#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 4.37 1.11 0.00 2.96 -1.26 -4.98 118.68 120.88 3cf0 s LEU 464 Ca 0.00 2.74 -0.14 0.00 -0.22 0.00 0.00 54.13 56.52 3cf0 s LEU 464 Cb 0.00 -3.61 0.21 0.00 0.50 0.00 0.00 46.19 43.30 3cf0 s LEU 464 CO 0.00 -0.85 0.77 -1.14 -1.32 0.00 0.00 176.35 173.81 3cf0 n ARG 465 N 3.38 -1.84 -2.92 1.98 0.63 -1.26 -4.97 116.66 111.65 3cf0 n ARG 465 Ca 0.12 -0.50 -0.41 0.00 -0.92 0.00 0.00 57.85 56.14 3cf0 n ARG 465 Cb 0.38 -2.08 -0.04 0.00 0.45 0.00 0.00 32.46 31.17 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 -4.17 4.31 -0.30 -0.14 2.56 -1.26 -5.03 118.70 114.68 3cf0 s GLU 466 Ca 0.65 0.97 -0.29 0.00 0.00 0.00 0.00 54.97 56.30 3cf0 s GLU 466 Cb -0.22 -3.56 -0.01 0.00 2.00 0.00 0.00 34.13 32.34 3cf0 s GLU 466 CO 0.65 -0.27 1.56 0.99 -0.56 0.00 0.00 175.26 177.62 3cf0 s THR 467 N 1.94 3.77 -0.30 -1.70 2.01 -1.26 -4.98 115.64 115.12 3cf0 s THR 467 Ca 0.38 0.84 -0.08 0.00 0.31 0.00 0.00 61.69 63.13 3cf0 s THR 467 Cb -0.17 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.47 3cf0 s THR 467 CO 0.13 -0.45 0.11 -0.69 -0.69 0.00 0.00 174.62 173.03 3cf0 s VAL 468 N 5.45 4.23 0.45 3.82 1.01 -1.26 -5.09 120.40 129.01 3cf0 s VAL 468 Ca 0.68 -0.59 -0.15 0.00 0.00 0.00 0.00 61.98 61.92 3cf0 s VAL 468 Cb -0.21 -3.18 -0.08 0.00 0.00 0.00 0.00 36.38 32.92 3cf0 s VAL 468 CO 0.30 0.07 0.89 -0.69 0.00 0.00 0.00 175.10 175.67 3cf0 s VAL 469 N 1.54 4.59 0.15 2.92 1.01 -1.26 -4.50 120.40 124.86 3cf0 s VAL 469 Ca 0.03 1.07 -0.24 0.00 0.00 0.00 0.00 61.98 62.85 3cf0 s VAL 469 Cb -0.17 -3.69 0.06 0.00 0.00 0.00 0.00 36.38 32.58 3cf0 s VAL 469 CO 0.04 -0.53 0.73 -1.83 0.00 0.00 0.00 175.10 173.51 3cf0 s GLU 470 N -3.74 1.30 -0.22 2.72 -1.05 -1.10 -4.98 118.70 111.62 3cf0 s GLU 470 Ca 0.57 -0.58 -0.08 0.00 -0.15 0.00 0.00 54.97 54.74 3cf0 s GLU 470 Cb -0.10 0.53 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 3cf0 s GLU 470 CO 0.27 -0.58 0.07 0.08 0.95 0.00 0.00 175.26 176.05 3cf0 s VAL 471 N -3.61 4.63 -0.02 1.83 1.01 -1.26 -2.14 120.40 120.83 3cf0 s VAL 471 Ca 0.05 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 3cf0 s VAL 471 Cb -0.02 -3.13 -0.08 0.00 0.00 0.00 0.00 36.38 33.15 3cf0 s VAL 471 CO -0.06 0.39 2.03 -2.84 0.00 0.00 0.00 175.10 174.62 3cf0 s PRO 472 N 0.98 3.90 0.53 2.72 0.02 -1.26 -4.86 135.00 137.03 3cf0 s PRO 472 Ca 0.04 2.48 0.31 0.00 0.02 0.00 0.00 61.00 63.85 3cf0 s PRO 472 Cb -0.14 -4.21 1.46 0.00 0.02 0.00 0.00 34.50 31.63 3cf0 s PRO 472 CO 0.03 -1.23 2.04 -0.56 -0.33 0.00 0.00 177.00 176.96 3cf0 h GLN 473 N 11.65 0.00 -5.93 5.54 -0.00 -1.95 -3.43 115.11 121.00 3cf0 h GLN 473 Ca -0.48 0.00 -0.67 0.00 -0.00 0.00 0.00 58.65 57.50 3cf0 h GLN 473 Cb 1.24 0.00 -0.12 0.00 -0.00 0.00 0.00 27.48 28.60 3cf0 h GLN 473 CO 0.95 0.09 -0.58 0.54 -0.00 0.00 0.00 178.83 179.83 3cf0 s VAL 474 N -3.94 4.64 0.39 1.86 0.11 -1.26 -5.11 120.40 117.10 3cf0 s VAL 474 Ca -0.01 -0.22 0.04 0.00 -2.93 0.00 0.00 61.98 58.86 3cf0 s VAL 474 Cb 0.11 -3.02 -0.05 0.00 -1.53 0.00 0.00 36.38 31.89 3cf0 s VAL 474 CO 0.56 0.53 0.05 0.42 -3.33 0.00 0.00 175.10 173.33 3cf0 s THR 475 N -1.00 1.32 0.49 5.04 -4.23 -1.26 -3.41 115.64 112.59 3cf0 s THR 475 Ca 0.16 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.95 3cf0 s THR 475 Cb -0.12 -2.68 0.47 0.00 1.34 0.00 0.00 72.50 71.51 3cf0 s THR 475 CO 0.06 0.00 1.83 -0.50 -0.54 0.00 0.00 174.62 175.47 3cf0 h TRP 476 N 1.84 0.23 -0.13 3.99 4.06 -1.95 -0.80 115.95 123.19 3cf0 h TRP 476 Ca -0.41 0.01 0.02 0.00 2.06 0.00 0.00 58.89 60.56 3cf0 h TRP 476 Cb 1.26 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 29.35 3cf0 h TRP 476 CO 0.92 0.03 0.09 0.93 -3.56 0.00 0.00 178.44 176.85 3cf0 h GLU 477 N 0.15 0.09 -0.00 0.49 5.08 -2.01 -1.62 114.58 116.77 3cf0 h GLU 477 Ca 0.51 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.86 3cf0 h GLU 477 Cb 1.75 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.98 3cf0 h GLU 477 CO -0.10 0.06 -0.05 -0.25 -1.00 0.00 0.00 179.01 177.67 3cf0 n ASP 478 N -4.51 0.17 -4.40 1.42 9.92 -0.31 -4.65 116.55 114.19 3cf0 n ASP 478 Ca -0.00 -0.27 -0.38 0.00 -0.53 0.00 0.00 54.79 53.60 3cf0 n ASP 478 Cb 0.15 -0.20 -0.12 0.00 -0.64 0.00 0.00 41.12 40.30 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 -2.56 4.31 -0.07 0.53 1.01 -0.61 -4.73 121.20 119.09 3cf0 s ILE 479 Ca 0.28 -0.48 -0.28 0.00 0.00 0.00 0.00 60.65 60.17 3cf0 s ILE 479 Cb 0.20 -3.18 -0.02 0.00 0.01 0.00 0.00 42.46 39.47 3cf0 s ILE 479 CO 0.47 0.12 0.90 -0.83 0.00 0.00 0.00 174.94 175.61 3cf0 s GLY 480 N 1.57 2.58 0.00 6.18 0.00 -1.26 -4.91 107.32 111.49 3cf0 s GLY 480 Ca 0.04 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.09 3cf0 s GLY 480 CO 0.04 1.63 0.00 0.61 0.00 0.00 0.00 173.10 175.38 3cf0 n GLY 481 N 3.08 -0.48 2.78 0.20 0.00 -1.26 -4.62 105.19 104.88 3cf0 n GLY 481 Ca 0.05 -1.11 -0.17 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.54 -0.06 0.99 4.77 -1.26 -4.91 117.00 113.99 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 -2.38 -0.03 0.00 -2.33 0.00 0.00 43.42 38.68 3cf0 n LEU 482 CO 0.00 0.24 0.97 -0.33 -1.33 0.00 0.00 177.39 176.94 3cf0 h GLU 483 N -1.25 0.31 -0.68 3.23 4.39 -1.97 -2.09 114.58 116.52 3cf0 h GLU 483 Ca -0.41 -0.02 0.15 0.00 0.34 0.00 0.00 59.36 59.42 3cf0 h GLU 483 Cb 1.28 -0.07 -0.11 0.00 -0.10 0.00 0.00 28.75 29.75 3cf0 h GLU 483 CO 0.43 0.21 0.04 0.38 -1.16 0.00 0.00 179.01 178.91 3cf0 h ASP 484 N 0.31 -0.23 0.55 1.42 2.03 -2.00 -1.69 116.42 116.81 3cf0 h ASP 484 Ca 0.09 0.16 -0.19 0.00 -0.73 0.00 0.00 57.03 56.36 3cf0 h ASP 484 Cb -0.03 0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.73 3cf0 h ASP 484 CO -0.02 -0.12 -0.85 -0.37 -1.03 0.00 0.00 179.24 176.86 3cf0 h VAL 485 N 0.14 1.48 -0.52 4.15 -1.51 -1.85 -1.81 116.25 116.33 3cf0 h VAL 485 Ca 0.37 -2.54 0.06 0.00 -1.23 0.00 0.00 66.70 63.36 3cf0 h VAL 485 Cb 0.61 2.41 -0.05 0.00 -2.13 0.00 0.00 31.29 32.13 3cf0 h VAL 485 CO -0.56 0.74 0.23 0.11 -1.23 0.00 0.00 177.57 176.86 3cf0 h LYS 486 N 0.12 0.42 0.27 5.19 1.57 -0.73 0.56 116.57 123.98 3cf0 h LYS 486 Ca -0.04 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3cf0 h LYS 486 Cb 1.46 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.68 3cf0 h LYS 486 CO 0.13 0.28 -0.13 -0.09 -0.57 0.00 0.00 179.45 179.07 3cf0 h ARG 487 N 0.44 -0.35 -0.75 3.15 2.43 -1.27 -1.88 114.38 116.14 3cf0 h ARG 487 Ca 0.24 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.55 3cf0 h ARG 487 Cb 0.21 0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 29.76 3cf0 h ARG 487 CO -0.21 -0.16 0.36 1.49 -1.51 0.00 0.00 179.97 179.93 3cf0 h GLU 488 N -0.47 0.55 -0.36 0.20 4.22 -0.80 -0.88 114.58 117.04 3cf0 h GLU 488 Ca -0.04 -0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.36 3cf0 h GLU 488 Cb 0.35 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3cf0 h GLU 488 CO 0.06 0.36 0.18 -0.07 -2.18 0.00 0.00 179.01 177.37 3cf0 h LEU 489 N 0.57 0.47 -0.14 1.64 3.38 0.24 -2.66 115.31 118.80 3cf0 h LEU 489 Ca 0.39 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.27 3cf0 h LEU 489 Cb 0.49 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3cf0 h LEU 489 CO -0.32 0.45 -0.06 1.56 0.09 0.00 0.00 178.44 180.17 3cf0 h GLN 490 N 0.45 -0.03 0.00 1.13 4.20 -0.73 -1.40 115.11 118.73 3cf0 h GLN 490 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3cf0 h GLN 490 Cb 0.10 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.89 3cf0 h GLN 490 CO -0.02 -0.02 0.23 0.93 -0.67 0.00 0.00 178.83 179.28 3cf0 h GLU 491 N -0.04 0.00 0.00 1.46 5.08 -0.99 0.13 114.58 120.23 3cf0 h GLU 491 Ca 0.07 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 3cf0 h GLU 491 Cb 0.15 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3cf0 h GLU 491 CO -0.16 0.00 -1.80 1.28 -1.00 0.00 0.00 179.01 177.33 3cf0 n LEU 492 N -2.70 0.34 0.00 1.33 4.77 -0.57 -4.42 117.00 115.74 3cf0 n LEU 492 Ca -0.02 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3cf0 n LEU 492 Cb 0.27 0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3cf0 n LEU 492 CO 0.13 0.12 -0.48 1.33 -1.33 0.00 0.00 177.39 177.16 3cf0 n VAL 493 N -2.59 0.00 0.32 4.08 0.24 -0.88 -4.67 118.33 114.83 3cf0 n VAL 493 Ca -0.11 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.06 3cf0 n VAL 493 Cb 0.77 -0.78 -0.06 0.00 -1.47 0.00 0.00 33.84 32.30 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 -0.79 -0.45 7.34 1.08 -0.97 -3.26 115.11 118.04 3cf0 h GLN 494 Ca 0.00 0.05 0.08 0.00 -1.45 0.00 0.00 58.65 57.34 3cf0 h GLN 494 Cb 0.96 0.18 -0.07 0.00 -0.05 0.00 0.00 27.48 28.50 3cf0 h GLN 494 CO 0.00 -0.53 0.04 1.88 -0.95 0.00 0.00 178.83 179.27 3cf0 h TYR 495 N -1.02 0.05 -0.73 2.96 0.99 -1.75 0.27 116.97 117.74 3cf0 h TYR 495 Ca -0.08 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.73 3cf0 h TYR 495 Cb 0.63 0.05 -0.04 0.00 1.00 0.00 0.00 36.73 38.36 3cf0 h TYR 495 CO 0.03 -0.06 0.48 -1.00 -0.00 0.00 0.00 178.16 177.62 3cf0 h PRO 496 N 0.16 0.77 0.11 4.88 0.13 -1.80 0.13 132.00 136.37 3cf0 h PRO 496 Ca 0.23 -0.05 -0.23 0.00 -0.87 0.00 0.00 66.00 65.08 3cf0 h PRO 496 Cb 0.32 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.28 3cf0 h PRO 496 CO -0.34 0.51 -1.12 -0.24 -0.23 0.00 0.00 178.00 176.58 3cf0 h VAL 497 N 0.80 1.23 -0.01 1.56 3.04 -1.28 -3.09 116.25 118.49 3cf0 h VAL 497 Ca 0.31 -2.43 0.00 0.00 -1.01 0.00 0.00 