#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf0 s LEU 464 N 0.00 4.38 1.10 0.00 2.96 -1.26 -4.99 118.68 120.87 3cf0 s LEU 464 Ca 0.00 2.66 -0.17 0.00 -0.22 0.00 0.00 54.13 56.40 3cf0 s LEU 464 Cb 0.00 -3.58 0.11 0.00 0.50 0.00 0.00 46.19 43.22 3cf0 s LEU 464 CO 0.00 -0.91 0.14 -1.14 -1.32 0.00 0.00 176.35 173.12 3cf0 n ARG 465 N 4.81 -1.51 -3.08 1.98 0.63 -1.26 -4.97 116.66 113.26 3cf0 n ARG 465 Ca 0.16 -0.42 -0.40 0.00 -0.92 0.00 0.00 57.85 56.27 3cf0 n ARG 465 Cb 0.38 -1.76 -0.05 0.00 0.45 0.00 0.00 32.46 31.48 3cf0 n ARG 465 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 3cf0 s GLU 466 N -3.55 4.30 -0.17 -0.14 2.56 -1.26 -5.03 118.70 115.41 3cf0 s GLU 466 Ca 0.57 0.73 -0.29 0.00 0.00 0.00 0.00 54.97 55.98 3cf0 s GLU 466 Cb -0.14 -3.53 -0.03 0.00 2.00 0.00 0.00 34.13 32.43 3cf0 s GLU 466 CO 0.66 -0.13 1.51 0.99 -0.56 0.00 0.00 175.26 177.73 3cf0 s THR 467 N 1.51 3.86 -0.37 -1.70 2.01 -1.26 -4.98 115.64 114.70 3cf0 s THR 467 Ca 0.32 1.00 -0.07 0.00 0.31 0.00 0.00 61.69 63.25 3cf0 s THR 467 Cb -0.16 -3.75 0.05 0.00 0.01 0.00 0.00 72.50 68.65 3cf0 s THR 467 CO 0.13 -0.21 0.16 -0.69 -0.69 0.00 0.00 174.62 173.32 3cf0 s VAL 468 N 4.36 3.95 0.51 3.82 1.01 -1.26 -5.09 120.40 127.71 3cf0 s VAL 468 Ca 0.66 -1.23 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 3cf0 s VAL 468 Cb -0.26 -3.31 -0.07 0.00 0.00 0.00 0.00 36.38 32.74 3cf0 s VAL 468 CO 0.25 -0.30 1.01 -0.69 0.00 0.00 0.00 175.10 175.37 3cf0 s VAL 469 N 1.41 4.13 0.16 2.92 1.01 -1.26 -4.56 120.40 124.21 3cf0 s VAL 469 Ca 0.01 1.14 -0.24 0.00 0.00 0.00 0.00 61.98 62.89 3cf0 s VAL 469 Cb -0.21 -3.54 0.06 0.00 0.00 0.00 0.00 36.38 32.69 3cf0 s VAL 469 CO 0.03 -0.47 0.72 -1.83 0.00 0.00 0.00 175.10 173.55 3cf0 s GLU 470 N -3.72 1.33 -0.24 2.72 -1.05 -1.16 -4.98 118.70 111.60 3cf0 s GLU 470 Ca 0.63 -0.60 -0.08 0.00 -0.15 0.00 0.00 54.97 54.76 3cf0 s GLU 470 Cb -0.13 0.54 -0.03 0.00 -0.44 0.00 0.00 34.13 34.07 3cf0 s GLU 470 CO 0.27 -0.59 0.08 0.08 0.95 0.00 0.00 175.26 176.05 3cf0 s VAL 471 N -3.63 4.52 -0.08 1.83 1.01 -1.26 -1.91 120.40 120.87 3cf0 s VAL 471 Ca 0.06 -0.10 -0.32 0.00 0.00 0.00 0.00 61.98 61.62 3cf0 s VAL 471 Cb -0.02 -3.11 -0.10 0.00 0.00 0.00 0.00 36.38 33.16 3cf0 s VAL 471 CO -0.05 0.35 2.00 -2.65 0.00 0.00 0.00 175.10 174.75 3cf0 n PRO 472 N 4.67 2.33 0.23 2.72 -0.02 -1.26 -4.86 135.00 138.81 3cf0 n PRO 472 Ca -0.16 0.81 0.10 0.00 -2.02 0.00 0.00 63.50 62.23 3cf0 n PRO 472 Cb 0.52 -2.88 0.56 0.00 -0.02 0.00 0.00 33.50 31.68 3cf0 n PRO 472 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3cf0 h GLN 473 N 11.01 0.00 -5.81 -0.52 -0.00 -1.96 -3.43 115.11 114.40 3cf0 h GLN 473 Ca -0.46 0.00 -0.66 0.00 -0.00 0.00 0.00 58.65 57.53 3cf0 h GLN 473 Cb 1.26 0.00 -0.08 0.00 -0.00 0.00 0.00 27.48 28.66 3cf0 h GLN 473 CO 0.95 0.21 -0.52 0.54 -0.00 0.00 0.00 178.83 180.01 3cf0 s VAL 474 N -3.98 5.18 0.44 1.86 0.11 -1.26 -5.11 120.40 117.65 3cf0 s VAL 474 Ca -0.02 -0.09 0.03 0.00 -2.93 0.00 0.00 61.98 58.97 3cf0 s VAL 474 Cb 0.12 -3.33 -0.03 0.00 -1.53 0.00 0.00 36.38 31.62 3cf0 s VAL 474 CO 0.63 0.47 0.06 0.42 -3.33 0.00 0.00 175.10 173.35 3cf0 s THR 475 N -1.14 0.98 0.55 5.04 -4.23 -1.26 -3.54 115.64 112.03 3cf0 s THR 475 Ca 0.20 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.00 3cf0 s THR 475 Cb -0.12 -2.35 0.42 0.00 1.34 0.00 0.00 72.50 71.79 3cf0 s THR 475 CO 0.11 0.00 1.94 -0.50 -0.54 0.00 0.00 174.62 175.62 3cf0 h TRP 476 N 1.63 0.00 -0.27 3.99 4.06 -1.95 -1.73 115.95 121.68 3cf0 h TRP 476 Ca -0.40 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.52 3cf0 h TRP 476 Cb 1.29 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.43 3cf0 h TRP 476 CO 1.39 0.00 0.04 0.93 -3.56 0.00 0.00 178.44 177.23 3cf0 h GLU 477 N 0.00 0.40 0.00 0.49 5.08 -2.00 -2.06 114.58 116.48 3cf0 h GLU 477 Ca 0.30 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3cf0 h GLU 477 Cb 1.28 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3cf0 h GLU 477 CO -0.00 0.40 0.00 -0.25 -1.00 0.00 0.00 179.01 178.16 3cf0 n ASP 478 N -4.35 0.00 -4.35 1.42 9.92 -0.65 -4.65 116.55 113.88 3cf0 n ASP 478 Ca 0.01 -0.29 -0.37 0.00 -0.53 0.00 0.00 54.79 53.60 3cf0 n ASP 478 Cb 0.19 -0.21 -0.13 0.00 -0.64 0.00 0.00 41.12 40.33 3cf0 n ASP 478 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3cf0 s ILE 479 N -2.43 4.00 -0.07 0.53 1.01 -0.78 -4.70 121.20 118.76 3cf0 s ILE 479 Ca 0.30 -0.64 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 3cf0 s ILE 479 Cb 0.18 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 3cf0 s ILE 479 CO 0.39 0.11 0.94 -0.83 0.00 0.00 0.00 174.94 175.54 3cf0 s GLY 480 N 1.51 2.54 0.00 6.18 0.00 -1.26 -4.92 107.32 111.37 3cf0 s GLY 480 Ca 0.03 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.10 3cf0 s GLY 480 CO 0.02 1.72 0.00 0.61 0.00 0.00 0.00 173.10 175.45 3cf0 n GLY 481 N 3.08 -1.15 2.71 0.20 0.00 -1.26 -4.58 105.19 104.19 3cf0 n GLY 481 Ca 0.06 -1.23 -0.16 0.00 0.00 0.00 0.00 46.02 44.69 3cf0 n GLY 481 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3cf0 n LEU 482 N 0.00 -2.51 -0.07 0.99 4.77 -1.26 -4.92 117.00 114.00 3cf0 n LEU 482 Ca 0.00 -0.25 -0.10 0.00 -0.03 0.00 0.00 56.01 55.63 3cf0 n LEU 482 Cb 0.00 -2.22 -0.03 0.00 -2.33 0.00 0.00 43.42 38.84 3cf0 n LEU 482 CO 0.00 0.24 0.91 -0.33 -1.33 0.00 0.00 177.39 176.88 3cf0 h GLU 483 N -1.22 0.34 -0.83 3.23 4.39 -1.97 -1.98 114.58 116.54 3cf0 h GLU 483 Ca -0.37 -0.05 0.20 0.00 0.34 0.00 0.00 59.36 59.48 3cf0 h GLU 483 Cb 1.25 -0.06 -0.13 0.00 -0.10 0.00 0.00 28.75 29.71 3cf0 h GLU 483 CO 0.39 0.33 0.23 0.38 -1.16 0.00 0.00 179.01 179.18 3cf0 h ASP 484 N 0.26 0.05 0.03 1.42 2.03 -2.00 -1.81 116.42 116.41 3cf0 h ASP 484 Ca 0.08 0.17 -0.25 0.00 -0.73 0.00 0.00 57.03 56.30 3cf0 h ASP 484 Cb 0.10 0.22 0.02 0.00 -0.83 0.00 0.00 39.33 38.84 3cf0 h ASP 484 CO -0.01 -0.08 -0.99 -0.37 -1.03 0.00 0.00 179.24 176.75 3cf0 h VAL 485 N 0.27 1.32 -0.55 4.15 -1.51 -1.88 -2.07 116.25 115.98 3cf0 h VAL 485 Ca 0.50 -2.27 0.11 0.00 -1.23 0.00 0.00 66.70 63.81 3cf0 h VAL 485 Cb 0.94 2.53 -0.10 0.00 -2.13 0.00 0.00 31.29 32.53 3cf0 h VAL 485 CO -0.58 0.69 -0.05 0.11 -1.23 0.00 0.00 177.57 176.51 3cf0 h LYS 486 N 0.24 0.07 -0.17 5.19 1.57 -0.91 1.03 116.57 123.60 3cf0 h LYS 486 Ca -0.13 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3cf0 h LYS 486 Cb 1.67 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.95 3cf0 h LYS 486 CO 0.19 0.05 0.07 -0.09 -0.57 0.00 0.00 179.45 179.11 3cf0 h ARG 487 N 0.07 0.16 -0.92 3.15 2.43 -1.37 -1.81 114.38 116.10 3cf0 h ARG 487 Ca 0.28 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3cf0 h ARG 487 Cb 0.43 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.90 3cf0 h ARG 487 CO -0.50 0.11 0.56 1.49 -1.51 0.00 0.00 179.97 180.11 3cf0 h GLU 488 N 0.17 1.24 -0.39 0.20 4.22 -0.32 -0.39 114.58 119.31 3cf0 h GLU 488 Ca 0.07 -0.11 -0.02 0.00 0.08 0.00 0.00 59.36 59.38 3cf0 h GLU 488 Cb 0.02 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 3cf0 h GLU 488 CO -0.05 0.86 0.15 -0.07 -2.18 0.00 0.00 179.01 177.72 3cf0 h LEU 489 N 1.26 0.53 -0.24 1.64 3.38 0.13 -2.58 115.31 119.44 3cf0 h LEU 489 Ca 0.33 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3cf0 h LEU 489 Cb -0.06 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3cf0 h LEU 489 CO -0.06 0.56 0.11 1.56 0.09 0.00 0.00 178.44 180.69 3cf0 h GLN 490 N 0.48 0.23 0.00 1.13 4.20 -0.68 -0.72 115.11 119.75 3cf0 h GLN 490 Ca 0.13 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.82 3cf0 h GLN 490 Cb 0.19 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.92 3cf0 h GLN 490 CO -0.01 0.15 0.05 0.39 -0.67 0.00 0.00 178.83 178.75 3cf0 n GLU 491 N -5.00 0.12 -0.04 1.46 1.02 -0.21 -0.22 120.64 117.78 3cf0 n GLU 491 Ca -0.02 0.62 0.04 0.00 -0.02 0.00 0.00 57.16 57.78 3cf0 n GLU 491 Cb 0.06 -1.96 -0.16 0.00 -0.02 0.00 0.00 31.44 29.37 3cf0 n GLU 491 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3cf0 n LEU 492 N -2.18 0.00 -0.01 -4.62 4.77 -0.35 -4.49 117.00 110.11 3cf0 n LEU 492 Ca -0.01 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.95 3cf0 n LEU 492 Cb 0.08 0.15 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 3cf0 n LEU 492 CO 0.08 0.15 -0.58 1.33 -1.33 0.00 0.00 177.39 177.05 3cf0 n VAL 493 N -2.37 0.14 0.26 4.08 0.24 -0.74 -4.70 118.33 115.23 3cf0 n VAL 493 Ca -0.13 -0.05 -0.11 0.00 -2.04 0.00 0.00 64.34 62.02 3cf0 n VAL 493 Cb 0.73 -0.72 -0.05 0.00 -1.47 0.00 0.00 33.84 32.33 3cf0 n VAL 493 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3cf0 h GLN 494 N -0.01 -0.66 -0.55 7.34 1.08 -0.81 -3.25 115.11 118.24 3cf0 h GLN 494 Ca -0.06 0.05 0.11 0.00 -1.45 0.00 0.00 58.65 57.30 3cf0 h GLN 494 Cb 1.08 0.15 -0.09 0.00 -0.05 0.00 0.00 27.48 28.57 3cf0 h GLN 494 CO -0.01 -0.44 0.01 1.88 -0.95 0.00 0.00 178.83 179.31 3cf0 h TYR 495 N -0.91 -0.02 -0.46 2.96 0.99 -1.76 0.20 116.97 117.96 3cf0 h TYR 495 Ca -0.07 0.04 0.01 0.00 2.00 0.00 0.00 58.73 60.71 3cf0 h TYR 495 Cb 0.53 0.10 -0.02 0.00 1.00 0.00 0.00 36.73 38.33 3cf0 h TYR 495 CO 0.04 -0.13 0.31 -1.00 -0.00 0.00 0.00 178.16 177.38 3cf0 h PRO 496 N 0.13 0.59 0.14 4.88 0.13 -1.82 0.13 132.00 136.17 3cf0 h PRO 496 Ca 0.28 -0.04 -0.26 0.00 -0.87 0.00 0.00 66.00 65.12 3cf0 h PRO 496 Cb 0.44 -0.13 0.01 0.00 0.13 0.00 0.00 31.00 31.45 3cf0 h PRO 496 CO -0.46 0.39 -1.26 -0.24 -0.23 0.00 0.00 178.00 176.19 3cf0 h VAL 497 N 0.61 1.18 -0.01 1.56 3.04 -1.03 -3.21 116.25 118.38 3cf0 h VAL 497 Ca 0.17 -2.47 0.00 0.00 -1.01 0.00 0.00 66.70 63.40 3cf0 h VAL 497 Cb -0.03 2.88 0.00 0.00 -2.01 0.00 0.00 31.29 32.13 3cf0 h VAL 497 CO -0.04 0.72 -0.18 -0.62 -1.01 0.00 0.00 177.57 176.44 3cf0 n GLU 498 N -3.95 1.39 -2.72 4.17 1.02 0.50 -4.14 120.64 116.92 