#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 4.34 1.08 0.00 2.96 -1.26 -4.98 118.68 120.83 3cf0 s LEU 464 Ca 0.00 2.96 -0.13 0.00 -0.22 0.00 0.00 54.13 56.74 3cf0 s LEU 464 Cb 0.00 -3.63 0.19 0.00 0.50 0.00 0.00 46.19 43.25 3cf0 s LEU 464 CO 0.00 -0.93 0.77 -1.14 -1.32 0.00 0.00 176.35 173.72 3cf0 n ARG 465 N 2.33 -1.58 -2.99 1.98 0.63 -1.26 -4.98 116.66 110.79 3cf0 n ARG 465 Ca 0.09 -0.42 -0.40 0.00 -0.92 0.00 0.00 57.85 56.19 3cf0 n ARG 465 Cb 0.37 -2.08 -0.04 0.00 0.45 0.00 0.00 32.46 31.15 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 -4.16 4.40 -0.26 -0.14 2.56 -1.26 -5.02 118.70 114.82 3cf0 s GLU 466 Ca 0.64 0.93 -0.29 0.00 0.00 0.00 0.00 54.97 56.25 3cf0 s GLU 466 Cb -0.22 -3.49 -0.02 0.00 2.00 0.00 0.00 34.13 32.41 3cf0 s GLU 466 CO 0.64 -0.05 1.57 0.99 -0.56 0.00 0.00 175.26 177.85 3cf0 s THR 467 N 1.19 3.76 -0.38 -1.70 2.01 -1.26 -4.98 115.64 114.28 3cf0 s THR 467 Ca 0.38 0.84 -0.10 0.00 0.31 0.00 0.00 61.69 63.12 3cf0 s THR 467 Cb -0.18 -3.82 0.05 0.00 0.01 0.00 0.00 72.50 68.57 3cf0 s THR 467 CO 0.17 -0.38 0.20 -0.69 -0.69 0.00 0.00 174.62 173.24 3cf0 s VAL 468 N 5.29 4.31 0.41 3.82 1.01 -1.26 -5.07 120.40 128.90 3cf0 s VAL 468 Ca 0.69 -1.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.34 3cf0 s VAL 468 Cb -0.22 -3.49 -0.09 0.00 0.00 0.00 0.00 36.38 32.58 3cf0 s VAL 468 CO 0.29 -0.32 1.01 -0.69 0.00 0.00 0.00 175.10 175.40 3cf0 s VAL 469 N 1.48 3.92 0.18 2.92 1.01 -1.26 -4.48 120.40 124.17 3cf0 s VAL 469 Ca 0.01 1.39 -0.22 0.00 0.00 0.00 0.00 61.98 63.17 3cf0 s VAL 469 Cb -0.21 -3.68 0.06 0.00 0.00 0.00 0.00 36.38 32.55 3cf0 s VAL 469 CO 0.04 -0.07 0.60 -1.83 0.00 0.00 0.00 175.10 173.84 3cf0 s GLU 470 N -2.67 1.35 -0.25 2.72 -1.05 -1.16 -4.98 118.70 112.65 3cf0 s GLU 470 Ca 0.59 -0.60 -0.09 0.00 -0.15 0.00 0.00 54.97 54.72 3cf0 s GLU 470 Cb -0.18 0.58 -0.04 0.00 -0.44 0.00 0.00 34.13 34.05 3cf0 s GLU 470 CO 0.23 -0.59 0.11 0.08 0.95 0.00 0.00 175.26 176.04 3cf0 s VAL 471 N -3.79 4.74 -0.01 1.83 1.01 -1.26 -1.55 120.40 121.38 3cf0 s VAL 471 Ca 0.03 -0.03 -0.32 0.00 0.00 0.00 0.00 61.98 61.66 3cf0 s VAL 471 Cb -0.02 -3.23 -0.11 0.00 0.00 0.00 0.00 36.38 33.03 3cf0 s VAL 471 CO -0.09 0.32 1.89 -2.65 0.00 0.00 0.00 175.10 174.57 3cf0 n PRO 472 N 4.79 2.47 0.24 2.72 -0.02 -1.26 -4.86 135.00 139.08 3cf0 n PRO 472 Ca -0.15 0.90 0.13 0.00 -2.02 0.00 0.00 63.50 62.36 3cf0 n PRO 472 Cb 0.52 -2.79 0.53 0.00 -0.02 0.00 0.00 33.50 31.74 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 9.35 0.00 -5.92 -0.52 -0.00 -1.95 -3.43 115.11 112.63 3cf0 h GLN 473 Ca -0.48 0.00 -0.66 0.00 -0.00 0.00 0.00 58.65 57.51 3cf0 h GLN 473 Cb 1.25 0.00 -0.09 0.00 -0.00 0.00 0.00 27.48 28.64 3cf0 h GLN 473 CO 0.94 0.13 -0.55 0.54 -0.00 0.00 0.00 178.83 179.89 3cf0 s VAL 474 N -3.64 4.92 0.42 1.86 0.11 -1.26 -5.11 120.40 117.70 3cf0 s VAL 474 Ca 0.01 -0.28 0.04 0.00 -2.93 0.00 0.00 61.98 58.82 3cf0 s VAL 474 Cb 0.09 -3.23 -0.04 0.00 -1.53 0.00 0.00 36.38 31.67 3cf0 s VAL 474 CO 0.60 0.40 0.05 0.42 -3.33 0.00 0.00 175.10 173.24 3cf0 s THR 475 N -1.17 1.19 0.57 5.04 -4.23 -1.26 -3.59 115.64 112.18 3cf0 s THR 475 Ca 0.22 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.01 3cf0 s THR 475 Cb -0.12 -2.51 0.39 0.00 1.34 0.00 0.00 72.50 71.60 3cf0 s THR 475 CO 0.13 0.00 1.97 -0.50 -0.54 0.00 0.00 174.62 175.67 3cf0 h TRP 476 N 1.71 0.00 -0.05 3.99 4.06 -1.94 -1.50 115.95 122.22 3cf0 h TRP 476 Ca -0.41 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.49 3cf0 h TRP 476 Cb 1.27 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.43 3cf0 h TRP 476 CO 1.16 0.00 -0.19 0.93 -3.56 0.00 0.00 178.44 176.78 3cf0 h GLU 477 N 0.00 0.07 -0.00 0.49 5.08 -2.00 -2.09 114.58 116.13 3cf0 h GLU 477 Ca 0.22 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3cf0 h GLU 477 Cb 1.04 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.28 3cf0 h GLU 477 CO -0.00 0.27 -0.06 -0.25 -1.00 0.00 0.00 179.01 177.97 3cf0 n ASP 478 N -4.28 0.22 -4.44 1.42 9.92 -0.57 -4.65 116.55 114.18 3cf0 n ASP 478 Ca -0.02 -0.38 -0.39 0.00 -0.53 0.00 0.00 54.79 53.48 3cf0 n ASP 478 Cb 0.27 -0.17 -0.12 0.00 -0.64 0.00 0.00 41.12 40.47 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 -2.51 4.62 -0.01 0.53 1.01 -0.79 -4.70 121.20 119.35 3cf0 s ILE 479 Ca 0.29 -0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 3cf0 s ILE 479 Cb 0.20 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 3cf0 s ILE 479 CO 0.47 0.07 1.04 -0.83 0.00 0.00 0.00 174.94 175.69 3cf0 s GLY 480 N 1.62 2.66 0.00 6.18 0.00 -1.26 -4.91 107.32 111.61 3cf0 s GLY 480 Ca 0.05 0.58 0.00 0.00 0.00 0.00 0.00 44.72 45.35 3cf0 s GLY 480 CO 0.06 1.84 0.00 0.61 0.00 0.00 0.00 173.10 175.61 3cf0 n GLY 481 N 3.03 0.10 2.97 0.20 0.00 -1.26 -4.64 105.19 105.59 3cf0 n GLY 481 Ca 0.07 -0.96 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.74 -0.00 0.99 4.77 -1.26 -4.92 117.00 113.83 3cf0 n LEU 482 Ca 0.00 -0.31 -0.11 0.00 -0.03 0.00 0.00 56.01 55.55 3cf0 n LEU 482 Cb 0.00 -2.63 -0.06 0.00 -2.33 0.00 0.00 43.42 38.40 3cf0 n LEU 482 CO 0.00 0.32 0.87 -0.33 -1.33 0.00 0.00 177.39 176.92 3cf0 h GLU 483 N -1.55 0.12 -0.76 3.23 4.39 -1.97 -2.01 114.58 116.04 3cf0 h GLU 483 Ca -0.46 -0.01 0.17 0.00 0.34 0.00 0.00 59.36 59.39 3cf0 h GLU 483 Cb 1.31 -0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 29.80 3cf0 h GLU 483 CO 0.48 0.15 -0.04 0.38 -1.16 0.00 0.00 179.01 178.82 3cf0 h ASP 484 N 0.07 -0.44 0.08 1.42 2.03 -2.00 -1.77 116.42 115.80 3cf0 h ASP 484 Ca 0.03 0.21 -0.22 0.00 -0.73 0.00 0.00 57.03 56.32 3cf0 h ASP 484 Cb 0.06 0.38 0.01 0.00 -0.83 0.00 0.00 39.33 38.94 3cf0 h ASP 484 CO -0.01 -0.20 -0.83 -0.37 -1.03 0.00 0.00 179.24 176.80 3cf0 h VAL 485 N 0.07 1.33 -0.60 4.15 -1.51 -1.84 -1.60 116.25 116.25 3cf0 h VAL 485 Ca 0.41 -2.14 0.09 0.00 -1.23 0.00 0.00 66.70 63.82 3cf0 h VAL 485 Cb 0.70 2.15 -0.07 0.00 -2.13 0.00 0.00 31.29 31.94 3cf0 h VAL 485 CO -0.70 0.66 0.24 0.11 -1.23 0.00 0.00 177.57 176.65 3cf0 h LYS 486 N 0.39 0.42 0.46 5.19 1.57 -0.71 0.77 116.57 124.65 3cf0 h LYS 486 Ca -0.06 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3cf0 h LYS 486 Cb 1.45 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.67 3cf0 h LYS 486 CO 0.16 0.28 -0.22 -0.09 -0.57 0.00 0.00 179.45 179.01 3cf0 h ARG 487 N 0.43 -0.59 -0.99 3.15 2.43 -1.25 -1.26 114.38 116.31 3cf0 h ARG 487 Ca 0.29 0.04 0.14 0.00 -0.81 0.00 0.00 59.98 59.65 3cf0 h ARG 487 Cb 0.34 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 29.93 3cf0 h ARG 487 CO -0.28 -0.35 0.62 1.49 -1.51 0.00 0.00 179.97 179.94 3cf0 h GLU 488 N -0.70 0.87 -0.31 0.20 4.22 -0.47 0.04 114.58 118.42 3cf0 h GLU 488 Ca -0.06 -0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.30 3cf0 h GLU 488 Cb 0.51 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3cf0 h GLU 488 CO 0.10 0.57 0.08 -0.07 -2.18 0.00 0.00 179.01 177.52 3cf0 h LEU 489 N 0.89 0.47 -0.26 1.64 3.38 0.79 -2.44 115.31 119.79 3cf0 h LEU 489 Ca 0.51 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 58.29 3cf0 h LEU 489 Cb 0.63 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 3cf0 h LEU 489 CO -0.28 0.57 0.06 1.56 0.09 0.00 0.00 178.44 180.44 3cf0 h GLN 490 N 0.35 0.16 0.00 1.13 4.20 -0.29 -0.98 115.11 119.68 3cf0 h GLN 490 Ca 0.10 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.80 3cf0 h GLN 490 Cb 0.28 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.02 3cf0 h GLN 490 CO -0.00 0.11 0.12 0.93 -0.67 0.00 0.00 178.83 179.32 3cf0 h GLU 491 N 0.17 0.00 0.00 1.46 5.08 -0.78 0.16 114.58 120.67 3cf0 h GLU 491 Ca 0.12 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 3cf0 h GLU 491 Cb 0.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3cf0 h GLU 491 CO -0.14 0.00 -2.08 1.28 -1.00 0.00 0.00 179.01 177.07 3cf0 n LEU 492 N -2.65 0.00 -0.00 1.33 4.77 -0.46 -4.44 117.00 115.55 3cf0 n LEU 492 Ca -0.02 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 3cf0 n LEU 492 Cb 0.16 0.13 -0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3cf0 n LEU 492 CO 0.13 0.13 -0.52 1.33 -1.33 0.00 0.00 177.39 177.13 3cf0 n VAL 493 N -2.37 0.04 0.15 4.08 0.24 -0.69 -4.69 118.33 115.09 3cf0 n VAL 493 Ca -0.11 -0.02 -0.06 0.00 -2.04 0.00 0.00 64.34 62.11 3cf0 n VAL 493 Cb 0.71 -0.59 -0.03 0.00 -1.47 0.00 0.00 33.84 32.46 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 -0.00 -0.37 -0.77 7.34 1.08 -0.91 -3.26 115.11 118.22 3cf0 h GLN 494 Ca -0.02 0.03 0.17 0.00 -1.45 0.00 0.00 58.65 57.37 3cf0 h GLN 494 Cb 1.03 0.08 -0.14 0.00 -0.05 0.00 0.00 27.48 28.40 3cf0 h GLN 494 CO -0.00 -0.25 -0.09 1.88 -0.95 0.00 0.00 178.83 179.42 3cf0 h TYR 495 N -0.46 -0.22 -0.31 2.96 0.99 -1.75 0.15 116.97 118.34 3cf0 h TYR 495 Ca -0.04 0.06 -0.03 0.00 2.00 0.00 0.00 58.73 60.72 3cf0 h TYR 495 Cb 0.29 0.22 -0.02 0.00 1.00 0.00 0.00 36.73 38.23 3cf0 h TYR 495 CO 0.12 -0.29 0.04 -1.00 -0.00 0.00 0.00 178.16 177.03 3cf0 h PRO 496 N 0.05 0.45 0.13 4.88 0.13 -1.81 0.69 132.00 136.52 3cf0 h PRO 496 Ca 0.40 -0.08 -0.26 0.00 -0.87 0.00 0.00 66.00 65.19 3cf0 h PRO 496 Cb 0.67 -0.08 0.01 0.00 0.13 0.00 0.00 31.00 31.73 3cf0 h PRO 496 CO -0.73 0.45 -1.28 -0.24 -0.23 0.00 0.00 178.00 175.97 3cf0 h VAL 497 N 0.45 1.16 -0.01 1.56 3.04 -1.02 -3.13 116.25 118.29 3cf0 h VAL 497 Ca 0.10 -2.45 0.00 0.00 -1.01 0.00 0.00 66.70 63.34 3cf0 h VAL 497 Cb 0.23 2.86 0.00 0.00 -2.01 0.00 0.00 31.29 32.36 3cf0 h VAL 497 CO 0.00 0.72 -0.32 -0.62 -1.01 0.00 0.00 177.57 176.34 3cf0 n GLU 498 N -3.95 0.95 -2.66 4.17 1.02 0.32 -4.13 120.64 116.35 3cf0 n GLU 498 Ca -0.22 -0.64 -0.09 0.00 -0.02 0.00 0.00 57.16 56.19 3cf0 n GLU 498 Cb 0.90 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.86 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 -0.47 1.37 0.01 -0.32 8.25 0.23 -4.93 115.22 119.36 3cf0 n HIS 499 Ca 0.11 -2.71 0.16 0.00 -0.26 0.00 0.00 57.72 55.03 3cf0 n HIS 499 Cb 0.38 -0.33 0.63 0.00 1.12 0.00 0.00 29.99 31.79 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 2.90 0.12 -0.49 -0.41 0.11 -1.66 -0.87 132.00 131.70 3cf0 h PRO 500 Ca -0.07 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.13 3cf0 h PRO 500 Cb 1.18 -0.03 -0.09 0.00 0.11 0.00 0.00 31.00 32.17 3cf0 h PRO 500 CO 0.48 0.08 -0.11 0.38 -0.21 0.00 0.00 178.00 178.62 3cf0 h ASP 501 N 0.12 -0.43 0.42 -2.05 -0.00 -1.91 -0.41 116.42 112.15 3cf0 h ASP 501 Ca 0.23 0.14 -0.08 0.00 -0.00 0.00 0.00 57.03 57.32 3cf0 h ASP 501 Cb 0.75 0.29 -0.01 0.00 -0.00 0.00 0.00 39.33 40.36 3cf0 h ASP 501 CO -0.03 -0.15 -0.39 0.11 -0.00 0.00 0.00 179.24 178.78 3cf0 h LYS 502 N 0.01 0.00 0.07 4.15 6.56 -1.53 0.18 116.57 126.02 3cf0 h LYS 502 Ca 0.24 0.00 -0.25 0.00 -1.06 0.00 0.00 60.65 59.58 3cf0 h LYS 502 Cb 0.36 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.03 3cf0 h LYS 502 CO -0.50 0.39 -1.10 0.74 -2.06 0.00 0.00 179.45 176.92 3cf0 h PHE 503 N 0.00 0.52 -0.13 -1.35 0.04 -1.31 -2.50 116.94 112.22 3cf0 h PHE 503 Ca -0.00 -0.34 -0.17 0.00 2.80 0.00 0.00 57.97 60.26 3cf0 h PHE 503 Cb 0.70 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 3cf0 h PHE 503 CO 0.00 1.21 -0.62 -0.07 -0.60 0.00 0.00 178.31 178.23 3cf0 h LEU 504 N 0.13 0.52 0.47 1.54 4.07 -0.87 -1.44 115.31 119.74 3cf0 h LEU 504 Ca -0.11 -0.30 -0.02 0.00 0.08 0.00 0.00 57.88 57.54 3cf0 h LEU 504 Cb 1.79 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 43.37 3cf0 h LEU 504 CO 0.18 1.01 -0.30 0.11 -1.08 0.00 0.00 178.44 178.37 3cf0 h LYS 505 N 0.34 -0.70 0.00 1.13 1.57 -0.63 -2.96 116.57 115.31 3cf0 h LYS 505 Ca -0.01 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3cf0 h LYS 505 Cb 1.16 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3cf0 h LYS 505 CO 0.11 -0.47 -0.08 1.19 -0.57 0.00 0.00 179.45 179.63 3cf0 n PHE 506 N -5.43 0.22 0.00 -1.35 3.72 -0.94 -4.96 117.46 108.72 3cf0 n PHE 506 Ca -0.11 0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 3cf0 n PHE 506 Cb 0.33 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.30 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 1.45 2.47 3.52 1.37 0.00 -0.54 -5.02 105.19 108.44 3cf0 n GLY 507 Ca 0.06 -0.52 -0.51 0.00 0.00 0.00 0.00 46.02 45.06 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 0.65 -3.93 1.61 0.00 -1.24 -4.73 117.12 109.47 3cf0 n MET 508 Ca 0.00 0.23 -0.32 0.00 0.00 0.00 0.00 57.70 57.61 3cf0 n MET 508 Cb 0.00 -1.61 -0.05 0.00 0.00 0.00 0.00 33.22 31.56 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 -0.36 5.30 1.17 3.17 -4.23 -1.26 -4.66 115.64 114.78 3cf0 s THR 509 Ca 0.75 -0.35 -0.19 0.00 -1.18 0.00 0.00 61.69 60.71 3cf0 s THR 509 Cb -0.96 -3.54 0.28 0.00 1.34 0.00 0.00 72.50 69.62 3cf0 s THR 509 CO 0.54 0.21 1.15 -2.84 -0.54 0.00 0.00 174.62 173.14 3cf0 s PRO 510 N -2.29 -1.01 0.04 3.99 0.02 -1.26 -5.05 135.00 129.45 3cf0 s PRO 510 Ca 0.32 -0.17 0.01 0.00 0.02 0.00 0.00 61.00 61.17 3cf0 s PRO 510 Cb -0.13 -1.63 -0.04 0.00 0.02 0.00 0.00 34.50 32.72 3cf0 s PRO 510 CO 0.24 -3.55 0.13 -1.54 -0.33 0.00 0.00 177.00 171.95 3cf0 s SER 511 N -4.11 5.90 0.36 2.53 1.04 -1.26 -5.03 113.70 113.13 3cf0 s SER 511 Ca 0.72 0.15 0.18 0.00 0.48 0.00 0.00 55.95 57.48 3cf0 s SER 511 Cb -0.08 -1.71 0.61 0.00 0.10 0.00 0.00 66.02 64.93 3cf0 s SER 511 CO 0.55 0.21 1.70 0.11 0.98 0.00 0.00 173.24 176.79 3cf0 h LYS 512 N 3.51 0.00 0.00 4.02 1.57 -1.89 -3.49 116.57 120.30 3cf0 h LYS 512 Ca -0.47 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 58.58 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 0.68 0.41 0.77 0.41 -0.57 0.00 0.00 179.45 181.15 3cf0 n GLY 513 N 0.30 0.36 3.15 3.86 0.00 -1.23 -2.44 105.19 109.20 3cf0 n GLY 513 Ca -0.00 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.82 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 0.05 -0.23 1.61 1.01 -0.70 -3.50 120.40 116.60 3cf0 s VAL 514 Ca 0.27 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.83 3cf0 s VAL 514 Cb -0.01 -0.46 0.06 0.00 0.00 0.00 0.00 36.38 35.96 3cf0 s VAL 514 CO 0.02 -0.24 -0.09 -0.22 0.00 0.00 0.00 175.10 174.57 3cf0 s LEU 515 N -0.96 2.79 0.04 3.92 0.20 0.51 -0.54 118.68 124.64 3cf0 s LEU 515 Ca -0.10 -1.18 -0.26 0.00 0.69 0.00 0.00 54.13 53.28 3cf0 s LEU 515 Cb -0.05 -1.32 -0.05 0.00 -0.43 0.00 0.00 46.19 44.34 3cf0 s LEU 515 CO 0.02 -0.20 0.82 -0.36 -0.29 0.00 0.00 176.35 176.34 3cf0 s PHE 516 N 1.29 3.72 0.16 5.38 2.99 0.03 -1.21 117.98 130.35 3cf0 s PHE 516 Ca -0.06 1.53 0.06 0.00 0.00 0.00 0.00 56.93 58.46 3cf0 s PHE 516 Cb -0.19 -2.90 -0.04 0.00 0.00 0.00 0.00 43.02 39.89 3cf0 s PHE 516 CO -0.06 0.20 -0.12 1.52 -0.00 0.00 0.00 175.22 176.76 3cf0 s TYR 517 N 0.20 1.40 0.00 0.36 -0.85 -0.46 -1.98 117.35 116.02 3cf0 s TYR 517 Ca 0.41 -0.68 0.00 0.00 -0.52 0.00 0.00 57.07 56.28 3cf0 s TYR 517 Cb -0.21 -0.69 0.00 0.00 0.38 0.00 0.00 41.96 41.44 3cf0 s TYR 517 CO 0.24 0.16 0.00 0.41 -1.52 0.00 0.00 175.55 174.84 3cf0 n GLY 518 N -0.14 2.48 3.67 5.49 0.00 -1.06 -0.28 105.19 115.34 3cf0 n GLY 518 Ca -0.10 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.00 0.92 0.17 1.61 0.04 -1.25 -4.06 135.00 130.43 3cf0 s PRO 519 Ca 0.00 1.17 -0.30 0.00 0.04 0.00 0.00 61.00 61.91 3cf0 s PRO 519 Cb 0.00 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.72 3cf0 s PRO 519 CO 0.00 -2.57 1.15 -2.14 0.04 0.00 0.00 177.00 173.48 3cf0 s PRO 520 N -4.73 4.53 0.00 0.56 0.02 -1.26 -4.16 135.00 129.97 3cf0 s PRO 520 Ca 0.65 1.79 0.00 0.00 0.02 0.00 0.00 61.00 63.46 3cf0 s PRO 520 Cb -0.21 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.04 3cf0 s PRO 520 CO 0.59 -0.03 0.00 0.41 -0.33 0.00 0.00 177.00 177.64 3cf0 n GLY 521 N 2.22 0.71 0.00 0.52 0.00 -1.26 -4.83 105.19 102.54 3cf0 n GLY 521 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.01 1.14 0.35 0.00 0.00 -1.26 -4.83 105.19 100.58 3cf0 n GLY 523 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 0.68 0.87 -0.09 1.61 1.57 -1.94 0.31 116.57 119.58 3cf0 h LYS 524 Ca 0.00 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3cf0 h LYS 524 Cb 0.00 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.11 3cf0 h LYS 524 CO 0.00 0.57 -0.09 1.15 -0.57 0.00 0.00 179.45 180.52 3cf0 h THR 525 N 0.89 1.36 -0.48 -0.16 2.02 -2.00 -2.77 112.91 111.78 3cf0 h THR 525 Ca 0.51 -1.24 0.07 0.00 0.77 0.00 0.00 66.41 66.52 3cf0 h THR 525 Cb 0.60 1.98 -0.06 0.00 -1.74 0.00 0.00 68.15 68.94 3cf0 h THR 525 CO -0.30 0.35 0.16 -0.07 0.37 0.00 0.00 175.52 176.03 3cf0 h LEU 526 N -0.19 0.16 -0.68 2.58 3.38 -1.86 0.42 115.31 119.11 3cf0 h LEU 526 Ca 0.01 0.06 0.08 0.00 0.09 0.00 0.00 57.88 58.13 3cf0 h LEU 526 Cb 0.60 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.33 3cf0 h LEU 526 CO 0.02 0.12 0.34 -0.07 0.09 0.00 0.00 178.44 178.94 3cf0 h LEU 527 N 0.33 0.45 -0.87 1.67 3.38 -0.99 0.26 115.31 119.55 3cf0 h LEU 527 Ca 0.23 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 58.15 3cf0 h LEU 527 Cb 0.25 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3cf0 h LEU 527 CO -0.24 0.27 -0.31 0.00 0.09 0.00 0.00 178.44 178.24 3cf0 h ALA 528 N 1.41 1.04 0.17 1.53 0.00 -0.71 -2.15 119.26 120.55 3cf0 h ALA 528 Ca 0.33 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3cf0 h ALA 528 Cb 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3cf0 h ALA 528 CO -0.25 0.58 -0.08 0.87 0.00 0.00 0.00 179.25 180.37 3cf0 h LYS 529 N 0.40 -0.22 -0.78 0.00 1.57 -0.26 -2.95 116.57 114.33 3cf0 h LYS 529 Ca 0.05 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.99 3cf0 h LYS 529 Cb 0.75 0.05 -0.15 0.00 0.08 0.00 0.00 32.23 32.96 3cf0 h LYS 529 CO 0.06 0.06 -0.25 0.00 -0.57 0.00 0.00 179.45 178.75 3cf0 h ALA 530 N -0.73 0.36 -0.77 3.86 0.00 -0.52 0.32 119.26 121.78 3cf0 h ALA 530 Ca -0.02 0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.21 3cf0 h ALA 530 Cb 0.38 0.70 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 3cf0 h ALA 530 CO 0.04 -0.49 0.47 0.97 0.00 0.00 0.00 179.25 180.24 3cf0 h ILE 531 N -0.04 1.05 -0.28 0.00 6.09 -1.47 0.48 117.51 123.34 3cf0 h ILE 531 Ca 0.35 -0.30 -0.02 0.00 -1.37 0.00 0.00 64.86 63.52 3cf0 h ILE 531 Cb 0.58 0.09 -0.01 0.00 0.47 0.00 0.00 36.82 37.95 3cf0 h ILE 531 CO -0.82 0.16 0.10 0.00 -3.07 0.00 0.00 178.15 174.53 3cf0 h ALA 532 N 1.36 0.37 -0.52 0.18 0.00 -0.60 -1.90 119.26 118.15 3cf0 h ALA 532 Ca 0.33 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 3cf0 h ALA 532 Cb 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3cf0 h ALA 532 CO -0.15 -0.02 0.07 -0.97 0.00 0.00 0.00 179.25 178.18 3cf0 h ASN 533 N 0.30 0.78 0.16 0.00 -1.24 0.99 0.13 115.58 116.70 3cf0 h ASN 533 Ca 0.09 -0.16 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 3cf0 h ASN 533 Cb 0.20 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.05 3cf0 h ASN 533 CO -0.01 0.80 -0.09 -0.08 -1.29 0.00 0.00 177.43 176.77 3cf0 h