66.70 63.57 3cf0 h VAL 497 Cb 0.21 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 32.38 3cf0 h VAL 497 CO -0.10 0.68 -0.23 -0.62 -1.01 0.00 0.00 177.57 176.29 3cf0 n GLU 498 N -4.07 1.24 -2.69 4.17 1.02 0.85 -4.17 120.64 116.99 3cf0 n GLU 498 Ca -0.21 -0.84 -0.07 0.00 -0.02 0.00 0.00 57.16 56.02 3cf0 n GLU 498 Cb 0.83 -1.48 0.04 0.00 -0.02 0.00 0.00 31.44 30.81 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 -0.15 1.09 0.12 -0.32 8.25 0.03 -4.93 115.22 119.32 3cf0 n HIS 499 Ca 0.13 -2.65 0.18 0.00 -0.26 0.00 0.00 57.72 55.11 3cf0 n HIS 499 Cb 0.40 -0.31 0.74 0.00 1.12 0.00 0.00 29.99 31.94 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 0.00 -0.41 -0.41 0.11 -1.66 0.23 132.00 132.76 3cf0 h PRO 500 Ca -0.11 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.06 3cf0 h PRO 500 Cb 1.20 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 3cf0 h PRO 500 CO 0.43 0.00 0.09 0.38 -0.21 0.00 0.00 178.00 178.69 3cf0 h ASP 501 N 0.00 0.04 0.05 -2.05 -0.00 -1.91 -1.02 116.42 111.52 3cf0 h ASP 501 Ca 0.15 0.07 -0.09 0.00 -0.00 0.00 0.00 57.03 57.16 3cf0 h ASP 501 Cb 0.70 0.08 -0.01 0.00 -0.00 0.00 0.00 39.33 40.10 3cf0 h ASP 501 CO -0.00 0.05 -0.26 0.11 -0.00 0.00 0.00 179.24 179.14 3cf0 h LYS 502 N 0.23 0.34 -0.16 4.15 6.56 -1.32 0.27 116.57 126.65 3cf0 h LYS 502 Ca 0.20 -0.12 -0.19 0.00 -1.06 0.00 0.00 60.65 59.48 3cf0 h LYS 502 Cb 0.24 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.87 3cf0 h LYS 502 CO -0.25 0.59 -0.67 0.74 -2.06 0.00 0.00 179.45 177.79 3cf0 h PHE 503 N 0.31 0.81 -0.17 -1.35 0.04 -1.40 -2.10 116.94 113.08 3cf0 h PHE 503 Ca 0.05 -0.33 -0.17 0.00 2.80 0.00 0.00 57.97 60.32 3cf0 h PHE 503 Cb 0.63 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.64 3cf0 h PHE 503 CO 0.01 1.11 -0.59 -0.07 -0.60 0.00 0.00 178.31 178.18 3cf0 h LEU 504 N 0.44 0.63 0.27 1.54 4.07 -1.02 -0.47 115.31 120.78 3cf0 h LEU 504 Ca -0.02 -0.35 -0.01 0.00 0.08 0.00 0.00 57.88 57.57 3cf0 h LEU 504 Cb 1.26 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 42.82 3cf0 h LEU 504 CO 0.13 1.08 -0.13 0.11 -1.08 0.00 0.00 178.44 178.55 3cf0 h LYS 505 N 0.42 -0.35 0.00 1.13 1.57 -0.39 -2.98 116.57 115.98 3cf0 h LYS 505 Ca -0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3cf0 h LYS 505 Cb 1.14 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.53 3cf0 h LYS 505 CO 0.11 -0.20 -0.20 1.19 -0.57 0.00 0.00 179.45 179.78 3cf0 n PHE 506 N -5.23 0.37 0.00 -1.35 3.72 -0.80 -4.96 117.46 109.21 3cf0 n PHE 506 Ca -0.10 0.11 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3cf0 n PHE 506 Cb 0.18 -0.61 0.00 0.00 -0.94 0.00 0.00 39.48 38.10 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 1.42 2.71 3.57 1.37 0.00 -0.19 -5.02 105.19 109.04 3cf0 n GLY 507 Ca 0.06 -0.65 -0.49 0.00 0.00 0.00 0.00 46.02 44.94 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 1.09 -3.86 1.61 0.00 -1.22 -4.72 117.12 110.02 3cf0 n MET 508 Ca 0.00 0.39 -0.32 0.00 0.00 0.00 0.00 57.70 57.77 3cf0 n MET 508 Cb 0.00 -1.88 -0.04 0.00 0.00 0.00 0.00 33.22 31.29 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 -0.16 5.35 1.19 3.17 -4.23 -1.26 -4.64 115.64 115.06 3cf0 s THR 509 Ca 0.74 -0.22 -0.20 0.00 -1.18 0.00 0.00 61.69 60.83 3cf0 s THR 509 Cb -0.88 -3.61 0.29 0.00 1.34 0.00 0.00 72.50 69.64 3cf0 s THR 509 CO 0.52 0.17 1.17 -2.65 -0.54 0.00 0.00 174.62 173.29 3cf0 n PRO 510 N 0.44 -2.72 -4.08 3.99 -0.02 -1.26 -5.05 135.00 126.30 3cf0 n PRO 510 Ca -0.06 -1.85 -0.33 0.00 -2.02 0.00 0.00 63.50 59.24 3cf0 n PRO 510 Cb 0.52 -1.60 -0.07 0.00 -0.02 0.00 0.00 33.50 32.33 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 -4.85 5.74 0.49 2.55 1.04 -1.26 -5.02 113.70 112.38 3cf0 s SER 511 Ca 0.73 0.16 0.26 0.00 0.48 0.00 0.00 55.95 57.58 3cf0 s SER 511 Cb -0.06 -1.66 1.26 0.00 0.10 0.00 0.00 66.02 65.66 3cf0 s SER 511 CO 0.55 0.27 1.98 0.11 0.98 0.00 0.00 173.24 177.13 3cf0 h LYS 512 N 4.04 0.00 0.00 4.02 1.57 -1.89 -3.48 116.57 120.82 3cf0 h LYS 512 Ca -0.49 0.00 0.31 0.00 -1.87 0.00 0.00 60.65 58.60 3cf0 h LYS 512 Cb 1.18 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 3cf0 h LYS 512 CO 0.63 0.16 0.77 0.41 -0.57 0.00 0.00 179.45 180.85 3cf0 n GLY 513 N -0.40 0.21 3.21 3.86 0.00 -1.24 -2.15 105.19 108.69 3cf0 n GLY 513 Ca -0.01 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.02 0.03 -0.21 1.61 1.01 -0.88 -3.51 120.40 116.42 3cf0 s VAL 514 Ca 0.25 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.02 3cf0 s VAL 514 Cb -0.00 -0.51 0.04 0.00 0.00 0.00 0.00 36.38 35.91 3cf0 s VAL 514 CO -0.02 -0.13 -0.14 -0.22 0.00 0.00 0.00 175.10 174.59 3cf0 s LEU 515 N -0.52 2.67 -0.07 3.92 0.20 0.37 -0.49 118.68 124.76 3cf0 s LEU 515 Ca -0.06 -0.99 -0.25 0.00 0.69 0.00 0.00 54.13 53.52 3cf0 s LEU 515 Cb -0.04 -1.45 -0.03 0.00 -0.43 0.00 0.00 46.19 44.24 3cf0 s LEU 515 CO 0.02 -0.11 0.77 -0.36 -0.29 0.00 0.00 176.35 176.39 3cf0 s PHE 516 N 1.24 3.57 0.14 5.38 2.99 -0.26 -0.64 117.98 130.39 3cf0 s PHE 516 Ca -0.02 1.33 0.05 0.00 0.00 0.00 0.00 56.93 58.30 3cf0 s PHE 516 Cb -0.16 -2.90 -0.04 0.00 0.00 0.00 0.00 43.02 39.92 3cf0 s PHE 516 CO -0.09 0.02 -0.12 1.52 -0.00 0.00 0.00 175.22 176.55 3cf0 s TYR 517 N 1.06 1.33 0.00 0.36 -0.85 -0.61 -1.85 117.35 116.79 3cf0 s TYR 517 Ca 0.40 -0.65 0.00 0.00 -0.52 0.00 0.00 57.07 56.31 3cf0 s TYR 517 Cb -0.18 -0.68 0.00 0.00 0.38 0.00 0.00 41.96 41.48 3cf0 s TYR 517 CO 0.19 0.12 0.00 0.41 -1.52 0.00 0.00 175.55 174.75 3cf0 n GLY 518 N 0.17 1.19 3.71 5.49 0.00 -1.11 -1.37 105.19 113.28 3cf0 n GLY 518 Ca -0.13 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.95 1.48 0.30 1.61 0.04 -1.25 -4.08 135.00 131.15 3cf0 s PRO 519 Ca 0.00 1.28 -0.29 0.00 0.04 0.00 0.00 61.00 62.03 3cf0 s PRO 519 Cb 0.00 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 3cf0 s PRO 519 CO 0.00 -2.23 1.21 -2.14 0.04 0.00 0.00 177.00 173.88 3cf0 s PRO 520 N -4.78 4.50 -0.15 0.56 0.02 -1.26 -3.98 135.00 129.91 3cf0 s PRO 520 Ca 0.64 2.01 -0.00 0.00 0.02 0.00 0.00 61.00 63.67 3cf0 s PRO 520 Cb -0.20 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.19 3cf0 s PRO 520 CO 0.57 0.00 0.13 0.41 -0.33 0.00 0.00 177.00 177.78 3cf0 n GLY 521 N 1.06 0.46 0.00 0.52 0.00 -1.26 -4.84 105.19 101.13 3cf0 n GLY 521 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.03 1.18 0.32 0.00 0.00 -1.26 -4.84 105.19 100.56 3cf0 n GLY 523 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 1.30 0.87 -0.24 1.61 1.57 -1.95 0.67 116.57 120.40 3cf0 h LYS 524 Ca 0.00 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 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 -0.24 1.15 -0.57 0.00 0.00 179.45 180.36 3cf0 h THR 525 N 0.89 1.32 -0.51 -0.16 2.02 -1.99 -2.53 112.91 111.95 3cf0 h THR 525 Ca 0.40 -1.41 0.04 0.00 0.77 0.00 0.00 66.41 66.21 3cf0 h THR 525 Cb 0.30 1.69 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 3cf0 h THR 525 CO -0.22 0.44 0.28 -0.07 0.37 0.00 0.00 175.52 176.32 3cf0 h LEU 526 N 0.29 0.42 -0.74 2.58 3.38 -1.85 0.05 115.31 119.45 3cf0 h LEU 526 Ca 0.04 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.08 3cf0 h LEU 526 Cb 0.80 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.43 3cf0 h LEU 526 CO 0.06 0.29 0.44 -0.07 0.09 0.00 0.00 178.44 179.26 3cf0 h LEU 527 N 0.54 0.69 -1.04 1.67 3.38 -0.94 0.27 115.31 119.90 3cf0 h LEU 527 Ca 0.22 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 3cf0 h LEU 527 Cb 0.09 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3cf0 h LEU 527 CO -0.13 0.45 -0.10 0.00 0.09 0.00 0.00 178.44 178.75 3cf0 h ALA 528 N 1.35 1.20 0.12 1.53 0.00 -0.70 -1.74 119.26 121.01 3cf0 h ALA 528 Ca 0.32 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3cf0 h ALA 528 Cb 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3cf0 h ALA 528 CO -0.16 0.52 -0.06 0.87 0.00 0.00 0.00 179.25 180.43 3cf0 h LYS 529 N 0.53 -0.15 -0.96 0.00 1.57 -0.10 -2.99 116.57 114.46 3cf0 h LYS 529 Ca 0.10 0.01 0.21 0.00 -1.87 0.00 0.00 60.65 59.10 3cf0 h LYS 529 Cb 0.50 0.03 -0.18 0.00 0.08 0.00 0.00 32.23 32.66 3cf0 h LYS 529 CO 0.03 -0.10 -0.16 0.00 -0.57 0.00 0.00 179.45 178.65 3cf0 h ALA 530 N -1.04 0.78 -0.56 3.86 0.00 -0.51 0.40 119.26 122.19 3cf0 h ALA 530 Ca -0.02 0.36 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 3cf0 h ALA 530 Cb 0.12 0.69 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3cf0 h ALA 530 CO 0.03 -0.44 0.17 0.97 0.00 0.00 0.00 179.25 179.98 3cf0 h ILE 531 N 0.01 1.22 0.06 0.00 6.09 -1.38 0.10 117.51 123.61 3cf0 h ILE 531 Ca 0.50 -0.77 -0.00 0.00 -1.37 0.00 0.00 64.86 63.22 3cf0 h ILE 531 Cb 0.85 0.61 0.00 0.00 0.47 0.00 0.00 36.82 38.75 3cf0 h ILE 531 CO -0.96 0.29 -0.03 0.00 -3.07 0.00 0.00 178.15 174.38 3cf0 h ALA 532 N 1.36 -0.08 -0.57 0.18 0.00 -0.19 -2.05 119.26 117.92 3cf0 h ALA 532 Ca 0.19 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.03 3cf0 h ALA 532 Cb 0.25 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3cf0 h ALA 532 CO -0.01 -0.46 0.38 -0.97 0.00 0.00 0.00 179.25 178.19 3cf0 h ASN 533 N -0.26 0.55 -0.05 0.00 -1.24 -0.06 -0.52 115.58 114.01 3cf0 h ASN 533 Ca -0.01 -0.01 -0.01 0.00 0.71 0.00 0.00 56.30 56.99 3cf0 h ASN 533 Cb 0.23 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.15 3cf0 h ASN 533 CO 0.01 0.38 0.01 -0.08 -1.29 0.00 0.00 177.43 176.46 3cf0 h GLU 534 N 0.64 0.08 0.00 6.67 4.57 -0.73 -1.45 114.58 124.37 3cf0 h GLU 534 Ca 0.23 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 3cf0 h GLU 534 Cb 0.11 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3cf0 h GLU 534 CO -0.06 0.31 0.00 0.00 -1.18 0.00 0.00 179.01 178.08 3cf0 n GLN 536 N -0.61 -2.20 -4.57 0.00 1.13 -0.55 -4.96 117.38 105.62 3cf0 n GLN 536 Ca 0.03 0.31 -0.27 0.00 -1.94 0.00 0.00 57.00 55.12 3cf0 n GLN 536 Cb 0.01 -4.07 -0.11 0.00 0.11 0.00 0.00 30.24 26.19 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 -3.94 3.17 0.67 -1.58 0.00 -0.29 -4.99 121.76 114.79 3cf0 s ALA 537 Ca 0.11 -2.26 -0.11 0.00 0.00 0.00 0.00 51.96 49.70 3cf0 s ALA 537 Cb -0.05 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 3cf0 s ALA 537 CO 0.92 -0.09 1.05 -0.80 0.00 0.00 0.00 175.76 176.84 3cf0 s ASN 538 N -3.71 5.71 -0.05 0.00 0.01 -0.27 -4.45 114.94 112.18 3cf0 s ASN 538 Ca 0.35 1.45 -0.02 0.00 -0.71 0.00 0.00 52.86 53.93 3cf0 s ASN 538 Cb 0.08 -2.39 0.03 0.00 0.41 0.00 0.00 41.25 39.38 3cf0 s ASN 538 CO 0.18 -1.21 0.05 0.12 -1.51 0.00 0.00 177.10 174.73 3cf0 s PHE 539 N -3.15 0.17 -0.11 2.20 5.36 -0.91 -0.46 117.98 121.08 3cf0 s PHE 539 Ca 0.57 0.18 -0.01 0.00 -0.96 0.00 0.00 56.93 56.71 3cf0 s PHE 539 Cb -0.12 -0.54 -0.02 0.00 -0.34 0.00 0.00 43.02 41.99 3cf0 s PHE 539 CO 0.54 -0.22 -0.08 0.42 -1.46 0.00 0.00 175.22 174.42 3cf0 s ILE 540 N 2.13 3.54 -0.25 3.12 1.01 -0.35 -2.73 121.20 127.67 3cf0 s ILE 540 Ca 0.05 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.20 3cf0 s ILE 540 Cb -0.12 -2.49 0.04 0.00 0.01 0.00 0.00 42.46 39.90 3cf0 s ILE 540 CO -0.03 0.54 -0.09 -0.55 0.00 0.00 0.00 174.94 174.81 3cf0 s SER 541 N -0.10 4.33 -0.24 3.58 0.15 -1.26 0.11 113.70 120.26 3cf0 s SER 541 Ca 0.00 -1.14 -0.09 0.00 0.70 0.00 0.00 55.95 55.42 3cf0 s SER 541 Cb -0.13 -1.60 -0.04 0.00 -1.71 0.00 0.00 66.02 62.53 3cf0 s SER 541 CO 0.03 -0.16 0.13 -0.63 1.20 0.00 0.00 173.24 173.81 3cf0 s ILE 542 N 1.21 5.02 0.30 6.45 1.09 -0.31 -4.92 121.20 130.03 3cf0 s ILE 542 Ca -0.04 0.06 0.04 0.00 -1.10 0.00 0.00 60.65 59.61 3cf0 s ILE 542 Cb -0.18 -3.34 0.04 0.00 -1.06 0.00 0.00 42.46 37.92 3cf0 s ILE 542 CO -0.05 0.34 0.30 0.29 -0.10 0.00 0.00 174.94 175.72 3cf0 n LYS 543 N 4.47 0.95 0.18 2.79 5.02 -1.26 -1.23 118.16 129.07 3cf0 n LYS 543 Ca -0.15 -1.79 -0.14 0.00 -2.02 0.00 0.00 58.31 54.21 3cf0 n LYS 543 Cb 0.52 0.07 -0.07 0.00 -0.02 0.00 0.00 35.03 35.53 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 0.24 -0.49 1.75 0.72 0.00 -1.81 -2.47 103.07 101.01 3cf0 h GLY 544 Ca -0.17 0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 3cf0 h GLY 544 CO 0.26 -0.20 0.14 -2.55 0.00 0.00 0.00 176.54 174.18 3cf0 h PRO 545 N -0.48 0.33 -0.17 4.80 0.11 -1.94 0.17 132.00 134.82 3cf0 h PRO 545 Ca -0.02 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 3cf0 h PRO 545 Cb 0.42 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 3cf0 h PRO 545 CO -0.01 0.24 -0.05 1.49 -0.21 0.00 0.00 178.00 179.47 3cf0 h GLU 546 N 0.33 0.33 -0.68 1.05 4.81 -1.88 0.10 114.58 118.64 3cf0 h GLU 546 Ca 0.09 -0.13 0.09 0.00 -0.13 0.00 0.00 59.36 59.28 3cf0 h GLU 546 Cb 0.01 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.30 3cf0 h GLU 546 CO -0.02 0.60 0.34 -0.07 -0.73 0.00 0.00 179.01 179.14 3cf0 h LEU 547 N 0.03 0.44 -0.95 1.64 3.38 -0.90 -2.48 115.31 116.47 3cf0 h LEU 547 Ca 0.04 0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3cf0 h LEU 547 Cb 0.49 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3cf0 h LEU 547 CO 0.02 0.26 -0.02 -0.07 0.09 0.00 0.00 178.44 178.72 3cf0 h LEU 548 N 0.58 0.71 -0.42 1.67 3.38 -0.45 -1.16 115.31 119.62 3cf0 h LEU 548 Ca 0.33 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.17 3cf0 h LEU 548 Cb 0.34 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3cf0 h LEU 548 CO -0.26 0.79 0.19 0.74 0.09 0.00 0.00 178.44 180.00 3cf0 h THR 549 N 0.69 0.94 0.00 0.22 2.02 -0.38 0.54 112.91 116.93 3cf0 h THR 549 Ca 0.13 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 3cf0 h THR 549 Cb 0.45 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3cf0 h THR 549 CO 0.02 0.07 -0.16 0.24 0.37 0.00 0.00 175.52 176.06 3cf0 h MET 550 N 0.39 0.00 0.01 6.66 2.86 -1.03 0.04 114.93 123.86 3cf0 h MET 550 Ca 0.19 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.76 3cf0 h MET 550 Cb 0.12 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.79 3cf0 h MET 550 CO -0.15 0.16 -0.26 2.35 1.06 0.00 0.00 176.91 180.07 3cf0 h TRP 551 N 0.00 0.25 -0.24 -0.22 7.01 0.27 -0.64 115.95 122.38 3cf0 h TRP 551 Ca -0.00 -0.14 0.00 0.00 2.11 0.00 0.00 58.89 60.86 3cf0 h TRP 551 Cb 0.28 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.31 3cf0 h TRP 551 CO 0.00 0.96 0.15 0.74 -2.79 0.00 0.00 178.44 177.51 3cf0 h PHE 552 N -0.53 0.31 0.00 2.65 0.04 0.01 -2.93 116.94 116.50 3cf0 h PHE 552 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 3cf0 h PHE 552 Cb 1.04 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 39.09 3cf0 h PHE 552 CO 0.19 0.22 0.00 0.41 -0.60 0.00 0.00 178.31 178.53 3cf0 n GLY 553 N -1.09 -0.80 2.84 -1.45 0.00 -0.01 -4.88 105.19 99.80 3cf0 n GLY 553 Ca -0.03 -0.16 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.99 -3.00 -2.42 1.61 1.02 -0.51 -4.86 120.64 111.48 3cf0 n GLU 554 Ca 0.19 0.62 -0.31 0.00 -0.02 0.00 0.00 57.16 57.64 3cf0 n GLU 554 Cb 0.09 -5.30 0.01 0.00 -0.02 0.00 0.00 31.44 26.22 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 -2.09 5.55 0.20 1.62 3.41 -0.36 -4.74 113.62 117.21 3cf0 n SER 555 Ca -0.10 -3.74 0.14 0.00 -0.26 0.00 0.00 58.87 54.91 3cf0 n SER 555 Cb 0.59 -0.67 0.50 0.00 -0.26 0.00 0.00 64.21 64.37 3cf0 n SER 555 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 3cf0 h GLU 556 N 2.85 0.00 -0.90 4.33 9.09 -1.89 -2.77 114.58 125.29 3cf0 h GLU 556 Ca 0.36 0.00 0.26 0.00 0.05 0.00 0.00 59.36 60.03 3cf0 h GLU 556 Cb 0.60 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.66 3cf0 h GLU 556 CO 1.01 0.00 0.66 0.00 0.05 0.00 0.00 179.01 180.73 3cf0 h ALA 557 N 2.16 2.85 0.00 1.06 0.00 -1.95 0.20 119.26 123.58 3cf0 h ALA 557 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3cf0 h ALA 557 Cb 0.58 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3cf0 h ALA 557 CO 0.00 -1.12 0.14 0.09 0.00 0.00 0.00 179.25 178.35 3cf0 n ASN 558 N -4.24 0.42 0.21 0.00 4.13 -1.04 -1.21 115.26 113.53 3cf0 n ASN 558 Ca 0.19 0.64 0.06 0.00 1.68 0.00 0.00 54.58 57.15 3cf0 n ASN 558 Cb 0.98 -0.65 0.48 0.00 -1.54 0.00 0.00 39.78 39.04 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 1.03 -0.04 2.41 2.07 -0.85 -1.97 116.25 118.89 3cf0 h VAL 559 Ca 0.00 -0.96 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 3cf0 h VAL 559 Cb 0.27 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3cf0 h VAL 559 CO 0.00 0.26 0.01 -0.09 0.02 0.00 0.00 177.57 177.77 3cf0 h ARG 560 N 0.00 0.06 -0.04 1.57 2.43 -1.34 -0.83 114.38 116.22 3cf0 h ARG 560 Ca -0.00 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 3cf0 h ARG 560 Cb 0.52 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 3cf0 h ARG 560 CO 0.03 0.24 -0.26 1.49 -1.51 0.00 0.00 179.97 179.96 3cf0 h GLU 561 N -0.13 -0.37 -0.59 0.20 4.22 -1.52 0.61 114.58 117.00 3cf0 h GLU 561 Ca 0.01 0.03 0.12 0.00 0.08 0.00 0.00 59.36 59.60 3cf0 h GLU 561 Cb 0.21 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.43 3cf0 h GLU 561 CO -0.00 -0.24 -0.15 0.82 -2.18 0.00 0.00 179.01 177.26 3cf0 h ILE 562 N -0.38 0.41 -0.49 2.32 2.04 -1.22 0.13 117.51 120.31 3cf0 h ILE 562 Ca 0.07 -0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.86 3cf0 h ILE 562 Cb 0.49 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 3cf0 h ILE 562 CO -0.26 0.00 0.01 -0.26 0.00 0.00 0.00 178.15 177.64 3cf0 h PHE 563 N 0.00 0.87 0.59 1.37 0.04 -0.42 -2.02 116.94 117.37 3cf0 h PHE 563 Ca 0.28 -0.12 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 3cf0 h PHE 563 Cb 0.43 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 3cf0 h PHE 563 CO -0.49 0.80 -0.48 -0.44 -0.60 0.00 0.00 178.31 177.10 3cf0 h ASP 564 N 0.77 -1.29 -0.95 2.17 3.45 -0.06 -0.37 116.42 120.13 3cf0 h ASP 564 Ca 0.15 0.09 0.27 0.00 0.43 0.00 0.00 57.03 57.98 3cf0 h ASP 564 Cb 0.45 0.41 -0.04 0.00 -0.56 0.00 0.00 39.33 39.59 3cf0 h ASP 564 CO 0.02 -0.67 0.69 0.50 -1.57 0.00 0.00 179.24 178.20 3cf0 h LYS 565 N -1.04 0.00 0.18 3.56 3.64 -0.58 0.35 116.57 122.68 3cf0 h LYS 565 Ca -0.08 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.00 3cf0 h LYS 565 Cb 0.88 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.71 3cf0 h LYS 565 CO -0.00 0.00 -1.37 0.00 -2.27 0.00 0.00 179.45 175.81 3cf0 h ALA 566 N 1.51 0.02 -0.19 5.00 0.00 -0.88 -1.99 119.26 122.73 3cf0 h ALA 566 Ca 0.45 -0.90 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 3cf0 h ALA 566 Cb 1.82 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 3cf0 h ALA 566 CO -0.00 0.89 -0.05 -0.09 0.00 0.00 0.00 179.25 179.99 3cf0 h ARG 567 N 0.10 0.38 -0.32 0.00 2.43 0.13 -2.60 114.38 114.49 3cf0 h ARG 567 Ca -0.19 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 58.78 3cf0 h ARG 567 Cb 2.05 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 31.57 3cf0 h ARG 567 CO 0.23 0.64 0.01 0.37 -1.51 0.00 0.00 179.97 179.70 3cf0 h GLN 568 N 0.09 0.49 -0.32 0.20 -0.00 -0.84 -2.56 115.11 112.17 3cf0 h GLN 568 Ca 0.05 