#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cf0 n LEU 464 N 0.00 3.41 -4.36 0.00 7.94 -1.26 -4.98 117.00 117.75 3cf0 n LEU 464 Ca 0.00 1.06 -0.32 0.00 -1.11 0.00 0.00 56.01 55.64 3cf0 n LEU 464 Cb 0.00 -1.47 0.17 0.00 0.53 0.00 0.00 43.42 42.65 3cf0 n LEU 464 CO 0.00 -0.12 -0.23 -1.14 -1.11 0.00 0.00 177.39 174.79 3cf0 n ARG 465 N 3.91 -1.31 -3.04 1.96 0.63 -1.26 -4.97 116.66 112.58 3cf0 n ARG 465 Ca 0.17 -0.35 -0.40 0.00 -0.92 0.00 0.00 57.85 56.35 3cf0 n ARG 465 Cb 0.31 -1.83 -0.05 0.00 0.45 0.00 0.00 32.46 31.34 3cf0 n ARG 465 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 3cf0 s GLU 466 N -3.67 4.34 -0.23 -0.14 2.56 -1.26 -5.02 118.70 115.28 3cf0 s GLU 466 Ca 0.58 0.82 -0.29 0.00 0.00 0.00 0.00 54.97 56.08 3cf0 s GLU 466 Cb -0.17 -3.51 -0.02 0.00 2.00 0.00 0.00 34.13 32.43 3cf0 s GLU 466 CO 0.66 -0.10 1.50 0.99 -0.56 0.00 0.00 175.26 177.75 3cf0 s THR 467 N 1.38 3.86 -0.35 -1.70 2.01 -1.26 -4.98 115.64 114.60 3cf0 s THR 467 Ca 0.35 0.99 -0.08 0.00 0.31 0.00 0.00 61.69 63.25 3cf0 s THR 467 Cb -0.17 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.54 3cf0 s THR 467 CO 0.14 -0.31 0.14 -0.69 -0.69 0.00 0.00 174.62 173.21 3cf0 s VAL 468 N 4.74 4.04 0.49 3.82 1.01 -1.26 -5.08 120.40 128.15 3cf0 s VAL 468 Ca 0.66 -1.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.39 3cf0 s VAL 468 Cb -0.23 -3.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 3cf0 s VAL 468 CO 0.26 -0.21 0.99 -0.69 0.00 0.00 0.00 175.10 175.45 3cf0 s VAL 469 N 1.45 4.31 0.12 2.92 1.01 -1.26 -4.49 120.40 124.46 3cf0 s VAL 469 Ca -0.00 1.27 -0.25 0.00 0.00 0.00 0.00 61.98 63.00 3cf0 s VAL 469 Cb -0.20 -3.61 0.07 0.00 0.00 0.00 0.00 36.38 32.65 3cf0 s VAL 469 CO 0.04 -0.48 0.77 -1.83 0.00 0.00 0.00 175.10 173.60 3cf0 s GLU 470 N -3.63 1.19 -0.22 2.72 -1.05 -1.18 -4.97 118.70 111.55 3cf0 s GLU 470 Ca 0.62 -0.52 -0.07 0.00 -0.15 0.00 0.00 54.97 54.85 3cf0 s GLU 470 Cb -0.11 0.49 -0.03 0.00 -0.44 0.00 0.00 34.13 34.05 3cf0 s GLU 470 CO 0.23 -0.53 0.05 0.08 0.95 0.00 0.00 175.26 176.05 3cf0 s VAL 471 N -3.49 4.31 0.00 1.83 1.01 -1.26 -1.69 120.40 121.10 3cf0 s VAL 471 Ca 0.05 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 3cf0 s VAL 471 Cb -0.02 -2.98 -0.08 0.00 0.00 0.00 0.00 36.38 33.30 3cf0 s VAL 471 CO -0.07 0.38 1.99 -2.84 0.00 0.00 0.00 175.10 174.57 3cf0 s PRO 472 N 1.21 4.01 0.44 2.72 0.02 -1.26 -4.86 135.00 137.29 3cf0 s PRO 472 Ca 0.04 2.53 0.21 0.00 0.02 0.00 0.00 61.00 63.80 3cf0 s PRO 472 Cb -0.14 -4.19 1.01 0.00 0.02 0.00 0.00 34.50 31.20 3cf0 s PRO 472 CO 0.03 -1.10 1.90 -0.56 -0.33 0.00 0.00 177.00 176.94 3cf0 h GLN 473 N 11.14 0.00 -5.84 5.54 -0.00 -1.96 -3.43 115.11 120.56 