 0.00 0.00 37.83 36.64 3fqs s LYS 509 CO 0.13 0.12 0.78 0.42 -0.92 0.00 0.00 175.35 175.87 3fqs s ILE 510 N -0.82 4.74 0.00 2.17 1.01 -0.37 -0.43 121.20 127.50 3fqs s ILE 510 Ca -0.03 1.65 0.00 0.00 0.00 0.00 0.00 60.65 62.27 3fqs s ILE 510 Cb -0.07 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.28 3fqs s ILE 510 CO 0.00 0.35 0.00 -1.54 0.00 0.00 0.00 174.94 173.76 3fqs n SER 511 N 2.87 0.99 -3.13 3.58 3.41 0.22 -1.21 113.62 120.36 3fqs n SER 511 Ca -0.02 -0.81 -0.20 0.00 -0.26 0.00 0.00 58.87 57.58 3fqs n SER 511 Cb 0.50 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.47 3fqs n SER 511 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3fqs n ASP 512 N -1.62 -6.91 -1.90 4.04 4.64 -1.26 -4.87 116.55 108.67 3fqs n ASP 512 Ca 0.00 0.30 0.02 0.00 -1.38 0.00 0.00 54.79 53.73 3fqs n ASP 512 Cb 0.00 -3.70 0.35 0.00 -1.04 0.00 0.00 41.12 36.73 3fqs n ASP 512 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 3fqs n PHE 513 N -0.12 2.17 0.25 -0.67 3.72 -1.26 -4.56 117.46 116.99 3fqs n PHE 513 Ca 0.02 -0.88 0.11 0.00 -0.05 0.00 0.00 57.45 56.65 3fqs n PHE 513 Cb 0.53 -0.57 0.68 0.00 -0.94 0.00 0.00 39.48 39.17 3fqs n PHE 513 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3fqs h GLY 514 N 3.57 0.00 -1.68 1.37 0.00 -1.92 -2.52 103.07 101.89 3fqs h GLY 514 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 3fqs h GLY 514 CO 0.58 0.00 -0.01 1.04 0.00 0.00 0.00 176.54 178.15 3fqs n LEU 515 N -3.73 2.74 -4.80 3.11 4.77 -1.26 -4.87 117.00 112.96 3fqs n LEU 515 Ca -0.02 -1.00 -0.33 0.00 -0.03 0.00 0.00 56.01 54.63 3fqs n LEU 515 Cb 0.25 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 3fqs n LEU 515 CO 0.31 0.47 0.72 -0.44 -1.33 0.00 0.00 177.39 177.12 3fqs s SER 516 N -1.77 6.08 -0.01 -1.43 0.01 -0.95 -4.72 113.70 110.91 3fqs s SER 516 Ca 0.24 1.88 0.02 0.00 1.31 0.00 0.00 55.95 59.40 3fqs s SER 516 Cb 0.18 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.86 3fqs s SER 516 CO 0.27 -0.97 -0.06 -0.54 0.41 0.00 0.00 173.24 172.36 3fqs s LYS 517 N -3.63 0.53 -0.05 12.44 -0.14 -0.56 -4.99 119.74 123.33 3fqs s LYS 517 Ca 0.66 -0.19 -0.30 0.00 -1.36 0.00 0.00 55.97 54.78 3fqs s LYS 517 Cb -0.16 -0.52 -0.03 0.00 -1.68 0.00 0.00 37.83 35.44 3fqs s LYS 517 CO 0.28 0.09 1.09 0.00 -0.76 0.00 0.00 175.35 176.05 3fqs s ALA 518 N 0.04 3.40 0.31 5.17 0.00 -1.26 -1.13 121.76 128.29 3fqs s ALA 518 Ca -0.00 0.53 -0.28 0.00 0.00 0.00 0.00 51.96 52.21 3fqs s ALA 518 Cb -0.04 -3.45 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 3fqs s ALA 518 CO -0.00 -0.58 1.09 -0.51 0.00 0.00 0.00 175.76 175.75 3fqs s LEU 519 N 1.83 4.44 0.63 0.00 1.43 -0.38 -4.98 118.68 121.65 3fqs s LEU 519 Ca 0.53 2.21 -0.18 0.00 -1.03 0.00 0.00 54.13 55.65 3fqs s LEU 519 Cb -0.22 -3.77 -0.03 0.00 0.03 0.00 0.00 46.19 42.20 3fqs s LEU 519 CO 0.22 -0.24 1.17 0.54 0.23 0.00 0.00 176.35 178.27 3fqs n ARG 520 N 0.85 1.05 0.31 1.70 1.74 -1.26 -4.90 116.66 116.16 3fqs n ARG 520 Ca 0.01 0.41 0.20 0.00 -0.77 0.00 0.00 57.85 57.70 3fqs n ARG 520 Cb 0.46 -2.40 1.03 0.00 -1.02 0.00 0.00 32.46 30.53 3fqs n ARG 520 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3fqs h ALA 521 N 0.54 1.08 -0.01 7.54 0.00 -1.99 -2.84 119.26 123.58 3fqs h ALA 521 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3fqs h ALA 521 Cb 1.35 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3fqs h ALA 521 CO 0.52 0.02 -0.49 -0.40 0.00 0.00 0.00 179.25 178.90 3fqs n ASP 522 N -3.21 1.63 -4.19 0.00 5.75 -1.26 -4.98 116.55 110.29 3fqs n ASP 522 Ca -0.02 -1.32 -0.23 0.00 -0.01 0.00 0.00 54.79 53.21 3fqs n ASP 522 Cb 0.14 0.57 -0.14 0.00 -1.03 0.00 0.00 41.12 40.67 3fqs n ASP 522 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3fqs s GLU 523 N -2.27 1.19 -0.06 0.11 0.41 -1.07 -5.03 118.70 111.97 3fqs s GLU 523 Ca 0.14 -0.80 0.20 0.00 -0.41 0.00 0.00 54.97 54.10 3fqs s GLU 523 Cb 0.15 -1.23 0.69 0.00 -1.78 0.00 0.00 34.13 31.95 3fqs s GLU 523 CO 0.53 0.32 1.59 0.27 -0.49 0.00 0.00 175.26 177.48 3fqs n ASN 524 N 2.03 4.38 -3.97 -0.19 6.94 -1.26 -4.21 115.26 118.98 3fqs n ASN 524 Ca -0.17 -2.25 -0.09 0.00 -0.02 0.00 0.00 54.58 52.05 3fqs n ASN 524 Cb 0.54 -0.54 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 3fqs n ASN 524 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 