GLU 534 N 0.78 -0.22 0.00 6.67 4.57 0.11 0.43 114.58 126.92 3cf0 h GLU 534 Ca 0.16 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3cf0 h GLU 534 Cb 0.37 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.01 3cf0 h GLU 534 CO 0.01 -0.15 0.00 0.00 -1.18 0.00 0.00 179.01 177.69 3cf0 n GLN 536 N -0.62 -2.42 -4.36 0.00 1.13 0.14 -4.96 117.38 106.29 3cf0 n GLN 536 Ca 0.03 0.31 -0.25 0.00 -1.94 0.00 0.00 57.00 55.14 3cf0 n GLN 536 Cb 0.01 -4.17 -0.09 0.00 0.11 0.00 0.00 30.24 26.11 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 -4.03 3.28 0.59 -1.58 0.00 -0.02 -5.01 121.76 114.99 3cf0 s ALA 537 Ca 0.05 -2.09 -0.14 0.00 0.00 0.00 0.00 51.96 49.78 3cf0 s ALA 537 Cb -0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 3cf0 s ALA 537 CO 0.92 -0.04 1.03 -0.80 0.00 0.00 0.00 175.76 176.87 3cf0 s ASN 538 N -3.76 6.12 -0.11 0.00 0.01 -0.66 -4.44 114.94 112.11 3cf0 s ASN 538 Ca 0.36 1.60 -0.01 0.00 -0.71 0.00 0.00 52.86 54.11 3cf0 s ASN 538 Cb 0.03 -2.50 0.03 0.00 0.41 0.00 0.00 41.25 39.22 3cf0 s ASN 538 CO 0.20 -0.93 -0.03 0.12 -1.51 0.00 0.00 177.10 174.94 3cf0 s PHE 539 N -2.78 1.13 -0.12 2.20 5.36 -0.60 -0.14 117.98 123.03 3cf0 s PHE 539 Ca 0.59 -0.55 -0.01 0.00 -0.96 0.00 0.00 56.93 56.00 3cf0 s PHE 539 Cb -0.12 -1.05 -0.02 0.00 -0.34 0.00 0.00 43.02 41.48 3cf0 s PHE 539 CO 0.42 -0.46 -0.07 0.42 -1.46 0.00 0.00 175.22 174.07 3cf0 s ILE 540 N 1.82 3.61 -0.30 3.12 1.01 -0.24 -3.00 121.20 127.22 3cf0 s ILE 540 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3cf0 s ILE 540 Cb -0.13 -2.54 0.06 0.00 0.01 0.00 0.00 42.46 39.87 3cf0 s ILE 540 CO -0.07 0.53 -0.01 -0.55 0.00 0.00 0.00 174.94 174.84 3cf0 s SER 541 N 0.04 4.76 -0.22 3.58 0.15 -1.26 -0.81 113.70 119.94 3cf0 s SER 541 Ca -0.02 -1.48 -0.13 0.00 0.70 0.00 0.00 55.95 55.02 3cf0 s SER 541 Cb -0.14 -1.66 -0.05 0.00 -1.71 0.00 0.00 66.02 62.47 3cf0 s SER 541 CO 0.03 -0.27 0.26 -0.63 1.20 0.00 0.00 173.24 173.82 3cf0 s ILE 542 N 1.15 5.30 0.17 6.45 1.09 -0.76 -4.93 121.20 129.67 3cf0 s ILE 542 Ca -0.03 0.40 0.02 0.00 -1.10 0.00 0.00 60.65 59.93 3cf0 s ILE 542 Cb -0.20 -3.59 0.02 0.00 -1.06 0.00 0.00 42.46 37.63 3cf0 s ILE 542 CO -0.03 0.31 0.17 0.29 -0.10 0.00 0.00 174.94 175.58 3cf0 n LYS 543 N 4.31 1.10 0.49 2.79 5.02 -1.26 -0.98 118.16 129.63 3cf0 n LYS 543 Ca -0.12 -1.01 -0.20 0.00 -2.02 0.00 0.00 58.31 54.96 3cf0 n LYS 543 Cb 0.52 0.04 -0.10 0.00 -0.02 0.00 0.00 35.03 35.47 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 -1.28 0.87 0.72 0.00 -1.81 -2.69 103.07 99.01 3cf0 h GLY 544 Ca -0.10 0.47 0.08 0.00 0.00 0.00 0.00 47.33 47.79 3cf0 h GLY 544 CO 0.15 -0.47 0.53 -2.55 0.00 0.00 0.00 176.54 174.20 3cf0 h PRO 545 N -1.25 0.79 -0.04 4.80 0.11 -1.94 -0.12 132.00 134.36 3cf0 h PRO 545 Ca -0.13 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3cf0 h PRO 545 Cb 0.94 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.87 3cf0 h PRO 545 CO 0.21 0.52 0.01 1.49 -0.21 0.00 0.00 178.00 180.02 3cf0 h GLU 546 N 0.81 0.03 -0.36 1.05 4.81 -1.93 -0.06 114.58 118.93 3cf0 h GLU 546 Ca 0.37 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.67 3cf0 h GLU 546 Cb 0.35 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.66 3cf0 h GLU 546 CO -0.14 0.02 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.01 3cf0 h LEU 547 N 0.03 -0.33 -1.29 1.64 3.38 -0.91 -2.16 115.31 115.67 3cf0 h LEU 547 Ca 0.01 0.11 0.05 0.00 0.09 0.00 0.00 57.88 58.14 3cf0 h LEU 547 Cb 0.01 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 3cf0 h LEU 547 CO -0.01 -0.12 0.51 -0.07 0.09 0.00 0.00 178.44 178.84 3cf0 h LEU 548 N 0.01 0.78 -0.36 1.67 3.38 -0.90 -0.56 115.31 119.32 3cf0 h LEU 548 Ca 0.17 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.16 3cf0 h LEU 548 Cb 0.26 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3cf0 h LEU 548 CO -0.37 0.52 0.21 0.74 0.09 0.00 0.00 178.44 179.62 3cf0 h THR 549 N 0.89 1.03 0.00 0.22 2.02 -0.36 0.26 112.91 116.97 3cf0 h THR 549 Ca 0.32 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.34 3cf0 h THR 549 Cb 0.14 0.57 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3cf0 h THR 549 CO -0.10 0.08 -0.09 0.24 0.37 0.00 0.00 175.52 176.01 3cf0 h MET 550 N 0.42 0.00 0.05 6.66 2.86 -1.02 -0.03 114.93 123.86 3cf0 h MET 550 Ca 0.14 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 3cf0 h MET 550 Cb 0.01 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.68 3cf0 h MET 550 CO -0.07 0.09 -0.43 2.35 1.06 0.00 0.00 176.91 179.91 3cf0 h TRP 551 N 0.00 0.35 -0.41 -0.22 7.01 0.94 -0.86 115.95 122.75 3cf0 h TRP 551 Ca -0.00 -0.22 -0.12 0.00 2.11 0.00 0.00 58.89 60.65 3cf0 h TRP 551 Cb 0.24 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.26 3cf0 h TRP 551 CO 0.00 1.10 -0.23 0.74 -2.79 0.00 0.00 178.44 177.27 3cf0 h PHE 552 N -0.51 1.02 -0.04 2.65 0.04 -0.72 -2.90 116.94 116.49 3cf0 h PHE 552 Ca -0.07 -0.26 0.00 0.00 2.80 0.00 0.00 57.97 60.44 3cf0 h PHE 552 Cb 1.26 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 39.17 3cf0 h PHE 552 CO 0.20 1.05 0.00 0.41 -0.60 0.00 0.00 178.31 179.37 3cf0 n GLY 553 N -0.04 -0.30 2.98 -1.45 0.00 -0.04 -4.90 105.19 101.44 3cf0 n GLY 553 Ca -0.01 -0.34 -0.20 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.20 -3.49 -2.32 1.61 1.02 -0.49 -4.87 120.64 111.90 3cf0 n GLU 554 Ca 0.19 0.68 -0.31 0.00 -0.02 0.00 0.00 57.16 57.70 3cf0 n GLU 554 Cb 0.26 -5.41 0.01 0.00 -0.02 0.00 0.00 31.44 26.28 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 -2.24 5.65 0.06 1.62 3.41 -0.45 -4.76 113.62 116.92 3cf0 n SER 555 Ca -0.09 -3.76 0.11 0.00 -0.26 0.00 0.00 58.87 54.87 3cf0 n SER 555 Cb 0.59 -0.67 0.43 0.00 -0.26 0.00 0.00 64.21 64.30 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 -0.48 0.11 0.10 4.33 0.00 -1.26 -2.22 120.64 121.22 3cf0 n GLU 556 Ca 0.44 0.27 0.19 0.00 0.00 0.00 0.00 57.16 58.06 3cf0 n GLU 556 Cb 0.51 -1.68 0.75 0.00 0.00 0.00 0.00 31.44 31.02 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 2.15 0.00 -1.84 0.00 -1.95 0.17 119.26 120.28 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 0.39 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3cf0 h ALA 557 CO 0.00 -0.52 0.00 0.09 0.00 0.00 0.00 179.25 178.82 3cf0 n ASN 558 N -4.00 0.00 0.12 0.00 4.13 -0.94 -1.96 115.26 112.60 3cf0 n ASN 558 Ca 0.06 0.40 -0.01 0.00 1.68 0.00 0.00 54.58 56.71 3cf0 n ASN 558 Cb 0.50 -0.43 0.23 0.00 -1.54 0.00 0.00 39.78 38.54 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 1.34 -0.08 2.41 2.07 -0.91 -1.93 116.25 119.15 3cf0 h VAL 559 Ca 0.00 -1.65 0.03 0.00 0.82 0.00 0.00 66.70 65.91 3cf0 h VAL 559 Cb 0.08 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.63 3cf0 h VAL 559 CO 0.00 0.48 -0.15 -0.09 0.02 0.00 0.00 177.57 177.83 3cf0 h ARG 560 N 0.11 -0.20 0.13 1.57 2.43 -1.58 -0.83 114.38 116.02 3cf0 h ARG 560 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3cf0 h ARG 560 Cb 0.87 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 3cf0 h ARG 560 CO 0.07 -0.13 -0.13 1.49 -1.51 0.00 0.00 179.97 179.76 3cf0 h GLU 561 N -0.21 -0.28 -0.73 0.20 4.22 -1.49 0.26 114.58 116.56 3cf0 h GLU 561 Ca 0.08 0.02 0.16 0.00 0.08 0.00 0.00 59.36 59.70 3cf0 h GLU 561 Cb 0.31 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.51 3cf0 h GLU 561 CO -0.20 -0.18 0.07 0.82 -2.18 0.00 0.00 179.01 177.33 3cf0 h ILE 562 N -0.29 0.42 -0.39 2.32 2.04 -1.27 0.88 117.51 121.23 3cf0 h ILE 562 Ca 0.00 -0.05 -0.15 0.00 1.00 0.00 0.00 64.86 65.66 3cf0 h ILE 562 Cb 0.27 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 3cf0 h ILE 562 CO -0.04 0.03 -0.34 -0.26 0.00 0.00 0.00 178.15 177.55 3cf0 h PHE 563 N 0.16 1.09 -0.02 1.37 0.04 0.57 -1.63 116.94 118.51 3cf0 h PHE 563 Ca 0.40 -0.31 0.02 0.00 2.80 0.00 0.00 57.97 60.88 3cf0 h PHE 563 Cb 0.70 -0.23 -0.06 0.00 2.20 0.00 0.00 35.95 38.56 3cf0 h PHE 563 CO -0.35 1.13 -0.54 -0.44 -0.60 0.00 0.00 178.31 177.51 3cf0 h ASP 564 N 0.73 -1.67 -1.02 2.17 3.45 0.25 0.11 116.42 120.45 3cf0 h ASP 564 Ca 0.07 0.19 0.30 0.00 0.43 0.00 0.00 57.03 58.01 3cf0 h ASP 564 Cb 0.93 0.64 -0.04 0.00 -0.56 0.00 0.00 39.33 40.29 3cf0 h ASP 564 CO 0.09 -0.52 0.74 0.50 -1.57 0.00 0.00 179.24 178.48 3cf0 h LYS 565 N -0.66 0.00 0.18 3.56 3.64 -0.52 0.36 116.57 123.13 3cf0 h LYS 565 Ca 0.02 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.12 3cf0 h LYS 565 Cb 0.72 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.56 3cf0 h LYS 565 CO -0.37 0.00 -1.24 0.00 -2.27 0.00 0.00 179.45 175.57 3cf0 h ALA 566 N 1.47 -0.06 -0.43 5.00 0.00 -0.36 -2.21 119.26 122.67 3cf0 h ALA 566 Ca 0.48 -0.86 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3cf0 h ALA 566 Cb 1.97 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.96 3cf0 h ALA 566 CO -0.01 0.62 0.22 -0.09 0.00 0.00 0.00 179.25 179.99 3cf0 h ARG 567 N -0.13 0.62 -0.08 0.00 2.43 0.18 -1.64 114.38 115.76 3cf0 h ARG 567 Ca -0.23 -0.09 -0.11 0.00 -0.81 0.00 0.00 59.98 58.75 3cf0 h ARG 567 Cb 1.90 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 31.32 3cf0 h ARG 567 CO 0.19 0.52 -0.43 0.37 -1.51 0.00 0.00 179.97 179.11 3cf0 h GLN 568 N 0.56 0.19 -0.27 0.20 -0.00 -0.51 -2.37 115.11 112.91 3cf0 h GLN 568 Ca 0.15 -0.09 0.00 0.00 -0.00 0.00 0.00 58.65 58.71 3cf0 h GLN 568 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.58 3cf0 h GLN 568 CO -0.02 0.59 0.00 0.00 0.00 0.00 0.00 178.83 179.40 