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.60 3cf0 h GLN 568 Cb 0.50 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 27.90 3cf0 h GLN 568 CO 0.02 0.51 0.00 0.00 0.00 0.00 0.00 178.83 179.36 3cf0 n ALA 569 N -2.48 2.45 -1.74 3.38 0.00 -0.75 -4.95 120.51 116.42 3cf0 n ALA 569 Ca 0.01 -0.57 -0.42 0.00 0.00 0.00 0.00 53.44 52.47 3cf0 n ALA 569 Cb 0.23 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.70 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 0.45 2.08 -2.22 0.00 0.00 -0.97 -4.24 120.51 115.61 3cf0 n ALA 570 Ca 0.11 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.50 3cf0 n ALA 570 Cb 0.27 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 17.30 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 -1.27 4.58 -0.09 0.00 0.02 -1.26 -4.99 135.00 131.99 3cf0 s PRO 571 Ca 0.59 1.66 -0.07 0.00 0.02 0.00 0.00 61.00 63.21 3cf0 s PRO 571 Cb -0.52 -3.32 0.03 0.00 0.02 0.00 0.00 34.50 30.71 3cf0 s PRO 571 CO 0.56 0.03 0.23 0.00 -0.33 0.00 0.00 177.00 177.48 3cf0 s VAL 573 N 0.54 5.23 -0.23 0.00 -7.23 0.39 -0.32 120.40 118.78 3cf0 s VAL 573 Ca -0.03 0.43 -0.15 0.00 -1.81 0.00 0.00 61.98 60.41 3cf0 s VAL 573 Cb -0.05 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 33.22 3cf0 s VAL 573 CO -0.03 0.21 0.39 -0.22 -0.31 0.00 0.00 175.10 175.14 3cf0 s LEU 574 N 1.82 4.11 -0.26 1.32 2.96 0.88 -1.21 118.68 128.30 3cf0 s LEU 574 Ca 0.12 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.48 3cf0 s LEU 574 Cb -0.16 -2.48 0.07 0.00 0.50 0.00 0.00 46.19 44.13 3cf0 s LEU 574 CO 0.10 -0.12 -0.03 0.12 -1.32 0.00 0.00 176.35 175.10 3cf0 s PHE 575 N 1.59 2.61 -0.75 5.38 5.36 0.12 -0.64 117.98 131.65 3cf0 s PHE 575 Ca 0.17 -1.98 -0.19 0.00 -0.96 0.00 0.00 56.93 53.97 3cf0 s PHE 575 Cb -0.15 -1.81 0.12 0.00 -0.34 0.00 0.00 43.02 40.85 3cf0 s PHE 575 CO 0.08 -0.82 0.90 -0.06 -1.46 0.00 0.00 175.22 173.87 3cf0 s PHE 576 N 1.32 3.10 0.70 10.12 0.40 0.58 -1.16 117.98 133.04 3cf0 s PHE 576 Ca -0.03 -1.19 -0.11 0.00 -0.60 0.00 0.00 56.93 55.00 3cf0 s PHE 576 Cb -0.19 -4.13 0.01 0.00 0.51 0.00 0.00 43.02 39.23 3cf0 s PHE 576 CO -0.08 -1.38 1.08 0.34 0.70 0.00 0.00 175.22 175.88 3cf0 s ASP 577 N 3.43 5.45 -1.55 1.36 2.15 -0.36 -1.96 116.67 125.19 3cf0 s ASP 577 Ca 0.21 1.25 -0.14 0.00 0.43 0.00 0.00 52.55 54.30 3cf0 s ASP 577 Cb -0.14 -2.09 0.10 0.00 -0.30 0.00 0.00 42.92 40.49 3cf0 s ASP 577 CO -0.01 -1.35 0.86 -0.62 -0.17 0.00 0.00 175.17 173.89 3cf0 n GLU 578 N -3.03 -4.63 0.24 4.34 1.02 -1.07 -3.85 120.64 113.66 3cf0 n GLU 578 Ca 0.07 0.53 0.13 0.00 -0.02 0.00 0.00 57.16 57.87 3cf0 n GLU 578 Cb 0.56 -5.36 0.51 0.00 -0.02 0.00 0.00 31.44 27.12 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 -1.77 0.00 -1.56 -4.62 3.38 -1.50 -2.07 115.31 107.17 3cf0 h LEU 579 Ca -0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.41 3cf0 h LEU 579 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 3cf0 h LEU 579 CO 0.68 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.31 3cf0 n ASP 580 N -2.92 2.37 0.14 -0.43 5.75 -1.26 -4.55 116.55 115.64 3cf0 n ASP 580 Ca 0.03 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.01 3cf0 n ASP 580 Cb 0.74 -0.11 0.14 0.00 -1.03 0.00 0.00 41.12 40.87 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 3.30 0.00 -0.18 -1.12 4.64 -1.75 -0.65 113.55 117.79 3cf0 h SER 581 Ca 0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.14 3cf0 h SER 581 Cb 0.72 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3cf0 h SER 581 CO 0.00 0.60 -0.57 0.40 -0.87 0.00 0.00 176.83 176.39 3cf0 h ILE 582 N 0.00 1.29 0.31 0.95 2.04 -1.84 -2.03 117.51 118.23 3cf0 h ILE 582 Ca -0.01 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 64.08 3cf0 h ILE 582 Cb 1.21 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 38.95 3cf0 h ILE 582 CO 0.08 0.57 -0.47 0.00 0.00 0.00 0.00 178.15 178.33 3cf0 h ALA 583 N 0.76 -0.96 -0.70 1.87 0.00 -1.58 0.12 119.26 118.76 3cf0 h ALA 583 Ca 0.01 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.94 3cf0 h ALA 583 Cb 1.16 0.72 -0.12 0.00 0.00 0.00 0.00 17.79 19.56 3cf0 h ALA 583 CO 0.12 -1.09 0.04 0.87 0.00 0.00 0.00 179.25 179.19 3cf0 h LYS 584 N -0.83 0.14 0.00 0.00 1.57 -1.23 -1.22 116.57 114.99 3cf0 h LYS 584 Ca -0.02 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 3cf0 h LYS 584 Cb 0.78 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 3cf0 h LYS 584 CO -0.15 0.09 -0.20 0.00 -0.57 0.00 0.00 179.45 178.61 3cf0 h ALA 585 N 1.64 1.58 -0.20 3.86 0.00 -0.09 -0.79 119.26 125.25 3cf0 h ALA 585 Ca 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3cf0 h ALA 585 Cb 0.65 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3cf0 h ALA 585 CO -0.58 0.26 0.00 2.89 0.00 0.00 0.00 179.25 181.81 3cf0 n ARG 586 N -4.17 1.83 0.00 0.00 1.85 -0.04 -4.89 116.66 111.24 3cf0 n ARG 586 Ca -0.02 -1.24 0.00 0.00 -1.00 0.00 0.00 57.85 55.58 3cf0 n ARG 586 Cb 0.27 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.28 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 1.17 1.29 7.00 2.89 0.00 -0.31 -3.35 105.19 113.88 3cf0 n GLY 587 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 3.60 0.30 -0.02 0.00 -0.56 -3.14 105.19 105.38 3cf0 n GLY 588 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 46.02 45.96 3cf0 n GLY 588 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3cf0 h ASN 589 N 0.00 -0.83 0.00 1.61 2.35 -1.92 -3.16 115.58 113.62 3cf0 h ASN 589 Ca 0.00 0.24 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 3cf0 h ASN 589 Cb 0.00 0.51 0.00 0.00 0.05 0.00 0.00 38.32 38.88 3cf0 h ASN 589 CO 0.00 -0.27 -0.20 0.16 -1.65 0.00 0.00 177.43 175.48 3cf0 h ILE 590 N -0.03 0.00 0.00 2.81 3.07 -1.98 -3.52 117.51 117.86 3cf0 h ILE 590 Ca 0.35 -0.99 0.00 0.00 1.55 0.00 0.00 64.86 65.77 3cf0 h ILE 590 Cb 0.56 0.00 0.00 0.00 -0.27 0.00 0.00 36.82 37.11 3cf0 h ILE 590 CO -0.79 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 176.92 3cf0 n GLY 591 N 1.72 -1.80 0.00 0.16 0.00 -1.19 -5.03 105.19 99.06 3cf0 n GLY 591 Ca -0.03 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.14 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 0.17 0.34 0.25 1.61 5.75 -1.21 -4.76 116.55 118.70 3cf0 n ASP 592 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.63 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 -0.66 -0.29 6.12 0.00 -1.95 -3.47 103.07 102.82 3cf0 h GLY 593 Ca 0.00 0.24 -0.14 0.00 0.00 0.00 0.00 47.33 47.43 3cf0 h GLY 593 CO 0.00 -0.24 0.13 0.61 0.00 0.00 0.00 176.54 177.04 3cf0 n GLY 594 N -0.89 -1.41 0.00 4.60 0.00 -1.26 -5.09 105.19 101.15 3cf0 n GLY 594 Ca -0.11 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.25 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 1.87 0.24 0.21 -0.02 0.00 -1.26 -4.98 105.19 101.25 3cf0 n GLY 595 Ca 0.05 -1.81 0.08 0.00 0.00 0.00 0.00 46.02 44.34 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 -1.42 1.05 -2.58 4.61 0.00 -1.95 -3.44 119.26 115.53 3cf0 h ALA 596 Ca 0.00 -0.27 -0.57 0.00 0.00 0.00 0.00 54.91 54.06 3cf0 h ALA 596 Cb 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 17.79 17.87 3cf0 h ALA 596 CO 0.00 0.38 0.31 0.00 0.00 0.00 0.00 179.25 179.93 3cf0 n ALA 597 N -2.28 0.67 -2.83 0.00 0.00 -1.26 -4.62 120.51 110.20 3cf0 n ALA 597 Ca -0.00 0.22 -0.10 0.00 0.00 0.00 0.00 53.44 53.56 3cf0 n ALA 597 Cb 0.45 -2.17 -0.08 0.00 0.00 0.00 0.00 19.45 17.65 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 -0.70 0.02 0.38 0.00 1.47 -1.26 -5.05 116.67 111.53 3cf0 s ASP 598 Ca 0.64 -0.39 0.08 0.00 1.18 0.00 0.00 52.55 54.06 3cf0 s ASP 598 Cb -0.52 0.31 0.81 0.00 -0.34 0.00 0.00 42.92 43.18 3cf0 s ASP 598 CO 0.56 -0.60 1.95 0.08 0.68 0.00 0.00 175.17 177.85 3cf0 h ARG 599 N 3.30 0.65 0.08 2.11 0.11 -1.99 -0.20 114.38 118.43 3cf0 h ARG 599 Ca -0.32 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 59.71 3cf0 h ARG 599 Cb 1.19 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.13 3cf0 h ARG 599 CO 0.49 0.43 -0.04 0.28 0.10 0.00 0.00 179.97 181.24 3cf0 h VAL 600 N 0.67 0.91 -0.80 0.08 2.07 -1.95 -2.27 116.25 114.95 3cf0 h VAL 600 Ca 0.32 -1.45 0.03 0.00 0.82 0.00 0.00 66.70 66.43 3cf0 h VAL 600 Cb 0.38 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.74 3cf0 h VAL 600 CO -0.11 0.28 0.53 0.40 0.02 0.00 0.00 177.57 178.68 3cf0 h ILE 601 N -0.94 1.13 -0.50 4.57 1.08 -1.93 -1.38 117.51 119.54 3cf0 h ILE 601 Ca -0.01 -0.34 0.05 0.00 -0.39 0.00 0.00 64.86 64.17 3cf0 h ILE 601 Cb 0.53 0.05 -0.05 0.00 -3.07 0.00 0.00 36.82 34.29 3cf0 h ILE 601 CO 0.02 0.18 0.22 -1.13 -0.69 0.00 0.00 178.15 176.75 3cf0 h ASN 602 N 0.99 0.29 -0.05 1.72 -1.24 -1.06 -0.27 115.58 115.96 3cf0 h ASN 602 Ca 0.32 0.04 0.03 0.00 0.71 0.00 0.00 56.30 57.40 3cf0 h ASN 602 Cb 0.04 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.05 3cf0 h ASN 602 CO -0.09 0.20 -0.13 -0.61 -1.29 0.00 0.00 177.43 175.52 3cf0 h GLN 603 N 0.44 -0.18 -0.86 6.67 5.75 -0.67 0.09 115.11 126.36 3cf0 h GLN 603 Ca 0.23 0.01 0.22 0.00 -0.15 0.00 0.00 58.65 58.95 3cf0 h GLN 603 Cb 0.18 0.04 -0.15 0.00 1.07 0.00 0.00 27.48 28.62 3cf0 h GLN 603 CO -0.19 -0.12 0.06 0.82 -2.65 0.00 0.00 178.83 176.75 3cf0 h ILE 604 N -0.19 0.23 -0.37 2.39 2.04 -0.65 -0.62 117.51 120.35 3cf0 h ILE 604 Ca 0.06 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 3cf0 h ILE 604 Cb 0.27 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 