3cf0 n GLU 498 Ca -0.21 -0.96 -0.06 0.00 -0.02 0.00 0.00 57.16 55.91 3cf0 n GLU 498 Cb 0.90 -1.48 0.04 0.00 -0.02 0.00 0.00 31.44 30.88 3cf0 n GLU 498 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3cf0 n HIS 499 N 0.03 1.08 0.02 -0.32 8.25 0.03 -4.92 115.22 119.40 3cf0 n HIS 499 Ca 0.14 -2.55 0.20 0.00 -0.26 0.00 0.00 57.72 55.25 3cf0 n HIS 499 Cb 0.41 -0.27 0.70 0.00 1.12 0.00 0.00 29.99 31.95 3cf0 n HIS 499 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3cf0 h PRO 500 N 2.83 0.00 -0.58 -0.41 0.11 -1.69 0.11 132.00 132.38 3cf0 h PRO 500 Ca -0.12 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.07 3cf0 h PRO 500 Cb 1.21 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 3cf0 h PRO 500 CO 0.38 0.00 0.23 0.38 -0.21 0.00 0.00 178.00 178.78 3cf0 h ASP 501 N 0.00 0.26 0.15 -2.05 -0.00 -1.91 -1.27 116.42 111.59 3cf0 h ASP 501 Ca 0.23 0.07 -0.12 0.00 -0.00 0.00 0.00 57.03 57.21 3cf0 h ASP 501 Cb 0.96 0.04 -0.01 0.00 -0.00 0.00 0.00 39.33 40.32 3cf0 h ASP 501 CO -0.00 0.16 -0.44 0.11 -0.00 0.00 0.00 179.24 179.07 3cf0 h LYS 502 N 0.43 0.35 -0.19 4.15 6.56 -1.15 0.21 116.57 126.94 3cf0 h LYS 502 Ca 0.28 -0.18 -0.17 0.00 -1.06 0.00 0.00 60.65 59.52 3cf0 h LYS 502 Cb 0.32 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.98 3cf0 h LYS 502 CO -0.27 0.73 -0.59 0.74 -2.06 0.00 0.00 179.45 178.00 3cf0 h PHE 503 N 0.29 0.80 -0.11 -1.35 0.04 -1.40 -1.76 116.94 113.45 3cf0 h PHE 503 Ca 0.02 -0.30 -0.16 0.00 2.80 0.00 0.00 57.97 60.34 3cf0 h PHE 503 Cb 0.89 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.89 3cf0 h PHE 503 CO 0.02 1.06 -0.60 -0.07 -0.60 0.00 0.00 178.31 178.13 3cf0 h LEU 504 N 0.47 0.42 0.33 1.54 4.07 -1.00 -0.12 115.31 121.03 3cf0 h LEU 504 Ca -0.00 -0.24 -0.02 0.00 0.08 0.00 0.00 57.88 57.70 3cf0 h LEU 504 Cb 1.16 -0.12 0.00 0.00 1.08 0.00 0.00 40.66 42.78 3cf0 h LEU 504 CO 0.12 0.93 -0.16 0.11 -1.08 0.00 0.00 178.44 178.35 3cf0 h LYS 505 N 0.28 -0.43 0.00 1.13 1.57 -0.46 -3.06 116.57 115.60 3cf0 h LYS 505 Ca -0.01 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3cf0 h LYS 505 Cb 1.13 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.53 3cf0 h LYS 505 CO 0.10 -0.22 -0.13 1.19 -0.57 0.00 0.00 179.45 179.82 3cf0 n PHE 506 N -5.24 0.31 0.00 -1.35 3.72 -0.67 -4.96 117.46 109.27 3cf0 n PHE 506 Ca -0.10 0.09 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3cf0 n PHE 506 Cb 0.22 -0.60 0.00 0.00 -0.94 0.00 0.00 39.48 38.16 3cf0 n PHE 506 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3cf0 n GLY 507 N 1.43 2.64 3.54 1.37 0.00 -0.06 -5.02 105.19 109.09 3cf0 n GLY 507 Ca 0.06 -0.61 -0.48 0.00 0.00 0.00 0.00 46.02 44.99 3cf0 n GLY 507 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3cf0 n MET 508 N 0.00 0.89 -4.01 1.61 0.00 -1.24 -4.74 117.12 109.64 3cf0 n MET 508 Ca 0.00 0.31 -0.33 0.00 0.00 0.00 0.00 57.70 57.69 3cf0 n MET 508 Cb 0.00 -1.68 -0.06 0.00 0.00 0.00 0.00 33.22 31.48 3cf0 n MET 508 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 3cf0 s THR 509 N -0.56 5.02 1.08 3.17 -4.23 -1.26 -4.65 115.64 114.21 3cf0 s THR 509 Ca 0.69 -0.37 -0.18 0.00 -1.18 0.00 0.00 61.69 60.65 3cf0 s THR 509 Cb -0.86 -3.35 0.27 0.00 1.34 0.00 0.00 72.50 69.90 3cf0 s THR 509 CO 0.55 0.29 0.99 -2.65 -0.54 0.00 0.00 174.62 173.26 3cf0 n PRO 510 N 0.90 -2.80 -4.20 3.99 -0.02 -1.26 -5.04 135.00 126.57 3cf0 n PRO 510 Ca -0.11 -1.58 -0.32 0.00 -2.02 0.00 0.00 63.50 59.47 3cf0 n PRO 510 Cb 0.52 -1.45 -0.08 0.00 -0.02 0.00 0.00 33.50 32.47 3cf0 n PRO 510 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3cf0 s SER 511 N -4.23 5.25 0.44 2.55 1.04 -1.26 -5.03 113.70 112.46 3cf0 s SER 511 Ca 0.64 -0.00 0.24 0.00 0.48 0.00 0.00 55.95 57.31 3cf0 s SER 511 Cb -0.06 -1.39 0.90 0.00 0.10 0.00 0.00 66.02 65.58 3cf0 s SER 511 CO 0.49 0.25 1.82 0.11 0.98 0.00 0.00 173.24 176.89 3cf0 h LYS 512 N 4.06 0.00 0.00 4.02 1.57 -1.90 -3.48 116.57 120.84 3cf0 h LYS 512 Ca -0.49 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 58.57 3cf0 h LYS 512 Cb 1.17 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.43 3cf0 h LYS 512 CO 0.59 0.22 0.76 0.41 -0.57 0.00 0.00 179.45 180.87 3cf0 n GLY 513 N 0.19 0.35 3.15 3.86 0.00 -1.23 -2.44 105.19 109.08 3cf0 n GLY 513 Ca 0.00 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 3cf0 n GLY 513 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cf0 s VAL 514 N -2.04 0.02 -0.25 1.61 1.01 -0.74 -3.46 120.40 116.54 3cf0 s VAL 514 Ca 0.26 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 3cf0 s VAL 514 Cb -0.01 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 35.99 3cf0 s VAL 514 CO 0.01 -0.08 -0.05 -0.22 0.00 0.00 0.00 175.10 174.76 3cf0 s LEU 515 N -0.23 3.28 -0.04 3.92 0.20 0.06 -0.73 118.68 125.14 3cf0 s LEU 515 Ca -0.03 -0.91 -0.23 0.00 0.69 0.00 0.00 54.13 53.64 3cf0 s LEU 515 Cb -0.03 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 44.02 3cf0 s LEU 515 CO 0.01 -0.14 0.70 -0.36 -0.29 0.00 0.00 176.35 176.27 3cf0 s PHE 516 N 1.32 3.62 0.13 5.38 2.99 0.57 -0.58 117.98 131.40 3cf0 s PHE 516 Ca -0.00 1.29 0.03 0.00 0.00 0.00 0.00 56.93 58.25 3cf0 s PHE 516 Cb -0.17 -2.79 -0.04 0.00 0.00 0.00 0.00 43.02 40.02 3cf0 s PHE 516 CO -0.04 0.15 -0.09 1.52 -0.00 0.00 0.00 175.22 176.76 3cf0 s TYR 517 N 0.55 1.11 0.00 0.36 -0.85 -0.53 -1.74 117.35 116.25 3cf0 s TYR 517 Ca 0.37 -0.81 0.00 0.00 -0.52 0.00 0.00 57.07 56.12 3cf0 s TYR 517 Cb -0.18 -0.59 0.00 0.00 0.38 0.00 0.00 41.96 41.57 3cf0 s TYR 517 CO 0.19 -0.01 0.00 0.41 -1.52 0.00 0.00 175.55 174.62 3cf0 n GLY 518 N -0.08 2.66 3.70 5.49 0.00 -1.11 -0.73 105.19 115.12 3cf0 n GLY 518 Ca -0.11 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.32 3cf0 n GLY 518 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3cf0 s PRO 519 N -2.06 1.42 0.18 1.61 0.04 -1.25 -4.11 135.00 130.83 3cf0 s PRO 519 Ca 0.00 1.47 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3cf0 s PRO 519 Cb 0.00 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.68 3cf0 s PRO 519 CO 0.00 -2.32 1.18 -2.14 0.04 0.00 0.00 177.00 173.76 3cf0 s PRO 520 N -4.66 4.51 0.00 0.56 0.02 -1.26 -4.10 135.00 130.07 3cf0 s PRO 520 Ca 0.66 1.84 0.00 0.00 0.02 0.00 0.00 61.00 63.52 3cf0 s PRO 520 Cb -0.22 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.05 3cf0 s PRO 520 CO 0.56 -0.07 0.00 0.41 -0.33 0.00 0.00 177.00 177.57 3cf0 n GLY 521 N 2.22 0.87 0.00 0.52 0.00 -1.26 -4.83 105.19 102.71 3cf0 n GLY 521 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3cf0 n GLY 521 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf0 n GLY 523 N -0.08 1.07 0.31 0.00 0.00 -1.26 -4.86 105.19 100.37 3cf0 n GLY 523 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3cf0 n GLY 523 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cf0 h LYS 524 N 0.00 0.97 -0.14 1.61 1.57 -1.95 -0.87 116.57 117.75 3cf0 h LYS 524 Ca 0.00 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3cf0 h LYS 524 Cb 0.00 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.09 3cf0 h LYS 524 CO 0.00 0.64 -0.14 1.15 -0.57 0.00 0.00 179.45 180.53 3cf0 h THR 525 N 0.99 1.35 -0.53 -0.16 2.02 -1.99 -2.40 112.91 112.18 3cf0 h THR 525 Ca 0.32 -1.30 0.09 0.00 0.77 0.00 0.00 66.41 66.29 3cf0 h THR 525 Cb 0.02 1.88 -0.07 0.00 -1.74 0.00 0.00 68.15 68.24 3cf0 h THR 525 CO -0.12 0.38 0.14 -0.07 0.37 0.00 0.00 175.52 176.23 3cf0 h LEU 526 N -0.02 0.07 -0.53 2.58 3.38 -1.93 0.13 115.31 118.99 3cf0 h LEU 526 Ca 0.02 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.11 3cf0 h LEU 526 Cb 0.67 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 3cf0 h LEU 526 CO 0.04 0.06 0.30 -0.07 0.09 0.00 0.00 178.44 178.86 3cf0 h LEU 527 N 0.29 0.47 -1.28 1.67 3.38 -1.17 0.24 115.31 118.91 3cf0 h LEU 527 Ca 0.27 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.18 3cf0 h LEU 527 Cb 0.35 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3cf0 h LEU 527 CO -0.32 0.32 -0.32 0.00 0.09 0.00 0.00 178.44 178.21 3cf0 h ALA 528 N 1.26 1.40 0.00 1.53 0.00 -0.52 -2.39 119.26 120.54 3cf0 h ALA 528 Ca 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3cf0 h ALA 528 Cb 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3cf0 h ALA 528 CO -0.12 0.44 -0.13 0.87 0.00 0.00 0.00 179.25 180.31 3cf0 h LYS 529 N 0.06 0.00 -0.84 0.00 1.57 -0.41 -2.96 116.57 113.99 3cf0 h LYS 529 Ca 0.01 0.00 0.16 0.00 -1.87 0.00 0.00 60.65 58.95 3cf0 h LYS 529 Cb 0.60 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.75 3cf0 h LYS 529 CO 0.04 0.39 -0.25 0.00 -0.57 0.00 0.00 179.45 179.06 3cf0 h ALA 530 N -0.64 0.43 -0.89 3.86 0.00 -0.57 0.39 119.26 121.85 3cf0 h ALA 530 Ca -0.02 0.30 0.04 0.00 0.00 0.00 0.00 54.91 55.23 3cf0 h ALA 530 Cb 0.46 0.72 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 3cf0 h ALA 530 CO -0.01 -0.47 0.57 0.97 0.00 0.00 0.00 179.25 180.31 3cf0 h ILE 531 N -0.02 1.14 -0.65 0.00 6.09 -1.54 0.52 117.51 123.05 3cf0 h ILE 531 Ca 0.38 -0.38 -0.04 0.00 -1.37 0.00 0.00 64.86 63.45 3cf0 h ILE 531 Cb 0.61 -0.06 -0.03 0.00 0.47 0.00 0.00 36.82 37.81 3cf0 h ILE 531 CO -0.87 0.20 0.24 0.00 -3.07 0.00 0.00 178.15 174.65 3cf0 h ALA 532 N 1.37 0.85 -0.43 0.18 0.00 -0.21 -1.89 119.26 119.12 3cf0 h ALA 532 Ca 0.35 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 3cf0 h ALA 532 Cb 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3cf0 h ALA 532 CO -0.12 0.48 -0.19 -0.97 0.00 0.00 0.00 179.25 178.45 3cf0 h ASN 533 N 0.92 0.84 0.10 0.00 -1.24 0.64 0.13 115.58 116.98 3cf0 h ASN 533 Ca 0.21 -0.30 0.00 0.00 0.71 0.00 0.00 56.30 56.93 3cf0 h ASN 533 Cb 0.23 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 3cf0 h ASN 533 CO -0.01 1.02 -0.09 -0.08 -1.29 0.00 0.00 177.43 176.97 3cf0 h GLU 534 N 0.73 -0.20 0.00 6.67 4.57 