3cf0 n ALA 569 N -2.47 2.47 -1.70 3.38 0.00 -0.83 -4.97 120.51 116.39 3cf0 n ALA 569 Ca -0.02 -0.52 -0.43 0.00 0.00 0.00 0.00 53.44 52.48 3cf0 n ALA 569 Cb 0.48 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.92 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 0.33 1.33 -1.92 0.00 0.00 -0.66 -4.28 120.51 115.31 3cf0 n ALA 570 Ca 0.12 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.51 3cf0 n ALA 570 Cb 0.26 -2.26 -0.04 0.00 0.00 0.00 0.00 19.45 17.41 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 -1.85 4.64 -0.14 0.00 0.02 -1.26 -4.99 135.00 131.43 3cf0 s PRO 571 Ca 0.56 1.72 -0.09 0.00 0.02 0.00 0.00 61.00 63.20 3cf0 s PRO 571 Cb -0.57 -3.25 0.05 0.00 0.02 0.00 0.00 34.50 30.75 3cf0 s PRO 571 CO 0.62 0.18 0.36 0.00 -0.33 0.00 0.00 177.00 177.83 3cf0 s VAL 573 N 0.96 5.28 -0.23 0.00 -7.23 0.80 0.04 120.40 120.02 3cf0 s VAL 573 Ca -0.06 0.29 -0.16 0.00 -1.81 0.00 0.00 61.98 60.24 3cf0 s VAL 573 Cb -0.07 -3.57 -0.04 0.00 0.56 0.00 0.00 36.38 33.26 3cf0 s VAL 573 CO -0.07 0.24 0.39 -0.22 -0.31 0.00 0.00 175.10 175.13 3cf0 s LEU 574 N 1.72 4.11 -0.22 1.32 2.96 0.67 -1.08 118.68 128.15 3cf0 s LEU 574 Ca 0.09 0.43 0.00 0.00 -0.22 0.00 0.00 54.13 54.43 3cf0 s LEU 574 Cb -0.16 -2.48 0.06 0.00 0.50 0.00 0.00 46.19 44.11 3cf0 s LEU 574 CO 0.10 -0.13 -0.04 0.12 -1.32 0.00 0.00 176.35 175.08 3cf0 s PHE 575 N 1.64 2.12 -0.65 5.38 5.36 0.01 0.11 117.98 131.94 3cf0 s PHE 575 Ca 0.17 -1.56 -0.19 0.00 -0.96 0.00 0.00 56.93 54.40 3cf0 s PHE 575 Cb -0.15 -1.47 0.12 0.00 -0.34 0.00 0.00 43.02 41.18 3cf0 s PHE 575 CO 0.09 -0.74 0.76 -0.06 -1.46 0.00 0.00 175.22 173.81 3cf0 s PHE 576 N 1.49 3.07 0.62 10.12 0.40 0.24 -1.84 117.98 132.09 3cf0 s PHE 576 Ca -0.05 -1.09 -0.08 0.00 -0.60 0.00 0.00 56.93 55.11 3cf0 s PHE 576 Cb -0.18 -4.03 -0.00 0.00 0.51 0.00 0.00 43.02 39.31 3cf0 s PHE 576 CO -0.07 -1.30 0.97 0.34 0.70 0.00 0.00 175.22 175.87 3cf0 s ASP 577 N 3.50 5.72 -1.52 1.36 2.15 -0.15 -1.22 116.67 126.51 3cf0 s ASP 577 Ca 0.14 0.98 -0.11 0.00 0.43 0.00 0.00 52.55 53.99 3cf0 s ASP 577 Cb -0.21 -1.96 0.08 0.00 -0.30 0.00 0.00 42.92 40.54 3cf0 s ASP 577 CO 0.03 -1.07 0.85 -0.62 -0.17 0.00 0.00 175.17 174.19 3cf0 n GLU 578 N -2.71 -4.76 0.08 4.34 1.02 -1.06 -3.70 120.64 113.85 3cf0 n GLU 578 Ca 0.05 0.54 0.20 0.00 -0.02 0.00 0.00 57.16 57.93 3cf0 n GLU 578 Cb 0.57 -5.27 0.69 0.00 -0.02 0.00 0.00 31.44 27.40 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 -1.92 0.00 -0.93 -4.62 3.38 -1.47 -1.48 115.31 108.28 3cf0 h LEU 579 Ca -0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.38 3cf0 h LEU 579 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3cf0 h LEU 579 CO 0.67 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.30 3cf0 n ASP 580 N -3.49 1.43 0.14 -0.43 5.75 -1.26 -4.45 116.55 114.23 3cf0 n ASP 580 Ca 0.08 -1.52 -0.00 0.00 -0.01 0.00 0.00 54.79 53.34 3cf0 n ASP 580 Cb 0.74 -0.03 0.18 0.00 -1.03 0.00 0.00 41.12 40.99 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 2.14 0.00 -0.08 -1.12 4.64 -1.64 -0.54 113.55 116.95 3cf0 h SER 581 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3cf0 h SER 581 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3cf0 h SER 581 CO 0.00 0.59 0.01 0.40 -0.87 0.00 0.00 176.83 176.96 3cf0 h ILE 582 N 0.00 1.23 -0.19 0.95 2.04 -1.83 -1.96 117.51 117.75 3cf0 h ILE 582 Ca -0.01 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.16 3cf0 h ILE 582 Cb 1.09 1.55 -0.06 0.00 -0.74 0.00 0.00 36.82 38.67 3cf0 h ILE 582 CO 0.08 0.20 -0.43 0.00 0.00 0.00 0.00 178.15 178.00 3cf0 h ALA 583 N 0.76 -0.75 -0.95 1.87 0.00 -1.57 0.23 119.26 118.84 3cf0 h ALA 583 Ca 0.02 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.03 3cf0 h ALA 583 Cb 0.31 0.97 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 3cf0 h ALA 583 CO 0.00 -0.93 -0.45 0.87 0.00 0.00 0.00 179.25 178.75 3cf0 h LYS 584 N -0.40 -0.02 -0.50 0.00 1.57 -1.20 -1.08 116.57 114.93 3cf0 h LYS 584 Ca 0.04 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.90 3cf0 h LYS 584 Cb 0.51 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.80 3cf0 h LYS 584 CO -0.39 -0.02 0.34 0.00 -0.57 0.00 0.00 179.45 178.81 3cf0 h ALA 585 N 1.06 2.05 -0.01 3.86 0.00 -0.22 -0.04 119.26 125.96 3cf0 h ALA 585 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3cf0 h ALA 585 Cb 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3cf0 h ALA 585 CO -0.94 -0.16 -0.08 2.89 0.00 0.00 0.00 179.25 180.96 3cf0 n ARG 586 N -4.47 1.11 0.00 0.00 1.85 -0.12 -4.87 116.66 110.17 3cf0 n ARG 586 Ca 0.08 -0.51 0.00 0.00 -1.00 0.00 0.00 57.85 56.42 3cf0 n ARG 586 Cb 0.34 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.26 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 1.21 1.15 7.00 2.89 0.00 -0.04 -3.56 105.19 113.84 3cf0 n GLY 587 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 3.18 0.38 -0.02 0.00 -0.52 -2.87 105.19 105.34 3cf0 n GLY 588 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 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 7.88 -0.76 -0.06 1.61 3.02 -1.26 -3.17 115.26 122.51 3cf0 n ASN 589 Ca 0.00 1.68 -0.03 0.00 -0.03 0.00 0.00 54.58 56.20 3cf0 n ASN 589 Cb 0.00 -0.32 -0.02 0.00 -0.61 0.00 0.00 39.78 38.83 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 0.20 0.00 2.41 3.07 -1.98 -3.51 117.51 117.69 3cf0 h ILE 590 Ca 0.27 -1.16 0.00 0.00 1.55 0.00 0.00 64.86 65.51 3cf0 h ILE 590 Cb 0.50 0.38 0.00 0.00 -0.27 0.00 0.00 36.82 37.44 3cf0 h ILE 590 CO -0.93 0.07 0.00 0.61 -1.05 0.00 0.00 178.15 176.85 3cf0 n GLY 591 N 1.72 -1.80 0.00 0.16 0.00 -1.14 -5.02 105.19 99.11 3cf0 n GLY 591 Ca -0.03 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.15 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 0.20 0.38 0.45 1.61 5.75 -1.23 -4.73 116.55 118.98 3cf0 n ASP 592 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 54.79 54.59 3cf0 n ASP 592 Cb 0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 39.99 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 -1.21 -0.76 6.12 0.00 -1.95 -3.48 103.07 101.78 3cf0 h GLY 593 Ca 0.00 0.46 -0.37 0.00 0.00 0.00 0.00 47.33 47.42 3cf0 h GLY 593 CO 0.00 -0.44 0.33 0.61 0.00 0.00 0.00 176.54 177.04 3cf0 n GLY 594 N -1.59 -1.67 0.00 4.60 0.00 -1.26 -5.10 105.19 100.17 3cf0 n GLY 594 Ca -0.15 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.87 -0.56 0.27 -0.02 0.00 -1.26 -4.95 105.19 95.80 3cf0 n GLY 595 Ca 0.14 -1.74 0.13 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.60 1.45 -2.95 4.61 0.00 -1.96 -3.44 119.26 115.38 3cf0 h ALA 596 Ca 0.00 -0.07 -0.54 0.00 0.00 0.00 0.00 54.91 54.31 3cf0 h ALA 596 Cb 0.00 -0.01 0.11 0.00 0.00 0.00 0.00 17.79 17.89 3cf0 h ALA 596 CO 0.00 0.09 0.67 0.00 0.00 0.00 0.00 179.25 180.02 3cf0 s ALA 597 N -4.45 3.24 0.06 0.00 0.00 -1.26 -4.62 121.76 114.72 3cf0 s ALA 597 Ca -0.04 1.40 -0.07 0.00 0.00 0.00 0.00 51.96 53.25 3cf0 s ALA 597 Cb 0.14 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 3cf0 s ALA 597 CO 0.58 -1.09 0.13 0.16 0.00 0.00 0.00 175.76 175.54 3cf0 s ASP 598 N -0.58 0.17 0.27 0.00 1.47 -1.26 -5.04 116.67 111.70 3cf0 s ASP 598 Ca 0.60 -0.61 -0.01 0.00 1.18 0.00 0.00 52.55 53.71 3cf0 s ASP 598 Cb -0.42 0.27 0.47 0.00 -0.34 0.00 0.00 42.92 42.90 3cf0 s ASP 598 CO 0.54 -0.61 1.85 0.08 0.68 0.00 0.00 175.17 177.71 3cf0 h ARG 599 N 3.24 1.01 0.06 2.11 0.11 -1.98 -0.46 114.38 118.47 3cf0 h ARG 599 Ca -0.33 -0.06 -0.00 0.00 0.10 0.00 0.00 59.98 59.69 3cf0 h ARG 599 Cb 1.18 -0.23 0.00 0.00 1.11 0.00 0.00 29.97 32.04 3cf0 h ARG 599 CO 0.54 0.67 -0.03 0.28 0.10 0.00 0.00 179.97 181.53 3cf0 h VAL 600 N 1.04 0.90 -0.99 0.08 2.07 -1.94 -2.45 116.25 114.95 3cf0 h VAL 600 Ca 0.46 -1.50 0.05 0.00 0.82 0.00 0.00 66.70 66.53 3cf0 h VAL 600 Cb 0.34 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 31.69 3cf0 h VAL 600 CO -0.23 0.28 0.65 0.40 0.02 0.00 0.00 177.57 178.69 3cf0 h ILE 601 N -0.96 1.13 -0.92 4.57 1.08 -1.95 -0.88 117.51 119.58 3cf0 h ILE 601 Ca -0.01 -0.42 0.12 0.00 -0.39 0.00 0.00 64.86 64.17 3cf0 h ILE 601 Cb 0.52 -0.19 -0.08 0.00 -3.07 0.00 0.00 36.82 34.00 3cf0 h ILE 601 CO 0.01 0.22 0.55 -1.13 -0.69 0.00 0.00 178.15 177.11 3cf0 h ASN 602 N 1.21 0.78 -0.04 1.72 -1.24 -1.08 0.19 115.58 117.12 3cf0 h ASN 602 Ca 0.41 0.06 -0.00 0.00 0.71 0.00 0.00 56.30 57.48 3cf0 h ASN 602 Cb 0.08 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 39.04 3cf0 h ASN 602 CO -0.15 0.40 0.01 -0.61 -1.29 0.00 0.00 177.43 175.80 3cf0 h GLN 603 N 0.86 0.06 -1.02 6.67 5.75 -0.67 -0.09 115.11 126.67 3cf0 h GLN 603 Ca 0.46 -0.01 0.29 0.00 -0.15 0.00 0.00 58.65 59.24 3cf0 h GLN 603 Cb 0.50 -0.01 -0.13 0.00 1.07 0.00 0.00 27.48 28.90 3cf0 h GLN 603 CO -0.28 0.22 0.60 0.82 -2.65 0.00 0.00 178.83 177.54 3cf0 h ILE 604 N -0.11 0.42 -0.21 2.39 2.04 -0.46 -0.22 117.51 121.36 3cf0 h ILE 604 Ca 0.01 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.66 3cf0 h ILE 604 Cb 0.18 -0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.20 3cf0 h ILE 604 CO -0.00 0.08 -0.13 -0.07 0.00 0.00 0.00 178.15 178.03 3cf0 h LEU 605 N 0.44 0.48 0.18 1.44 3.38 0.11 -2.75 115.31 118.59 3cf0 h LEU 605 Ca 0.69 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 58.23 3cf0 h LEU 605 Cb 1.48 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 3cf0 h LEU 605 CO -0.52 0.80 -0.19 0.74 0.09 0.00 0.00 178.44 179.36 3cf0 