3fqs s TYR 525 N -1.50 0.29 -0.10 -2.53 -0.85 -1.26 -4.38 117.35 107.01 3fqs s TYR 525 Ca 0.50 -0.66 -0.04 0.00 -0.52 0.00 0.00 57.07 56.35 3fqs s TYR 525 Cb 0.30 -0.21 -0.04 0.00 0.38 0.00 0.00 41.96 42.39 3fqs s TYR 525 CO 0.28 -0.36 0.06 -0.47 -1.52 0.00 0.00 175.55 173.55 3fqs s TYR 526 N -2.87 3.34 -0.38 -3.49 6.14 0.91 -4.79 117.35 116.22 3fqs s TYR 526 Ca -0.03 0.32 -0.09 0.00 0.64 0.00 0.00 57.07 57.92 3fqs s TYR 526 Cb 0.00 -1.86 0.05 0.00 0.42 0.00 0.00 41.96 40.57 3fqs s TYR 526 CO -0.06 0.56 0.20 0.21 0.64 0.00 0.00 175.55 177.10 3fqs s LYS 527 N -0.88 2.66 0.00 4.97 2.47 -1.26 -0.99 119.74 126.71 3fqs s LYS 527 Ca 0.13 -1.27 0.00 0.00 -1.56 0.00 0.00 55.97 53.28 3fqs s LYS 527 Cb -0.12 -3.67 0.00 0.00 -1.46 0.00 0.00 37.83 32.59 3fqs s LYS 527 CO 0.03 -0.79 0.00 0.00 0.16 0.00 0.00 175.35 174.74 3fqs n ALA 528 N 4.90 0.00 -1.66 3.13 0.00 -0.63 -5.05 120.51 121.20 3fqs n ALA 528 Ca -0.11 0.00 -0.51 0.00 0.00 0.00 0.00 53.44 52.82 3fqs n ALA 528 Cb 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 3fqs n ALA 528 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fqs n LYS 533 N 0.00 1.65 -4.28 0.00 5.02 -1.26 -4.96 118.16 114.33 3fqs n LYS 533 Ca 0.00 0.60 -0.34 0.00 -2.02 0.00 0.00 58.31 56.55 3fqs n LYS 533 Cb 0.00 -2.34 -0.10 0.00 -0.02 0.00 0.00 35.03 32.57 3fqs n LYS 533 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3fqs s TRP 534 N 2.29 3.14 -0.85 2.13 0.51 -1.26 -5.02 118.94 119.89 3fqs s TRP 534 Ca 0.89 -0.01 -0.16 0.00 -2.12 0.00 0.00 56.10 54.70 3fqs s TRP 534 Cb -0.85 -1.93 -0.11 0.00 -0.81 0.00 0.00 33.47 29.77 3fqs s TRP 534 CO 0.51 0.21 2.00 -0.35 -0.51 0.00 0.00 176.95 178.81 3fqs n PRO 535 N 3.00 1.76 -0.33 4.98 -0.04 -1.26 -4.78 135.00 138.32 3fqs n PRO 535 Ca -0.18 -1.74 0.21 0.00 -0.04 0.00 0.00 63.50 61.75 3fqs n PRO 535 Cb 0.53 -2.77 0.42 0.00 -0.04 0.00 0.00 33.50 31.64 3fqs n PRO 535 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3fqs h VAL 536 N 4.09 0.38 0.00 0.52 2.07 -1.96 -1.10 116.25 120.26 3fqs h VAL 536 Ca 0.45 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.84 3fqs h VAL 536 Cb 0.49 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3fqs h VAL 536 CO 1.78 0.07 0.00 0.11 0.02 0.00 0.00 177.57 179.55 3fqs h LYS 537 N 0.40 0.00 -0.19 1.57 1.57 -1.92 -1.11 116.57 116.88 3fqs h LYS 537 Ca 0.68 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.46 3fqs h LYS 537 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.77 3fqs h LYS 537 CO -0.57 0.00 0.00 0.91 -0.57 0.00 0.00 179.45 179.22 3fqs n TRP 538 N -2.49 0.24 -4.01 -1.35 8.01 -0.42 -4.96 117.44 112.46 3fqs n TRP 538 Ca -0.01 -0.16 -0.36 0.00 -1.31 0.00 0.00 57.50 55.66 3fqs n TRP 538 Cb 0.11 -0.00 -0.07 0.00 -2.01 0.00 0.00 31.31 29.34 3fqs n TRP 538 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 3fqs s TYR 539 N -1.32 3.48 0.62 -5.99 4.12 -0.42 -3.42 117.35 114.42 3fqs s TYR 539 Ca 0.26 0.43 -0.16 0.00 0.02 0.00 0.00 57.07 57.63 3fqs s TYR 539 Cb 0.16 -1.90 -0.02 0.00 -1.52 0.00 0.00 41.96 38.68 3fqs s TYR 539 CO 0.23 0.66 1.09 0.00 0.02 0.00 0.00 175.55 177.55 3fqs s ALA 540 N -0.96 2.60 0.24 3.71 0.00 -1.26 -4.89 121.76 121.20 3fqs s ALA 540 Ca 0.14 0.50 -0.04 0.00 0.00 0.00 0.00 51.96 52.56 3fqs s ALA 540 Cb -0.12 -3.28 0.47 0.00 0.00 0.00 0.00 23.12 20.18 3fqs s ALA 540 CO 0.03 -1.04 1.70 -1.35 0.00 0.00 0.00 175.76 175.11 3fqs h PRO 541 N 0.29 0.33 -0.24 0.00 0.11 -1.95 -2.03 132.00 128.51 3fqs h PRO 541 Ca -0.47 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.63 3fqs h PRO 541 Cb 1.24 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3fqs h PRO 541 CO 0.56 0.22 0.16 1.05 -0.21 0.00 0.00 178.00 179.77 3fqs h GLU 542 N 0.34 0.26 -0.33 1.05 9.09 -1.88 0.17 114.58 123.29 3fqs h GLU 542 Ca 0.42 -0.02 -0.10 0.00 0.05 0.00 0.00 59.36 59.71 3fqs h GLU 542 Cb 0.69 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.72 3fqs h GLU 542 CO -0.47 0.17 -0.18 0.00 0.05 0.00 0.00 179.01 178.59 3fqs h ILE 544 N 0.47 1.30 0.05 0.00 1.08 -1.05 -1.94 117.51 117.41 3fqs h ILE 544 Ca 0.07 -1.69 -0.34 0.00 -0.39 0.00 0.00 64.86 62.51 3fqs h ILE 544 Cb 0.72 1.62 -0.04 0.00 -3.07 0.00 0.00 36.82 36.05 3fqs h ILE 544 CO 0.05 0.54 -1.98 0.59 -0.69 0.00 0.00 178.15 176.66 3fqs n ASN 