3cf0 h ILE 604 CO -0.16 0.02 0.19 -0.07 0.00 0.00 0.00 178.15 178.13 3cf0 h LEU 605 N 0.10 0.46 0.45 1.44 3.38 0.75 -2.24 115.31 119.64 3cf0 h LEU 605 Ca 0.50 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.36 3cf0 h LEU 605 Cb 0.96 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3cf0 h LEU 605 CO -0.75 0.43 -0.32 0.74 0.09 0.00 0.00 178.44 178.63 3cf0 h THR 606 N 0.46 0.34 0.00 0.22 2.02 -0.78 -0.59 112.91 114.58 3cf0 h THR 606 Ca 0.13 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.31 3cf0 h THR 606 Cb 0.08 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 3cf0 h THR 606 CO -0.02 0.00 0.02 -0.62 0.37 0.00 0.00 175.52 175.27 3cf0 n GLU 607 N -5.45 0.00 -0.01 6.66 -0.58 -0.29 0.02 120.64 121.00 3cf0 n GLU 607 Ca -0.11 0.07 0.01 0.00 -0.42 0.00 0.00 57.16 56.71 3cf0 n GLU 607 Cb 0.35 -1.52 -0.05 0.00 -0.57 0.00 0.00 31.44 29.64 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 -0.96 1.11 0.02 3.49 1.56 -0.37 -3.72 117.12 118.25 3cf0 n MET 608 Ca 0.00 -0.04 -0.18 0.00 -0.27 0.00 0.00 57.70 57.20 3cf0 n MET 608 Cb 0.02 -1.17 -0.13 0.00 2.15 0.00 0.00 33.22 34.10 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 0.49 0.90 6.12 3.32 0.10 -3.27 116.42 124.08 3cf0 h ASP 609 Ca -0.06 -0.85 0.00 0.00 0.02 0.00 0.00 57.03 56.14 3cf0 h ASP 609 Cb 0.69 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3cf0 h ASP 609 CO 0.00 1.28 0.00 0.61 -1.72 0.00 0.00 179.24 179.42 3cf0 n GLY 610 N 1.33 -1.36 3.52 2.75 0.00 0.19 -4.66 105.19 106.95 3cf0 n GLY 610 Ca -0.12 0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 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 3.31 0.04 1.61 0.00 -1.24 -4.97 119.30 114.85 3cf0 s MET 611 Ca 0.07 -0.31 -0.37 0.00 0.00 0.00 0.00 55.69 55.08 3cf0 s MET 611 Cb 0.11 -4.06 -0.16 0.00 0.00 0.00 0.00 34.83 30.71 3cf0 s MET 611 CO 0.44 -1.50 1.43 0.45 0.00 0.00 0.00 175.02 175.83 3cf0 n SER 612 N 7.45 1.93 -0.17 1.11 2.88 -1.26 -4.82 113.62 120.74 3cf0 n SER 612 Ca 0.01 1.11 0.29 0.00 -1.33 0.00 0.00 58.87 58.95 3cf0 n SER 612 Cb 0.47 -1.21 0.69 0.00 -0.75 0.00 0.00 64.21 63.41 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 3.66 0.31 -0.02 2.46 1.03 -1.93 -2.31 112.91 116.11 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 1.32 0.40 0.00 0.00 -1.07 0.00 0.00 68.15 68.80 3cf0 h THR 613 CO 0.82 0.00 0.00 0.29 -0.01 0.00 0.00 175.52 176.62 3cf0 n LYS 614 N -3.84 1.73 0.00 0.00 5.02 -1.26 -4.77 118.16 115.04 3cf0 n LYS 614 Ca 0.20 -1.06 0.00 0.00 -2.02 0.00 0.00 58.31 55.42 3cf0 n LYS 614 Cb 1.11 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.65 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 0.29 -0.27 -2.09 1.97 4.76 -0.87 -5.00 118.16 116.95 3cf0 n LYS 615 Ca 0.18 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.40 3cf0 n LYS 615 Cb 0.38 0.00 0.02 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 -2.54 4.66 -4.53 4.39 2.85 -1.26 -5.01 115.26 113.82 3cf0 n ASN 616 Ca 0.00 -3.61 -0.35 0.00 -0.11 0.00 0.00 54.58 50.51 3cf0 n ASN 616 Cb 0.00 -0.35 -0.11 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 -4.54 4.43 -0.19 3.44 1.01 -1.26 -1.84 120.40 121.46 3cf0 s VAL 617 Ca 0.49 -0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.29 3cf0 s VAL 617 Cb 0.40 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 3cf0 s VAL 617 CO 0.03 0.41 -0.06 0.12 0.00 0.00 0.00 175.10 175.60 3cf0 s PHE 618 N 0.90 2.93 -0.17 5.22 5.36 0.57 -4.97 117.98 127.81 3cf0 s PHE 618 Ca 0.03 -0.78 -0.10 0.00 -0.96 0.00 0.00 56.93 55.12 3cf0 s PHE 618 Cb -0.14 -2.02 -0.05 0.00 -0.34 0.00 0.00 43.02 40.47 3cf0 s PHE 618 CO 0.02 -0.39 0.17 0.42 -1.46 0.00 0.00 175.22 173.98 3cf0 s ILE 619 N 1.04 5.40 -0.08 3.12 1.01 -0.91 -0.08 121.20 130.70 3cf0 s ILE 619 Ca 0.00 0.28 0.02 0.00 0.00 0.00 0.00 60.65 60.96 3cf0 s ILE 619 Cb -0.15 -3.50 0.01 0.00 0.01 0.00 0.00 42.46 38.84 3cf0 s ILE 619 CO -0.00 0.47 -0.13 -0.63 0.00 0.00 0.00 174.94 174.64 3cf0 s ILE 620 N 0.10 1.25 0.21 2.92 1.01 0.19 -2.08 121.20 124.80 3cf0 s ILE 620 Ca 0.11 -0.54 0.05 0.00 0.00 0.00 0.00 60.65 60.28 3cf0 s ILE 620 Cb -0.12 -1.14 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 3cf0 s ILE 620 CO 0.01 0.38 0.21 -0.83 0.00 0.00 0.00 174.94 174.71 3cf0 s GLY 621 N 0.73 1.53 0.00 6.18 0.00 0.35 -0.30 107.32 115.80 3cf0 s GLY 621 Ca -0.13 -1.27 -0.05 0.00 0.00 0.00 0.00 44.72 43.26 3cf0 s GLY 621 CO 0.03 -1.29 0.10 0.00 0.00 0.00 0.00 173.10 171.93 3cf0 s ALA 622 N -1.93 -0.21 -0.15 3.20 0.00 -0.83 -1.10 121.76 120.74 3cf0 s ALA 622 Ca 0.33 -0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.78 3cf0 s ALA 622 Cb -0.09 0.10 0.09 0.00 0.00 0.00 0.00 23.12 23.22 3cf0 s ALA 622 CO 0.25 -0.19 0.82 -0.08 0.00 0.00 0.00 175.76 176.57 3cf0 s THR 623 N -1.29 0.00 -0.40 0.00 -1.32 -0.77 -1.71 115.64 110.14 3cf0 s THR 623 Ca -0.14 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.49 3cf0 s THR 623 Cb -0.08 -1.00 0.47 0.00 -1.51 0.00 0.00 72.50 70.39 3cf0 s THR 623 CO 0.01 0.00 1.38 -0.46 -2.21 0.00 0.00 174.62 173.34 3cf0 n ASN 624 N 1.31 3.65 -3.19 8.08 2.04 -1.26 -2.73 115.26 123.17 3cf0 n ASN 624 Ca -0.15 -2.72 -0.22 0.00 -0.44 0.00 0.00 54.58 51.05 3cf0 n ASN 624 Cb 0.57 -0.46 -0.05 0.00 -2.53 0.00 0.00 39.78 37.31 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 -0.19 1.02 0.22 -3.83 5.12 -1.26 -4.83 116.66 112.91 3cf0 n ARG 625 Ca 0.19 -3.43 0.10 0.00 -1.93 0.00 0.00 57.85 52.78 3cf0 n ARG 625 Cb 0.77 -1.52 0.50 0.00 -1.16 0.00 0.00 32.46 31.05 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 3.54 0.00 -0.74 5.56 0.13 -1.95 -0.13 132.00 138.41 3cf0 h PRO 626 Ca 0.09 0.00 0.21 0.00 -0.87 0.00 0.00 66.00 65.43 3cf0 h PRO 626 Cb 0.89 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.99 3cf0 h PRO 626 CO 0.51 0.23 0.53 0.38 -0.23 0.00 0.00 178.00 179.42 3cf0 h ASP 627 N 0.00 0.02 -0.01 1.44 2.03 -1.99 -2.88 116.42 115.04 3cf0 h ASP 627 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3cf0 h ASP 627 Cb 0.68 -0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.18 3cf0 h ASP 627 CO 0.03 0.01 -0.66 2.30 -1.03 0.00 0.00 179.24 179.89 3cf0 n ILE 628 N -4.32 0.00 -1.53 4.15 -5.35 -0.06 -4.98 119.36 107.26 3cf0 n ILE 628 Ca 0.15 -0.17 -0.41 0.00 -0.27 0.00 0.00 62.75 62.04 3cf0 n ILE 628 Cb 0.80 1.12 0.01 0.00 -1.74 0.00 0.00 39.64 39.83 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 -0.76 2.17 -2.33 7.28 2.08 -1.09 -4.89 119.36 121.83 3cf0 n ILE 629 Ca 0.06 -0.50 -0.42 0.00 0.56 0.00 0.00 62.75 62.44 3cf0 n ILE 629 Cb 0.36 -0.82 -0.03 0.00 -0.75 0.00 0.00 39.64 38.41 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 -0.89 6.91 0.54 4.38 2.15 -1.26 -4.91 116.67 123.59 3cf0 s ASP 630 Ca 0.64 1.89 0.33 0.00 0.43 0.00 0.00 52.55 55.84 3cf0 s ASP 630 Cb -0.58 -2.55 1.50 0.00 -0.30 0.00 0.00 42.92 40.99 3cf0 s ASP 630 CO 0.57 -0.73 1.86 -0.65 -0.17 0.00 0.00 175.17 176.05 3cf0 h PRO 631 N 8.10 0.00 -0.17 4.34 0.11 -1.95 -1.49 132.00 140.94 3cf0 h PRO 631 Ca -0.33 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.83 3cf0 h PRO 631 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3cf0 h PRO 631 CO 0.93 0.00 0.16 0.00 -0.21 0.00 0.00 178.00 178.88 3cf0 h ALA 632 N 1.50 1.91 0.00 -0.75 0.00 -1.99 0.15 119.26 120.08 3cf0 h ALA 632 Ca 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.35 3cf0 h ALA 632 Cb 1.84 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 3cf0 h ALA 632 CO -0.00 -0.25 -0.02 0.82 0.00 0.00 0.00 179.25 179.80 3cf0 h ILE 633 N 0.00 0.08 0.00 0.00 2.04 -1.66 -2.61 117.51 115.36 3cf0 h ILE 633 Ca 0.08 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.66 3cf0 h ILE 633 Cb 0.40 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 3cf0 h ILE 633 CO -0.00 0.02 -0.93 0.18 0.00 0.00 0.00 178.15 177.42 3cf0 n LEU 634 N -3.16 0.63 -4.60 1.44 4.77 0.52 -1.78 117.00 114.82 3cf0 n LEU 634 Ca -0.01 0.02 -0.36 0.00 -0.03 0.00 0.00 56.01 55.63 3cf0 n LEU 634 Cb 0.19 -0.12 0.09 0.00 -2.33 0.00 0.00 43.42 41.25 3cf0 n LEU 634 CO 0.24 0.03 0.48 0.54 -1.33 0.00 0.00 177.39 177.35 3cf0 n ARG 635 N -1.97 0.47 -1.52 3.23 1.74 -0.99 -4.41 116.66 113.22 3cf0 n ARG 635 Ca 0.02 0.22 -0.50 0.00 -0.77 0.00 0.00 57.85 56.82 3cf0 n ARG 635 Cb 0.43 -2.18 -0.04 0.00 -1.02 0.00 0.00 32.46 29.65 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 -1.75 0.70 -0.42 5.56 -0.02 -1.26 -2.44 135.00 135.36 3cf0 n PRO 636 Ca 0.13 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3cf0 n PRO 636 Cb 0.49 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 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 1.85 0.73 0.00 -1.23 0.00 -1.26 -4.98 105.19 100.30 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 -2.13 0.00 -3.00 1.61 1.74 -1.02 -4.83 116.66 109.04 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 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 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 5.29 0.11 0.55 1.43 -0.73 -3.65 118.68 121.69 3cf0 s LEU 639 Ca 0.00 -2.51 -0.04 0.00 -1.03 0.00 0.00 54.13 50.55 3cf0 s LEU 639 Cb 0.00 -2.37 -0.15 0.00 0.03 0.00 0.00 46.19 43.70 3cf0 s LEU 639 CO 0.00 -0.87 1.26 0.44 0.23 0.00 0.00 176.35 177.41 3cf0 h ASP 640 N 8.06 0.49 -2.78 2.29 5.19 -1.77 -3.39 116.42 124.51 3cf0 h ASP 640 Ca 0.21 -0.43 -0.63 0.00 -0.62 0.00 0.00 57.03 