0.15 -1.13 114.58 125.38 3cf0 h GLU 534 Ca 0.11 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3cf0 h GLU 534 Cb 0.71 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.35 3cf0 h GLU 534 CO 0.05 -0.14 0.00 0.00 -1.18 0.00 0.00 179.01 177.75 3cf0 n GLN 536 N -0.81 -2.63 -4.28 0.00 1.13 -0.43 -4.97 117.38 105.39 3cf0 n GLN 536 Ca 0.05 0.32 -0.25 0.00 -1.94 0.00 0.00 57.00 55.17 3cf0 n GLN 536 Cb 0.02 -4.26 -0.08 0.00 0.11 0.00 0.00 30.24 26.03 3cf0 n GLN 536 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3cf0 s ALA 537 N -4.08 3.40 0.59 -1.58 0.00 0.43 -4.99 121.76 115.53 3cf0 s ALA 537 Ca 0.00 -2.10 -0.10 0.00 0.00 0.00 0.00 51.96 49.76 3cf0 s ALA 537 Cb -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 3cf0 s ALA 537 CO 0.92 -0.09 0.98 -0.80 0.00 0.00 0.00 175.76 176.77 3cf0 s ASN 538 N -3.82 6.25 -0.06 0.00 0.01 0.25 -4.48 114.94 113.10 3cf0 s ASN 538 Ca 0.38 1.33 -0.01 0.00 -0.71 0.00 0.00 52.86 53.85 3cf0 s ASN 538 Cb 0.04 -2.43 0.03 0.00 0.41 0.00 0.00 41.25 39.30 3cf0 s ASN 538 CO 0.21 -0.81 0.01 0.12 -1.51 0.00 0.00 177.10 175.12 3cf0 s PHE 539 N -3.08 0.56 -0.11 2.20 5.36 -0.80 0.68 117.98 122.79 3cf0 s PHE 539 Ca 0.54 -0.10 0.02 0.00 -0.96 0.00 0.00 56.93 56.43 3cf0 s PHE 539 Cb -0.11 -0.72 -0.01 0.00 -0.34 0.00 0.00 43.02 41.84 3cf0 s PHE 539 CO 0.52 -0.28 -0.18 0.42 -1.46 0.00 0.00 175.22 174.23 3cf0 s ILE 540 N 1.86 2.62 -0.28 3.12 1.01 -0.23 -2.96 121.20 126.34 3cf0 s ILE 540 Ca 0.03 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 3cf0 s ILE 540 Cb -0.12 -2.05 0.04 0.00 0.01 0.00 0.00 42.46 40.34 3cf0 s ILE 540 CO -0.04 0.55 -0.03 -0.55 0.00 0.00 0.00 174.94 174.86 3cf0 s SER 541 N 0.23 4.65 -0.25 3.58 0.15 -1.26 0.18 113.70 120.98 3cf0 s SER 541 Ca -0.12 -1.17 -0.09 0.00 0.70 0.00 0.00 55.95 55.27 3cf0 s SER 541 Cb -0.16 -1.67 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 3cf0 s SER 541 CO 0.06 -0.21 0.13 -0.63 1.20 0.00 0.00 173.24 173.79 3cf0 s ILE 542 N 1.25 4.91 0.21 6.45 1.09 -0.73 -4.95 121.20 129.44 3cf0 s ILE 542 Ca -0.04 0.03 0.03 0.00 -1.10 0.00 0.00 60.65 59.57 3cf0 s ILE 542 Cb -0.19 -3.30 0.03 0.00 -1.06 0.00 0.00 42.46 37.94 3cf0 s ILE 542 CO -0.03 0.32 0.24 0.29 -0.10 0.00 0.00 174.94 175.66 3cf0 n LYS 543 N 4.72 1.00 0.37 2.79 5.02 -1.26 -1.41 118.16 129.38 3cf0 n LYS 543 Ca -0.15 -1.21 -0.15 0.00 -2.02 0.00 0.00 58.31 54.77 3cf0 n LYS 543 Cb 0.52 0.01 -0.08 0.00 -0.02 0.00 0.00 35.03 35.46 3cf0 n LYS 543 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3cf0 h GLY 544 N 0.13 -1.09 0.86 0.72 0.00 -1.82 -2.54 103.07 99.32 3cf0 h GLY 544 Ca -0.11 0.43 0.15 0.00 0.00 0.00 0.00 47.33 47.80 3cf0 h GLY 544 CO 0.17 -0.38 0.42 -2.55 0.00 0.00 0.00 176.54 174.20 3cf0 h PRO 545 N -0.98 0.14 -0.06 4.80 0.11 -1.94 0.00 132.00 134.07 3cf0 h PRO 545 Ca -0.09 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 3cf0 h PRO 545 Cb 0.77 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.84 3cf0 h PRO 545 CO 0.12 0.09 -0.02 1.49 -0.21 0.00 0.00 178.00 179.47 3cf0 h GLU 546 N 0.14 0.12 -0.34 1.05 4.81 -1.90 -0.99 114.58 117.47 3cf0 h GLU 546 Ca 0.29 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.55 3cf0 h GLU 546 Cb 0.95 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.25 3cf0 h GLU 546 CO -0.04 0.47 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.48 3cf0 h LEU 547 N -0.24 -0.54 -1.49 1.64 3.38 -0.79 -2.29 115.31 114.99 3cf0 h LEU 547 Ca 0.01 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3cf0 h LEU 547 Cb 0.43 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 3cf0 h LEU 547 CO 0.01 -0.19 0.24 -0.07 0.09 0.00 0.00 178.44 178.52 3cf0 h LEU 548 N -0.10 0.52 -0.28 1.67 3.38 -0.97 -0.68 115.31 118.84 3cf0 h LEU 548 Ca 0.17 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.13 3cf0 h LEU 548 Cb 0.36 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3cf0 h LEU 548 CO -0.40 0.42 0.15 0.74 0.09 0.00 0.00 178.44 179.43 3cf0 h THR 549 N 0.60 1.01 0.00 0.22 2.02 -0.63 0.53 112.91 116.66 3cf0 h THR 549 Ca 0.16 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 3cf0 h THR 549 Cb 0.01 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3cf0 h THR 549 CO -0.03 0.06 -0.15 0.24 0.37 0.00 0.00 175.52 176.01 3cf0 h MET 550 N 0.32 0.00 0.02 6.66 2.86 -0.89 0.25 114.93 124.15 3cf0 h MET 550 Ca 0.11 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3cf0 h MET 550 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 3cf0 h MET 550 CO -0.06 0.15 -0.01 2.35 1.06 0.00 0.00 176.91 180.40 3cf0 h TRP 551 N 0.00 -0.02 -0.16 -0.22 7.01 0.47 0.06 115.95 123.09 3cf0 h TRP 551 Ca -0.00 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.02 3cf0 h TRP 551 Cb 0.38 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 3cf0 h TRP 551 CO 0.00 0.73 0.03 0.74 -2.79 0.00 0.00 178.44 177.15 3cf0 h PHE 552 N -0.93 0.05 -0.12 2.65 0.04 0.04 -2.78 116.94 115.89 3cf0 h PHE 552 Ca -0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3cf0 h PHE 552 Cb 0.76 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.91 3cf0 h PHE 552 CO 0.20 0.02 0.00 0.41 -0.60 0.00 0.00 178.31 178.34 3cf0 n GLY 553 N -1.16 -0.38 3.57 -1.45 0.00 0.07 -4.89 105.19 100.95 3cf0 n GLY 553 Ca -0.03 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 3cf0 n GLY 553 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cf0 n GLU 554 N -0.17 -4.17 -2.34 1.61 1.02 -0.74 -4.86 120.64 111.00 3cf0 n GLU 554 Ca 0.08 0.55 -0.32 0.00 -0.02 0.00 0.00 57.16 57.45 3cf0 n GLU 554 Cb 0.14 -5.34 0.01 0.00 -0.02 0.00 0.00 31.44 26.23 3cf0 n GLU 554 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3cf0 n SER 555 N -2.51 5.79 0.08 1.62 3.41 -0.07 -4.78 113.62 117.17 3cf0 n SER 555 Ca 0.00 -3.76 0.12 0.00 -0.26 0.00 0.00 58.87 54.97 3cf0 n SER 555 Cb 0.54 -0.71 0.45 0.00 -0.26 0.00 0.00 64.21 64.23 3cf0 n SER 555 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3cf0 n GLU 556 N -0.46 0.16 0.16 4.33 0.00 -1.25 -2.25 120.64 121.33 3cf0 n GLU 556 Ca 0.44 0.27 0.18 0.00 0.00 0.00 0.00 57.16 58.05 3cf0 n GLU 556 Cb 0.47 -1.74 0.79 0.00 0.00 0.00 0.00 31.44 30.96 3cf0 n GLU 556 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3cf0 h ALA 557 N 2.49 1.94 0.00 -1.84 0.00 -1.94 0.67 119.26 120.58 3cf0 h ALA 557 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3cf0 h ALA 557 Cb 0.50 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3cf0 h ALA 557 CO 0.00 -0.42 0.00 0.09 0.00 0.00 0.00 179.25 178.92 3cf0 n ASN 558 N -3.82 0.35 -0.06 0.00 4.13 -0.95 -2.16 115.26 112.76 3cf0 n ASN 558 Ca 0.04 0.65 -0.05 0.00 1.68 0.00 0.00 54.58 56.90 3cf0 n ASN 558 Cb 0.42 -0.70 0.16 0.00 -1.54 0.00 0.00 39.78 38.12 3cf0 n ASN 558 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 3cf0 h VAL 559 N 0.00 1.25 -0.42 2.41 2.07 -1.11 -1.44 116.25 119.01 3cf0 h VAL 559 Ca 0.00 -1.16 0.09 0.00 0.82 0.00 0.00 66.70 66.45 3cf0 h VAL 559 Cb 0.05 1.12 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 3cf0 h VAL 559 CO 0.00 0.39 -0.11 -0.09 0.02 0.00 0.00 177.57 177.78 3cf0 h ARG 560 N 0.61 -0.00 -0.03 1.57 2.43 -1.62 0.13 114.38 117.46 3cf0 h ARG 560 Ca 0.10 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3cf0 h ARG 560 Cb 0.59 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3cf0 h ARG 560 CO 0.04 -0.00 -0.03 1.49 -1.51 0.00 0.00 179.97 179.95 3cf0 h GLU 561 N -0.00 -0.04 -0.67 0.20 4.22 -1.46 0.18 114.58 117.01 3cf0 h GLU 561 Ca 0.20 0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.73 3cf0 h GLU 561 Cb 0.32 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.51 3cf0 h GLU 561 CO -0.44 -0.03 0.32 0.82 -2.18 0.00 0.00 179.01 177.51 3cf0 h ILE 562 N -0.04 0.85 -0.40 2.32 2.04 -1.04 0.35 117.51 121.60 3cf0 h ILE 562 Ca 0.03 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.62 3cf0 h ILE 562 Cb 0.08 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 3cf0 h ILE 562 CO -0.06 0.10 -0.02 -0.26 0.00 0.00 0.00 178.15 177.92 3cf0 h PHE 563 N 0.57 0.80 -0.05 1.37 0.04 -0.28 -2.47 116.94 116.91 3cf0 h PHE 563 Ca 0.33 -0.14 0.02 0.00 2.80 0.00 0.00 57.97 60.97 3cf0 h PHE 563 Cb 0.33 -0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.22 3cf0 h PHE 563 CO -0.12 0.81 -0.52 -0.44 -0.60 0.00 0.00 178.31 177.45 3cf0 h ASP 564 N 0.55 -1.62 -0.71 2.17 3.45 -0.17 0.11 116.42 120.20 3cf0 h ASP 564 Ca 0.11 0.18 0.20 0.00 0.43 0.00 0.00 57.03 57.96 3cf0 h ASP 564 Cb 0.51 0.62 -0.03 0.00 -0.56 0.00 0.00 39.33 39.87 3cf0 h ASP 564 CO 0.02 -0.49 0.59 0.50 -1.57 0.00 0.00 179.24 178.29 3cf0 h LYS 565 N -0.62 0.00 0.21 3.56 3.64 -0.87 0.19 116.57 122.68 3cf0 h LYS 565 Ca 0.02 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.07 3cf0 h LYS 565 Cb 0.68 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.52 3cf0 h LYS 565 CO -0.37 0.00 -1.52 0.00 -2.27 0.00 0.00 179.45 175.29 3cf0 h ALA 566 N 1.49 -0.01 -0.30 5.00 0.00 -0.85 -2.59 119.26 122.00 3cf0 h ALA 566 Ca 0.34 -0.97 -0.00 0.00 0.00 0.00 0.00 54.91 54.27 3cf0 h ALA 566 Cb 1.51 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.59 3cf0 h ALA 566 CO -0.00 0.80 0.17 -0.09 0.00 0.00 0.00 179.25 180.13 3cf0 h ARG 567 N 0.04 0.41 0.00 0.00 2.43 0.14 -1.63 114.38 115.77 3cf0 h ARG 567 Ca -0.29 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 58.79 3cf0 h ARG 567 Cb 2.06 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 31.52 3cf0 h ARG 567 CO 0.21 0.33 -0.26 0.37 -1.51 0.00 0.00 179.97 179.11 3cf0 h GLN 568 N 0.37 0.00 -0.63 0.20 -0.00 -0.84 -2.51 115.11 111.70 3cf0 h GLN 568 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 3cf0 h GLN 568 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.51 3cf0 h GLN 568 CO -0.02 0.26 0.00 0.00 0.00 0.00 0.00 178.83 179.07 3cf0 n ALA 569 N -2.32 2.84 -1.77 3.38 0.00 -0.68 -4.98 120.51 116.99 3cf0 n ALA 569 Ca -0.01 -1.25 -0.41 0.00 0.00 0.00 0.00 53.44 51.76 3cf0 n ALA 569 Cb 0.37 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.81 3cf0 n ALA 569 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cf0 n ALA 570 N 1.02 2.34 -2.06 0.00 0.00 -0.83 -4.21 120.51 116.77 3cf0 n ALA 570 Ca 0.21 0.35 -0.41 0.00 0.00 0.00 0.00 53.44 53.59 3cf0 n ALA 570 Cb 0.70 -2.42 -0.04 0.00 0.00 0.00 0.00 19.45 17.69 3cf0 n ALA 570 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3cf0 s PRO 571 N -1.81 4.60 -0.15 0.00 0.02 -1.26 -4.99 135.00 131.41 3cf0 s PRO 571 Ca 0.55 1.71 -0.09 0.00 0.02 0.00 0.00 61.00 63.19 3cf0 s PRO 571 Cb -0.48 -3.28 0.05 0.00 0.02 0.00 0.00 34.50 30.81 3cf0 s PRO 571 CO 0.61 0.08 0.37 0.00 -0.33 0.00 0.00 177.00 177.73 3cf0 s VAL 573 N 1.10 5.18 -0.23 0.00 -7.23 0.21 -0.42 120.40 119.02 3cf0 s VAL 573 Ca -0.07 0.09 -0.17 0.00 -1.81 0.00 0.00 61.98 60.01 3cf0 s VAL 573 Cb -0.07 -3.