545 N -4.00 1.43 0.00 1.72 3.02 0.53 -4.55 115.26 113.42 3fqs n ASN 545 Ca -0.03 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 3fqs n ASN 545 Cb 0.58 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.42 3fqs n ASN 545 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3fqs n TYR 546 N -3.22 0.00 -3.13 3.10 4.02 -0.02 -5.02 117.16 112.89 3fqs n TYR 546 Ca -0.28 -0.12 -0.22 0.00 -0.01 0.00 0.00 57.90 57.27 3fqs n TYR 546 Cb 1.05 -0.01 0.02 0.00 -0.02 0.00 0.00 39.34 40.38 3fqs n TYR 546 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3fqs n TYR 547 N -0.12 -1.89 -4.07 -0.72 4.01 -0.73 -4.89 117.16 108.75 3fqs n TYR 547 Ca 0.00 0.49 -0.35 0.00 -0.16 0.00 0.00 57.90 57.88 3fqs n TYR 547 Cb 0.16 -3.90 -0.14 0.00 -0.31 0.00 0.00 39.34 35.16 3fqs n TYR 547 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3fqs s LYS 548 N -5.80 3.42 -0.23 -0.72 1.02 -1.14 -1.61 119.74 114.67 3fqs s LYS 548 Ca 0.33 -0.62 0.01 0.00 0.02 0.00 0.00 55.97 55.72 3fqs s LYS 548 Cb -0.16 -2.96 0.04 0.00 -0.52 0.00 0.00 37.83 34.23 3fqs s LYS 548 CO 0.41 -0.09 -0.13 -0.06 -0.92 0.00 0.00 175.35 174.56 3fqs s PHE 549 N 1.20 3.08 0.46 3.18 0.08 -0.16 -3.41 117.98 122.42 3fqs s PHE 549 Ca 0.02 -1.97 0.02 0.00 0.12 0.00 0.00 56.93 55.12 3fqs s PHE 549 Cb -0.14 -1.96 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 3fqs s PHE 549 CO -0.01 -0.83 0.07 -1.13 -0.10 0.00 0.00 175.22 173.22 3fqs n SER 550 N 4.54 2.39 -0.14 1.36 3.41 -1.26 -0.06 113.62 123.85 3fqs n SER 550 Ca -0.17 -3.21 -0.01 0.00 -0.26 0.00 0.00 58.87 55.22 3fqs n SER 550 Cb 0.45 0.68 0.23 0.00 -0.26 0.00 0.00 64.21 65.31 3fqs n SER 550 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3fqs h SER 551 N 1.42 0.77 -0.97 4.04 0.02 -1.89 -2.19 113.55 114.75 3fqs h SER 551 Ca -0.38 -0.09 0.05 0.00 -0.84 0.00 0.00 61.79 60.53 3fqs h SER 551 Cb 1.25 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 63.54 3fqs h SER 551 CO 0.61 0.68 0.63 0.11 -1.14 0.00 0.00 176.83 177.73 3fqs h LYS 552 N 0.84 1.15 0.00 3.45 1.79 -1.92 0.30 116.57 122.18 3fqs h LYS 552 Ca 0.20 -0.07 -0.04 0.00 -2.18 0.00 0.00 60.65 58.56 3fqs h LYS 552 Cb 0.14 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 3fqs h LYS 552 CO -0.02 0.76 -0.20 0.66 -1.08 0.00 0.00 179.45 179.57 3fqs h SER 553 N 1.19 0.00 -0.36 0.86 4.64 -1.77 -1.95 113.55 116.15 3fqs h SER 553 Ca 0.40 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.56 3fqs h SER 553 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 3fqs h SER 553 CO -0.14 0.20 -0.40 0.44 -0.87 0.00 0.00 176.83 176.06 3fqs h ASP 554 N 0.00 0.99 -0.63 4.97 3.32 -0.78 -2.81 116.42 121.49 3fqs h ASP 554 Ca -0.00 -0.46 0.10 0.00 0.02 0.00 0.00 57.03 56.68 3fqs h ASP 554 Cb 0.59 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 39.79 3fqs h ASP 554 CO 0.03 1.26 0.24 0.58 -1.72 0.00 0.00 179.24 179.62 3fqs h VAL 555 N 0.75 0.76 -0.37 -1.35 2.07 -0.26 0.92 116.25 118.77 3fqs h VAL 555 Ca 0.06 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.49 3fqs h VAL 555 Cb 1.00 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3fqs h VAL 555 CO 0.10 0.08 0.03 -0.25 0.02 0.00 0.00 177.57 177.55 3fqs h TRP 556 N 0.42 0.05 -0.97 1.57 2.91 -1.25 -1.47 115.95 117.20 3fqs h TRP 556 Ca 0.32 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.38 3fqs h TRP 556 Cb 0.40 0.03 -0.05 0.00 -0.51 0.00 0.00 29.16 29.03 3fqs h TRP 556 CO -0.17 -0.03 0.64 0.77 -1.03 0.00 0.00 178.44 178.63 3fqs h SER 557 N 0.14 1.10 -0.82 2.65 0.02 -1.07 -2.04 113.55 113.53 3fqs h SER 557 Ca 0.18 -0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.18 3fqs h SER 557 Cb 0.23 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.44 3fqs h SER 557 CO -0.27 0.79 0.54 0.15 -1.14 0.00 0.00 176.83 176.90 3fqs h PHE 558 N 1.30 0.87 -0.25 3.45 3.57 0.15 0.35 116.94 126.39 3fqs h PHE 558 Ca 0.36 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 3fqs h PHE 558 Cb -0.12 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.33 3fqs h PHE 558 CO -0.00 0.43 0.06 0.78 -2.23 0.00 0.00 178.31 177.35 3fqs h GLY 559 N 0.83 0.42 0.99 2.40 0.00 -0.65 0.48 103.07 107.55 3fqs h GLY 559 Ca 0.37 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3fqs h GLY 559 CO -0.14 0.25 0.10 -2.08 0.00 0.00 0.00 176.54 