h THR 606 N 0.15 0.58 0.00 0.22 2.02 -0.46 -1.75 112.91 113.66 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 0.64 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3cf0 h THR 606 CO 0.04 0.00 0.07 -0.62 0.37 0.00 0.00 175.52 175.38 3cf0 n GLU 607 N -5.32 0.00 -0.01 6.66 -0.58 -0.17 -0.13 120.64 121.10 3cf0 n GLU 607 Ca -0.08 0.24 0.02 0.00 -0.42 0.00 0.00 57.16 56.93 3cf0 n GLU 607 Cb 0.23 -1.57 -0.06 0.00 -0.57 0.00 0.00 31.44 29.48 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 -1.20 0.76 0.01 3.49 1.56 -0.82 -3.54 117.12 117.38 3cf0 n MET 608 Ca 0.00 -0.05 -0.18 0.00 -0.27 0.00 0.00 57.70 57.20 3cf0 n MET 608 Cb 0.07 -1.17 -0.13 0.00 2.15 0.00 0.00 33.22 34.14 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 0.36 0.66 6.12 3.32 0.31 -3.29 116.42 123.91 3cf0 h ASP 609 Ca -0.04 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.13 3cf0 h ASP 609 Cb 0.55 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.99 3cf0 h ASP 609 CO 0.00 1.21 0.00 0.61 -1.72 0.00 0.00 179.24 179.34 3cf0 n GLY 610 N 1.39 -1.16 3.49 2.75 0.00 0.45 -4.64 105.19 107.47 3cf0 n GLY 610 Ca -0.12 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.04 3.23 -0.09 1.61 0.00 -1.23 -4.98 119.30 114.80 3cf0 s MET 611 Ca 0.08 -0.56 -0.39 0.00 0.00 0.00 0.00 55.69 54.83 3cf0 s MET 611 Cb 0.12 -4.11 -0.16 0.00 0.00 0.00 0.00 34.83 30.67 3cf0 s MET 611 CO 0.35 -1.51 1.51 0.45 0.00 0.00 0.00 175.02 175.82 3cf0 n SER 612 N 7.21 1.89 -0.15 1.11 2.88 -1.26 -4.81 113.62 120.49 3cf0 n SER 612 Ca -0.02 1.10 0.29 0.00 -1.33 0.00 0.00 58.87 58.91 3cf0 n SER 612 Cb 0.46 -1.15 0.67 0.00 -0.75 0.00 0.00 64.21 63.44 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 4.17 0.26 -0.07 2.46 1.03 -1.93 -2.10 112.91 116.73 3cf0 h THR 613 Ca -0.47 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.93 3cf0 h THR 613 Cb 1.33 0.37 0.00 0.00 -1.07 0.00 0.00 68.15 68.78 3cf0 h THR 613 CO 0.86 0.00 0.00 0.29 -0.01 0.00 0.00 175.52 176.66 3cf0 n LYS 614 N -3.73 1.76 0.00 0.00 5.02 -1.26 -4.77 118.16 115.18 3cf0 n LYS 614 Ca 0.19 -1.12 0.00 0.00 -2.02 0.00 0.00 58.31 55.36 3cf0 n LYS 614 Cb 1.13 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.68 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 0.35 -0.53 -1.98 1.97 4.76 -0.79 -5.01 118.16 116.93 3cf0 n LYS 615 Ca 0.18 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.39 3cf0 n LYS 615 Cb 0.38 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.59 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 -2.96 4.85 -4.46 4.39 2.85 -1.26 -5.01 115.26 113.67 3cf0 n ASN 616 Ca 0.00 -3.75 -0.36 0.00 -0.11 0.00 0.00 54.58 50.36 3cf0 n ASN 616 Cb 0.00 -0.35 -0.12 0.00 1.24 0.00 0.00 39.78 40.55 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 -4.56 4.19 -0.20 3.44 1.01 -1.26 -1.67 120.40 121.35 3cf0 s VAL 617 Ca 0.51 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 3cf0 s VAL 617 Cb 0.41 -2.93 -0.02 0.00 0.00 0.00 0.00 36.38 33.84 3cf0 s VAL 617 CO 0.04 0.38 -0.02 0.12 0.00 0.00 0.00 175.10 175.62 3cf0 s PHE 618 N 1.30 3.01 -0.16 5.22 5.36 0.11 -4.97 117.98 127.85 3cf0 s PHE 618 Ca 0.04 -0.56 -0.08 0.00 -0.96 0.00 0.00 56.93 55.38 3cf0 s PHE 618 Cb -0.15 -2.07 -0.04 0.00 -0.34 0.00 0.00 43.02 40.42 3cf0 s PHE 618 CO 0.02 -0.30 0.12 0.42 -1.46 0.00 0.00 175.22 174.02 3cf0 s ILE 619 N 1.05 5.28 -0.07 3.12 1.01 -1.02 -0.24 121.20 130.33 3cf0 s ILE 619 Ca 0.02 0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.81 3cf0 s ILE 619 Cb -0.14 -3.35 0.02 0.00 0.01 0.00 0.00 42.46 38.99 3cf0 s ILE 619 CO 0.01 0.52 -0.10 -0.63 0.00 0.00 0.00 174.94 174.75 3cf0 s ILE 620 N -0.26 0.99 0.15 2.92 1.01 0.12 -1.73 121.20 124.40 3cf0 s ILE 620 Ca 0.10 -0.36 0.05 0.00 0.00 0.00 0.00 60.65 60.45 3cf0 s ILE 620 Cb -0.12 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 3cf0 s ILE 620 CO 0.01 0.33 0.08 -0.83 0.00 0.00 0.00 174.94 174.53 3cf0 s GLY 621 N 0.97 1.77 0.02 6.18 0.00 0.29 0.82 107.32 117.37 3cf0 s GLY 621 Ca -0.09 -1.23 -0.00 0.00 0.00 0.00 0.00 44.72 43.40 3cf0 s GLY 621 CO 0.00 -1.23 -0.02 0.00 0.00 0.00 0.00 173.10 171.85 3cf0 s ALA 622 N -1.67 0.09 -0.15 3.20 0.00 -0.35 -0.79 121.76 122.08 3cf0 s ALA 622 Ca 0.29 -0.51 -0.29 0.00 0.00 0.00 0.00 51.96 51.46 3cf0 s ALA 622 Cb -0.10 0.13 0.09 0.00 0.00 0.00 0.00 23.12 23.24 3cf0 s ALA 622 CO 0.22 -0.14 0.79 -0.08 0.00 0.00 0.00 175.76 176.54 3cf0 s THR 623 N -1.30 0.00 -0.17 0.00 -1.32 -0.84 -1.62 115.64 110.39 3cf0 s THR 623 Ca -0.14 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.51 3cf0 s THR 623 Cb -0.09 -1.00 0.47 0.00 -1.51 0.00 0.00 72.50 70.37 3cf0 s THR 623 CO -0.01 0.00 1.36 -0.46 -2.21 0.00 0.00 174.62 173.30 3cf0 n ASN 624 N 1.48 3.51 -3.16 8.08 2.04 -1.26 -2.57 115.26 123.39 3cf0 n ASN 624 Ca -0.15 -3.03 -0.19 0.00 -0.44 0.00 0.00 54.58 50.77 3cf0 n ASN 624 Cb 0.57 -0.51 -0.04 0.00 -2.53 0.00 0.00 39.78 37.26 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 -0.72 0.88 -0.04 -3.83 5.12 -1.26 -4.81 116.66 111.98 3cf0 n ARG 625 Ca 0.20 -3.22 -0.05 0.00 -1.93 0.00 0.00 57.85 52.86 3cf0 n ARG 625 Cb 0.83 -1.50 0.17 0.00 -1.16 0.00 0.00 32.46 30.80 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 3.38 0.64 -1.57 5.56 0.13 -1.96 -0.08 132.00 138.10 3cf0 h PRO 626 Ca 0.07 -0.22 0.49 0.00 -0.87 0.00 0.00 66.00 65.48 3cf0 h PRO 626 Cb 0.95 -0.05 -0.11 0.00 0.13 0.00 0.00 31.00 31.92 3cf0 h PRO 626 CO 0.46 0.77 1.08 0.38 -0.23 0.00 0.00 178.00 180.46 3cf0 h ASP 627 N 0.58 0.12 0.04 1.44 2.03 -1.98 -1.61 116.42 117.04 3cf0 h ASP 627 Ca 0.10 0.08 0.00 0.00 -0.73 0.00 0.00 57.03 56.47 3cf0 h ASP 627 Cb 0.60 0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 3cf0 h ASP 627 CO 0.04 -0.11 -0.73 2.30 -1.03 0.00 0.00 179.24 179.71 3cf0 n ILE 628 N -4.37 0.00 -1.67 4.15 -5.35 -0.04 -4.96 119.36 107.11 3cf0 n ILE 628 Ca 0.40 -0.10 -0.43 0.00 -0.27 0.00 0.00 62.75 62.34 3cf0 n ILE 628 Cb 1.67 1.02 -0.01 0.00 -1.74 0.00 0.00 39.64 40.57 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 -0.90 1.97 -1.95 7.28 2.08 -0.61 -4.89 119.36 122.35 3cf0 n ILE 629 Ca 0.06 -0.49 -0.42 0.00 0.56 0.00 0.00 62.75 62.46 3cf0 n ILE 629 Cb 0.38 -1.45 -0.03 0.00 -0.75 0.00 0.00 39.64 37.80 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 -0.35 6.63 0.42 4.38 2.15 -1.26 -4.90 116.67 123.74 3cf0 s ASP 630 Ca 0.56 2.33 0.21 0.00 0.43 0.00 0.00 52.55 56.09 3cf0 s ASP 630 Cb -0.60 -2.54 1.18 0.00 -0.30 0.00 0.00 42.92 40.66 3cf0 s ASP 630 CO 0.61 -0.94 1.78 -0.65 -0.17 0.00 0.00 175.17 175.81 3cf0 h PRO 631 N 9.55 0.32 -1.13 4.34 0.11 -1.95 -1.12 132.00 142.12 3cf0 h PRO 631 Ca -0.41 -0.02 0.33 0.00 0.11 0.00 0.00 66.00 66.01 3cf0 h PRO 631 Cb 1.19 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.18 3cf0 h PRO 631 CO 0.95 0.21 0.81 0.00 -0.21 0.00 0.00 178.00 179.76 3cf0 h ALA 632 N 1.59 3.07 0.00 -0.75 0.00 -1.99 0.31 119.26 121.49 3cf0 h ALA 632 Ca 0.58 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.44 3cf0 h ALA 632 Cb 1.60 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 3cf0 h ALA 632 CO -0.24 -1.39 -0.02 0.82 0.00 0.00 0.00 179.25 178.42 3cf0 h ILE 633 N 0.00 0.24 0.00 0.00 2.04 -1.59 -2.93 117.51 115.27 3cf0 h ILE 633 Ca 0.54 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 66.26 3cf0 h ILE 633 Cb 2.15 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 3cf0 h ILE 633 CO -0.01 0.02 -1.50 0.18 0.00 0.00 0.00 178.15 176.84 3cf0 n LEU 634 N -3.38 0.40 -4.46 1.44 4.77 0.11 -1.54 117.00 114.34 3cf0 n LEU 634 Ca -0.02 0.07 -0.39 0.00 -0.03 0.00 0.00 56.01 55.64 3cf0 n LEU 634 Cb 0.12 -0.03 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3cf0 n LEU 634 CO 0.24 -0.04 0.04 0.54 -1.33 0.00 0.00 177.39 176.84 3cf0 n ARG 635 N -2.31 0.51 -1.47 3.23 1.74 -1.11 -4.32 116.66 112.94 3cf0 n ARG 635 Ca -0.02 0.20 -0.48 0.00 -0.77 0.00 0.00 57.85 56.79 3cf0 n ARG 635 Cb 0.53 -1.64 -0.03 0.00 -1.02 0.00 0.00 32.46 30.30 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 0.14 0.43 -0.62 5.56 -0.02 -1.26 -2.51 135.00 136.71 3cf0 n PRO 636 Ca 0.11 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3cf0 n PRO 636 Cb 0.46 -1.30 0.00 0.00 -0.02 0.00 0.00 33.50 32.64 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 1.76 0.74 0.00 -1.23 0.00 -1.26 -4.97 105.19 100.23 3cf0 n GLY 637 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.38 0.00 -2.98 1.61 1.74 -1.04 -4.81 116.66 108.80 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 -0.00 0.00 -1.02 0.00 0.00 32.46 31.44 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 5.17 0.15 0.55 1.43 -0.59 -3.47 118.68 121.93 3cf0 s LEU 639 Ca 0.00 -2.94 -0.06 0.00 -1.03 0.00 0.00 54.13 50.10 3cf0 s LEU 639 Cb 0.00 -2.38 -0.01 0.00 0.03 0.00 0.00 46.19 43.83 3cf0 s LEU 639 CO 0.00 -0.74 1.40 0.44 0.23 0.00 0.00 176.35 177.68 3cf0 h ASP 640 N 7.30 0.67 -2.84 2.29 5.19 -1.75 -3.38 116.42 123.90 3cf0 h ASP 640 Ca 0.29 -0.43 -0.68 0.00 -0.62 0.00 0.00 57.03 55.59 3cf0 h ASP 640 Cb 0.89 -0.20 -0.19 0.00 0.18 0.00 0.00 39.33 40.02 3cf0 h ASP 640 CO 1.21 1.18 0.23 -1.10 -3.12 0.00 0.00 179.24 177.65 3cf0 s GLN 641 N -3.74 3.07 0.23 3.56 -1.52 -1.23 -4.95 119.66 115.08 3cf0 s GLN 641 Ca -0.08 -1.22 -0.30 0.00 -1.95 0.00 0.00 55.36 51.81 3cf0 s GLN 641 Cb 0.10 -4.27 -0.09 0.00 -0.22 0.00 0.00 33.01 28.53 3cf0 s GLN 641 CO 0.86 -1.61 1.16 -0.51 -0.25 0.00 0.00 175.29 174.94 3cf0 s LEU 642 N 3.00 4.49 -0.05 2.90 2.01 -1.26 -0.36 118.68 129.41 3cf0 s LEU 642 Ca 0.14 2.26 -0.02 0.00 0.01 0.00 0.00 54.13 56.52 3cf0 s LEU 642 Cb -0.22 -3.62 0.04 0.00 0.01 0.00 0.00 46.19 42.40 3cf0 s LEU 642 CO 0.07 -0.28 0.09 -0.63 1.01 0.00 0.00 176.35 176.61 3cf0 s ILE 643 N -0.55 -0.12 -0.18 -0.59 1.01 -0.35 -4.91 121.20 115.51 3cf0 s ILE 643 Ca 0.49 0.32 -0.20 0.00 0.00 0.00 0.00 60.65 61.26 3cf0 s ILE 643 Cb -0.32 -0.19 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 3cf0 s ILE 643 CO 0.39 0.13 0.57 -0.47 0.00 0.00 0.00 174.94 175.56 3cf0 s TYR 644 N 1.75 3.40 -0.44 3.97 5.04 -1.26 -1.35 117.35 128.47 3cf0 s TYR 644 Ca -0.01 0.88 -0.07 0.00 -2.44 0.00 0.00 57.07 55.43 3cf0 s TYR 644 Cb -0.12 -2.72 0.11 0.00 0.35 0.00 0.00 41.96 39.58 3cf0 s TYR 644 CO -0.04 -0.09 0.27 0.42 -1.34 0.00 0.00 175.55 174.77 3cf0 s ILE 645 N 1.57 3.82 0.71 3.14 1.09 0.61 -4.95 121.20 127.20 3cf0 s ILE 645 Ca 0.27 -1.83 -0.08 0.00 -1.10 0.00 0.00 60.65 57.91 3cf0 s ILE 645 Cb -0.16 -3.52 0.05 0.00 -1.06 0.00 0.00 42.46 37.77 3cf0 s ILE 645 CO 0.11 -0.69 1.04 -2.16 -0.10 0.00 0.00 174.94 173.13 3cf0 s PRO 646 N 1.28 2.34 0.65 2.79 0.04 -1.26 -3.84 135.00 137.01 3cf0 s PRO 646 Ca 0.06 -0.06 -0.17 0.00 0.04 0.00 0.00 61.00 60.87 3cf0 s PRO 646 Cb -0.24 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 3cf0 s PRO 646 CO -0.02 -1.20 0.91 1.28 0.04 0.00 0.00 177.00 178.01 3cf0 n LEU 647 N -2.96 3.34 -4.74 -3.56 4.32 -1.26 -4.93 117.00 107.21 3cf0 n LEU 647 Ca 0.07 0.74 -0.41 0.00 -0.02 0.00 0.00 56.01 56.39 3cf0 n LEU 647 Cb 0.60 -1.37 -0.03 0.00 -1.62 0.00 0.00 43.42 40.99 3cf0 n LEU 647 CO 0.54 -2.08 0.89 -2.16 -1.22 0.00 0.00 177.39 173.37 3cf0 s PRO 648 N -2.93 4.49 0.92 3.23 0.04 -1.26 -5.03 135.00 134.45 3cf0 s PRO 648 Ca 0.75 1.93 -0.12 0.00 0.04 0.00 0.00 61.00 63.60 3cf0 s PRO 648 Cb -0.39 -3.21 0.20 0.00 0.04 0.00 0.00 34.50 31.15 3cf0 s PRO 648 CO 0.49 -0.07 1.25 0.16 0.04 0.00 0.00 177.00 178.87 3cf0 s ASP 649 N -0.09 3.25 0.02 6.66 -4.77 -1.26 -4.74 116.67 115.74 3cf0 s ASP 649 Ca 0.51 -0.04 -0.03 0.00 -3.30 0.00 0.00 52.55 49.69 3cf0 s ASP 649 Cb -0.34 -0.01 -0.01 0.00 -1.09 0.00 0.00 42.92 41.48 3cf0 s ASP 649 CO 0.39 -2.62 0.62 -0.62 0.70 0.00 0.00 175.17 173.64 3cf0 n GLU 650 N -3.56 -0.04 -0.10 2.11 4.71 -1.26 -0.74 120.64 121.76 3cf0 n GLU 650 Ca 0.17 0.62 -0.10 0.00 -0.01 0.00 0.00 57.16 57.83 3cf0 n GLU 650 Cb 0.60 -0.92 -0.02 0.00 -1.01 0.00 0.00 31.44 30.08 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 0.45 -0.95 3.49 1.57 -1.95 -3.12 116.57 116.06 3cf0 h LYS 651 Ca 0.02 -0.08 0.08 0.00 -1.87 0.00 0.00 60.65 58.80 3cf0 h LYS 651 Cb 0.04 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.21 3cf0 h LYS 651 CO -0.09 0.46 0.60 0.77 -0.57 0.00 0.00 179.45 180.62 3cf0 h SER 652 N 0.34 0.92 -0.71 0.86 0.02 -1.79 -0.36 113.55 112.84 3cf0 h SER 652 Ca 0.10 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 3cf0 h SER 652 Cb 0.18 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 3cf0 h SER 652 CO -0.01 0.56 0.47 0.03 -1.14 0.00 0.00 176.83 176.74 3cf0 h ARG 653 N 1.04 0.88 0.31 3.45 3.08 -0.87 0.78 114.38 123.05 3cf0 h ARG 653 Ca 0.43 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.41 3cf0 h ARG 653 Cb 0.27 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3cf0 h ARG 653 CO -0.21 0.58 -0.15 0.28 -1.07 0.00 0.00 179.97 179.41 3cf0 h VAL 654 N 0.91 0.71 -0.50 2.04 2.07 -1.12 -1.23 116.25 119.13 3cf0 h VAL 654 Ca 0.27 -0.15 0.10 0.00 0.82 0.00 0.00 66.70 67.74 3cf0 h VAL 654 Cb -0.03 0.80 -0.09 0.00 -1.52 0.00 0.00 31.29 30.44 3cf0 h VAL 654 CO -0.07 0.03 -0.11 0.00 0.02 0.00 0.00 177.57 177.45 3cf0 h ALA 655 N 0.18 0.35 -0.59 1.67 0.00 -0.98 -0.22 119.26 119.68 3cf0 h ALA 655 Ca -0.04 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3cf0 h ALA 655 Cb 0.37 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 3cf0 h ALA 655 CO 0.07 -0.43 0.32 0.82 0.00 0.00 0.00 179.25 180.02 3cf0 h ILE 656 N 0.02 0.98 -0.14 0.00 2.04 -0.71 0.58 117.51 120.27 3cf0 h ILE 656 Ca 0.24 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 3cf0 h ILE 656 Cb 0.37 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 3cf0 h ILE 656 CO -0.50 0.11 0.08 -0.07 0.00 0.00 0.00 178.15 177.77 3cf0 h LEU 657 N 0.61 0.18 -0.06 1.44 3.38 -0.41 -0.24 115.31 120.21 3cf0 h LEU 657 Ca 0.26 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.19 3cf0 h LEU 657 Cb 0.14 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3cf0 h LEU 657 CO -0.16 0.19 -0.11 0.11 0.09 0.00 0.00 178.44 178.56 3cf0 h LYS 658 N 0.15 -0.15 -0.70 1.13 1.57 -0.35 -0.99 116.57 117.23 3cf0 h LYS 658 Ca 0.05 0.01 0.10 0.00 -1.87 0.00 0.00 60.65 58.94 3cf0 h LYS 658 Cb 0.05 0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.31 3cf0 h LYS 658 CO -0.01 -0.10 0.32 0.00 -0.57 0.00 0.00 179.45 179.09 3cf0 h ALA 659 N 0.87 0.96 0.00 3.86 0.00 0.25 0.49 119.26 125.69 3cf0 h ALA 659 Ca 0.06 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3cf0 h ALA 659 Cb 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3cf0 h ALA 659 CO -0.15 -0.11 0.00 -0.91 0.00 0.00 0.00 179.25 178.08 3cf0 h ASN 660 N 0.54 0.00 -0.04 0.00 4.21 -0.41 -2.99 115.58 116.88 3cf0 h ASN 660 Ca 0.36 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.87 3cf0 h ASN 660 Cb 0.42 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.62 3cf0 h ASN 660 CO -0.30 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.02 3cf0 n LEU 661 N -2.48 1.71 -0.32 1.61 4.77 -0.32 -4.69 117.00 117.28 3cf0 n LEU 661 Ca 0.02 -1.19 0.13 0.00 -0.03 0.00 0.00 56.01 54.95 3cf0 n LEU 661 Cb 0.28 -0.02 0.28 0.00 -2.33 0.00 0.00 43.42 41.62 3cf0 n LEU 661 CO 0.23 0.37 0.85 0.03 -1.33 0.00 0.00 177.39 177.54 3cf0 h ARG 662 N 1.22 0.07 -1.64 3.23 3.08 -0.82 0.48 114.38 120.00 3cf0 h ARG 662 Ca 0.00 -0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.33 3cf0 h ARG 662 Cb 0.33 -0.02 -0.30 0.00 0.08 0.00 0.00 29.97 30.07 3cf0 h ARG 662 CO 0.00 0.05 0.74 1.63 -1.07 0.00 0.00 179.97 181.31 3cf0 n LYS 663 N -5.39 2.85 -3.87 0.04 5.02 -1.26 -4.96 118.16 110.59 3cf0 n LYS 663 Ca 0.22 -3.60 -0.11 0.00 -2.02 0.00 0.00 58.31 52.79 3cf0 n LYS 663 Cb 0.71 -2.27 -0.11 0.00 -0.02 0.00 0.00 35.03 33.35 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 -1.65 -0.00 -1.32 4.39 0.01 0.16 -5.09 113.70 110.19 3cf0 s SER 664 Ca 0.55 -0.11 -0.18 0.00 1.31 0.00 0.00 55.95 57.53 3cf0 s SER 664 Cb 0.45 0.22 0.05 0.00 0.21 0.00 0.00 66.02 66.96 3cf0 s SER 664 CO -0.27 -0.29 1.84 -2.65 0.41 0.00 0.00 173.24 172.28 3cf0 n PRO 665 N 1.84 3.03 -2.49 12.44 -0.02 -1.26 -4.97 135.00 143.56 3cf0 n PRO 665 Ca -0.20 -3.09 -0.43 0.00 -2.02 0.00 0.00 63.50 57.76 3cf0 n PRO 665 Cb 0.56 -3.47 -0.02 0.00 -0.02 0.00 0.00 33.50 30.55 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 4.42 4.37 0.39 -1.45 -7.23 -1.26 -0.78 120.40 118.86 3cf0 s VAL 666 Ca 0.54 1.67 -0.26 0.00 -1.81 0.00 0.00 61.98 62.11 3cf0 s VAL 666 Cb 0.06 -4.08 -0.11 0.00 0.56 0.00 0.00 36.38 32.81 3cf0 s VAL 666 CO 0.05 -0.08 1.29 0.00 -0.31 0.00 0.00 175.10 176.05 3cf0 n ALA 667 N 5.95 1.35 -0.29 1.32 0.00 -0.19 -4.91 120.51 123.75 3cf0 n ALA 667 Ca 0.12 0.30 -0.05 0.00 0.00 0.00 0.00 53.44 53.82 3cf0 n ALA 667 Cb 0.46 -2.27 0.07 0.00 0.00 0.00 0.00 19.45 17.71 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 2.29 1.06 -0.81 0.00 1.57 -1.94 -3.07 116.57 115.67 3cf0 h LYS 668 Ca -0.47 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.18 3cf0 h LYS 668 Cb 1.29 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 33.34 3cf0 h LYS 668 CO 0.61 0.75 0.38 0.38 -0.57 0.00 0.00 179.45 181.00 3cf0 h ASP 669 N 1.07 1.07 -0.86 0.86 2.03 -1.98 -3.45 116.42 115.16 3cf0 h ASP 669 Ca 0.28 -0.14 -0.79 0.00 -0.73 0.00 0.00 57.03 55.65 3cf0 h ASP 669 Cb -0.04 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 38.18 3cf0 h ASP 669 CO -0.05 0.91 1.02 0.52 -1.03 0.00 0.00 179.24 180.60 3cf0 n VAL 670 N -4.33 0.10 -3.40 4.15 0.31 -1.16 -4.91 118.33 109.08 3cf0 n VAL 670 Ca 0.08 -0.05 -0.44 0.00 -0.01 0.00 0.00 64.34 63.92 3cf0 n VAL 670 Cb 0.14 -0.82 -0.09 0.00 -0.91 0.00 0.00 33.84 32.16 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 4.54 6.14 0.05 4.52 2.15 -1.26 -4.93 116.67 127.88 3cf0 s ASP 671 Ca 1.08 -1.02 -0.10 0.00 0.43 0.00 0.00 52.55 52.93 3cf0 s ASP 671 Cb -1.31 -2.18 -0.32 0.00 -0.30 0.00 0.00 42.92 38.80 3cf0 s ASP 671 CO 0.69 -0.56 1.04 -0.07 -0.17 0.00 0.00 175.17 176.10 3cf0 h LEU 672 N 8.79 0.65 -2.02 -1.34 3.38 -1.99 -3.01 115.31 119.77 3cf0 h LEU 672 Ca -0.27 -0.71 0.12 0.00 0.09 0.00 0.00 57.88 57.11 3cf0 h LEU 672 Cb 1.