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.04 3cf0 s VAL 573 CO -0.09 -0.05 0.46 -0.22 -0.31 0.00 0.00 175.10 174.89 3cf0 s LEU 574 N 1.99 4.10 -0.27 1.32 2.96 -0.32 -1.06 118.68 127.40 3cf0 s LEU 574 Ca 0.11 0.52 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 3cf0 s LEU 574 Cb -0.16 -2.59 0.07 0.00 0.50 0.00 0.00 46.19 44.01 3cf0 s LEU 574 CO 0.11 -0.19 -0.02 0.12 -1.32 0.00 0.00 176.35 175.06 3cf0 s PHE 575 N 1.84 2.72 -0.61 5.38 5.36 0.13 -0.60 117.98 132.20 3cf0 s PHE 575 Ca 0.20 -2.10 -0.18 0.00 -0.96 0.00 0.00 56.93 53.89 3cf0 s PHE 575 Cb -0.15 -1.93 0.11 0.00 -0.34 0.00 0.00 43.02 40.71 3cf0 s PHE 575 CO 0.09 -0.84 0.69 -0.06 -1.46 0.00 0.00 175.22 173.64 3cf0 s PHE 576 N 1.28 3.08 0.49 10.12 0.40 0.24 -1.77 117.98 131.81 3cf0 s PHE 576 Ca -0.01 -1.08 -0.05 0.00 -0.60 0.00 0.00 56.93 55.19 3cf0 s PHE 576 Cb -0.19 -3.98 -0.03 0.00 0.51 0.00 0.00 43.02 39.33 3cf0 s PHE 576 CO -0.09 -1.24 0.79 0.34 0.70 0.00 0.00 175.22 175.72 3cf0 s ASP 577 N 3.56 6.13 -1.44 1.36 2.15 -0.50 -1.48 116.67 126.44 3cf0 s ASP 577 Ca 0.11 0.84 -0.10 0.00 0.43 0.00 0.00 52.55 53.84 3cf0 s ASP 577 Cb -0.24 -2.11 0.06 0.00 -0.30 0.00 0.00 42.92 40.33 3cf0 s ASP 577 CO 0.04 -0.66 0.71 -0.62 -0.17 0.00 0.00 175.17 174.47 3cf0 n GLU 578 N -2.29 -4.67 -0.38 4.34 1.02 -0.91 -3.80 120.64 113.94 3cf0 n GLU 578 Ca 0.01 0.65 0.37 0.00 -0.02 0.00 0.00 57.16 58.16 3cf0 n GLU 578 Cb 0.56 -5.47 0.58 0.00 -0.02 0.00 0.00 31.44 27.09 3cf0 n GLU 578 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3cf0 h LEU 579 N -1.51 0.00 -1.32 -4.62 3.38 -1.46 -1.36 115.31 108.43 3cf0 h LEU 579 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3cf0 h LEU 579 Cb 1.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.09 3cf0 h LEU 579 CO 0.59 0.00 -0.01 -0.90 0.09 0.00 0.00 178.44 178.20 3cf0 n ASP 580 N -3.50 2.06 0.20 -0.43 5.75 -1.26 -4.45 116.55 114.92 3cf0 n ASP 580 Ca 0.30 -1.67 0.06 0.00 -0.01 0.00 0.00 54.79 53.47 3cf0 n ASP 580 Cb 1.68 0.01 0.42 0.00 -1.03 0.00 0.00 41.12 42.20 3cf0 n ASP 580 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3cf0 h SER 581 N 3.22 0.00 -0.16 -1.12 4.64 -1.62 -0.76 113.55 117.74 3cf0 h SER 581 Ca 0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 3cf0 h SER 581 Cb 0.69 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3cf0 h SER 581 CO 0.00 0.33 -0.64 0.40 -0.87 0.00 0.00 176.83 176.05 3cf0 h ILE 582 N 0.00 1.30 0.21 0.95 2.04 -1.83 -2.55 117.51 117.62 3cf0 h ILE 582 Ca -0.00 -1.86 0.01 0.00 1.00 0.00 0.00 64.86 64.00 3cf0 h ILE 582 Cb 0.72 1.97 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 3cf0 h ILE 582 CO 0.04 0.59 -0.33 0.00 0.00 0.00 0.00 178.15 178.45 3cf0 h ALA 583 N 0.55 -0.62 -0.88 1.87 0.00 -1.57 0.15 119.26 118.77 3cf0 h ALA 583 Ca -0.03 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 54.97 3cf0 h ALA 583 Cb 1.27 0.51 -0.16 0.00 0.00 0.00 0.00 17.79 19.40 3cf0 h ALA 583 CO 0.13 -0.89 -0.24 0.87 0.00 0.00 0.00 179.25 179.12 3cf0 h LYS 584 N -0.60 -0.01 0.00 0.00 1.57 -1.29 -0.28 116.57 115.95 3cf0 h LYS 584 Ca 0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3cf0 h LYS 584 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 3cf0 h LYS 584 CO -0.14 -0.00 -0.29 0.00 -0.57 0.00 0.00 179.45 178.45 3cf0 h ALA 585 N 1.81 1.16 -0.55 3.86 0.00 -0.34 0.11 119.26 125.30 3cf0 h ALA 585 Ca 0.41 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3cf0 h ALA 585 Cb 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3cf0 h ALA 585 CO -0.91 0.36 0.00 2.89 0.00 0.00 0.00 179.25 181.60 3cf0 n ARG 586 N -3.66 2.36 0.00 0.00 1.85 -0.22 -4.89 116.66 112.10 3cf0 n ARG 586 Ca -0.01 -2.11 0.00 0.00 -1.00 0.00 0.00 57.85 54.73 3cf0 n ARG 586 Cb 0.41 -1.47 0.00 0.00 -1.05 0.00 0.00 32.46 30.35 3cf0 n ARG 586 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3cf0 n GLY 587 N 1.44 1.29 7.00 2.89 0.00 0.02 -3.21 105.19 114.62 3cf0 n GLY 587 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3cf0 n GLY 587 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf0 n GLY 588 N 0.00 2.88 0.36 -0.02 0.00 -0.17 -2.97 105.19 105.27 3cf0 n GLY 588 Ca 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 3cf0 n GLY 588 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3cf0 n ASN 589 N 7.62 -0.70 -0.06 1.61 3.02 -1.26 -2.98 115.26 122.51 3cf0 n ASN 589 Ca 0.00 1.59 -0.06 0.00 -0.03 0.00 0.00 54.58 56.08 3cf0 n ASN 589 Cb 0.00 -0.32 -0.05 0.00 -0.61 0.00 0.00 39.78 38.81 3cf0 n ASN 589 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 3cf0 h ILE 590 N 0.00 0.53 0.00 2.41 3.07 -1.98 -3.51 117.51 118.03 3cf0 h ILE 590 Ca 0.27 -1.45 0.00 0.00 1.55 0.00 0.00 64.86 65.23 3cf0 h ILE 590 Cb 0.49 1.05 0.00 0.00 -0.27 0.00 0.00 36.82 38.10 3cf0 h ILE 590 CO -0.89 0.18 0.00 0.61 -1.05 0.00 0.00 178.15 177.01 3cf0 n GLY 591 N 1.68 -1.84 0.00 0.16 0.00 -1.16 -5.02 105.19 99.02 3cf0 n GLY 591 Ca -0.07 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3cf0 n GLY 591 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cf0 n ASP 592 N 0.35 0.61 0.29 1.61 5.75 -1.20 -4.73 116.55 119.22 3cf0 n ASP 592 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 54.79 54.62 3cf0 n ASP 592 Cb 0.00 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.01 3cf0 n ASP 592 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3cf0 h GLY 593 N 0.00 -0.74 -0.19 6.12 0.00 -1.95 -3.47 103.07 102.84 3cf0 h GLY 593 Ca 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.52 3cf0 h GLY 593 CO 0.00 -0.27 0.08 0.61 0.00 0.00 0.00 176.54 176.95 3cf0 n GLY 594 N -0.96 -1.50 0.00 4.60 0.00 -1.26 -5.09 105.19 100.97 3cf0 n GLY 594 Ca -0.12 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.27 3cf0 n GLY 594 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cf0 n GLY 595 N 2.65 -0.04 0.20 -0.02 0.00 -1.26 -4.98 105.19 101.74 3cf0 n GLY 595 Ca 0.03 -1.78 0.07 0.00 0.00 0.00 0.00 46.02 44.35 3cf0 n GLY 595 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cf0 h ALA 596 N -1.50 1.00 -2.43 4.61 0.00 -1.96 -3.44 119.26 115.54 3cf0 h ALA 596 Ca 0.00 -0.30 -0.58 0.00 0.00 0.00 0.00 54.91 54.04 3cf0 h ALA 596 Cb 0.00 -0.05 0.12 0.00 0.00 0.00 0.00 17.79 17.86 3cf0 h ALA 596 CO 0.00 0.41 0.34 0.00 0.00 0.00 0.00 179.25 179.99 3cf0 n ALA 597 N -2.27 0.70 -3.08 0.00 0.00 -1.26 -4.61 120.51 109.98 3cf0 n ALA 597 Ca -0.00 0.31 -0.12 0.00 0.00 0.00 0.00 53.44 53.63 3cf0 n ALA 597 Cb 0.48 -2.16 -0.09 0.00 0.00 0.00 0.00 19.45 17.68 3cf0 n ALA 597 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3cf0 s ASP 598 N -0.52 -0.06 0.29 0.00 1.47 -1.26 -5.05 116.67 111.53 3cf0 s ASP 598 Ca 0.59 -0.14 0.03 0.00 1.18 0.00 0.00 52.55 54.21 3cf0 s ASP 598 Cb -0.58 0.28 0.68 0.00 -0.34 0.00 0.00 42.92 42.96 3cf0 s ASP 598 CO 0.59 -0.47 1.74 0.08 0.68 0.00 0.00 175.17 177.80 3cf0 h ARG 599 N 3.83 0.58 0.12 2.11 0.11 -1.98 -0.13 114.38 119.02 3cf0 h ARG 599 Ca -0.31 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 59.73 3cf0 h ARG 599 Cb 1.19 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 32.14 3cf0 h ARG 599 CO 0.43 0.38 -0.06 0.28 0.10 0.00 0.00 179.97 181.10 3cf0 h VAL 600 N 0.60 0.89 -0.98 0.08 2.07 -1.94 -1.90 116.25 115.05 3cf0 h VAL 600 Ca 0.54 -1.28 0.04 0.00 0.82 0.00 0.00 66.70 66.82 3cf0 h VAL 600 Cb 0.89 1.54 -0.06 0.00 -1.52 0.00 0.00 31.29 32.14 3cf0 h VAL 600 CO -0.42 0.25 0.64 0.40 0.02 0.00 0.00 177.57 178.46 3cf0 h ILE 601 N -0.89 1.16 -0.91 4.57 1.08 -1.94 -1.58 117.51 119.00 3cf0 h ILE 601 Ca -0.02 -0.42 0.03 0.00 -0.39 0.00 0.00 64.86 64.06 3cf0 h ILE 601 Cb 0.53 -0.18 -0.05 0.00 -3.07 0.00 0.00 36.82 34.05 3cf0 h ILE 601 CO 0.03 0.22 0.60 -1.13 -0.69 0.00 0.00 178.15 177.18 3cf0 h ASN 602 N 1.23 0.99 0.44 1.72 -1.24 -0.95 -0.63 115.58 117.14 3cf0 h ASN 602 Ca 0.39 -0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.37 3cf0 h ASN 602 Cb 0.02 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 38.85 3cf0 h ASN 602 CO -0.13 0.69 -0.21 -0.61 -1.29 0.00 0.00 177.43 175.88 3cf0 h GLN 603 N 1.15 -0.57 -0.98 6.67 5.75 -0.47 -1.66 115.11 124.99 3cf0 h GLN 603 Ca 0.36 0.04 0.34 0.00 -0.15 0.00 0.00 58.65 59.23 3cf0 h GLN 603 Cb -0.00 0.13 -0.17 0.00 1.07 0.00 0.00 27.48 28.50 3cf0 h GLN 603 CO -0.10 -0.35 0.33 0.82 -2.65 0.00 0.00 178.83 176.88 3cf0 h ILE 604 N -0.65 0.08 -0.16 2.39 2.04 -0.52 0.18 117.51 120.87 3cf0 h ILE 604 Ca -0.06 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 3cf0 h ILE 604 Cb 0.48 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 3cf0 h ILE 604 CO 0.10 0.01 -0.01 -0.07 0.00 0.00 0.00 178.15 178.18 3cf0 h LEU 605 N 0.06 0.28 0.27 1.44 3.38 -0.41 -2.66 115.31 117.67 3cf0 h LEU 605 Ca 0.72 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3cf0 