174.66 3fqs h VAL 560 N 0.22 1.05 -0.67 4.60 2.07 -0.99 -1.04 116.25 121.49 3fqs h VAL 560 Ca 0.08 -0.11 0.14 0.00 0.82 0.00 0.00 66.70 67.63 3fqs h VAL 560 Cb 0.28 0.85 -0.10 0.00 -1.52 0.00 0.00 31.29 30.79 3fqs h VAL 560 CO 0.00 0.05 0.11 0.25 0.02 0.00 0.00 177.57 178.00 3fqs h LEU 561 N 0.19 -0.08 -0.23 2.57 6.46 -0.15 -0.51 115.31 123.56 3fqs h LEU 561 Ca 0.06 0.14 0.03 0.00 -0.12 0.00 0.00 57.88 57.99 3fqs h LEU 561 Cb -0.01 0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.11 3fqs h LEU 561 CO -0.01 -0.05 0.05 0.24 -0.62 0.00 0.00 178.44 178.04 3fqs h MET 562 N 0.22 0.14 -0.27 1.25 2.86 0.34 -1.81 114.93 117.66 3fqs h MET 562 Ca 0.36 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 58.05 3fqs h MET 562 Cb 0.60 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.17 3fqs h MET 562 CO -0.49 0.09 -0.08 2.35 1.06 0.00 0.00 176.91 179.84 3fqs h TRP 563 N 0.14 -0.17 -0.88 -0.22 7.01 -0.54 -1.44 115.95 119.85 3fqs h TRP 563 Ca 0.10 0.03 0.14 0.00 2.11 0.00 0.00 58.89 61.27 3fqs h TRP 563 Cb 0.10 0.12 -0.09 0.00 -2.10 0.00 0.00 29.16 27.18 3fqs h TRP 563 CO -0.15 -0.13 0.49 0.93 -2.79 0.00 0.00 178.44 176.80 3fqs h GLU 564 N -0.01 0.70 -0.21 2.65 5.08 -0.91 0.09 114.58 121.96 3fqs h GLU 564 Ca 0.13 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.26 3fqs h GLU 564 Cb 0.21 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3fqs h GLU 564 CO -0.29 0.46 -0.63 0.00 -1.00 0.00 0.00 179.01 177.56 3fqs h ALA 565 N 1.55 0.48 0.00 3.43 0.00 -0.63 0.19 119.26 124.28 3fqs h ALA 565 Ca 0.47 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3fqs h ALA 565 Cb 0.61 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3fqs h ALA 565 CO -0.33 0.69 0.00 1.19 0.00 0.00 0.00 179.25 180.80 3fqs n PHE 566 N -3.96 0.00 -0.42 0.00 3.72 -0.61 -2.64 117.46 113.55 3fqs n PHE 566 Ca -0.05 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.46 3fqs n PHE 566 Cb 0.66 -0.36 0.32 0.00 -0.94 0.00 0.00 39.48 39.16 3fqs n PHE 566 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3fqs n SER 567 N -1.36 4.06 -3.75 4.37 7.64 -0.01 -4.68 113.62 119.89 3fqs n SER 567 Ca 0.11 -2.11 -0.24 0.00 1.01 0.00 0.00 58.87 57.64 3fqs n SER 567 Cb 0.27 -0.49 0.03 0.00 -1.01 0.00 0.00 64.21 63.01 3fqs n SER 567 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3fqs n TYR 568 N 1.41 -2.09 -0.81 1.43 4.01 -1.05 -3.23 117.16 116.84 3fqs n TYR 568 Ca 0.24 0.87 0.00 0.00 -0.16 0.00 0.00 57.90 58.85 3fqs n TYR 568 Cb 0.67 -4.33 0.00 0.00 -0.31 0.00 0.00 39.34 35.37 3fqs n TYR 568 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fqs n GLY 569 N -1.62 0.51 3.75 2.72 0.00 0.62 -2.64 105.19 108.54 3fqs n GLY 569 Ca -0.18 -0.77 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 3fqs n GLY 569 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fqs s GLN 570 N -1.42 4.68 0.32 1.61 -1.52 -1.20 -4.83 119.66 117.31 3fqs s GLN 570 Ca 0.00 1.69 -0.29 0.00 -1.95 0.00 0.00 55.36 54.81 3fqs s GLN 570 Cb 0.00 -3.24 -0.12 0.00 -0.22 0.00 0.00 33.01 29.42 3fqs s GLN 570 CO 0.00 0.25 1.37 1.63 -0.25 0.00 0.00 175.29 178.28 3fqs n LYS 571 N 1.66 2.23 -1.60 2.91 5.02 -1.26 -4.66 118.16 122.46 3fqs n LYS 571 Ca -0.00 0.79 -0.31 0.00 -2.02 0.00 0.00 58.31 56.77 3fqs n LYS 571 Cb 0.46 -2.42 0.05 0.00 -0.02 0.00 0.00 35.03 33.10 3fqs n LYS 571 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3fqs s PRO 572 N -1.50 2.82 -1.44 1.97 0.04 -1.26 -4.07 135.00 131.56 3fqs s PRO 572 Ca 0.58 0.86 -0.05 0.00 0.04 0.00 0.00 61.00 62.44 3fqs s PRO 572 Cb -0.57 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.00 3fqs s PRO 572 CO 0.59 -1.16 0.27 0.66 0.04 0.00 0.00 177.00 177.40 3fqs n TYR 573 N -3.16 -1.45 -1.62 0.56 4.02 -1.26 -4.81 117.16 109.45 3fqs n TYR 573 Ca 0.07 0.59 -0.49 0.00 -0.01 0.00 0.00 57.90 58.06 3fqs n TYR 573 Cb 0.54 -3.18 -0.05 0.00 -0.02 0.00 0.00 39.34 36.63 3fqs n TYR 573 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 3fqs n ARG 574 N -4.55 1.50 -0.99 -0.72 0.63 -1.26 -2.29 116.66 108.98 3fqs n ARG 574 Ca -0.29 0.54 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 3fqs n ARG 574 Cb 0.67 -2.17 0.00 0.00 0.45 0.00 0.00 32.46 31.41 3fqs n ARG 574 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fqs n GLY 575 N 2.52 0.87 3.68 