55.56 3cf0 h ASP 640 Cb 0.97 -0.15 -0.15 0.00 0.18 0.00 0.00 39.33 40.18 3cf0 h ASP 640 CO 1.11 1.26 0.50 -1.10 -3.12 0.00 0.00 179.24 177.88 3cf0 s GLN 641 N -3.07 3.14 0.15 3.56 -1.52 -1.23 -4.96 119.66 115.73 3cf0 s GLN 641 Ca -0.05 -0.78 -0.30 0.00 -1.95 0.00 0.00 55.36 52.28 3cf0 s GLN 641 Cb 0.08 -4.20 -0.08 0.00 -0.22 0.00 0.00 33.01 28.60 3cf0 s GLN 641 CO 0.87 -1.72 1.29 -0.51 -0.25 0.00 0.00 175.29 174.96 3cf0 s LEU 642 N 3.90 4.40 -0.05 2.90 2.01 -1.26 -0.48 118.68 130.10 3cf0 s LEU 642 Ca 0.22 2.29 0.00 0.00 0.01 0.00 0.00 54.13 56.66 3cf0 s LEU 642 Cb -0.17 -3.60 0.02 0.00 0.01 0.00 0.00 46.19 42.46 3cf0 s LEU 642 CO 0.11 -0.52 -0.03 -0.63 1.01 0.00 0.00 176.35 176.30 3cf0 s ILE 643 N 0.46 0.48 -0.27 -0.59 1.01 0.19 -4.92 121.20 117.56 3cf0 s ILE 643 Ca 0.58 -0.04 -0.19 0.00 0.00 0.00 0.00 60.65 60.99 3cf0 s ILE 643 Cb -0.35 -0.55 -0.02 0.00 0.01 0.00 0.00 42.46 41.55 3cf0 s ILE 643 CO 0.35 0.24 0.59 -0.47 0.00 0.00 0.00 174.94 175.64 3cf0 s TYR 644 N 1.27 3.26 -0.55 3.97 5.04 -1.26 -1.57 117.35 127.51 3cf0 s TYR 644 Ca -0.06 0.70 -0.15 0.00 -2.44 0.00 0.00 57.07 55.12 3cf0 s TYR 644 Cb -0.14 -2.83 0.13 0.00 0.35 0.00 0.00 41.96 39.48 3cf0 s TYR 644 CO -0.02 -0.34 0.50 0.42 -1.34 0.00 0.00 175.55 174.76 3cf0 s ILE 645 N 2.46 5.12 0.80 3.14 1.09 -0.47 -4.97 121.20 128.37 3cf0 s ILE 645 Ca 0.24 -1.59 -0.11 0.00 -1.10 0.00 0.00 60.65 58.09 3cf0 s ILE 645 Cb -0.15 -4.28 0.09 0.00 -1.06 0.00 0.00 42.46 37.05 3cf0 s ILE 645 CO 0.09 -0.87 1.15 -2.16 -0.10 0.00 0.00 174.94 173.06 3cf0 s PRO 646 N 1.49 1.86 0.61 2.79 0.04 -1.26 -3.91 135.00 136.61 3cf0 s PRO 646 Ca 0.04 -0.07 -0.19 0.00 0.04 0.00 0.00 61.00 60.83 3cf0 s PRO 646 Cb -0.28 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 3cf0 s PRO 646 CO 0.02 -1.60 1.10 1.28 0.04 0.00 0.00 177.00 177.84 3cf0 n LEU 647 N -3.26 4.54 -4.76 -3.56 4.32 -1.26 -4.93 117.00 108.09 3cf0 n LEU 647 Ca 0.09 0.84 -0.41 0.00 -0.02 0.00 0.00 56.01 56.51 3cf0 n LEU 647 Cb 0.61 -1.46 -0.03 0.00 -1.62 0.00 0.00 43.42 40.92 3cf0 n LEU 647 CO 0.54 -1.47 0.89 -2.16 -1.22 0.00 0.00 177.39 173.97 3cf0 s PRO 648 N -2.93 4.49 0.88 3.23 0.04 -1.26 -5.03 135.00 134.42 3cf0 s PRO 648 Ca 0.77 1.98 -0.10 0.00 0.04 0.00 0.00 61.00 63.70 3cf0 s PRO 648 Cb -0.41 -3.16 0.18 0.00 0.04 0.00 0.00 34.50 31.15 3cf0 s PRO 648 CO 0.45 -0.02 1.21 0.16 0.04 0.00 0.00 177.00 178.84 3cf0 s ASP 649 N -0.45 3.50 0.02 6.66 -4.77 -1.26 -4.75 116.67 115.62 3cf0 s ASP 649 Ca 0.49 -0.05 -0.04 0.00 -3.30 0.00 0.00 52.55 49.65 3cf0 s ASP 649 Cb -0.35 -0.08 -0.01 0.00 -1.09 0.00 0.00 42.92 41.39 3cf0 s ASP 649 CO 0.44 -2.46 0.64 -0.62 0.70 0.00 0.00 175.17 173.87 3cf0 n GLU 650 N -3.43 -0.06 0.00 2.11 4.71 -1.26 -0.70 120.64 122.01 3cf0 n GLU 650 Ca 0.16 0.63 -0.12 0.00 -0.01 0.00 0.00 57.16 57.83 3cf0 n GLU 650 Cb 0.60 -0.95 -0.06 0.00 -1.01 0.00 0.00 31.44 30.02 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 0.09 -0.68 3.49 1.57 -1.95 -3.13 116.57 115.97 3cf0 h LYS 651 Ca 0.02 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.90 3cf0 h LYS 651 Cb 0.05 -0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.26 3cf0 h LYS 651 CO -0.12 0.15 0.26 0.77 -0.57 0.00 0.00 179.45 179.95 3cf0 h SER 652 N 0.01 0.26 -0.72 0.86 0.02 -1.76 0.71 113.55 112.93 3cf0 h SER 652 Ca 0.02 0.09 0.09 0.00 -0.84 0.00 0.00 61.79 61.15 3cf0 h SER 652 Cb 0.09 0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.65 3cf0 h SER 652 CO -0.00 0.13 0.47 0.03 -1.14 0.00 0.00 176.83 176.32 3cf0 h ARG 653 N 0.44 0.61 0.60 3.45 3.08 -0.86 0.31 114.38 122.02 3cf0 h ARG 653 Ca 0.35 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.34 3cf0 h ARG 653 Cb 0.48 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.40 3cf0 h ARG 653 CO -0.35 0.40 -0.29 0.28 -1.07 0.00 0.00 179.97 178.95 3cf0 h VAL 654 N 0.63 0.40 -0.56 2.04 2.07 -0.91 -1.64 116.25 118.27 3cf0 h VAL 654 Ca 0.33 -0.06 0.11 0.00 0.82 0.00 0.00 66.70 67.90 3cf0 h VAL 654 Cb 0.44 0.42 -0.09 0.00 -1.52 0.00 0.00 31.29 30.55 3cf0 h VAL 654 CO -0.11 0.01 0.05 0.00 0.02 0.00 0.00 177.57 177.54 3cf0 h ALA 655 N -0.46 0.59 -0.96 1.67 0.00 -0.70 0.27 119.26 119.67 3cf0 h ALA 655 Ca -0.08 0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.05 3cf0 h ALA 655 Cb 0.64 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.60 3cf0 h ALA 655 CO 0.14 -0.36 0.62 0.82 0.00 0.00 0.00 179.25 180.47 3cf0 h ILE 656 N 0.17 1.06 -0.24 0.00 2.04 -0.36 0.56 117.51 120.75 3cf0 h ILE 656 Ca 0.29 -0.37 -0.08 0.00 1.00 0.00 0.00 64.86 65.70 3cf0 h ILE 656 Cb 0.44 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 3cf0 h ILE 656 CO -0.43 0.20 -0.16 -0.07 0.00 0.00 0.00 178.15 177.69 3cf0 h LEU 657 N 1.09 0.56 0.26 1.44 3.38 -0.05 -1.16 115.31 120.82 3cf0 h LEU 657 Ca 0.42 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3cf0 h LEU 657 Cb 0.22 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3cf0 h LEU 657 CO -0.17 0.87 -0.21 0.11 0.09 0.00 0.00 178.44 179.14 3cf0 h LYS 658 N 0.24 -0.45 -0.66 1.13 1.57 -0.20 -0.21 116.57 117.99 3cf0 h LYS 658 Ca 0.05 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 58.99 3cf0 h LYS 658 Cb 0.69 0.10 -0.10 0.00 0.08 0.00 0.00 32.23 33.00 3cf0 h LYS 658 CO 0.04 -0.30 0.13 0.00 -0.57 0.00 0.00 179.45 178.75 3cf0 h ALA 659 N 0.22 0.79 0.00 3.86 0.00 0.11 0.30 119.26 124.54 3cf0 h ALA 659 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3cf0 h ALA 659 Cb 0.42 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3cf0 h ALA 659 CO -0.02 -0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.00 3cf0 n ASN 660 N -5.16 0.11 -0.23 0.00 4.13 -0.44 -2.58 115.26 111.09 3cf0 n ASN 660 Ca 0.11 0.52 0.03 0.00 1.68 0.00 0.00 54.58 56.92 3cf0 n ASN 660 Cb 0.38 -0.55 0.03 0.00 -1.54 0.00 0.00 39.78 38.10 3cf0 n ASN 660 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3cf0 n LEU 661 N -1.62 1.71 -0.30 3.41 4.77 0.83 -4.70 117.00 121.09 3cf0 n LEU 661 Ca 0.04 -1.29 0.14 0.00 -0.03 0.00 0.00 56.01 54.88 3cf0 n LEU 661 Cb 0.24 -0.03 0.32 0.00 -2.33 0.00 0.00 43.42 41.62 3cf0 n LEU 661 CO 0.19 0.39 1.01 0.03 -1.33 0.00 0.00 177.39 177.68 3cf0 h ARG 662 N 0.97 0.30 -1.44 3.23 3.08 -0.67 0.40 114.38 120.25 3cf0 h ARG 662 Ca 0.00 -0.02 -0.70 0.00 0.07 0.00 0.00 59.98 59.33 3cf0 h ARG 662 Cb 0.32 -0.07 -0.31 0.00 0.08 0.00 0.00 29.97 30.00 3cf0 h ARG 662 CO 0.00 0.20 0.66 1.63 -1.07 0.00 0.00 179.97 181.39 3cf0 n LYS 663 N -5.12 2.86 -3.88 0.04 5.02 -1.26 -4.97 118.16 110.85 3cf0 n LYS 663 Ca 0.23 -3.57 -0.11 0.00 -2.02 0.00 0.00 58.31 52.83 3cf0 n LYS 663 Cb 0.70 -2.28 -0.11 0.00 -0.02 0.00 0.00 35.03 33.32 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 -1.83 0.02 -1.30 4.39 0.01 0.13 -5.09 113.70 110.03 3cf0 s SER 664 Ca 0.57 -0.14 -0.17 0.00 1.31 0.00 0.00 55.95 57.51 3cf0 s SER 664 Cb 0.46 0.20 0.08 0.00 0.21 0.00 0.00 66.02 66.97 3cf0 s SER 664 CO -0.19 -0.27 1.74 -2.65 0.41 0.00 0.00 173.24 172.28 3cf0 n PRO 665 N 1.88 3.20 -2.50 12.44 -0.02 -1.26 -4.96 135.00 143.77 3cf0 n PRO 665 Ca -0.20 -3.29 -0.43 0.00 -2.02 0.00 0.00 63.50 57.56 3cf0 n PRO 665 Cb 0.56 -3.44 -0.02 0.00 -0.02 0.00 0.00 33.50 30.58 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 3.91 4.40 0.39 -1.45 -7.23 -1.26 -0.61 120.40 118.55 3cf0 s VAL 666 Ca 0.53 1.70 -0.26 0.00 -1.81 0.00 0.00 61.98 62.13 3cf0 s VAL 666 Cb 0.04 -4.10 -0.11 0.00 0.56 0.00 0.00 36.38 32.78 3cf0 s VAL 666 CO 0.06 -0.11 1.27 0.00 -0.31 0.00 0.00 175.10 176.01 3cf0 n ALA 667 N 6.19 1.29 -0.23 1.32 0.00 0.11 -4.89 120.51 124.30 3cf0 n ALA 667 Ca 0.13 0.30 -0.05 0.00 0.00 0.00 0.00 53.44 53.82 3cf0 n ALA 667 Cb 0.46 -2.26 0.06 0.00 0.00 0.00 0.00 19.45 17.70 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 2.25 0.81 -0.81 0.00 1.57 -1.95 -2.99 116.57 115.45 3cf0 h LYS 668 Ca -0.47 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.23 3cf0 h LYS 668 Cb 1.29 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 33.38 3cf0 h LYS 668 CO 0.61 0.53 0.39 0.38 -0.57 0.00 0.00 179.45 180.79 3cf0 h ASP 669 N 0.83 1.06 -1.22 0.86 2.03 -1.98 -3.45 116.42 114.54 3cf0 h ASP 669 Ca 0.25 -0.12 -0.76 0.00 -0.73 0.00 0.00 57.03 55.67 3cf0 h ASP 669 Cb -0.03 -0.27 0.00 0.00 -0.83 0.00 0.00 39.33 38.20 3cf0 h ASP 669 CO -0.08 0.89 0.99 0.52 -1.03 0.00 0.00 179.24 180.52 3cf0 n VAL 670 N -4.31 0.21 -3.44 4.15 0.31 -1.13 -4.92 118.33 109.20 3cf0 n VAL 670 Ca 0.08 -0.07 -0.43 0.00 -0.01 0.00 0.00 64.34 63.91 3cf0 n VAL 670 Cb 0.14 -1.09 -0.09 0.00 -0.91 0.00 0.00 33.84 31.89 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 4.26 6.08 0.04 4.52 -1.08 -1.26 -4.93 116.67 124.30 3cf0 s ASP 671 Ca 1.03 -1.16 -0.01 0.00 -0.52 0.00 0.00 52.55 51.90 3cf0 s ASP 671 Cb -1.16 -2.16 -0.27 0.00 -1.46 0.00 0.00 42.92 37.88 3cf0 s ASP 671 CO 0.66 -0.55 0.99 -0.07 0.52 0.00 0.00 175.17 176.73 3cf0 h LEU 672 N 8.67 0.32 -2.28 -1.34 3.38 -1.98 -3.05 115.31 119.03 3cf0 h LEU 672 Ca -0.27 -0.40 0.04 0.00 0.09 0.00 0.00 57.88 57.34 3cf0 h LEU 672 Cb 1.