h LEU 605 Cb 1.71 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.36 3cf0 h LEU 605 CO -0.79 0.53 -0.26 0.74 0.09 0.00 0.00 178.44 178.75 3cf0 h THR 606 N 0.02 0.45 0.00 0.22 2.02 -0.35 -0.42 112.91 114.85 3cf0 h THR 606 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.22 3cf0 h THR 606 Cb 0.39 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3cf0 h THR 606 CO 0.01 0.00 0.02 -0.62 0.37 0.00 0.00 175.52 175.30 3cf0 n GLU 607 N -5.38 0.00 -0.01 6.66 -0.58 -0.07 -0.29 120.64 120.97 3cf0 n GLU 607 Ca -0.09 0.07 -0.00 0.00 -0.42 0.00 0.00 57.16 56.72 3cf0 n GLU 607 Cb 0.29 -1.52 -0.03 0.00 -0.57 0.00 0.00 31.44 29.60 3cf0 n GLU 607 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 3cf0 n MET 608 N -0.97 2.05 -0.02 3.49 1.56 -0.31 -3.70 117.12 119.22 3cf0 n MET 608 Ca 0.00 -0.02 -0.13 0.00 -0.27 0.00 0.00 57.70 57.29 3cf0 n MET 608 Cb 0.02 -1.11 -0.10 0.00 2.15 0.00 0.00 33.22 34.18 3cf0 n MET 608 CO 0.00 0.00 0.00 -0.44 -0.73 0.00 0.00 175.97 174.80 3cf0 h ASP 609 N 0.00 -0.04 0.55 6.12 3.32 0.75 -3.26 116.42 123.86 3cf0 h ASP 609 Ca -0.07 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.38 3cf0 h ASP 609 Cb 0.84 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.40 3cf0 h ASP 609 CO 0.00 0.61 0.00 0.61 -1.72 0.00 0.00 179.24 178.75 3cf0 n GLY 610 N 0.75 -1.11 3.51 2.75 0.00 0.38 -4.63 105.19 106.84 3cf0 n GLY 610 Ca -0.09 0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 3cf0 n GLY 610 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3cf0 s MET 611 N -3.21 3.29 0.00 1.61 0.00 -1.23 -4.97 119.30 114.79 3cf0 s MET 611 Ca 0.04 -0.36 -0.37 0.00 0.00 0.00 0.00 55.69 55.01 3cf0 s MET 611 Cb 0.09 -4.09 -0.16 0.00 0.00 0.00 0.00 34.83 30.67 3cf0 s MET 611 CO 0.31 -1.57 1.51 0.45 0.00 0.00 0.00 175.02 175.73 3cf0 n SER 612 N 7.57 2.18 -0.51 1.11 2.88 -1.26 -4.80 113.62 120.79 3cf0 n SER 612 Ca 0.01 1.09 0.43 0.00 -1.33 0.00 0.00 58.87 59.07 3cf0 n SER 612 Cb 0.47 -1.23 0.76 0.00 -0.75 0.00 0.00 64.21 63.46 3cf0 n SER 612 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3cf0 h THR 613 N 3.96 0.20 -0.01 2.46 1.03 -1.93 -2.31 112.91 116.31 3cf0 h THR 613 Ca -0.47 -0.01 0.00 0.00 -0.01 0.00 0.00 66.41 65.92 3cf0 h THR 613 Cb 1.31 0.16 0.00 0.00 -1.07 0.00 0.00 68.15 68.56 3cf0 h THR 613 CO 0.85 0.01 -0.01 0.29 -0.01 0.00 0.00 175.52 176.64 3cf0 n LYS 614 N -4.17 1.52 -0.14 0.00 5.02 -1.26 -4.77 118.16 114.36 3cf0 n LYS 614 Ca 0.36 -0.79 -0.03 0.00 -2.02 0.00 0.00 58.31 55.82 3cf0 n LYS 614 Cb 1.59 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 35.14 3cf0 n LYS 614 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3cf0 n LYS 615 N -0.05 -0.62 -1.88 1.97 4.76 -0.87 -4.99 118.16 116.48 3cf0 n LYS 615 Ca 0.19 -0.17 -0.22 0.00 -2.87 0.00 0.00 58.31 55.24 3cf0 n LYS 615 Cb 0.32 -0.13 0.04 0.00 -1.84 0.00 0.00 35.03 33.41 3cf0 n LYS 615 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3cf0 n ASN 616 N -3.12 4.78 -4.44 4.39 2.85 -1.26 -5.00 115.26 113.46 3cf0 n ASN 616 Ca 0.01 -3.76 -0.36 0.00 -0.11 0.00 0.00 54.58 50.36 3cf0 n ASN 616 Cb 0.05 -0.38 -0.13 0.00 1.24 0.00 0.00 39.78 40.57 3cf0 n ASN 616 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3cf0 s VAL 617 N -4.50 4.20 -0.22 3.44 1.01 -1.26 -2.11 120.40 120.96 3cf0 s VAL 617 Ca 0.51 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 62.22 3cf0 s VAL 617 Cb 0.41 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3cf0 s VAL 617 CO 0.03 0.36 0.03 0.12 0.00 0.00 0.00 175.10 175.63 3cf0 s PHE 618 N 1.53 3.06 -0.15 5.22 5.36 0.44 -4.96 117.98 128.47 3cf0 s PHE 618 Ca 0.06 -0.48 -0.13 0.00 -0.96 0.00 0.00 56.93 55.41 3cf0 s PHE 618 Cb -0.15 -2.15 -0.05 0.00 -0.34 0.00 0.00 43.02 40.33 3cf0 s PHE 618 CO 0.03 -0.31 0.27 0.42 -1.46 0.00 0.00 175.22 174.17 3cf0 s ILE 619 N 1.29 5.31 -0.08 3.12 1.01 -1.02 -1.17 121.20 129.66 3cf0 s ILE 619 Ca 0.04 0.51 0.03 0.00 0.00 0.00 0.00 60.65 61.23 3cf0 s ILE 619 Cb -0.15 -3.61 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3cf0 s ILE 619 CO 0.02 0.41 -0.16 -0.63 0.00 0.00 0.00 174.94 174.58 3cf0 s ILE 620 N 0.31 1.43 0.13 2.92 1.01 0.23 -1.79 121.20 125.44 3cf0 s ILE 620 Ca 0.16 -0.65 0.05 0.00 0.00 0.00 0.00 60.65 60.21 3cf0 s ILE 620 Cb -0.13 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 3cf0 s ILE 620 CO 0.04 0.42 0.09 -0.83 0.00 0.00 0.00 174.94 174.65 3cf0 s GLY 621 N 0.60 1.85 -0.04 6.18 0.00 0.09 0.79 107.32 116.78 3cf0 s GLY 621 Ca -0.15 -1.15 -0.06 0.00 0.00 0.00 0.00 44.72 43.36 3cf0 s GLY 621 CO 0.05 -1.14 0.16 0.00 0.00 0.00 0.00 173.10 172.16 3cf0 s ALA 622 N -1.57 -0.39 -0.12 3.20 0.00 -0.55 -0.32 121.76 122.02 3cf0 s ALA 622 Ca 0.29 0.29 -0.29 0.00 0.00 0.00 0.00 51.96 52.25 3cf0 s ALA 622 Cb -0.11 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 22.92 3cf0 s ALA 622 CO 0.22 -0.12 0.70 -0.08 0.00 0.00 0.00 175.76 176.48 3cf0 s THR 623 N -0.36 0.00 -0.31 0.00 -1.32 -0.71 -1.56 115.64 111.38 3cf0 s THR 623 Ca -0.04 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.58 3cf0 s THR 623 Cb -0.03 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.35 3cf0 s THR 623 CO 0.01 0.00 1.30 -0.46 -2.21 0.00 0.00 174.62 173.25 3cf0 n ASN 624 N 1.42 3.21 -3.20 8.08 2.04 -1.26 -2.77 115.26 122.79 3cf0 n ASN 624 Ca -0.17 -2.72 -0.23 0.00 -0.44 0.00 0.00 54.58 51.02 3cf0 n ASN 624 Cb 0.56 -0.41 -0.06 0.00 -2.53 0.00 0.00 39.78 37.35 3cf0 n ASN 624 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 3cf0 n ARG 625 N -0.47 0.89 0.20 -3.83 5.12 -1.26 -4.83 116.66 112.48 3cf0 n ARG 625 Ca 0.16 -3.35 0.04 0.00 -1.93 0.00 0.00 57.85 52.77 3cf0 n ARG 625 Cb 0.69 -1.39 0.40 0.00 -1.16 0.00 0.00 32.46 30.99 3cf0 n ARG 625 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3cf0 h PRO 626 N 3.76 0.00 -1.24 5.56 0.13 -1.96 -1.26 132.00 136.99 3cf0 h PRO 626 Ca 0.08 0.00 0.36 0.00 -0.87 0.00 0.00 66.00 65.57 3cf0 h PRO 626 Cb 0.88 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.94 3cf0 h PRO 626 CO 0.49 0.34 0.86 0.38 -0.23 0.00 0.00 178.00 179.83 3cf0 h ASP 627 N 0.00 0.17 0.02 1.44 2.03 -1.99 -2.42 116.42 115.67 3cf0 h ASP 627 Ca -0.00 0.05 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 3cf0 h ASP 627 Cb 0.62 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 3cf0 h ASP 627 CO 0.04 -0.01 -1.09 2.30 -1.03 0.00 0.00 179.24 179.46 3cf0 n ILE 628 N -4.37 0.00 -1.58 4.15 -5.35 -0.48 -4.96 119.36 106.78 3cf0 n ILE 628 Ca 0.29 -0.05 -0.47 0.00 -0.27 0.00 0.00 62.75 62.25 3cf0 n ILE 628 Cb 1.25 0.87 -0.03 0.00 -1.74 0.00 0.00 39.64 39.98 3cf0 n ILE 628 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 3cf0 n ILE 629 N -1.58 1.36 -1.86 7.28 2.08 -0.91 -4.91 119.36 120.81 3cf0 n ILE 629 Ca 0.03 -0.34 -0.42 0.00 0.56 0.00 0.00 62.75 62.58 3cf0 n ILE 629 Cb 0.36 -0.88 -0.03 0.00 -0.75 0.00 0.00 39.64 38.33 3cf0 n ILE 629 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3cf0 s ASP 630 N -0.25 6.57 0.45 4.38 2.15 -1.26 -4.90 116.67 123.81 3cf0 s ASP 630 Ca 0.67 2.46 0.21 0.00 0.43 0.00 0.00 52.55 56.32 3cf0 s ASP 630 Cb -0.79 -2.54 1.19 0.00 -0.30 0.00 0.00 42.92 40.47 3cf0 s ASP 630 CO 0.55 -0.97 1.86 -0.65 -0.17 0.00 0.00 175.17 175.79 3cf0 h PRO 631 N 9.60 0.29 -0.58 4.34 0.11 -1.94 -1.39 132.00 142.44 3cf0 h PRO 631 Ca -0.44 -0.02 0.17 0.00 0.11 0.00 0.00 66.00 65.82 3cf0 h PRO 631 Cb 1.20 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3cf0 h PRO 631 CO 0.94 0.19 0.51 0.00 -0.21 0.00 0.00 178.00 179.44 3cf0 h ALA 632 N 1.60 2.40 0.00 -0.75 0.00 -1.99 0.19 119.26 120.71 3cf0 h ALA 632 Ca 0.47 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 3cf0 h ALA 632 Cb 1.33 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 3cf0 h ALA 632 CO -0.15 -0.81 -0.02 0.82 0.00 0.00 0.00 179.25 179.09 3cf0 h ILE 633 N 0.00 0.47 0.00 0.00 2.04 -1.64 -2.94 117.51 115.44 3cf0 h ILE 633 Ca 0.28 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.04 3cf0 h ILE 633 Cb 1.30 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3cf0 h ILE 633 CO -0.00 0.02 -1.16 0.18 0.00 0.00 0.00 178.15 177.19 3cf0 n LEU 634 N -3.72 0.57 -4.51 1.44 4.77 0.66 -1.10 117.00 115.11 3cf0 n LEU 634 Ca -0.03 -0.02 -0.38 0.00 -0.03 0.00 0.00 56.01 55.55 3cf0 n LEU 634 Cb 0.11 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.16 3cf0 n LEU 634 CO 0.27 0.03 0.21 0.54 -1.33 0.00 0.00 177.39 177.11 3cf0 n ARG 635 N -2.04 0.63 -1.48 3.23 1.74 -1.11 -4.37 116.66 113.27 3cf0 n ARG 635 Ca 0.01 0.25 -0.46 0.00 -0.77 0.00 0.00 57.85 56.88 3cf0 n ARG 635 Cb 0.46 -1.83 -0.02 0.00 -1.02 0.00 0.00 32.46 30.05 3cf0 n ARG 635 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 3cf0 n PRO 636 N -0.30 0.62 -0.85 5.56 -0.02 -1.26 -2.22 135.00 136.53 3cf0 n PRO 636 Ca 0.12 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3cf0 n PRO 636 Cb 0.47 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 3cf0 n PRO 636 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cf0 n GLY 637 N 1.65 0.62 0.00 -1.23 0.00 -1.26 -4.97 105.19 100.01 3cf0 n GLY 637 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3cf0 n GLY 637 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf0 n ARG 638 N -2.73 0.00 -3.03 1.61 1.74 -0.94 -4.80 116.66 108.52 3cf0 n ARG 638 Ca 0.00 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 3cf0 n ARG 638 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 3cf0 n ARG 638 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3cf0 s LEU 639 N 0.00 5.40 0.10 0.55 1.43 -0.26 -3.51 118.68 122.39 3cf0 s LEU 639 Ca 0.00 -2.59 -0.07 0.00 -1.03 0.00 0.00 54.13 50.44 3cf0 s LEU 639 Cb 0.00 -2.36 -0.18 0.00 0.03 0.00 0.00 46.19 43.68 3cf0 s LEU 639 CO 0.00 -0.82 1.22 0.44 0.23 0.00 0.00 