5.14 0.00 -1.26 -5.01 105.19 111.13 3fqs n GLY 575 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 3fqs n GLY 575 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3fqs s MET 576 N -0.01 2.87 0.48 1.61 -1.94 -0.97 -5.11 119.30 116.23 3fqs s MET 576 Ca 0.00 -0.53 -0.08 0.00 -1.71 0.00 0.00 55.69 53.38 3fqs s MET 576 Cb 0.00 -2.72 -0.04 0.00 2.01 0.00 0.00 34.83 34.07 3fqs s MET 576 CO 0.00 0.66 0.82 -1.59 -0.01 0.00 0.00 175.02 174.89 3fqs s LYS 577 N -1.28 3.62 0.31 2.03 -2.85 -1.26 -4.91 119.74 115.39 3fqs s LYS 577 Ca 0.17 0.35 0.07 0.00 -1.00 0.00 0.00 55.97 55.56 3fqs s LYS 577 Cb -0.11 -2.34 0.84 0.00 -2.06 0.00 0.00 37.83 34.16 3fqs s LYS 577 CO 0.07 -0.21 1.67 0.78 0.10 0.00 0.00 175.35 177.77 3fqs h GLY 578 N 0.44 1.67 1.67 0.59 0.00 -1.99 -1.05 103.07 104.40 3fqs h GLY 578 Ca -0.47 -0.16 -0.14 0.00 0.00 0.00 0.00 47.33 46.56 3fqs h GLY 578 CO 0.62 -0.36 -0.55 1.48 0.00 0.00 0.00 176.54 177.73 3fqs h SER 579 N 0.34 0.39 -0.60 0.19 4.64 -1.99 -2.25 113.55 114.27 3fqs h SER 579 Ca 0.62 -0.21 -0.08 0.00 -0.47 0.00 0.00 61.79 61.65 3fqs h SER 579 Cb 1.27 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 63.22 3fqs h SER 579 CO -0.59 0.86 0.08 -0.33 -0.87 0.00 0.00 176.83 175.99 3fqs h GLU 580 N 0.27 1.02 -0.24 4.77 5.08 -1.60 -0.89 114.58 123.00 3fqs h GLU 580 Ca 0.00 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 3fqs h GLU 580 Cb 1.05 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 3fqs h GLU 580 CO 0.09 0.95 0.15 0.28 -1.00 0.00 0.00 179.01 179.48 3fqs h VAL 581 N 0.96 1.09 -0.30 3.13 2.07 -1.21 0.12 116.25 122.11 3fqs h VAL 581 Ca 0.19 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.53 3fqs h VAL 581 Cb 0.44 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 3fqs h VAL 581 CO 0.01 0.09 0.11 0.74 0.02 0.00 0.00 177.57 178.54 3fqs h THR 582 N 0.30 0.93 -0.99 2.57 2.02 -1.26 -0.64 112.91 115.83 3fqs h THR 582 Ca 0.09 -0.09 0.01 0.00 0.77 0.00 0.00 66.41 67.19 3fqs h THR 582 Cb 0.01 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 3fqs h THR 582 CO -0.02 0.05 0.66 0.00 0.37 0.00 0.00 175.52 176.58 3fqs h ALA 583 N 1.19 1.26 -0.32 6.16 0.00 -1.00 -1.65 119.26 124.90 3fqs h ALA 583 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3fqs h ALA 583 Cb 0.09 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3fqs h ALA 583 CO -0.13 0.64 0.16 1.98 0.00 0.00 0.00 179.25 181.91 3fqs h MET 584 N 1.34 0.45 -0.27 0.00 -1.53 -0.22 -2.81 114.93 111.89 3fqs h MET 584 Ca 0.36 -0.06 -0.08 0.00 -3.44 0.00 0.00 59.70 56.48 3fqs h MET 584 Cb -0.15 -0.09 -0.01 0.00 -0.55 0.00 0.00 31.60 30.81 3fqs h MET 584 CO -0.08 0.40 -0.15 -0.07 0.14 0.00 0.00 176.91 177.15 3fqs h LEU 585 N 0.39 0.60 -1.48 3.39 3.38 -0.98 -2.10 115.31 118.52 3fqs h LEU 585 Ca 0.11 -0.42 0.21 0.00 0.09 0.00 0.00 57.88 57.87 3fqs h LEU 585 Cb 0.09 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.60 3fqs h LEU 585 CO -0.02 0.89 0.61 -0.08 0.09 0.00 0.00 178.44 179.94 3fqs h GLU 586 N 0.32 0.40 -0.11 1.13 4.81 -1.30 0.07 114.58 119.90 3fqs h GLU 586 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3fqs h GLU 586 Cb 0.68 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.97 3fqs h GLU 586 CO 0.04 0.27 0.00 1.63 -0.73 0.00 0.00 179.01 180.22 3fqs n LYS 587 N -4.53 1.22 -0.99 1.92 5.02 -1.05 -4.87 118.16 114.89 3fqs n LYS 587 Ca 0.20 -0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 3fqs n LYS 587 Cb 0.72 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 3fqs n LYS 587 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fqs n GLY 588 N 0.65 0.50 3.80 0.72 0.00 0.01 -5.02 105.19 105.84 3fqs n GLY 588 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3fqs n GLY 588 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fqs s GLU 589 N -0.21 4.28 0.15 1.61 2.02 -0.81 -5.02 118.70 120.72 3fqs s GLU 589 Ca 0.00 0.80 0.05 0.00 0.02 0.00 0.00 54.97 55.84 3fqs s GLU 589 Cb 0.00 -3.26 -0.04 0.00 0.10 0.00 0.00 34.13 30.92 3fqs s GLU 589 CO 0.00 0.57 -0.11 1.03 0.02 0.00 0.00 175.26 176.77 3fqs s ARG 590 N -0.92 1.08 0.50 1.61 1.81 -1.26 -3.97 118.95 117.80 3fqs s ARG 590 Ca 0.30 -1.42 -0.23 0.00 -1.72 0.00 0.00 55.73 52.66 3fqs s ARG 590 Cb -0.20 -0.74 -0.07 0.00 -0.45 0.00 0.00 34.95 33.50 3fqs s ARG 590 