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3cf0 h LEU 672 CO 0.80 1.32 0.15 -0.33 0.09 0.00 0.00 178.44 180.48 3cf0 h GLU 673 N 0.06 0.00 0.00 1.13 3.07 -1.95 0.24 114.58 117.13 3cf0 h GLU 673 Ca -0.18 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.68 3cf0 h GLU 673 Cb 1.97 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.88 3cf0 h GLU 673 CO 0.16 0.00 -0.00 0.35 -1.40 0.00 0.00 179.01 178.12 3cf0 h PHE 674 N 0.00 -0.00 -1.10 4.33 3.57 -1.98 -3.06 116.94 118.70 3cf0 h PHE 674 Ca 0.07 -0.00 0.34 0.00 3.53 0.00 0.00 57.97 61.91 3cf0 h PHE 674 Cb 0.37 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 38.98 3cf0 h PHE 674 CO 0.00 0.48 0.67 -0.07 -2.23 0.00 0.00 178.31 177.15 3cf0 h LEU 675 N -1.00 0.42 -0.71 0.59 3.38 -1.22 0.58 115.31 117.35 3cf0 h LEU 675 Ca -0.00 0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 3cf0 h LEU 675 Cb 0.48 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 3cf0 h LEU 675 CO 0.00 -0.11 0.17 0.00 0.09 0.00 0.00 178.44 178.58 3cf0 h ALA 676 N 1.74 0.94 0.00 1.53 0.00 -0.62 -2.26 119.26 120.59 3cf0 h ALA 676 Ca 0.73 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.34 3cf0 h ALA 676 Cb 1.90 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 3cf0 h ALA 676 CO -0.50 0.67 -0.24 0.87 0.00 0.00 0.00 179.25 180.05 3cf0 h LYS 677 N 1.08 0.00 0.00 0.00 1.79 0.20 -3.10 116.57 116.54 3cf0 h LYS 677 Ca 0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 3cf0 h LYS 677 Cb 0.39 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 3cf0 h LYS 677 CO 0.00 0.24 0.00 -1.33 -1.08 0.00 0.00 179.45 177.28 3cf0 n MET 678 N -4.08 0.04 -4.86 3.15 2.81 -0.27 -4.84 117.12 109.07 3cf0 n MET 678 Ca -0.02 0.10 -0.27 0.00 -1.81 0.00 0.00 57.70 55.71 3cf0 n MET 678 Cb 0.31 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.15 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 -2.95 1.49 0.00 2.03 -4.23 -1.17 -5.08 115.64 105.73 3cf0 s THR 679 Ca 0.12 -0.73 0.00 0.00 -1.18 0.00 0.00 61.69 59.90 3cf0 s THR 679 Cb 0.15 -1.29 0.00 0.00 1.34 0.00 0.00 72.50 72.70 3cf0 s THR 679 CO 0.41 0.43 0.00 0.59 -0.54 0.00 0.00 174.62 175.51 3cf0 n ASN 680 N 3.30 0.00 -0.32 3.99 3.02 -1.26 -4.74 115.26 119.26 3cf0 n ASN 680 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 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 4.13 0.00 3.69 7.41 0.00 -1.26 -4.46 105.19 114.69 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 -0.81 3.34 0.38 1.61 0.40 -1.26 -3.95 117.98 117.68 3cf0 s PHE 682 Ca 0.00 1.39 0.05 0.00 -0.60 0.00 0.00 56.93 57.77 3cf0 s PHE 682 Cb 0.00 -3.31 -0.00 0.00 0.51 0.00 0.00 43.02 40.21 3cf0 s PHE 682 CO 0.00 -0.81 0.54 -1.54 0.70 0.00 0.00 175.22 174.10 3cf0 s SER 683 N 1.30 5.89 0.27 1.36 1.04 -1.26 -4.22 113.70 118.08 3cf0 s SER 683 Ca 0.52 -0.09 -0.02 0.00 0.48 0.00 0.00 55.95 56.85 3cf0 s SER 683 Cb -0.22 -1.25 0.58 0.00 0.10 0.00 0.00 66.02 65.24 3cf0 s SER 683 CO 0.20 -0.55 1.67 1.23 0.98 0.00 0.00 173.24 176.77 3cf0 h GLY 684 N 0.73 1.19 0.72 7.32 0.00 -1.17 0.13 103.07 111.99 3cf0 h GLY 684 Ca -0.45 -0.04 0.03 0.00 0.00 0.00 0.00 47.33 46.87 3cf0 h GLY 684 CO 0.53 -0.28 0.02 0.00 0.00 0.00 0.00 176.54 176.82 3cf0 h ALA 685 N 1.69 0.20 -0.85 3.60 0.00 -1.63 0.14 119.26 122.41 3cf0 h ALA 685 Ca 0.48 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.52 3cf0 h ALA 685 Cb 0.89 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.70 3cf0 h ALA 685 CO -0.58 -0.41 0.55 -0.44 0.00 0.00 0.00 179.25 178.38 3cf0 h ASP 686 N 0.10 0.80 0.08 0.00 3.32 -1.10 0.91 116.42 120.52 3cf0 h ASP 686 Ca 0.10 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 3cf0 h ASP 686 Cb 0.11 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3cf0 h ASP 686 CO -0.15 0.50 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.76 3cf0 h LEU 687 N 0.90 -0.09 -0.90 1.55 3.38 -0.11 -2.64 115.31 117.40 3cf0 h LEU 687 Ca 0.38 -0.36 0.24 0.00 0.09 0.00 0.00 57.88 58.23 3cf0 h LEU 687 Cb 0.30 0.02 -0.14 0.00 0.09 0.00 0.00 40.66 40.94 3cf0 h LEU 687 CO -0.15 0.33 0.33 0.74 0.09 0.00 0.00 178.44 179.78 3cf0 h THR 688 N -0.52 0.36 -0.94 0.22 2.02 -0.44 -0.37 112.91 113.24 3cf0 h THR 688 Ca -0.01 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.08 3cf0 h THR 688 Cb 0.44 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.86 3cf0 h THR 688 CO 0.02 0.05 0.63 -0.08 0.37 0.00 0.00 175.52 176.51 3cf0 h GLU 689 N 0.28 1.24 0.71 6.66 4.57 -0.52 -1.39 114.58 126.13 3cf0 h GLU 689 Ca 0.58 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.65 3cf0 h GLU 689 Cb 1.17 -0.28 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 3cf0 h GLU 689 CO -0.61 0.82 -0.40 0.82 -1.18 0.00 0.00 179.01 178.46 3cf0 h ILE 690 N 1.28 0.00 -0.87 2.32 2.04 -0.72 -2.26 117.51 119.30 3cf0 h ILE 690 Ca 0.35 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.36 3cf0 h ILE 690 Cb -0.14 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 35.78 3cf0 h ILE 690 CO -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 178.15 177.78 3cf0 h GLN 692 N -0.03 0.66 -0.44 0.00 4.20 -1.07 0.78 115.11 119.20 3cf0 h GLN 692 Ca 0.36 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.90 3cf0 h GLN 692 Cb 0.61 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 3cf0 h GLN 692 CO -0.89 0.44 -0.26 0.00 -0.67 0.00 0.00 178.83 177.44 3cf0 h ARG 693 N 0.68 0.95 -0.22 1.46 3.08 0.29 -0.63 114.38 119.98 3cf0 h ARG 693 Ca 0.46 -0.42 0.04 0.00 0.07 0.00 0.00 59.98 60.13 3cf0 h ARG 693 Cb 0.61 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 3cf0 h ARG 693 CO -0.34 1.09 -0.04 0.00 -1.07 0.00 0.00 179.97 179.60 3cf0 h ALA 694 N 0.89 0.16 0.14 0.04 0.00 0.31 0.69 119.26 121.48 3cf0 h ALA 694 Ca 0.10 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.11 3cf0 h ALA 694 Cb 0.83 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 3cf0 h ALA 694 CO 0.07 -0.46 -0.31 0.00 0.00 0.00 0.00 179.25 178.54 3cf0 h LYS 696 N -0.55 0.24 0.23 0.00 1.57 -0.85 0.51 116.57 117.73 3cf0 h LYS 696 Ca 0.03 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3cf0 h LYS 696 Cb 0.57 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3cf0 h LYS 696 CO -0.17 0.16 -0.11 -0.07 -0.57 0.00 0.00 179.45 178.69 3cf0 h LEU 697 N 0.25 -0.27 -0.61 2.94 3.38 0.22 -2.13 115.31 119.10 3cf0 h LEU 697 Ca 0.30 -0.24 0.11 0.00 0.09 0.00 0.00 57.88 58.14 3cf0 h LEU 697 Cb 0.85 0.07 -0.08 0.00 0.09 0.00 0.00 40.66 41.59 3cf0 h LEU 697 CO -0.06 0.15 0.17 0.00 0.09 0.00 0.00 178.44 178.78 3cf0 h ALA 698 N -0.13 0.76 0.02 1.53 0.00 0.29 0.45 119.26 122.18 3cf0 h ALA 698 Ca -0.03 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3cf0 h ALA 698 Cb 0.50 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3cf0 h ALA 698 CO 0.05 -0.27 -0.01 0.82 0.00 0.00 0.00 179.25 179.84 3cf0 h ILE 699 N 0.32 1.04 -0.27 0.00 2.04 -0.05 0.79 117.51 121.37 3cf0 h ILE 699 Ca 0.32 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 3cf0 h ILE 699 Cb 0.46 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 3cf0 h ILE 699 CO -0.37 0.05 0.08 -0.09 0.00 0.00 0.00 178.15 177.82 3cf0 h ARG 700 N -0.12 0.39 -0.00 2.37 2.43 -1.09 0.13 114.38 118.48 3cf0 h ARG 700 Ca -0.00 -0.05 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 3cf0 h ARG 700 Cb 0.11 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3cf0 h ARG 700 CO 0.01 0.35 -0.78 1.49 -1.51 0.00 0.00 179.97 179.52 3cf0 h GLU 701 N 0.39 0.04 0.00 0.20 4.22 0.88 -2.48 114.58 117.83 3cf0 h GLU 701 Ca 0.10 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.50 3cf0 h GLU 701 Cb 0.13 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3cf0 h GLU 701 CO -0.01 0.80 0.00 0.45 -2.18 0.00 0.00 179.01 178.07 3cf0 n SER 702 N -3.64 0.00 -0.29 1.04 2.88 0.27 -3.31 113.62 110.57 3cf0 n SER 702 Ca -0.01 0.55 0.33 0.00 -1.33 0.00 0.00 58.87 58.41 3cf0 n SER 702 Cb 0.75 -0.39 0.61 0.00 -0.75 0.00 0.00 64.21 64.44 3cf0 n SER 702 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 3cf0 h ILE 703 N 0.00 0.11 0.67 2.46 2.04 -0.93 0.14 117.51 122.00 3cf0 h ILE 703 Ca 0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 3cf0 h ILE 703 Cb 0.00 0.16 0.01 0.00 -0.74 0.00 0.00 36.82 36.24 3cf0 h ILE 703 CO 0.00 0.00 -0.32 -0.08 0.00 0.00 0.00 178.15 177.75 3cf0 h GLU 704 N 0.00 -0.87 -0.79 2.37 4.81 -1.51 -3.25 114.58 115.33 3cf0 h GLU 704 Ca 0.55 0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.94 3cf0 h GLU 704 Cb 2.75 0.20 -0.08 0.00 0.63 0.00 0.00 28.75 32.25 3cf0 h GLU 704 CO -0.01 -0.55 0.43 0.66 -0.73 0.00 0.00 179.01 178.82 3cf0 h SER 705 N -1.00 0.59 0.85 1.04 4.64 -0.70 -3.00 113.55 115.98 3cf0 h SER 705 Ca -0.09 0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.24 3cf0 h SER 705 Cb 0.72 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.76 3cf0 h SER 705 CO 0.15 0.32 -0.41 -0.33 -0.87 0.00 0.00 176.83 175.70 3cf0 h GLU 706 N 0.71 -1.10 0.00 4.77 5.08 -1.66 -3.53 114.58 118.85 3cf0 h GLU 706 Ca 0.39 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 3cf0 h GLU 706 Cb 0.41 0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3cf0 h GLU 706 CO -0.27 -0.73 0.00 -0.89 -1.00 0.00 0.00 179.01 176.12 3cf0 n ILE 707 N -5.54 0.00 0.00 3.13 2.08 -1.14 -5.17 119.36 112.72 3cf0 n ILE 707 Ca -0.14 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.17 3cf0 n ILE 707 Cb 0.45 -0.39 0.00 0.00 -0.75 0.00 0.00 39.64 38.96 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 -0.85 0.00 -3.24 1.39 0.31 -1.26 -5.04 118.33 109.63 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 -0.04 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 -0.64 3.28 -0.09 5.55 0.04 -1.26 -4.95 135.00 136.93 3cf0 s PRO 729 Ca 