176.35 177.42 3cf0 h ASP 640 N 7.94 0.60 -2.63 2.29 5.19 -1.76 -3.38 116.42 124.67 3cf0 h ASP 640 Ca 0.21 -0.53 -0.66 0.00 -0.62 0.00 0.00 57.03 55.43 3cf0 h ASP 640 Cb 0.96 -0.19 -0.16 0.00 0.18 0.00 0.00 39.33 40.13 3cf0 h ASP 640 CO 1.10 1.35 0.55 -1.10 -3.12 0.00 0.00 179.24 178.02 3cf0 s GLN 641 N -3.07 3.23 0.21 3.56 -1.52 -1.22 -4.94 119.66 115.90 3cf0 s GLN 641 Ca -0.06 -1.16 -0.31 0.00 -1.95 0.00 0.00 55.36 51.88 3cf0 s GLN 641 Cb 0.08 -4.42 -0.10 0.00 -0.22 0.00 0.00 33.01 28.35 3cf0 s GLN 641 CO 0.89 -1.76 1.48 -0.51 -0.25 0.00 0.00 175.29 175.13 3cf0 s LEU 642 N 3.48 4.38 -0.05 2.90 2.01 -1.26 -0.76 118.68 129.38 3cf0 s LEU 642 Ca 0.23 2.62 -0.01 0.00 0.01 0.00 0.00 54.13 56.99 3cf0 s LEU 642 Cb -0.15 -3.61 0.03 0.00 0.01 0.00 0.00 46.19 42.47 3cf0 s LEU 642 CO 0.04 -0.74 0.01 -0.63 1.01 0.00 0.00 176.35 176.04 3cf0 s ILE 643 N 0.46 0.24 -0.25 -0.59 1.01 0.25 -4.92 121.20 117.40 3cf0 s ILE 643 Ca 0.63 0.13 -0.19 0.00 0.00 0.00 0.00 60.65 61.22 3cf0 s ILE 643 Cb -0.42 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 41.65 3cf0 s ILE 643 CO 0.38 0.20 0.56 -0.47 0.00 0.00 0.00 174.94 175.62 3cf0 s TYR 644 N 1.52 3.29 -0.48 3.97 5.04 -1.26 -1.45 117.35 127.98 3cf0 s TYR 644 Ca -0.02 0.74 -0.13 0.00 -2.44 0.00 0.00 57.07 55.21 3cf0 s TYR 644 Cb -0.13 -2.76 0.11 0.00 0.35 0.00 0.00 41.96 39.52 3cf0 s TYR 644 CO -0.03 -0.27 0.39 0.42 -1.34 0.00 0.00 175.55 174.72 3cf0 s ILE 645 N 2.29 4.76 0.81 3.14 1.09 0.09 -4.96 121.20 128.42 3cf0 s ILE 645 Ca 0.24 -1.47 -0.11 0.00 -1.10 0.00 0.00 60.65 58.21 3cf0 s ILE 645 Cb -0.16 -4.00 0.10 0.00 -1.06 0.00 0.00 42.46 37.35 3cf0 s ILE 645 CO 0.09 -0.71 1.15 -2.16 -0.10 0.00 0.00 174.94 173.21 3cf0 s PRO 646 N 1.51 1.71 0.64 2.79 0.04 -1.26 -3.90 135.00 136.53 3cf0 s PRO 646 Ca 0.04 -0.19 -0.18 0.00 0.04 0.00 0.00 61.00 60.71 3cf0 s PRO 646 Cb -0.26 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 3cf0 s PRO 646 CO 0.03 -1.67 1.10 1.28 0.04 0.00 0.00 177.00 177.77 3cf0 n LEU 647 N -3.28 4.70 -4.75 -3.56 4.32 -1.26 -4.92 117.00 108.25 3cf0 n LEU 647 Ca 0.10 0.79 -0.41 0.00 -0.02 0.00 0.00 56.01 56.48 3cf0 n LEU 647 Cb 0.60 -1.46 -0.03 0.00 -1.62 0.00 0.00 43.42 40.91 3cf0 n LEU 647 CO 0.52 -1.53 0.90 -2.16 -1.22 0.00 0.00 177.39 173.90 3cf0 s PRO 648 N -3.10 4.48 0.88 3.23 0.04 -1.26 -5.03 135.00 134.25 3cf0 s PRO 648 Ca 0.79 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 63.70 3cf0 s PRO 648 Cb -0.39 -3.18 0.18 0.00 0.04 0.00 0.00 34.50 31.15 3cf0 s PRO 648 CO 0.44 -0.06 1.22 0.16 0.04 0.00 0.00 177.00 178.80 3cf0 s ASP 649 N -0.27 3.50 0.04 6.66 -4.77 -1.26 -4.73 116.67 115.84 3cf0 s ASP 649 Ca 0.50 0.03 -0.08 0.00 -3.30 0.00 0.00 52.55 49.70 3cf0 s ASP 649 Cb -0.35 -0.17 -0.02 0.00 -1.09 0.00 0.00 42.92 41.30 3cf0 s ASP 649 CO 0.42 -2.46 0.65 -0.62 0.70 0.00 0.00 175.17 173.86 3cf0 n GLU 650 N -3.46 -0.12 -0.01 2.11 4.71 -1.26 -0.90 120.64 121.71 3cf0 n GLU 650 Ca 0.15 0.64 -0.12 0.00 -0.01 0.00 0.00 57.16 57.82 3cf0 n GLU 650 Cb 0.60 -0.95 -0.08 0.00 -1.01 0.00 0.00 31.44 30.00 3cf0 n GLU 650 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 3cf0 h LYS 651 N 0.00 0.10 -0.65 3.49 1.57 -1.94 -3.20 116.57 115.93 3cf0 h LYS 651 Ca 0.04 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.92 3cf0 h LYS 651 Cb 0.11 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.32 3cf0 h LYS 651 CO -0.25 0.37 0.18 0.77 -0.57 0.00 0.00 179.45 179.95 3cf0 h SER 652 N -0.19 0.08 -0.92 0.86 0.02 -1.72 -0.58 113.55 111.10 3cf0 h SER 652 Ca 0.02 0.11 0.12 0.00 -0.84 0.00 0.00 61.79 61.20 3cf0 h SER 652 Cb 0.33 0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 3cf0 h SER 652 CO 0.00 0.03 0.59 0.03 -1.14 0.00 0.00 176.83 176.34 3cf0 h ARG 653 N 0.31 0.81 0.49 3.45 3.08 -1.01 0.36 114.38 121.87 3cf0 h ARG 653 Ca 0.35 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.33 3cf0 h ARG 653 Cb 0.53 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.40 3cf0 h ARG 653 CO -0.41 0.53 -0.27 0.28 -1.07 0.00 0.00 179.97 179.03 3cf0 h VAL 654 N 0.83 0.45 -0.61 2.04 2.07 -1.18 -1.18 116.25 118.68 3cf0 h VAL 654 Ca 0.45 0.00 0.11 0.00 0.82 0.00 0.00 66.70 68.07 3cf0 h VAL 654 Cb 0.56 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 3cf0 h VAL 654 CO -0.21 0.00 0.18 0.00 0.02 0.00 0.00 177.57 177.56 3cf0 h ALA 655 N -0.22 0.76 -0.76 1.67 0.00 -0.52 0.50 119.26 120.70 3cf0 h ALA 655 Ca -0.06 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3cf0 h ALA 655 Cb 0.56 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 3cf0 h ALA 655 CO 0.09 -0.26 0.45 0.82 0.00 0.00 0.00 179.25 180.35 3cf0 h ILE 656 N 0.33 1.21 -0.35 0.00 2.04 -0.29 0.27 117.51 120.72 3cf0 h ILE 656 Ca 0.32 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 3cf0 h ILE 656 Cb 0.44 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3cf0 h ILE 656 CO -0.36 0.23 -0.03 -0.07 0.00 0.00 0.00 178.15 177.92 3cf0 h LEU 657 N 1.04 0.64 -0.17 1.44 3.38 0.33 -1.57 115.31 120.41 3cf0 h LEU 657 Ca 0.27 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3cf0 h LEU 657 Cb -0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3cf0 h LEU 657 CO -0.05 0.81 0.10 0.11 0.09 0.00 0.00 178.44 179.50 3cf0 h LYS 658 N 0.45 0.21 -0.49 1.13 1.57 -0.70 -1.26 116.57 117.48 3cf0 h LYS 658 Ca 0.10 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.91 3cf0 h LYS 658 Cb 0.50 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 3cf0 h LYS 658 CO 0.02 0.14 0.24 0.00 -0.57 0.00 0.00 179.45 179.28 3cf0 h ALA 659 N 1.07 0.62 0.00 3.86 0.00 -0.42 0.13 119.26 124.53 3cf0 h ALA 659 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3cf0 h ALA 659 Cb -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3cf0 h ALA 659 CO -0.03 -0.11 0.00 -0.91 0.00 0.00 0.00 179.25 178.21 3cf0 h ASN 660 N 0.48 0.00 -0.06 0.00 4.21 -0.98 -2.88 115.58 116.34 3cf0 h ASN 660 Ca 0.21 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.72 3cf0 h ASN 660 Cb 0.12 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.32 3cf0 h ASN 660 CO -0.15 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.17 3cf0 n LEU 661 N -2.71 1.82 -0.31 1.61 4.77 -0.47 -4.67 117.00 117.03 3cf0 n LEU 661 Ca 0.01 -1.23 0.14 0.00 -0.03 0.00 0.00 56.01 54.90 3cf0 n LEU 661 Cb 0.23 -0.03 0.30 0.00 -2.33 0.00 0.00 43.42 41.59 3cf0 n LEU 661 CO 0.22 0.40 0.88 0.03 -1.33 0.00 0.00 177.39 177.59 3cf0 h ARG 662 N 1.37 0.09 -1.47 3.23 3.08 -0.56 -0.48 114.38 119.64 3cf0 h ARG 662 Ca 0.00 -0.01 -0.71 0.00 0.07 0.00 0.00 59.98 59.33 3cf0 h ARG 662 Cb 0.38 -0.02 -0.29 0.00 0.08 0.00 0.00 29.97 30.12 3cf0 h ARG 662 CO 0.00 0.06 0.85 1.63 -1.07 0.00 0.00 179.97 181.44 3cf0 n LYS 663 N -5.36 2.78 -3.89 0.04 5.02 -1.26 -4.97 118.16 110.52 3cf0 n LYS 663 Ca 0.23 -3.47 -0.11 0.00 -2.02 0.00 0.00 58.31 52.94 3cf0 n LYS 663 Cb 0.74 -2.28 -0.10 0.00 -0.02 0.00 0.00 35.03 33.37 3cf0 n LYS 663 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3cf0 s SER 664 N -1.61 0.05 -1.30 4.39 0.01 -0.19 -5.09 113.70 109.95 3cf0 s SER 664 Ca 0.58 -0.21 -0.17 0.00 1.31 0.00 0.00 55.95 57.46 3cf0 s SER 664 Cb 0.47 0.19 0.08 0.00 0.21 0.00 0.00 66.02 66.97 3cf0 s SER 664 CO -0.20 -0.33 1.75 -2.65 0.41 0.00 0.00 173.24 172.22 3cf0 n PRO 665 N 1.63 3.19 -2.46 12.44 -0.02 -1.26 -4.96 135.00 143.55 3cf0 n PRO 665 Ca -0.22 -3.28 -0.43 0.00 -2.02 0.00 0.00 63.50 57.55 3cf0 n PRO 665 Cb 0.56 -3.44 -0.02 0.00 -0.02 0.00 0.00 33.50 30.57 3cf0 n PRO 665 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3cf0 s VAL 666 N 3.92 4.34 0.34 -1.45 -7.23 -1.26 -0.21 120.40 118.85 3cf0 s VAL 666 Ca 0.53 1.62 -0.28 0.00 -1.81 0.00 0.00 61.98 62.03 3cf0 s VAL 666 Cb 0.04 -4.06 -0.12 0.00 0.56 0.00 0.00 36.38 32.80 3cf0 s VAL 666 CO 0.06 -0.16 1.23 0.00 -0.31 0.00 0.00 175.10 175.92 3cf0 n ALA 667 N 6.62 0.99 -0.21 1.32 0.00 0.06 -4.89 120.51 124.40 3cf0 n ALA 667 Ca 0.14 0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.88 3cf0 n ALA 667 Cb 0.45 -2.21 0.05 0.00 0.00 0.00 0.00 19.45 17.74 3cf0 n ALA 667 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3cf0 h LYS 668 N 2.39 0.75 -0.83 0.00 1.57 -1.95 -2.98 116.57 115.53 3cf0 h LYS 668 Ca -0.45 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 3cf0 h LYS 668 Cb 1.30 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.40 3cf0 h LYS 668 CO 0.62 0.50 0.48 0.38 -0.57 0.00 0.00 179.45 180.85 3cf0 h ASP 669 N 0.77 1.01 -1.10 0.86 2.03 -1.98 -3.45 116.42 114.56 3cf0 h ASP 669 Ca 0.24 -0.08 -0.79 0.00 -0.73 0.00 0.00 57.03 55.67 3cf0 h ASP 669 Cb -0.03 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.22 3cf0 h ASP 669 CO -0.08 0.79 0.93 0.52 -1.03 0.00 0.00 179.24 180.38 3cf0 n VAL 670 N -4.43 0.15 -3.44 4.15 0.31 -1.13 -4.91 118.33 109.03 3cf0 n VAL 670 Ca 0.08 -0.05 -0.43 0.00 -0.01 0.00 0.00 64.34 63.93 3cf0 n VAL 670 Cb 0.07 -0.91 -0.08 0.00 -0.91 0.00 0.00 33.84 32.00 3cf0 n VAL 670 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3cf0 s ASP 671 N 4.04 6.06 0.07 4.52 -1.08 -1.26 -4.92 116.67 124.09 3cf0 s ASP 671 Ca 1.05 -1.28 -0.09 0.00 -0.52 0.00 0.00 52.55 51.71 3cf0 s ASP 671 Cb -1.26 -2.15 -0.27 0.00 -1.46 0.00 0.00 42.92 37.78 3cf0 s ASP 671 CO 0.70 -0.59 1.12 -0.07 0.52 0.00 0.00 175.17 176.85 3cf0 h LEU 672 N 8.68 0.63 -2.04 -1.34 3.38 -1.98 -3.00 115.31 119.64 3cf0 h LEU 672 Ca -0.27 -0.63 0.12 0.00 0.09 0.00 0.00 57.88 57.18 3cf0 h LEU 672 Cb 1.11 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3cf0 h LEU 672 CO 0.83 1.47 0.38 -0.33 0.09 0.00 0.00 178.44 180.89 3cf0 h GLU 673 N 0.15 0.00 0.01 1.13 3.07 -1.95 0.44 114.58 117.44 3cf0 h GLU 673 Ca -0.17 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.62 3cf0 h GLU 673 Cb 1.95 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.86 3cf0 h GLU 673 CO 0.22 0.00 -0.37 0.35 -1.40 0.00 0.00 179.01 177.82 3cf0 h PHE 674 N 0.00 0.05 -1.01 4.33 3.57 -1.98 -3.04 116.94 118.87 3cf0 h PHE 674 Ca 0.19 -0.04 0.21 0.00 3.53 0.00 0.00 57.97 61.86 3cf0 h PHE 674 Cb 0.95 -0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.58 3cf0 h PHE 674 CO 0.00 1.14 0.61 -0.07 -2.23 0.00 0.00 178.31 177.76 3cf0 h LEU 675 N -0.93 0.75 -0.98 0.59 3.38 -0.91 0.73 115.31 117.94 3cf0 h LEU 675 Ca -0.09 0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3cf0 h LEU 675 Cb 1.13 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 3cf0 h LEU 675 CO -0.03 0.22 0.63 0.00 0.09 0.00 0.00 178.44 179.35 3cf0 h ALA 676 N 1.68 1.24 0.00 1.53 0.00 -0.27 -1.70 119.26 121.74 3cf0 h ALA 676 Ca 0.60 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.39 3cf0 h ALA 676 Cb 1.01 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3cf0 h ALA 676 CO -0.41 0.65 -0.24 0.87 0.00 0.00 0.00 179.25 180.11 3cf0 h LYS 677 N 1.33 0.00 0.00 0.00 1.79 -0.79 -3.20 116.57 115.70 3cf0 h LYS 677 Ca 0.36 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.83 3cf0 h LYS 677 Cb -0.