CO 0.20 0.11 1.39 -1.64 -0.68 0.00 0.00 175.30 174.68 3fqs s MET 591 N -3.50 3.42 0.89 3.54 -1.94 -1.26 -5.00 119.30 115.44 3fqs s MET 591 Ca 0.16 2.32 -0.12 0.00 -1.71 0.00 0.00 55.69 56.34 3fqs s MET 591 Cb 0.01 -2.46 0.12 0.00 2.01 0.00 0.00 34.83 34.51 3fqs s MET 591 CO 0.02 -1.00 1.11 0.20 -0.01 0.00 0.00 175.02 175.34 3fqs s GLY 592 N -0.74 1.60 0.01 -0.03 0.00 -1.26 -4.97 107.32 101.94 3fqs s GLY 592 Ca 0.66 -0.30 -0.30 0.00 0.00 0.00 0.00 44.72 44.78 3fqs s GLY 592 CO 0.52 0.22 1.65 0.00 0.00 0.00 0.00 173.10 175.48 3fqs s PRO 594 N 3.27 2.91 -0.16 0.00 0.02 -1.26 -4.89 135.00 134.89 3fqs s PRO 594 Ca 0.74 2.05 -0.38 0.00 0.02 0.00 0.00 61.00 63.43 3fqs s PRO 594 Cb -0.37 -2.03 -0.14 0.00 0.02 0.00 0.00 34.50 31.98 3fqs s PRO 594 CO 0.31 -1.31 1.74 0.00 -0.33 0.00 0.00 177.00 177.41 3fqs n ALA 595 N -1.46 0.14 -0.86 -1.55 0.00 -1.26 -1.72 120.51 113.79 3fqs n ALA 595 Ca 0.13 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3fqs n ALA 595 Cb 0.47 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.62 3fqs n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fqs n GLY 596 N 4.05 0.79 3.69 0.00 0.00 -1.26 -4.96 105.19 107.51 3fqs n GLY 596 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 3fqs n GLY 596 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fqs s PRO 598 N 1.84 4.12 0.38 0.00 0.02 -1.26 -4.83 135.00 135.27 3fqs s PRO 598 Ca 0.56 2.55 0.09 0.00 0.02 0.00 0.00 61.00 64.21 3fqs s PRO 598 Cb -0.25 -2.98 0.83 0.00 0.02 0.00 0.00 34.50 32.12 3fqs s PRO 598 CO 0.24 -0.52 1.94 -0.09 -0.33 0.00 0.00 177.00 178.23 3fqs h ARG 599 N 3.22 0.63 -0.21 5.54 9.65 -1.99 -0.44 114.38 130.78 3fqs h ARG 599 Ca -0.50 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 58.34 3fqs h ARG 599 Cb 1.24 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.66 3fqs h ARG 599 CO 0.66 0.42 0.12 0.93 2.80 0.00 0.00 179.97 184.90 3fqs h GLU 600 N 0.65 0.28 0.08 0.20 3.07 -1.99 0.16 114.58 117.03 3fqs h GLU 600 Ca 0.34 -0.02 -0.28 0.00 -0.50 0.00 0.00 59.36 58.90 3fqs h GLU 600 Cb 0.45 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 3fqs h GLU 600 CO -0.12 0.20 -1.41 0.52 -1.40 0.00 0.00 179.01 176.80 3fqs h MET 601 N 0.29 0.16 -0.25 2.33 2.86 -1.46 -2.98 114.93 115.88 3fqs h MET 601 Ca 0.08 -0.28 -0.14 0.00 -2.06 0.00 0.00 59.70 57.30 3fqs h MET 601 Cb -0.00 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 3fqs h MET 601 CO -0.01 1.02 -0.41 -0.92 1.06 0.00 0.00 176.91 177.65 3fqs h TYR 602 N 0.04 0.71 -0.88 -0.22 3.20 -0.90 -1.97 116.97 116.95 3fqs h TYR 602 Ca -0.19 -0.21 0.06 0.00 3.14 0.00 0.00 58.73 61.53 3fqs h TYR 602 Cb 1.96 -0.15 -0.06 0.00 1.54 0.00 0.00 36.73 40.01 3fqs h TYR 602 CO 0.04 0.91 0.56 -0.44 -1.64 0.00 0.00 178.16 177.59 3fqs h ASP 603 N 0.49 0.88 -0.28 -2.11 3.32 -0.76 -1.94 116.42 116.02 3fqs h ASP 603 Ca 0.04 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.97 3fqs h ASP 603 Cb 0.92 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 3fqs h ASP 603 CO 0.08 0.57 -0.29 0.25 -1.72 0.00 0.00 179.24 178.13 3fqs h LEU 604 N 1.02 0.82 -0.32 1.55 5.85 -1.32 -1.16 115.31 121.74 3fqs h LEU 604 Ca 0.38 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.83 3fqs h LEU 604 Cb 0.14 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 3fqs h LEU 604 CO -0.16 1.06 -0.00 0.24 -0.34 0.00 0.00 178.44 179.23 3fqs h MET 605 N 0.67 0.08 -0.58 1.25 2.86 -1.00 -0.59 114.93 117.63 3fqs h MET 605 Ca 0.08 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.64 3fqs h MET 605 Cb 0.83 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.45 3fqs h MET 605 CO 0.07 0.06 0.07 -0.91 1.06 0.00 0.00 176.91 177.26 3fqs h ASN 606 N 0.09 0.94 -0.89 1.22 2.35 -1.10 -1.35 115.58 116.84 3fqs h ASN 606 Ca 0.16 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 3fqs h ASN 606 Cb 0.21 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 3fqs h ASN 606 CO -0.27 0.97 0.54 0.25 -1.65 0.00 0.00 177.43 177.28 3fqs h LEU 607 N 0.87 1.07 -1.65 1.61 5.85 -1.05 -0.67 115.31 121.33 3fqs h LEU 607 Ca 0.17 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.80 3fqs h LEU 607 Cb 0.45 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3fqs h LEU 607 CO 0.02 0.81 -0.14 0.00 -0.34 0.00 0.00 178.44 178.79 3fqs n TRP 609 N -4.35 1.39 -2.33 0.00 8.01 -0.26 -3.92 117.44 115.97 3fqs n TRP 609 Ca -0.02 -1.22 -0.42 0.00 -1.31 0.00 0.00 57.50 54.52 3fqs n TRP 609 Cb 0.22 -0.62 -0.03 0.00 -2.01 0.00 0.00 31.31 28.88 3fqs n TRP 609 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 3fqs s THR 610 N -1.57 4.02 0.11 -0.99 2.01 -1.14 -4.93 115.64 113.14 3fqs s THR 610 Ca 0.26 1.32 -0.23 0.00 0.31 0.00 0.00 61.69 63.35 3fqs s THR 610 Cb 0.22 -3.85 -0.09 0.00 0.01 0.00 0.00 72.50 68.78 3fqs s THR 610 CO 0.04 -0.05 1.70 0.22 -0.69 0.00 0.00 174.62 175.84 3fqs h TYR 611 N 8.00 -0.24 -3.49 4.92 3.20 -1.92 -3.40 116.97 124.02 3fqs h TYR 611 Ca -0.34 0.01 -0.57 0.00 3.14 0.00 0.00 58.73 60.97 3fqs h TYR 611 Cb 1.15 0.11 -0.07 0.00 1.54 0.00 0.00 36.73 39.47 3fqs h TYR 611 CO 0.77 -0.15 0.89 0.34 -1.64 0.00 0.00 178.16 178.38 3fqs s ASP 612 N -5.05 6.77 0.34 -2.11 2.15 -1.26 -4.79 116.67 112.72 3fqs s ASP 612 Ca -0.14 0.78 0.14 0.00 0.43 0.00 0.00 52.55 53.76 3fqs s ASP 612 Cb 0.08 -2.55 1.08 0.00 -0.30 0.00 0.00 42.92 41.24 3fqs s ASP 612 CO 0.66 -1.08 1.65 0.58 -0.17 0.00 0.00 175.17 176.82 3fqs h VAL 613 N 5.99 0.26 0.00 1.11 2.07 -1.95 -0.28 116.25 123.45 3fqs h VAL 613 Ca -0.22 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 3fqs h VAL 613 Cb 1.06 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3fqs h VAL 613 CO 1.08 0.05 -0.40 -0.08 0.02 0.00 0.00 177.57 178.24 3fqs h GLU 614 N 0.27 0.00 0.00 1.57 4.57 -1.94 -3.00 114.58 116.04 3fqs h GLU 614 Ca 0.73 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.91 3fqs h GLU 614 Cb 1.69 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.28 3fqs h GLU 614 CO -0.64 0.40 -1.20 0.09 -1.18 0.00 0.00 179.01 176.49 3fqs n ASN 615 N -3.65 0.60 -4.74 1.04 3.02 -0.17 -4.93 115.26 106.42 3fqs n ASN 615 Ca -0.01 0.11 -0.41 0.00 -0.03 0.00 0.00 54.58 54.25 3fqs n ASN 615 Cb 0.50 0.84 -0.03 0.00 -0.61 0.00 0.00 39.78 40.48 3fqs n ASN 615 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3fqs s ARG 616 N -3.35 4.37 0.64 3.52 3.52 -0.85 -5.00 118.95 121.80 3fqs s ARG 616 Ca -0.01 2.12 -0.17 0.00 -0.13 0.00 0.00 55.73 57.54 3fqs s ARG 616 Cb 0.12 -3.16 -0.01 0.00 -1.56 0.00 0.00 34.95 30.34 3fqs s ARG 616 CO 0.81 -0.26 1.17 -1.25 -0.81 0.00 0.00 175.30 174.97 3fqs s PRO 617 N -0.44 2.77 0.72 5.12 0.04 -1.26 -5.00 135.00 136.94 3fqs s PRO 617 Ca 0.56 1.66 -0.04 0.00 0.04 0.00 0.00 61.00 63.22 3fqs s PRO 617 Cb -0.38 -1.92 0.10 0.00 0.04 0.00 0.00 34.50 32.34 3fqs s PRO 617 CO 0.41 -1.32 1.00 0.20 0.04 0.00 0.00 177.00 177.33 3fqs s GLY 618 N -1.99 1.75 0.47 0.56 0.00 -1.26 -4.86 107.32 102.00 3fqs s GLY 618 Ca 0.73 -1.33 0.17 0.00 0.00 0.00 0.00 44.72 44.29 3fqs s GLY 618 CO 0.37 -0.84 2.04 0.74 0.00 0.00 0.00 173.10 175.41 3fqs h PHE 619 N -0.59 0.00 0.08 1.90 -1.00 -1.91 -2.08 116.94 113.34 3fqs h PHE 619 Ca -0.41 0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.39 3fqs h PHE 619 Cb 1.28 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.80 3fqs h PHE 619 CO -0.05 0.14 -0.40 0.00 -1.61 0.00 0.00 178.31 176.39 3fqs h ALA 620 N 1.86 -0.68 -0.63 2.45 0.00 -1.91 0.26 119.26 120.61 3fqs h ALA 620 Ca -0.00 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3fqs h ALA 620 Cb 0.26 0.68 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3fqs h ALA 620 CO 0.02 -0.95 0.09 0.00 0.00 0.00 0.00 179.25 178.41 3fqs h ALA 621 N -0.07 0.84 0.25 0.00 0.00 -1.87 -2.38 119.26 116.03 3fqs h ALA 621 Ca 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3fqs h ALA 621 Cb 0.65 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3fqs h ALA 621 CO -0.26 0.62 -0.12 0.28 0.00 0.00 0.00 179.25 179.77 3fqs h VAL 622 N 0.97 0.76 -0.92 0.00 2.07 -1.19 -1.49 116.25 116.46 3fqs h VAL 622 Ca 0.19 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.75 3fqs h VAL 622 Cb 0.45 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 30.94 3fqs h VAL 622 CO 0.02 0.01 0.58 -0.08 0.02 0.00 0.00 177.57 178.11 3fqs h GLU 623 N -0.34 1.01 -0.47 1.57 4.22 -0.46 -1.81 114.58 118.30 3fqs h GLU 623 Ca -0.03 -0.06 -0.04 0.00 0.08 0.00 0.00 59.36 59.30 3fqs h GLU 623 Cb 0.26 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3fqs h GLU 623 CO 0.06 0.67 0.14 1.25 -2.18 0.00 0.00 179.01 178.94 3fqs h LEU 624 N 1.04 0.70 -0.79 1.64 5.85 -1.26 0.20 115.31 122.69 3fqs h LEU 624 Ca 0.40 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.93 3fqs h LEU 624 Cb 0.19 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3fqs h LEU 624 CO -0.18 0.73 0.51 0.03 -0.34 0.00 0.00 178.44 179.19 3fqs h ARG 625 N 0.63 0.98 -0.30 1.25 2.47 -0.90 -0.32 114.38 118.19 3fqs h ARG 625 Ca 0.15 -0.06 -0.17 0.00 -1.26 0.00 0.00 59.98 58.64 3fqs h ARG 625 Cb 0.29 -0.22 -0.00 0.00 -1.65 0.00 0.00 29.97 28.39 3fqs h ARG 625 CO -0.00 0.65 -0.48 -0.07 0.56 0.00 0.00 179.97 180.62 3fqs h LEU 626 N 1.01 0.95 0.29 3.04 3.38 -1.14 -2.57 115.31 120.27 3fqs h LEU 626 Ca 0.30 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3fqs h LEU 626 Cb -0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3fqs h LEU 626 CO -0.09 1.28 -0.25 -0.09 0.09 0.00 0.00 178.44 179.38 3fqs h ARG 627 N 0.64 -0.54 -0.64 1.13 2.43 -0.30 -0.23 114.38 116.88 3fqs h ARG 627 Ca 0.02 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 3fqs h ARG 627 Cb 1.09 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.70 3fqs h ARG 627 CO 0.11 -0.36 0.33 -0.91 -1.51 0.00 0.00 179.97 177.63 3fqs h ASN 628 N -0.56 0.46 -0.17 -3.80 2.35 -1.12 -2.29 115.58 110.44 3fqs h ASN 628 Ca -0.02 0.04 -0.18 0.00 -0.55 0.00 0.00 56.30 55.60 3fqs h ASN 628 Cb 0.50 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.83 3fqs h ASN 628 CO -0.03 0.29 -0.56 0.22 -1.65 0.00 0.00 177.43 175.70 3fqs h TYR 629 N 0.60 0.97 -0.94 1.19 3.20 -1.31 -2.50 116.97 118.18 3fqs h TYR 629 Ca 0.30 -0.35 0.01 0.00 3.14 0.00 0.00 58.73 61.83 3fqs h TYR 629 Cb 0.24 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.29 3fqs h TYR 629 CO -0.10 1.15 0.62 -0.92 -1.64 0.00 0.00 178.16 177.27 3fqs h TYR 630 N 0.59 1.18 0.00 -3.82 3.20 -0.83 -1.67 116.97 115.62 3fqs h TYR 630 Ca 0.01 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 3fqs h TYR 630 Cb 1.15 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 3fqs h TYR 630 CO 0.06 0.75 -0.37 1.88 -1.64 0.00 0.00 178.16 178.84 3fqs h TYR 631 N 1.27 0.00 -0.28 -3.82 0.05 -1.28 0.21 116.97 113.13 3fqs h TYR 631 Ca 0.34 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 59.09 3fqs h TYR 631 Cb -0.14 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.59 3fqs h TYR 631 CO -0.01 0.37 0.05 -0.44 -1.05 0.00 0.00 178.16 177.08 3fqs h ASP 632 N 0.00 0.44 0.07 3.88 3.32 -0.99 -0.44 116.42 122.71 3fqs h ASP 632 Ca -0.00 -0.26 -0.14 0.00 0.02 0.00 0.00 57.03 56.65 3fqs h ASP 632 Cb 0.83 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 3fqs h ASP 632 CO 0.05 0.59 -0.48 0.58 -1.72 0.00 0.00 179.24 178.26 3fqs h VAL 633 N 0.28 1.32 -0.55 -1.35 2.07 -0.86 0.11 116.25 117.27 3fqs h VAL 633 Ca 0.08 -1.69 -0.07 0.00 0.82 0.00 0.00 66.70 65.85 3fqs h VAL 633 Cb 0.34 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 3fqs h VAL 633 CO 0.01 0.52 0.08 0.58 0.02 0.00 0.00 177.57 178.78 3fqs h VAL 634 N 0.38 1.26 0.15 2.57 2.07 -0.58 -2.35 116.25 119.74 3fqs h VAL 634 Ca 0.02 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 3fqs h VAL 634 Cb 0.98 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3fqs h VAL 634 CO 0.09 0.35 -0.07 -1.13 0.02 0.00 0.00 177.57 176.83 3fqs h ASN 635 N 0.80 -0.17 -0.94 0.57 -1.24 -0.81 -3.22 115.58 110.56 3fqs h ASN 635 Ca 0.16 -0.17 0.13 0.00 0.71 0.00 0.00 56.30 57.13 3fqs h ASN 635 Cb 0.42 0.05 -0.09 0.00 0.73 0.00 0.00 38.32 39.43 3fqs h ASN 635 CO 0.01 0.07 0.57 -0.33 -1.29 0.00 0.00 177.43 176.46 3fqs h GLU 636 N -0.43 0.85 -0.83 6.67 4.39 -0.80 -1.79 114.58 122.64 3fqs h GLU 636 Ca -0.02 -0.05 0.10 0.00 0.34 0.00 0.00 59.36 59.73 3fqs h GLU 636 Cb 0.34 -0.19 -0.06 0.00 -0.10 0.00 0.00 28.75 28.74 3fqs h GLU 636 CO 0.03 0.56 0.54 0.78 -1.16 0.00 0.00 179.01 179.77 3fqs h GLY 637 N 0.87 1.13 2.00 -3.84 0.00 -1.43 -1.13 103.07 100.67 3fqs h GLY 637 Ca 0.48 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.39 3fqs h GLY 637 CO -0.29 0.17 -0.47 0.45 0.00 0.00 0.00 176.54 176.41 3fqs h HIS 638 N 0.77 0.00 -0.01 5.60 3.86 -1.34 -3.52 115.15 120.51 3fqs h HIS 638 Ca 0.39 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.60 3fqs h HIS 638 Cb 0.47 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.94 3fqs h HIS 638 CO -0.00 0.47 0.00 0.72 0.86 0.00 0.00 177.93 179.98