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 61.00 59.09 3cf0 s PRO 729 Cb 0.00 -4.39 0.05 0.00 0.04 0.00 0.00 34.50 30.19 3cf0 s PRO 729 CO 0.00 -1.40 0.18 -1.21 0.04 0.00 0.00 177.00 174.61 3cf0 s GLU 730 N 1.37 0.07 -0.27 4.56 8.01 -1.26 -4.95 118.70 126.22 3cf0 s GLU 730 Ca 0.13 0.56 -0.29 0.00 0.01 0.00 0.00 54.97 55.38 3cf0 s GLU 730 Cb -0.19 -0.21 -0.02 0.00 -4.31 0.00 0.00 34.13 29.39 3cf0 s GLU 730 CO -0.02 -0.27 1.73 -1.50 0.01 0.00 0.00 175.26 175.21 3cf0 s ILE 731 N 2.07 3.55 0.42 -1.63 -1.16 0.22 -4.72 121.20 119.93 3cf0 s ILE 731 Ca 0.00 0.58 0.06 0.00 -0.51 0.00 0.00 60.65 60.79 3cf0 s ILE 731 Cb -0.12 -3.65 -0.07 0.00 0.61 0.00 0.00 42.46 39.23 3cf0 s ILE 731 CO -0.06 -0.35 0.01 0.00 -2.81 0.00 0.00 174.94 171.73 3cf0 s ARG 732 N 5.23 1.97 0.07 3.50 1.70 -1.26 -0.71 118.95 129.45 3cf0 s ARG 732 Ca 0.77 -2.13 -0.13 0.00 -0.47 0.00 0.00 55.73 53.77 3cf0 s ARG 732 Cb -0.24 -1.59 -0.03 0.00 -0.57 0.00 0.00 34.95 32.52 3cf0 s ARG 732 CO 0.32 -0.08 0.86 -2.13 -1.08 0.00 0.00 175.30 173.19 3cf0 n ARG 733 N -0.98 -0.18 0.31 3.89 0.63 -1.26 -0.78 116.66 118.29 3cf0 n ARG 733 Ca -0.06 0.85 0.21 0.00 -0.92 0.00 0.00 57.85 57.93 3cf0 n ARG 733 Cb 0.67 -1.25 1.04 0.00 0.45 0.00 0.00 32.46 33.37 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 0.37 116.42 122.96 3cf0 h ASP 734 Ca 0.07 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.34 3cf0 h ASP 734 Cb 0.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.67 3cf0 h ASP 734 CO -0.39 0.00 -0.08 0.45 -1.03 0.00 0.00 179.24 178.19 3cf0 h HIS 735 N 0.00 0.15 -0.50 4.15 3.86 -1.32 -1.97 115.15 119.52 3cf0 h HIS 735 Ca 0.00 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 3cf0 h HIS 735 Cb 0.16 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.57 3cf0 h HIS 735 CO 0.00 0.67 0.33 0.74 0.86 0.00 0.00 177.93 180.54 3cf0 h PHE 736 N -0.41 0.63 0.07 2.45 0.04 -1.19 0.25 116.94 118.78 3cf0 h PHE 736 Ca 0.00 0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.81 3cf0 h PHE 736 Cb 0.67 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 38.56 3cf0 h PHE 736 CO 0.12 0.40 -0.35 0.93 -0.60 0.00 0.00 178.31 178.81 3cf0 h GLU 737 N 0.68 -0.53 0.00 1.51 5.08 -1.02 0.61 114.58 120.91 3cf0 h GLU 737 Ca 0.18 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 3cf0 h GLU 737 Cb -0.08 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3cf0 h GLU 737 CO -0.04 -0.35 -0.07 1.49 -1.00 0.00 0.00 179.01 179.04 3cf0 h GLU 738 N -0.55 0.00 -0.14 2.33 4.22 -1.30 -2.29 114.58 116.84 3cf0 h GLU 738 Ca 0.04 0.00 -0.16 0.00 0.08 0.00 0.00 59.36 59.32 3cf0 h GLU 738 Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3cf0 h GLU 738 CO -0.24 0.07 -0.58 0.00 -2.18 0.00 0.00 179.01 176.09 3cf0 h ALA 739 N 1.93 0.74 0.00 2.92 0.00 0.02 -3.04 119.26 121.83 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 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 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 0.34 0.00 0.00 0.00 2.86 -0.31 -2.93 114.93 114.89 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 0.00 176.91 178.65 3cf0 n ARG 741 N -3.46 0.09 -1.19 1.72 5.12 -1.15 -2.38 116.66 115.40 3cf0 n ARG 741 Ca -0.02 0.24 0.03 0.00 -1.93 0.00 0.00 57.85 56.18 3cf0 n ARG 741 Cb 0.15 -1.50 0.11 0.00 -1.16 0.00 0.00 32.46 30.05 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 -1.33 0.19 -3.03 -1.55 3.01 -1.11 -5.06 117.46 108.57 3cf0 n PHE 742 Ca 0.03 -1.10 -0.40 0.00 1.01 0.00 0.00 57.45 57.00 3cf0 n PHE 742 Cb 0.07 -0.21 -0.05 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 -1.78 3.35 0.49 4.37 0.00 -1.00 -5.03 121.76 122.16 3cf0 s ALA 743 Ca 0.36 0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.56 3cf0 s ALA 743 Cb 0.38 -2.96 0.01 0.00 0.00 0.00 0.00 23.12 20.55 3cf0 s ALA 743 CO -0.11 -0.04 0.36 1.03 0.00 0.00 0.00 175.76 177.00 3cf0 s ARG 744 N 0.51 2.32 -0.14 0.00 1.81 -1.26 -5.12 118.95 117.07 3cf0 s ARG 744 Ca 0.38 -1.86 0.01 0.00 -1.72 0.00 0.00 55.73 52.54 3cf0 s ARG 744 Cb -0.19 -2.16 0.02 0.00 -0.45 0.00 0.00 34.95 32.18 3cf0 s ARG 744 CO 0.20 -0.42 -0.15 1.03 -0.68 0.00 0.00 175.30 175.27 3cf0 s ARG 745 N -4.18 2.40 0.14 3.54 0.52 -1.26 -4.88 118.95 115.23 3cf0 s ARG 745 Ca 0.39 -0.60 -0.12 0.00 -0.52 0.00 0.00 55.73 54.88 3cf0 s ARG 745 Cb -0.01 -2.13 -0.01 0.00 0.52 0.00 0.00 34.95 33.31 3cf0 s ARG 745 CO 0.23 -0.19 1.53 0.66 0.02 0.00 0.00 175.30 177.56 3cf0 h SER 746 N 7.88 0.92 -3.24 0.23 4.64 -1.97 -3.43 113.55 118.57 3cf0 h SER 746 Ca -0.37 -0.39 -0.59 0.00 -0.47 0.00 0.00 61.79 59.96 3cf0 h SER 746 Cb 1.15 -0.25 -0.09 0.00 -0.31 0.00 0.00 62.40 62.89 3cf0 h SER 746 CO 0.53 1.10 -0.30 -0.69 -0.87 0.00 0.00 176.83 176.61 3cf0 s VAL 747 N -4.68 5.27 0.22 0.95 1.01 -1.25 -5.07 120.40 116.84 3cf0 s VAL 747 Ca -0.12 0.61 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 3cf0 s VAL 747 Cb 0.11 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 3cf0 s VAL 747 CO 0.85 0.41 0.42 -0.94 0.00 0.00 0.00 175.10 175.83 3cf0 s SER 748 N 0.29 6.40 0.29 3.32 1.04 -1.26 -4.81 113.70 118.96 3cf0 s SER 748 Ca 0.18 0.45 0.04 0.00 0.48 0.00 0.00 55.95 57.10 3cf0 s SER 748 Cb -0.14 -2.03 0.70 0.00 0.10 0.00 0.00 66.02 64.65 3cf0 s SER 748 CO 0.05 -0.07 1.73 -2.24 0.98 0.00 0.00 173.24 173.70 3cf0 h ASP 749 N 1.96 0.51 0.05 7.02 3.04 -1.97 -0.29 116.42 126.74 3cf0 h ASP 749 Ca -0.48 0.12 0.03 0.00 -3.24 0.00 0.00 57.03 53.46 3cf0 h ASP 749 Cb 1.19 0.05 -0.05 0.00 -1.04 0.00 0.00 39.33 39.49 3cf0 h ASP 749 CO 0.68 0.12 -0.32 0.78 -2.04 0.00 0.00 179.24 178.46 3cf0 h ASN 750 N 0.55 -0.93 -0.35 4.15 2.35 -1.99 0.18 115.58 119.55 3cf0 h ASN 750 Ca 0.55 0.12 0.07 0.00 -0.55 0.00 0.00 56.30 56.48 3cf0 h ASN 750 Cb 0.94 0.37 -0.06 0.00 0.05 0.00 0.00 38.32 39.61 3cf0 h ASN 750 CO -0.45 -0.39 -0.07 0.44 -1.65 0.00 0.00 177.43 175.31 3cf0 h ASP 751 N -0.49 -0.29 -0.41 5.81 3.32 -1.51 0.16 116.42 123.01 3cf0 h ASP 751 Ca 0.05 0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.26 3cf0 h ASP 751 Cb 0.56 0.20 -0.05 0.00 0.22 0.00 0.00 39.33 40.26 3cf0 h ASP 751 CO -0.23 -0.10 0.10 0.40 -1.72 0.00 0.00 179.24 177.69 3cf0 h ILE 752 N 0.02 0.81 -0.27 0.35 2.04 -0.56 0.12 117.51 120.01 3cf0 h ILE 752 Ca 0.17 -0.08 0.06 0.00 1.00 0.00 0.00 64.86 66.00 3cf0 h ILE 752 Cb 0.25 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 3cf0 h ILE 752 CO -0.35 0.04 -0.08 0.03 0.00 0.00 0.00 178.15 177.79 3cf0 h ARG 753 N 0.24 -0.02 -0.84 2.37 3.08 0.54 -0.57 114.38 119.17 3cf0 h ARG 753 Ca 0.20 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.41 3cf0 h ARG 753 Cb 0.23 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 30.18 3cf0 h ARG 753 CO -0.24 -0.02 0.40 0.87 -1.07 0.00 0.00 179.97 179.91 3cf0 h LYS 754 N -0.02 0.53 -0.86 0.04 1.57 0.74 -1.68 116.57 116.88 3cf0 h LYS 754 Ca 0.13 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3cf0 h LYS 754 Cb 0.23 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 3cf0 h LYS 754 CO -0.29 0.35 0.47 1.88 -0.57 0.00 0.00 179.45 181.28 3cf0 h TYR 755 N 0.54 1.18 -0.87 -1.35 -1.99 0.58 -1.05 116.97 114.01 3cf0 h TYR 755 Ca 0.47 -0.03 0.02 0.00 2.00 0.00 0.00 58.73 61.19 3cf0 h TYR 755 Cb 0.72 -0.38 -0.05 0.00 2.00 0.00 0.00 36.73 39.03 3cf0 h TYR 755 CO -0.12 0.82 0.58 0.93 -0.00 0.00 0.00 178.16 180.37 3cf0 h GLU 756 N 1.20 1.11 0.43 4.88 4.39 -0.90 1.59 114.58 127.28 3cf0 h GLU 756 Ca 0.30 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.91 3cf0 h GLU 756 Cb 0.03 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.44 3cf0 h GLU 756 CO -0.05 0.74 -0.21 0.52 -1.16 0.00 0.00 179.01 178.85 3cf0 h MET 757 N 1.14 -0.55 -0.13 2.33 2.86 -0.79 0.20 114.93 119.99 3cf0 h MET 757 Ca 0.33 0.04 0.05 0.00 -2.06 0.00 0.00 59.70 58.05 3cf0 h MET 757 Cb -0.07 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.66 3cf0 h MET 757 CO -0.08 -0.31 -0.21 0.74 1.06 0.00 0.00 176.91 178.10 3cf0 h PHE 758 N -0.68 -0.55 -0.27 -0.22 0.05 -0.38 -1.67 116.94 113.21 3cf0 h PHE 758 Ca -0.06 0.03 0.08 0.00 3.82 0.00 0.00 57.97 61.84 3cf0 h PHE 758 Cb 0.50 0.26 -0.01 0.00 2.00 0.00 0.00 35.95 38.70 3cf0 h PHE 758 CO -0.02 -0.29 0.23 0.00 -0.18 0.00 0.00 178.31 178.04 3cf0 h ALA 759 N 0.72 2.12 0.30 2.45 0.00 0.25 0.18 119.26 125.27 3cf0 h ALA 759 Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3cf0 h ALA 759 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3cf0 h ALA 759 CO -0.28 -0.37 -0.15 0.37 0.00 0.00 0.00 179.25 178.82 3cf0 h GLN 760 N 0.00 -0.39 -0.07 0.00 4.15 0.37 -2.03 115.11 117.13 3cf0 h GLN 760 Ca 0.13 0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.57 3cf0 h GLN 760 Cb 0.58 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 3cf0 h GLN 760 CO -0.00 -0.26 0.04 1.79 -1.93 0.00 0.00 178.83 178.46 3cf0 h THR 761 N -0.88 1.10 -0.23 2.39 1.35 -1.42 -3.10 112.91 112.12 3cf0 h THR 761 Ca -0.04 -0.30 0.06 0.00 -0.55 0.00 0.00 66.41 65.58 3cf0 h THR 761 Cb 0.31 1.17 -0.01 0.00 -1.73 0.00 0.00 68.15 67.90 3cf0 h THR 761 CO 0.07 0.09 0.17 -0.07 -0.25 0.00 0.00 175.52 175.52 3cf0 h LEU 762 N -0.00 0.03 -1.55 3.87 3.38 -0.77 -3.52 115.31 116.75 3cf0 h LEU 762 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3cf0 h LEU 762 Cb 0.11 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3cf0 h LEU 762 CO -0.00 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.54