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.52 3cf0 h LYS 677 CO -0.07 0.24 0.00 -1.33 -1.08 0.00 0.00 179.45 177.21 3cf0 n MET 678 N -3.69 0.05 -5.08 3.15 2.81 -0.42 -4.87 117.12 109.07 3cf0 n MET 678 Ca -0.01 0.09 -0.29 0.00 -1.81 0.00 0.00 57.70 55.67 3cf0 n MET 678 Cb 0.36 -1.56 -0.16 0.00 -0.71 0.00 0.00 33.22 31.14 3cf0 n MET 678 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 3cf0 s THR 679 N -3.03 1.77 0.00 2.03 -4.23 -1.17 -5.09 115.64 105.93 3cf0 s THR 679 Ca 0.12 -0.92 0.00 0.00 -1.18 0.00 0.00 61.69 59.71 3cf0 s THR 679 Cb 0.16 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.50 3cf0 s THR 679 CO 0.50 0.50 0.00 0.59 -0.54 0.00 0.00 174.62 175.67 3cf0 n ASN 680 N 2.97 0.00 -0.30 3.99 3.02 -1.26 -4.73 115.26 118.95 3cf0 n ASN 680 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 3cf0 n ASN 680 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 3cf0 n ASN 680 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3cf0 n GLY 681 N 3.95 0.00 3.67 7.41 0.00 -1.26 -4.48 105.19 114.49 3cf0 n GLY 681 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3cf0 n GLY 681 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3cf0 s PHE 682 N -0.95 2.98 0.49 1.61 0.40 -1.26 -3.92 117.98 117.33 3cf0 s PHE 682 Ca 0.00 1.08 -0.01 0.00 -0.60 0.00 0.00 56.93 57.40 3cf0 s PHE 682 Cb 0.00 -3.48 0.00 0.00 0.51 0.00 0.00 43.02 40.05 3cf0 s PHE 682 CO 0.00 -1.59 0.73 -1.54 0.70 0.00 0.00 175.22 173.52 3cf0 s SER 683 N 1.78 5.70 0.26 1.36 1.04 -1.26 -4.22 113.70 118.36 3cf0 s SER 683 Ca 0.56 0.34 -0.03 0.00 0.48 0.00 0.00 55.95 57.30 3cf0 s SER 683 Cb -0.23 -1.48 0.54 0.00 0.10 0.00 0.00 66.02 64.94 3cf0 s SER 683 CO 0.18 -0.84 1.68 1.23 0.98 0.00 0.00 173.24 176.48 3cf0 h GLY 684 N 0.23 1.15 0.51 7.32 0.00 -0.97 -0.31 103.07 111.00 3cf0 h GLY 684 Ca -0.45 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 46.85 3cf0 h GLY 684 CO 0.57 -0.23 -0.18 0.00 0.00 0.00 0.00 176.54 176.70 3cf0 h ALA 685 N 1.65 -0.19 -0.98 3.60 0.00 -1.44 0.99 119.26 122.89 3cf0 h ALA 685 Ca 0.46 0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.57 3cf0 h ALA 685 Cb 0.82 0.34 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 3cf0 h ALA 685 CO -0.54 -0.66 0.61 -0.44 0.00 0.00 0.00 179.25 178.22 3cf0 h ASP 686 N -0.27 0.73 -0.01 0.00 3.32 -1.36 -0.21 116.42 118.61 3cf0 h ASP 686 Ca 0.07 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 3cf0 h ASP 686 Cb 0.37 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3cf0 h ASP 686 CO -0.20 0.29 -0.03 -0.07 -1.72 0.00 0.00 179.24 177.51 3cf0 h LEU 687 N 0.73 0.05 -0.81 1.55 3.38 -0.23 -2.73 115.31 117.24 3cf0 h LEU 687 Ca 0.54 -0.58 0.19 0.00 0.09 0.00 0.00 57.88 58.12 3cf0 h LEU 687 Cb 0.89 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.48 3cf0 h LEU 687 CO -0.32 0.62 0.03 0.74 0.09 0.00 0.00 178.44 179.60 3cf0 h THR 688 N -0.53 0.29 -0.96 0.22 2.02 -0.43 0.28 112.91 113.80 3cf0 h THR 688 Ca 0.00 -0.03 0.10 0.00 0.77 0.00 0.00 66.41 67.24 3cf0 h THR 688 Cb 0.62 0.18 -0.08 0.00 -1.74 0.00 0.00 68.15 67.13 3cf0 h THR 688 CO 0.01 0.02 0.60 -0.08 0.37 0.00 0.00 175.52 176.43 3cf0 h GLU 689 N 0.10 0.96 0.88 6.66 4.57 -0.81 -1.61 114.58 125.34 3cf0 h GLU 689 Ca 0.45 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.53 3cf0 h GLU 689 Cb 0.83 -0.22 0.01 0.00 -0.16 0.00 0.00 28.75 29.21 3cf0 h GLU 689 CO -0.71 0.64 -0.43 0.82 -1.18 0.00 0.00 179.01 178.15 3cf0 h ILE 690 N 0.99 0.12 -0.68 2.32 2.04 -0.66 -2.08 117.51 119.56 3cf0 h ILE 690 Ca 0.45 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.46 3cf0 h ILE 690 Cb 0.37 0.12 -0.13 0.00 -0.74 0.00 0.00 36.82 36.45 3cf0 h ILE 690 CO -0.24 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 177.81 3cf0 h GLN 692 N 0.04 0.27 -0.93 0.00 4.20 -1.17 0.49 115.11 118.00 3cf0 h GLN 692 Ca 0.34 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.04 3cf0 h GLN 692 Cb 0.55 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.23 3cf0 h GLN 692 CO -0.67 0.18 0.60 0.00 -0.67 0.00 0.00 178.83 178.27 3cf0 h ARG 693 N 0.28 1.24 0.15 1.46 3.08 -0.27 0.17 114.38 120.49 3cf0 h ARG 693 Ca 0.23 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.20 3cf0 h ARG 693 Cb 0.27 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3cf0 h ARG 693 CO -0.27 0.84 -0.19 0.00 -1.07 0.00 0.00 179.97 179.28 3cf0 h ALA 694 N 1.33 -0.36 0.15 0.04 0.00 0.30 0.23 119.26 120.94 3cf0 h ALA 694 Ca 0.34 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3cf0 h ALA 694 Cb -0.11 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3cf0 h ALA 694 CO -0.07 -0.73 -0.51 0.00 0.00 0.00 0.00 179.25 177.93 3cf0 h LYS 696 N -0.75 0.22 -0.21 0.00 1.57 -0.56 0.39 116.57 117.23 3cf0 h LYS 696 Ca -0.01 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 3cf0 h LYS 696 Cb 0.75 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 3cf0 h LYS 696 CO -0.26 0.15 -0.25 -0.07 -0.57 0.00 0.00 179.45 178.44 3cf0 h LEU 697 N 0.23 0.58 -0.26 2.94 3.38 0.21 -1.82 115.31 120.57 3cf0 h LEU 697 Ca 0.59 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3cf0 h LEU 697 Cb 1.83 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 3cf0 h LEU 697 CO -0.19 0.96 0.10 0.00 0.09 0.00 0.00 178.44 179.40 3cf0 h ALA 698 N 0.64 0.34 0.30 1.53 0.00 0.56 0.28 119.26 122.91 3cf0 h ALA 698 Ca 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3cf0 h ALA 698 Cb 0.81 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3cf0 h ALA 698 CO 0.06 -0.05 -0.20 0.82 0.00 0.00 0.00 179.25 179.88 3cf0 h ILE 699 N 0.27 0.58 -0.51 0.00 2.04 -0.43 0.70 117.51 120.17 3cf0 h ILE 699 Ca 0.09 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.00 3cf0 h ILE 699 Cb 0.19 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3cf0 h ILE 699 CO -0.01 0.00 0.34 -0.09 0.00 0.00 0.00 178.15 178.40 3cf0 h ARG 700 N -0.48 0.49 0.00 2.37 2.43 -1.27 0.12 114.38 118.03 3cf0 h ARG 700 Ca -0.03 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.96 3cf0 h ARG 700 Cb 0.41 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 3cf0 h ARG 700 CO 0.02 0.32 -0.73 1.49 -1.51 0.00 0.00 179.97 179.56 3cf0 h GLU 701 N 0.50 0.00 0.03 0.20 4.22 0.09 -2.49 114.58 117.12 3cf0 h GLU 701 Ca 0.22 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.66 3cf0 h GLU 701 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3cf0 h GLU 701 CO -0.06 0.73 -0.01 1.03 -2.18 0.00 0.00 179.01 178.52 3cf0 h SER 702 N 0.00 -0.03 -1.28 1.04 0.87 0.15 -3.25 113.55 111.05 3cf0 h SER 702 Ca -0.01 0.00 0.37 0.00 -1.23 0.00 0.00 61.79 60.93 3cf0 h SER 702 Cb 1.31 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 63.23 3cf0 h SER 702 CO 0.09 0.03 0.96 0.40 -0.53 0.00 0.00 176.83 177.79 3cf0 h ILE 703 N -0.14 0.30 0.52 2.23 2.04 -0.96 0.15 117.51 121.66 3cf0 h ILE 703 Ca -0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 3cf0 h ILE 703 Cb 0.03 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.42 3cf0 h ILE 703 CO 0.01 0.00 -0.36 -0.08 0.00 0.00 0.00 178.15 177.72 3cf0 h GLU 704 N 0.00 -0.82 -0.89 2.37 4.81 -1.56 -3.24 114.58 115.25 3cf0 h GLU 704 Ca 0.61 0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.95 3cf0 h GLU 704 Cb 2.53 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 32.04 3cf0 h GLU 704 CO -0.01 -0.55 0.57 0.66 -0.73 0.00 0.00 179.01 178.96 3cf0 h SER 705 N -0.85 0.92 0.81 1.04 4.64 -0.98 -3.16 113.55 115.96 3cf0 h SER 705 Ca -0.06 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 3cf0 h SER 705 Cb 0.71 -0.19 0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3cf0 h SER 705 CO 0.03 0.60 -0.39 -0.33 -0.87 0.00 0.00 176.83 175.88 3cf0 h GLU 706 N 1.06 -1.05 0.00 4.77 5.08 -1.65 -3.53 114.58 119.27 3cf0 h GLU 706 Ca 0.38 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 3cf0 h GLU 706 Cb 0.10 0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3cf0 h GLU 706 CO -0.15 -0.70 0.00 -0.89 -1.00 0.00 0.00 179.01 176.27 3cf0 n ILE 707 N -5.38 0.00 0.00 3.13 2.08 -1.20 -5.17 119.36 112.82 3cf0 n ILE 707 Ca -0.13 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.18 3cf0 n ILE 707 Cb 0.43 -0.47 0.00 0.00 -0.75 0.00 0.00 39.64 38.85 3cf0 n ILE 707 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 3cf0 n VAL 728 N -0.89 0.00 -3.27 1.39 0.31 -1.26 -5.03 118.33 109.57 3cf0 n VAL 728 Ca 0.16 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 64.03 3cf0 n VAL 728 Cb 0.07 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.97 3cf0 n VAL 728 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3cf0 s PRO 729 N -0.59 