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3cf0 h LEU 672 CO 0.80 1.56 0.41 -0.33 0.09 0.00 0.00 178.44 180.97 3cf0 h GLU 673 N 0.11 0.00 0.00 1.13 3.07 -1.95 0.37 114.58 117.31 3cf0 h GLU 673 Ca -0.21 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.62 3cf0 h GLU 673 Cb 2.08 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.99 3cf0 h GLU 673 CO 0.24 0.00 -0.19 0.35 -1.40 0.00 0.00 179.01 178.01 3cf0 h PHE 674 N 0.00 0.00 -0.98 4.33 3.57 -1.98 -3.01 116.94 118.87 3cf0 h PHE 674 Ca 0.20 0.00 0.30 0.00 3.53 0.00 0.00 57.97 62.00 3cf0 h PHE 674 Cb 1.01 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 39.60 3cf0 h PHE 674 CO 0.00 0.70 0.50 -0.07 -2.23 0.00 0.00 178.31 177.21 3cf0 h LEU 675 N -1.00 0.41 -0.93 0.59 3.38 -0.98 0.54 115.31 117.31 3cf0 h LEU 675 Ca -0.04 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3cf0 h LEU 675 Cb 0.71 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 3cf0 h LEU 675 CO -0.03 -0.14 0.59 0.00 0.09 0.00 0.00 178.44 178.95 3cf0 h ALA 676 N 1.84 1.18 0.00 1.53 0.00 -0.42 -1.83 119.26 121.57 3cf0 h ALA 676 Ca 0.70 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.46 3cf0 h ALA 676 Cb 1.56 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3cf0 h ALA 676 CO -0.62 0.62 -0.27 0.87 0.00 0.00 0.00 179.25 179.84 3cf0 h LYS 677 N 1.27 0.00 0.00 0.00 1.79 0.16 -3.16 116.57 116.63 3cf0 h LYS 677 Ca 0.34 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 3cf0 h LYS 677 Cb -0.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.56 3cf0 h LYS 677 CO -0.07 0.27 0.00 -1.33 -1.08 0.00 0.00 179.45 177.25 3cf0 n MET 678 N -4.18 0.13 -4.91 3.15 2.81 -0.33 -4.84 117.12 108.96 3cf0 n MET 678 Ca -0.02 0.06 -0.27 0.00 -1.81 0.00 0.00 57.70 55.66 3cf0 n MET 678 Cb 0.33 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.17 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 -2.85 1.54 0.00 2.03 -4.23 -1.19 -5.09 115.64 105.86 3cf0 s THR 679 Ca 0.17 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.90 3cf0 s THR 679 Cb 0.17 -1.32 0.00 0.00 1.34 0.00 0.00 72.50 72.68 3cf0 s THR 679 CO 0.43 0.44 0.00 0.59 -0.54 0.00 0.00 174.62 175.55 3cf0 n ASN 680 N 3.17 0.00 -0.40 3.99 3.02 -1.26 -4.73 115.26 119.05 3cf0 n ASN 680 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 3cf0 n ASN 680 Cb 0.53 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 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 3.55 0.00 3.68 7.41 0.00 -1.26 -4.49 105.19 114.07 3cf0 n GLY 681 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.79 3.46 0.40 1.61 0.40 -1.26 -3.90 117.98 117.90 3cf0 s PHE 682 Ca 0.00 1.47 0.03 0.00 -0.60 0.00 0.00 56.93 57.83 3cf0 s PHE 682 Cb 0.00 -3.15 -0.01 0.00 0.51 0.00 0.00 43.02 40.38 3cf0 s PHE 682 CO 0.00 -0.27 0.59 -1.54 0.70 0.00 0.00 175.22 174.70 3cf0 s SER 683 N 1.13 5.88 0.21 1.36 1.04 -1.26 -4.24 113.70 117.82 3cf0 s SER 683 Ca 0.45 0.09 -0.17 0.00 0.48 0.00 0.00 55.95 56.79 3cf0 s SER 683 Cb -0.17 -1.41 0.21 0.00 0.10 0.00 0.00 66.02 64.75 3cf0 s SER 683 CO 0.14 -0.59 1.59 1.23 0.98 0.00 0.00 173.24 176.59 3cf0 h GLY 684 N 0.60 0.14 -0.08 7.32 0.00 -1.11 -0.83 103.07 109.11 3cf0 h GLY 684 Ca -0.46 0.39 0.08 0.00 0.00 0.00 0.00 47.33 47.33 3cf0 h GLY 684 CO 0.55 -0.24 -0.30 0.00 0.00 0.00 0.00 176.54 176.56 3cf0 h ALA 685 N 1.31 -0.15 -0.87 3.60 0.00 -1.52 0.15 119.26 121.78 3cf0 h ALA 685 Ca 0.29 0.10 0.15 0.00 0.00 0.00 0.00 54.91 55.46 3cf0 h ALA 685 Cb 0.56 0.64 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 3cf0 h ALA 685 CO -0.76 -0.70 0.56 -0.44 0.00 0.00 0.00 179.25 177.91 3cf0 h ASP 686 N -0.25 0.57 -0.02 0.00 3.32 -1.47 -0.93 116.42 117.63 3cf0 h ASP 686 Ca 0.17 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.20 3cf0 h ASP 686 Cb 0.52 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3cf0 h ASP 686 CO -0.50 0.28 -0.21 -0.07 -1.72 0.00 0.00 179.24 177.01 3cf0 h LEU 687 N 0.59 0.23 -0.73 1.55 3.38 0.25 -2.82 115.31 117.76 3cf0 h LEU 687 Ca 0.44 -0.71 0.16 0.00 0.09 0.00 0.00 57.88 57.86 3cf0 h LEU 687 Cb 0.82 -0.07 -0.12 0.00 0.09 0.00 0.00 40.66 41.38 3cf0 h LEU 687 CO -0.19 0.90 0.11 0.74 0.09 0.00 0.00 178.44 180.09 3cf0 h THR 688 N -0.43 0.45 -0.81 0.22 2.02 -0.89 -1.67 112.91 111.79 3cf0 h THR 688 Ca -0.02 -0.07 0.12 0.00 0.77 0.00 0.00 66.41 67.21 3cf0 h THR 688 Cb 0.92 0.24 -0.08 0.00 -1.74 0.00 0.00 68.15 67.48 3cf0 h THR 688 CO 0.04 0.04 0.42 -0.08 0.37 0.00 0.00 175.52 176.31 3cf0 h GLU 689 N 0.19 0.64 0.84 6.66 4.57 -0.95 -1.52 114.58 125.01 3cf0 h GLU 689 Ca 0.41 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.51 3cf0 h GLU 689 Cb 0.71 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3cf0 h GLU 689 CO -0.57 0.42 -0.44 0.82 -1.18 0.00 0.00 179.01 178.07 3cf0 h ILE 690 N 0.66 0.00 -0.82 2.32 2.04 -1.07 -2.02 117.51 118.61 3cf0 h ILE 690 Ca 0.42 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.40 3cf0 h ILE 690 Cb 0.52 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.47 3cf0 h ILE 690 CO -0.32 0.00 -0.44 0.00 0.00 0.00 0.00 178.15 177.40 3cf0 h GLN 692 N -0.09 0.14 -0.85 0.00 4.20 -1.23 0.23 115.11 117.51 3cf0 h GLN 692 Ca 0.24 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 3cf0 h GLN 692 Cb 0.55 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 3cf0 h GLN 692 CO -0.85 0.10 0.44 0.00 -0.67 0.00 0.00 178.83 177.84 3cf0 h ARG 693 N 0.15 1.20 0.41 1.46 3.08 -0.18 0.36 114.38 120.86 3cf0 h ARG 693 Ca 0.37 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 3cf0 h ARG 693 Cb 0.62 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 3cf0 h ARG 693 CO -0.56 0.90 -0.35 0.00 -1.07 0.00 0.00 179.97 178.89 3cf0 h ALA 694 N 1.28 -0.79 -0.11 0.04 0.00 0.35 -0.95 119.26 119.08 3cf0 h ALA 694 Ca 0.30 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3cf0 h ALA 694 Cb 0.07 0.49 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 3cf0 h ALA 694 CO -0.04 -0.98 -0.48 0.00 0.00 0.00 0.00 179.25 177.75 3cf0 h LYS 696 N -0.53 0.08 -0.03 0.00 1.57 -0.84 0.32 116.57 117.14 3cf0 h LYS 696 Ca 0.03 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 3cf0 h LYS 696 Cb 0.61 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.91 3cf0 h LYS 696 CO -0.38 0.05 -0.36 -0.07 -0.57 0.00 0.00 179.45 178.12 3cf0 h LEU 697 N 0.08 0.37 0.09 2.94 3.38 -0.02 -1.96 115.31 120.18 3cf0 h LEU 697 Ca 0.60 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 3cf0 h LEU 697 Cb 2.20 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.83 3cf0 h LEU 697 CO -0.08 1.03 -0.05 0.00 0.09 0.00 0.00 178.44 179.43 3cf0 h ALA 698 N 0.35 -0.12 0.16 1.53 0.00 0.13 0.23 119.26 121.54 3cf0 h ALA 698 Ca -0.04 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3cf0 h ALA 698 Cb 1.06 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 3cf0 h ALA 698 CO 0.07 -0.57 -0.38 0.82 0.00 0.00 0.00 179.25 179.19 3cf0 h ILE 699 N -0.13 0.21 -0.56 0.00 2.04 -0.62 1.06 117.51 119.52 3cf0 h ILE 699 Ca -0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.95 3cf0 h ILE 699 Cb 0.10 0.21 -0.03 0.00 -0.74 0.00 0.00 36.82 36.37 3cf0 h ILE 699 CO 0.01 0.00 0.38 -0.09 0.00 0.00 0.00 178.15 178.45 3cf0 h ARG 700 N -0.65 0.32 0.00 2.37 2.43 -1.31 0.14 114.38 117.68 3cf0 h ARG 700 Ca 0.02 -0.02 -0.18 0.00 -0.81 0.00 0.00 59.98 58.99 3cf0 h ARG 700 Cb 0.66 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 3cf0 h ARG 700 CO -0.20 0.21 -0.84 1.49 -1.51 0.00 0.00 179.97 179.12 3cf0 h GLU 701 N 0.33 0.00 0.02 0.20 4.22 0.44 -2.57 114.58 117.21 3cf0 h GLU 701 Ca 0.26 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.70 3cf0 h GLU 701 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 3cf0 h GLU 701 CO -0.06 0.84 -0.01 1.03 -2.18 0.00 0.00 179.01 178.63 3cf0 h SER 702 N 0.00 -0.02 -1.39 1.04 0.87 0.29 -3.23 113.55 111.11 3cf0 h SER 702 Ca -0.01 0.00 0.40 0.00 -1.23 0.00 0.00 61.79 60.95 3cf0 h SER 702 Cb 1.52 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 63.43 3cf0 h SER 702 CO 0.11 0.01 1.09 0.40 -0.53 0.00 0.00 176.83 177.91 3cf0 h ILE 703 N -0.08 0.19 0.44 2.23 2.04 -0.96 0.25 117.51 121.62 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 0.02 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.32 3cf0 h ILE 703 CO 0.00 0.00 -0.21 -0.08 0.00 0.00 0.00 178.15 177.86 3cf0 h GLU 704 N 0.00 -0.57 -0.81 2.37 4.81 -1.56 -3.26 114.58 115.56 3cf0 h GLU 704 Ca 0.66 0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.95 3cf0 h GLU 704 Cb 2.84 0.13 -0.05 0.00 0.63 0.00 0.00 28.75 32.30 3cf0 h GLU 704 CO -0.01 -0.34 0.52 0.66 -0.73 0.00 0.00 179.01 179.12 3cf0 h SER 705 N -0.67 0.88 0.75 1.04 4.64 -0.50 -3.21 113.55 116.49 3cf0 h SER 705 Ca -0.06 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.21 3cf0 h SER 705 Cb 0.50 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.39 3cf0 h SER 705 CO 0.10 0.62 -0.36 -0.33 -0.87 0.00 0.00 176.83 175.99 3cf0 h GLU 706 N 1.04 -0.98 0.00 4.77 5.08 -1.67 -3.53 114.58 119.30 3cf0 h GLU 706 Ca 0.31 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3cf0 h GLU 706 Cb -0.04 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3cf0 h GLU 706 CO -0.10 -0.65 0.00 -0.89 -1.00 0.00 0.00 179.01 176.37 3cf0 n ILE 707 N -4.84 0.00 0.00 3.13 2.08 -1.21 -5.17 119.36 113.34 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 0.40 -0.58 0.00 0.00 -0.75 0.00 0.00 39.64 38.71 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 -0.93 0.00 -3.32 1.39 0.31 -1.26 -5.04 118.33 109.48 3cf0 n VAL 728 Ca 0.15 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 64.01 3cf0 n VAL 728 Cb 0.07 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.95 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 -0.60 3.15 -0.11 5.55 0.04 -1.26 -4.95 135.00 136.83 3cf0 s PRO 729 Ca 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 61.00 59.08 3cf0 s PRO 729 Cb 0.00 -4.33 0.06 0.00 0.04 0.00 0.00 34.50 30.26 3cf0 s PRO 729 CO 0.00 -1.32 0.23 -1.21 0.04 0.00 0.00 177.00 174.74 3cf0 s GLU 730 N 1.21 0.12 -0.26 4.56 8.01 -1.26 -4.95 118.70 126.13 3cf0 s GLU 730 Ca 0.07 0.66 -0.29 0.00 0.01 0.00 0.00 54.97 55.42 3cf0 s GLU 730 Cb -0.25 -0.11 -0.02 0.00 -4.31 0.00 0.00 34.13 29.44 3cf0 s GLU 730 CO -0.00 -0.27 1.70 -1.50 0.01 0.00 0.00 175.26 175.20 3cf0 s ILE 731 N 2.19 3.59 0.43 -1.63 -1.16 0.04 -4.73 121.20 119.92 3cf0 s ILE 731 Ca -0.00 0.64 0.05 0.00 -0.51 0.00 0.00 60.65 60.83 3cf0 s ILE 731 Cb -0.12 -3.66 -0.06 0.00 0.61 0.00 0.00 42.46 39.23 3cf0 s ILE 731 CO -0.08 -0.33 0.02 0.00 -2.81 0.00 0.00 174.94 171.73 3cf0 s ARG 732 N 5.06 1.99 0.05 3.50 1.70 -1.26 -1.03 118.95 128.97 3cf0 s ARG 732 Ca 0.75 -2.17 -0.10 0.00 -0.47 0.00 0.00 55.73 53.75 3cf0 s ARG 732 Cb -0.24 -1.52 -0.02 0.00 -0.57 0.00 0.00 34.95 32.60 3cf0 s ARG 732 CO 0.31 -0.15 0.80 -2.13 -1.08 0.00 0.00 175.30 173.06 3cf0 n ARG 733 N -1.02 -0.14 0.31 3.89 0.63 -1.26 -0.43 116.66 118.64 3cf0 n ARG 733 Ca -0.08 0.79 0.19 0.00 -0.92 0.00 0.00 57.85 57.83 3cf0 n ARG 733 Cb 0.67 -1.17 0.98 0.00 0.45 0.00 0.00 32.46 33.39 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 0.04 6.15 2.03 -1.98 0.65 116.42 123.31 3cf0 h ASP 734 Ca 0.05 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.35 3cf0 h ASP 734 Cb 0.