3.33 -0.08 5.55 0.04 -1.26 -4.95 135.00 137.03 3cf0 s PRO 729 Ca 0.00 -2.03 -0.03 0.00 0.04 0.00 0.00 61.00 58.98 3cf0 s PRO 729 Cb 0.00 -4.40 0.05 0.00 0.04 0.00 0.00 34.50 30.19 3cf0 s PRO 729 CO 0.00 -1.37 0.16 -1.21 0.04 0.00 0.00 177.00 174.63 3cf0 s GLU 730 N 1.12 0.05 -0.24 4.56 8.01 -1.26 -4.93 118.70 126.00 3cf0 s GLU 730 Ca 0.13 0.54 -0.29 0.00 0.01 0.00 0.00 54.97 55.36 3cf0 s GLU 730 Cb -0.18 -0.25 -0.03 0.00 -4.31 0.00 0.00 34.13 29.36 3cf0 s GLU 730 CO -0.03 -0.28 1.71 -1.50 0.01 0.00 0.00 175.26 175.17 3cf0 s ILE 731 N 2.10 3.57 0.42 -1.63 -1.16 0.71 -4.71 121.20 120.49 3cf0 s ILE 731 Ca 0.01 0.63 0.06 0.00 -0.51 0.00 0.00 60.65 60.83 3cf0 s ILE 731 Cb -0.12 -3.63 -0.07 0.00 0.61 0.00 0.00 42.46 39.26 3cf0 s ILE 731 CO -0.06 -0.30 0.01 0.00 -2.81 0.00 0.00 174.94 171.78 3cf0 s ARG 732 N 5.01 1.97 0.04 3.50 1.70 -1.26 -0.76 118.95 129.15 3cf0 s ARG 732 Ca 0.76 -2.14 -0.07 0.00 -0.47 0.00 0.00 55.73 53.80 3cf0 s ARG 732 Cb -0.25 -1.55 -0.02 0.00 -0.57 0.00 0.00 34.95 32.56 3cf0 s ARG 732 CO 0.31 -0.12 0.80 -2.13 -1.08 0.00 0.00 175.30 173.09 3cf0 n ARG 733 N -1.00 -0.10 0.32 3.89 0.63 -1.26 -0.26 116.66 118.88 3cf0 n ARG 733 Ca -0.07 0.80 0.21 0.00 -0.92 0.00 0.00 57.85 57.87 3cf0 n ARG 733 Cb 0.67 -1.18 1.11 0.00 0.45 0.00 0.00 32.46 33.50 3cf0 n ARG 733 CO 0.00 0.00 0.00 0.38 -2.51 0.00 0.00 177.63 175.50 3cf0 h ASP 734 N 0.00 0.00 0.01 6.15 2.03 -1.98 0.51 116.42 123.14 3cf0 h ASP 734 Ca 0.04 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.34 3cf0 h ASP 734 Cb 0.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.60 3cf0 h ASP 734 CO -0.22 0.00 -0.00 0.45 -1.03 0.00 0.00 179.24 178.44 3cf0 h HIS 735 N 0.00 -0.01 -0.73 4.15 3.86 -1.00 -1.46 115.15 119.96 3cf0 h HIS 735 Ca 0.00 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.23 3cf0 h HIS 735 Cb 0.08 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.51 3cf0 h HIS 735 CO 0.00 0.55 0.47 0.74 0.86 0.00 0.00 177.93 180.55 3cf0 h PHE 736 N -0.57 0.89 0.00 2.45 0.04 -0.98 0.08 116.94 118.85 3cf0 h PHE 736 Ca -0.00 0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.82 3cf0 h PHE 736 Cb 0.56 -0.29 -0.05 0.00 2.20 0.00 0.00 35.95 38.37 3cf0 h PHE 736 CO 0.12 0.53 -0.28 0.93 -0.60 0.00 0.00 178.31 179.01 3cf0 h GLU 737 N 0.94 -0.41 0.00 1.51 5.08 -0.97 -0.02 114.58 120.71 3cf0 h GLU 737 Ca 0.29 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 3cf0 h GLU 737 Cb -0.03 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 3cf0 h GLU 737 CO -0.09 -0.27 -0.10 1.49 -1.00 0.00 0.00 179.01 179.03 3cf0 h GLU 738 N -0.43 0.00 -0.15 2.33 4.22 -1.10 -2.27 114.58 117.19 3cf0 h GLU 738 Ca 0.06 0.00 -0.16 0.00 0.08 0.00 0.00 59.36 59.34 3cf0 h GLU 738 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3cf0 h GLU 738 CO -0.24 0.10 -0.57 0.00 -2.18 0.00 0.00 179.01 176.12 3cf0 h ALA 739 N 1.90 0.72 0.00 2.92 0.00 -0.19 -3.02 119.26 121.59 3cf0 h ALA 739 Ca -0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 3cf0 h ALA 739 Cb 0.61 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3cf0 h ALA 739 CO 0.01 0.70 -0.04 0.52 0.00 0.00 0.00 179.25 180.44 3cf0 h MET 740 N 0.37 0.00 0.00 0.00 2.86 -0.41 -2.56 114.93 115.19 3cf0 h MET 740 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3cf0 h MET 740 Cb 1.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.77 3cf0 h MET 740 CO 0.10 0.04 0.00 0.54 1.06 0.00 0.00 176.91 178.66 3cf0 n ARG 741 N -3.64 0.04 -1.09 1.72 5.12 -1.14 -2.27 116.66 115.40 3cf0 n ARG 741 Ca -0.02 0.31 0.03 0.00 -1.93 0.00 0.00 57.85 56.24 3cf0 n ARG 741 Cb 0.14 -1.50 0.12 0.00 -1.16 0.00 0.00 32.46 30.07 3cf0 n ARG 741 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3cf0 n PHE 742 N -1.41 0.21 -2.81 -1.55 3.01 -0.96 -5.07 117.46 108.88 3cf0 n PHE 742 Ca 0.02 -1.21 -0.41 0.00 1.01 0.00 0.00 57.45 56.86 3cf0 n PHE 742 Cb 0.07 -0.22 -0.03 0.00 -0.01 0.00 0.00 39.48 39.29 3cf0 n PHE 742 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3cf0 s ALA 743 N -2.12 3.26 0.53 4.37 0.00 -0.96 -5.02 121.76 121.81 3cf0 s ALA 743 Ca 0.37 0.38 0.06 0.00 0.00 0.00 0.00 51.96 52.77 3cf0 s ALA 743 Cb 0.38 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 20.29 3cf0 s ALA 743 CO -0.10 -0.27 0.44 1.03 0.00 0.00 0.00 175.76 176.86 3cf0 s ARG 744 N 1.14 2.29 -0.18 0.00 1.81 -1.26 -5.12 118.95 117.63 3cf0 s ARG 744 Ca 0.47 -1.92 0.00 0.00 -1.72 0.00 0.00 55.73 52.56 3cf0 s ARG 744 Cb -0.20 -2.18 0.04 0.00 -0.45 0.00 0.00 34.95 32.16 3cf0 s ARG 744 CO 0.23 -0.59 -0.09 1.03 -0.68 0.00 0.00 175.30 175.21 3cf0 s ARG 745 N -4.30 1.82 0.16 3.54 0.52 -1.26 -4.88 118.95 114.56 3cf0 s ARG 745 Ca 0.39 -0.67 -0.12 0.00 -0.52 0.00 0.00 55.73 54.81 3cf0 s ARG 745 Cb -0.02 -2.20 0.04 0.00 0.52 0.00 0.00 34.95 33.28 3cf0 s ARG 745 CO 0.24 -0.40 1.63 0.66 0.02 0.00 0.00 175.30 177.45 3cf0 h SER 746 N 8.04 0.89 -3.49 0.23 4.64 -1.96 -3.42 113.55 118.48 3cf0 h SER 746 Ca -0.28 -0.28 -0.61 0.00 -0.47 0.00 0.00 61.79 60.16 3cf0 h SER 746 Cb 1.11 -0.24 -0.13 0.00 -0.31 0.00 0.00 62.40 62.84 3cf0 h SER 746 CO 0.45 0.94 -0.35 -0.69 -0.87 0.00 0.00 176.83 176.32 3cf0 s VAL 747 N -5.12 5.28 0.33 0.95 1.01 -1.25 -5.07 120.40 116.52 3cf0 s VAL 747 Ca -0.12 0.45 -0.08 0.00 0.00 0.00 0.00 61.98 62.23 3cf0 s VAL 747 Cb 0.12 -3.61 -0.06 0.00 0.00 0.00 0.00 36.38 32.83 3cf0 s VAL 747 CO 0.82 0.31 0.65 -0.94 0.00 0.00 0.00 175.10 175.94 3cf0 s SER 748 N 0.96 6.53 0.30 3.32 1.04 -1.26 -4.79 113.70 119.80 3cf0 s SER 748 Ca 0.14 0.95 0.06 0.00 0.48 0.00 0.00 55.95 57.57 3cf0 s SER 748 Cb -0.14 -2.24 0.75 0.00 0.10 0.00 0.00 66.02 64.49 3cf0 s SER 748 CO 0.06 -0.25 1.78 -2.24 0.98 0.00 0.00 173.24 173.56 3cf0 h ASP 749 N 1.69 0.78 0.24 7.02 3.04 -1.98 -0.69 116.42 126.53 3cf0 h ASP 749 Ca -0.47 0.10 0.01 0.00 -3.24 0.00 0.00 57.03 53.42 3cf0 h ASP 749 Cb 1.18 -0.04 -0.04 0.00 -1.04 0.00 0.00 39.33 39.40 3cf0 h ASP 749 CO 0.66 0.27 -0.41 0.78 -2.04 0.00 0.00 179.24 178.50 3cf0 h ASN 750 N 0.76 -1.16 -0.28 4.15 2.35 -1.99 0.15 115.58 119.56 3cf0 h ASN 750 Ca 0.58 0.12 0.07 0.00 -0.55 0.00 0.00 56.30 56.51 3cf0 h ASN 750 Cb 0.91 0.42 -0.07 0.00 0.05 0.00 0.00 38.32 39.62 3cf0 h ASN 750 CO -0.38 -0.51 -0.21 0.44 -1.65 0.00 0.00 177.43 175.12 3cf0 h ASP 751 N -0.72 -0.67 -0.46 5.81 3.32 -1.61 0.20 116.42 122.29 3cf0 h ASP 751 Ca -0.00 0.13 0.09 0.00 0.02 0.00 0.00 57.03 57.27 3cf0 h ASP 751 Cb 0.70 0.34 -0.08 0.00 0.22 0.00 0.00 39.33 40.50 3cf0 h ASP 751 CO -0.16 -0.24 -0.06 0.40 -1.72 0.00 0.00 179.24 177.46 3cf0 h ILE 752 N -0.19 0.59 -0.49 0.35 2.04 -0.69 0.21 117.51 119.34 3cf0 h ILE 752 Ca 0.15 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 66.08 3cf0 h ILE 752 Cb 0.42 0.53 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 3cf0 h ILE 752 CO -0.39 0.01 0.10 0.03 0.00 0.00 0.00 178.15 177.89 3cf0 h ARG 753 N 0.05 0.22 -0.88 2.37 3.08 0.66 0.44 114.38 120.32 3cf0 h ARG 753 Ca 0.23 -0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.37 3cf0 h ARG 753 Cb 0.34 -0.05 -0.08 0.00 0.08 0.00 0.00 29.97 30.26 3cf0 h ARG 753 CO -0.43 0.15 0.52 0.87 -1.07 0.00 0.00 179.97 180.01 3cf0 h LYS 754 N 0.23 0.81 -0.60 0.04 1.57 0.23 -2.11 116.57 116.74 3cf0 h LYS 754 Ca 0.25 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3cf0 h LYS 754 Cb 0.33 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3cf0 h LYS 754 CO -0.33 0.54 0.38 1.88 -0.57 0.00 0.00 179.45 181.36 3cf0 h TYR 755 N 0.84 0.76 -0.71 -1.35 -1.99 0.14 -1.37 116.97 113.29 3cf0 h TYR 755 Ca 0.44 0.01 0.02 0.00 2.00 0.00 0.00 58.73 61.20 3cf0 h TYR 755 Cb 0.43 -0.26 -0.04 0.00 2.00 0.00 0.00 36.73 38.87 3cf0 h TYR 755 CO -0.05 0.50 0.47 0.93 -0.00 0.00 0.00 178.16 180.01 3cf0 h GLU 756 N 0.81 0.88 0.28 4.88 4.39 -1.02 1.83 114.58 126.62 3cf0 h GLU 756 Ca 0.22 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.85 3cf0 h GLU 756 Cb -0.07 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.39 3cf0 h GLU 756 CO -0.04 0.58 -0.13 0.52 -1.16 0.00 0.00 179.01 178.77 3cf0 h MET 757 N 0.91 -0.36 -0.04 2.33 2.86 -0.90 0.18 114.93 119.91 3cf0 h MET 757 Ca 0.27 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.97 3cf0 h MET 757 Cb -0.02 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 3cf0 h MET 757 CO -0.07 -0.16 -0.20 0.74 1.06 0.00 0.00 176.91 178.27 3cf0 h PHE 758 N -0.48 -0.54 -0.08 -0.22 0.05 0.00 -1.89 116.94 113.78 3cf0 h PHE 758 Ca -0.04 0.02 0.02 0.00 3.82 0.00 0.00 57.97 61.79 3cf0 h PHE 758 Cb 0.36 0.25 -0.00 0.00 2.00 0.00 0.00 35.95 38.55 3cf0 h PHE 758 CO -0.03 -0.29 0.08 0.00 -0.18 0.00 0.00 178.31 177.90 3cf0 h ALA 759 N 0.61 1.69 0.19 2.45 0.00 0.30 0.35 119.26 124.85 3cf0 h ALA 759 Ca 0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3cf0 h ALA 759 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3cf0 h ALA 759 CO -0.22 -0.12 -0.09 0.37 0.00 0.00 0.00 179.25 179.19 3cf0 h GLN 760 N 0.00 -0.24 -0.17 0.00 4.15 0.19 -2.35 115.11 116.69 3cf0 h GLN 760 Ca 0.04 0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 3cf0 h GLN 760 Cb 0.20 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 3cf0 h GLN 760 CO -0.00 -0.16 0.10 1.79 -1.93 0.00 0.00 178.83 178.63 3cf0 h THR 761 N -0.58 1.08 -0.11 2.39 1.35 -1.41 -2.99 112.91 112.64 3cf0 h THR 761 Ca -0.03 -0.19 0.02 0.00 -0.55 0.00 0.00 66.41 65.66 3cf0 h THR 761 Cb 0.19 0.90 -0.01 0.00 -1.73 0.00 0.00 68.15 67.51 3cf0 h THR 761 CO 0.04 0.07 0.08 -0.07 -0.25 0.00 0.00 175.52 175.39 3cf0 h LEU 762 N 0.19 0.06 -1.61 3.87 3.38 -1.06 -3.52 115.31 116.61 3cf0 h LEU 762 Ca 0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3cf0 h LEU 762 Cb 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3cf0 h LEU 762 CO -0.01 0.04 0.00 0.00 0.09 0.00 0.00 178.44 178.56