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 3cf0 h ASP 734 CO -0.30 0.02 -0.02 0.45 -1.03 0.00 0.00 179.24 178.37 3cf0 h HIS 735 N 0.00 -0.04 -0.65 4.15 3.86 -1.11 -0.28 115.15 121.08 3cf0 h HIS 735 Ca -0.00 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3cf0 h HIS 735 Cb 0.17 0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 3cf0 h HIS 735 CO 0.00 0.35 0.42 0.74 0.86 0.00 0.00 177.93 180.30 3cf0 h PHE 736 N -0.45 0.82 0.06 2.45 0.04 -0.96 0.28 116.94 119.19 3cf0 h PHE 736 Ca -0.00 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.81 3cf0 h PHE 736 Cb 0.41 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 38.24 3cf0 h PHE 736 CO 0.06 0.53 -0.32 0.93 -0.60 0.00 0.00 178.31 178.91 3cf0 h GLU 737 N 0.88 -0.48 0.00 1.51 5.08 -0.94 0.97 114.58 121.60 3cf0 h GLU 737 Ca 0.24 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 3cf0 h GLU 737 Cb -0.09 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3cf0 h GLU 737 CO -0.05 -0.32 -0.09 1.49 -1.00 0.00 0.00 179.01 179.03 3cf0 h GLU 738 N -0.50 0.00 -0.21 2.33 4.22 -0.71 -2.21 114.58 117.50 3cf0 h GLU 738 Ca 0.05 0.00 -0.15 0.00 0.08 0.00 0.00 59.36 59.33 3cf0 h GLU 738 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 3cf0 h GLU 738 CO -0.23 0.09 -0.51 0.00 -2.18 0.00 0.00 179.01 176.19 3cf0 h ALA 739 N 1.91 0.72 0.00 2.92 0.00 0.39 -3.09 119.26 122.11 3cf0 h ALA 739 Ca -0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3cf0 h ALA 739 Cb 0.58 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3cf0 h ALA 739 CO 0.01 0.68 -0.01 0.52 0.00 0.00 0.00 179.25 180.45 3cf0 h MET 740 N 0.46 0.00 0.00 0.00 2.86 -0.18 -2.44 114.93 115.63 3cf0 h MET 740 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3cf0 h MET 740 Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3cf0 h MET 740 CO 0.10 0.01 0.00 0.54 1.06 0.00 0.00 176.91 178.62 3cf0 n ARG 741 N -3.33 0.04 -0.99 1.72 5.12 -1.17 -2.36 116.66 115.69 3cf0 n ARG 741 Ca -0.03 0.30 0.05 0.00 -1.93 0.00 0.00 57.85 56.25 3cf0 n ARG 741 Cb 0.12 -1.50 0.13 0.00 -1.16 0.00 0.00 32.46 30.04 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 -1.44 0.00 -2.68 -1.55 3.01 -0.92 -5.07 117.46 108.82 3cf0 n PHE 742 Ca 0.03 -1.06 -0.42 0.00 1.01 0.00 0.00 57.45 57.01 3cf0 n PHE 742 Cb 0.10 -0.21 -0.03 0.00 -0.01 0.00 0.00 39.48 39.33 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 -1.83 3.22 0.47 4.37 0.00 -1.00 -5.02 121.76 121.98 3cf0 s ALA 743 Ca 0.36 0.55 0.07 0.00 0.00 0.00 0.00 51.96 52.94 3cf0 s ALA 743 Cb 0.38 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 3cf0 s ALA 743 CO -0.11 -0.30 0.36 1.03 0.00 0.00 0.00 175.76 176.73 3cf0 s ARG 744 N 1.15 2.35 -0.19 0.00 1.81 -1.26 -5.12 118.95 117.69 3cf0 s ARG 744 Ca 0.52 -1.80 0.01 0.00 -1.72 0.00 0.00 55.73 52.74 3cf0 s ARG 744 Cb -0.22 -2.18 0.03 0.00 -0.45 0.00 0.00 34.95 32.13 3cf0 s ARG 744 CO 0.27 -0.37 -0.14 1.03 -0.68 0.00 0.00 175.30 175.41 3cf0 s ARG 745 N -4.16 2.40 0.16 3.54 0.52 -1.26 -4.88 118.95 115.27 3cf0 s ARG 745 Ca 0.41 -0.81 -0.12 0.00 -0.52 0.00 0.00 55.73 54.69 3cf0 s ARG 745 Cb -0.01 -2.42 0.04 0.00 0.52 0.00 0.00 34.95 33.07 3cf0 s ARG 745 CO 0.24 -0.33 1.64 0.66 0.02 0.00 0.00 175.30 177.53 3cf0 h SER 746 N 7.97 0.85 -3.44 0.23 4.64 -1.96 -3.42 113.55 118.41 3cf0 h SER 746 Ca -0.35 -0.27 -0.60 0.00 -0.47 0.00 0.00 61.79 60.11 3cf0 h SER 746 Cb 1.11 -0.23 -0.11 0.00 -0.31 0.00 0.00 62.40 62.87 3cf0 h SER 746 CO 0.54 0.90 -0.22 -0.69 -0.87 0.00 0.00 176.83 176.49 3cf0 s VAL 747 N -5.17 5.22 0.28 0.95 1.01 -1.25 -5.07 120.40 116.37 3cf0 s VAL 747 Ca -0.13 0.69 -0.08 0.00 0.00 0.00 0.00 61.98 62.47 3cf0 s VAL 747 Cb 0.12 -3.72 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 3cf0 s VAL 747 CO 0.81 0.28 0.58 -0.94 0.00 0.00 0.00 175.10 175.84 3cf0 s SER 748 N 0.92 6.54 0.37 3.32 1.04 -1.26 -4.79 113.70 119.83 3cf0 s SER 748 Ca 0.19 0.87 0.14 0.00 0.48 0.00 0.00 55.95 57.63 3cf0 s SER 748 Cb -0.14 -2.21 0.98 0.00 0.10 0.00 0.00 66.02 64.75 3cf0 s SER 748 CO 0.07 -0.17 1.78 -2.24 0.98 0.00 0.00 173.24 173.66 3cf0 h ASP 749 N 1.99 0.55 0.46 7.02 3.04 -1.97 -0.57 116.42 126.94 3cf0 h ASP 749 Ca -0.47 0.09 -0.02 0.00 -3.24 0.00 0.00 57.03 53.39 3cf0 h ASP 749 Cb 1.18 -0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.46 3cf0 h ASP 749 CO 0.67 0.14 -0.27 0.78 -2.04 0.00 0.00 179.24 178.52 3cf0 h ASN 750 N 0.51 -0.67 -0.16 4.15 2.35 -1.99 0.77 115.58 120.54 3cf0 h ASN 750 Ca 0.58 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 56.42 3cf0 h ASN 750 Cb 1.27 0.20 -0.07 0.00 0.05 0.00 0.00 38.32 39.77 3cf0 h ASN 750 CO -0.33 -0.43 -0.33 0.44 -1.65 0.00 0.00 177.43 175.13 3cf0 h ASP 751 N -0.69 -1.02 -0.51 5.81 3.32 -1.56 0.20 116.42 121.97 3cf0 h ASP 751 Ca -0.05 0.15 0.10 0.00 0.02 0.00 0.00 57.03 57.25 3cf0 h ASP 751 Cb 0.56 0.44 -0.10 0.00 0.22 0.00 0.00 39.33 40.45 3cf0 h ASP 751 CO 0.06 -0.36 -0.16 0.40 -1.72 0.00 0.00 179.24 177.46 3cf0 h ILE 752 N -0.39 0.43 -0.37 0.35 2.04 -0.91 0.40 117.51 119.06 3cf0 h ILE 752 Ca 0.10 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.04 3cf0 h ILE 752 Cb 0.55 0.43 -0.08 0.00 -0.74 0.00 0.00 36.82 36.97 3cf0 h ILE 752 CO -0.37 0.00 -0.22 0.03 0.00 0.00 0.00 178.15 177.59 3cf0 h ARG 753 N -0.04 -0.16 -0.87 2.37 3.08 0.07 -0.09 114.38 118.75 3cf0 h ARG 753 Ca 0.24 0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.46 3cf0 h ARG 753 Cb 0.41 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.40 3cf0 h ARG 753 CO -0.55 -0.11 0.45 0.87 -1.07 0.00 0.00 179.97 179.57 3cf0 h LYS 754 N -0.16 0.61 -0.64 0.04 1.57 0.28 -0.77 116.57 117.51 3cf0 h LYS 754 Ca 0.18 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 3cf0 h LYS 754 Cb 0.45 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 3cf0 h LYS 754 CO -0.47 0.40 0.29 1.88 -0.57 0.00 0.00 179.45 180.98 3cf0 h TYR 755 N 0.63 0.91 -0.49 -1.35 -1.99 0.96 -1.49 116.97 114.14 3cf0 h TYR 755 Ca 0.48 -0.04 -0.07 0.00 2.00 0.00 0.00 58.73 61.10 3cf0 h TYR 755 Cb 0.70 -0.28 -0.02 0.00 2.00 0.00 0.00 36.73 39.12 3cf0 h TYR 755 CO -0.08 0.68 0.00 0.93 -0.00 0.00 0.00 178.16 179.68 3cf0 h GLU 756 N 0.90 0.82 0.41 4.88 4.39 -0.68 1.44 114.58 126.75 3cf0 h GLU 756 Ca 0.22 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 3cf0 h GLU 756 Cb 0.12 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3cf0 h GLU 756 CO -0.03 0.82 -0.20 0.52 -1.16 0.00 0.00 179.01 178.96 3cf0 h MET 757 N 0.77 -0.54 -0.05 2.33 2.86 -0.81 0.17 114.93 119.66 3cf0 h MET 757 Ca 0.15 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.86 3cf0 h MET 757 Cb 0.46 0.12 -0.04 0.00 0.06 0.00 0.00 31.60 32.20 3cf0 h MET 757 CO 0.02 -0.36 -0.15 0.74 1.06 0.00 0.00 176.91 178.22 3cf0 h PHE 758 N -0.56 -0.38 -0.14 -0.22 0.05 -0.78 -1.96 116.94 112.95 3cf0 h PHE 758 Ca -0.06 0.02 0.04 0.00 3.82 0.00 0.00 57.97 61.79 3cf0 h PHE 758 Cb 0.43 0.18 -0.01 0.00 2.00 0.00 0.00 35.95 38.55 3cf0 h PHE 758 CO -0.05 -0.22 0.14 0.00 -0.18 0.00 0.00 178.31 178.01 3cf0 h ALA 759 N 0.77 1.81 0.15 2.45 0.00 0.22 0.35 119.26 125.01 3cf0 h ALA 759 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3cf0 h ALA 759 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3cf0 h ALA 759 CO -0.18 -0.22 -0.07 0.37 0.00 0.00 0.00 179.25 179.15 3cf0 h GLN 760 N 0.00 -0.19 -0.03 0.00 4.15 0.13 -2.57 115.11 116.59 3cf0 h GLN 760 Ca 0.07 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.52 3cf0 h GLN 760 Cb 0.36 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.08 3cf0 h GLN 760 CO -0.00 -0.13 -0.05 1.79 -1.93 0.00 0.00 178.83 178.51 3cf0 h THR 761 N -0.54 0.86 -0.28 2.39 1.35 -1.46 -3.01 112.91 112.22 3cf0 h THR 761 Ca -0.02 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.90 3cf0 h THR 761 Cb 0.15 0.86 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 3cf0 h THR 761 CO 0.03 0.00 0.20 -0.07 -0.25 0.00 0.00 175.52 175.43 3cf0 h LEU 762 N -0.07 0.11 -1.59 3.87 3.38 -1.07 -3.52 115.31 116.41 3cf0 h LEU 762 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3cf0 h LEU 762 Cb 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3cf0 h LEU 762 CO -0.07 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.53