3cf0 h GLN 473 Ca -0.48 0.00 -0.65 0.00 -0.00 0.00 0.00 58.65 57.52 3cf0 h GLN 473 Cb 1.24 0.00 -0.07 0.00 -0.00 0.00 0.00 27.48 28.64 3cf0 h GLN 473 CO 0.94 0.26 -0.52 0.54 -0.00 0.00 0.00 178.83 180.05 3cf0 s VAL 474 N -4.01 5.21 0.41 1.86 0.11 -1.26 -5.11 120.40 117.60 3cf0 s VAL 474 Ca -0.02 -0.17 0.04 0.00 -2.93 0.00 0.00 61.98 58.90 3cf0 s VAL 474 Cb 0.13 -3.38 -0.04 0.00 -1.53 0.00 0.00 36.38 31.55 3cf0 s VAL 474 CO 0.65 0.39 0.06 0.42 -3.33 0.00 0.00 175.10 173.29 3cf0 s THR 475 N -1.22 1.14 0.49 5.04 -4.23 -1.26 -3.68 115.64 111.92 3cf0 s THR 475 Ca 0.23 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.98 3cf0 s THR 475 Cb -0.12 -2.55 0.42 0.00 1.34 0.00 0.00 72.50 71.59 3cf0 s THR 475 CO 0.14 0.00 1.91 -0.50 -0.54 0.00 0.00 174.62 175.63 3cf0 h TRP 476 N 1.78 0.23 -0.09 3.99 4.06 -1.94 -1.79 115.95 122.18 3cf0 h TRP 476 Ca -0.40 0.01 0.01 0.00 2.06 0.00 0.00 58.89 60.56 3cf0 h TRP 476 Cb 1.27 -0.07 -0.00 0.00 -1.00 0.00 0.00 29.16 29.35 3cf0 h TRP 476 CO 1.10 0.07 0.06 0.93 -3.56 0.00 0.00 178.44 177.04 3cf0 h GLU 477 N 0.18 0.09 -0.00 0.49 5.08 -2.00 -1.18 114.58 117.24 3cf0 h GLU 477 Ca 0.39 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3cf0 h GLU 477 Cb 1.27 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3cf0 h GLU 477 CO -0.07 0.06 -0.03 -0.25 -1.00 0.00 0.00 179.01 177.72 3cf0 n ASP 478 N -4.52 0.11 -4.42 1.42 9.92 -0.67 -4.63 116.55 113.74 3cf0 n ASP 478 Ca -0.01 -0.34 -0.39 0.00 -0.53 0.00 0.00 54.79 53.52 3cf0 n ASP 478 Cb 0.10 -0.20 -0.12 0.00 -0.64 0.00 0.00 41.12 40.27 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 -2.48 4.56 -0.12 0.53 1.01 -0.45 -4.70 121.20 119.55 3cf0 s ILE 479 Ca 0.31 -0.49 -0.29 0.00 0.00 0.00 0.00 60.65 60.17 3cf0 s ILE 479 Cb 0.20 -3.35 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 3cf0 s ILE 479 CO 0.45 0.03 1.04 -0.83 0.00 0.00 0.00 174.94 175.63 3cf0 s GLY 480 N 1.60 2.21 0.00 6.18 0.00 -1.26 -4.91 107.32 111.14 3cf0 s GLY 480 Ca 0.04 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.14 3cf0 s GLY 480 CO 0.06 2.01 0.00 0.61 0.00 0.00 0.00 173.10 175.78 3cf0 n GLY 481 N 3.17 -0.43 3.28 0.20 0.00 -1.26 -4.62 105.19 105.52 3cf0 n GLY 481 Ca 0.10 -1.08 -0.23 0.00 0.00 0.00 0.00 46.02 44.80 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 -3.02 -0.03 0.99 4.77 -1.26 -4.91 117.00 113.54 3cf0 n LEU 482 Ca 0.00 -0.40 -0.11 0.00 -0.03 0.00 0.00 56.01 55.47 3cf0 n LEU 482 Cb 0.00 -3.00 -0.05 0.00 -2.33 0.00 0.00 43.42 38.04 3cf0 n LEU 482 CO 0.00 0.43 0.90 -0.33 -1.33 0.00 0.00 177.39 177.06 3cf0 h GLU 483 N -2.00 0.20 -0.60 3.23 4.39 -1.97 -1.84 114.58 116.00 3cf0 h GLU 483 Ca -0.55 -0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.25 3cf0 h GLU 483 Cb 1.37 -0.04 -0.12 0.00 -0.10 0.00 0.00 28.75 29.86 3cf0 h GLU 483 CO 0.56 0.19 -0.24 0.38 -1.16 0.00 0.00 179.01 178.74 3cf0 h ASP 484 N 0.16 -0.83 -0.33 1.42 2.03 -2.00 -1.62 116.42 115.25 3cf0 h ASP 484 Ca 0.05 0.20 -0.14 0.00 -0.73 0.00 0.00 57.03 56.42 3cf0 h ASP 484 Cb 0.04 0.47 -0.00 0.00 -0.83 0.00 0.00 39.33 39.00 3cf0 h ASP 484 CO -0.01 -0.26 -0.34 -0.37 -1.03 0.00 0.00 179.24 177.23 3cf0 h VAL 485 N -0.08 1.29 -0.72 4.15 -1.51 -1.90 -0.82 116.25 116.66 3cf0 h VAL 485 Ca 0.27 -1.51 0.15 0.00 -1.23 0.00 0.00 66.70 64.37 3cf0 h VAL 485 Cb 0.51 1.51 -0.10 0.00 -2.13 0.00 0.00 31.29 31.08 3cf0 h VAL 485 CO -0.66 0.49 0.20 0.11 -1.23 0.00 0.00 177.57 176.49 3cf0 h LYS 486 N 0.58 0.31 -0.11 5.19 1.57 -0.93 0.62 116.57 123.79 3cf0 h LYS 486 Ca 0.05 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3cf0 h LYS 486 Cb 0.92 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.16 3cf0 h LYS 486 CO 0.08 0.20 0.01 -0.09 -0.57 0.00 0.00 179.45 179.09 3cf0 h ARG 487 N 0.32 0.19 -0.89 3.15 2.43 -1.08 -1.94 114.38 116.56 3cf0 h ARG 487 Ca 0.40 -0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.58 3cf0 h ARG 487 Cb 0.64 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.11 3cf0 h ARG 487 CO -0.46 0.40 0.58 1.49 -1.51 0.00 0.00 179.97 180.48 3cf0 h GLU 488 N -0.05 0.98 -0.09 0.20 4.22 0.15 -0.95 114.58 119.04 3cf0 h GLU 488 Ca 0.03 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.40 3cf0 h GLU 488 Cb 0.31 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 3cf0 h GLU 488 CO 0.00 0.65 -0.00 -0.07 -2.18 0.00 0.00 179.01 177.41 3cf0 h LEU 489 N 1.01 0.16 -0.34 1.64 3.38 0.42 -2.57 115.31 119.01 3cf0 h LEU 489 Ca 0.38 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 58.11 3cf0 h LEU 489 Cb 0.19 -0.04 -0.08 0.00 0.09 0.00 0.00 40.66 40.82 3cf0 h LEU 489 CO -0.14 0.44 -0.18 1.56 0.09 0.00 0.00 178.44 180.21 3cf0 h GLN 490 N -0.13 -0.13 0.00 1.13 4.20 -1.05 0.19 115.11 119.33 3cf0 h GLN 490 Ca 0.03 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3cf0 h GLN 490 Cb 0.36 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.17 3cf0 h GLN 490 CO 0.01 -0.08 0.12 0.93 -0.67 0.00 0.00 178.83 179.13 3cf0 h GLU 491 N -0.13 0.00 0.00 1.46 5.08 -0.92 0.19 114.58 120.26 3cf0 h GLU 491 Ca 0.17 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.39 3cf0 h GLU 491 Cb 0.40 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 3cf0 h GLU 491 CO -0.42 0.00 -1.99 1.28 -1.00 0.00 0.00 179.01 176.88 3cf0 n LEU 492 N -2.46 0.17 -0.01 1.33 4.77 -0.01 -4.48 117.00 116.31 3cf0 n LEU 492 Ca -0.02 0.07 -0.02 0.00 -0.03 0.00 0.00 56.01 56.02 3cf0 n LEU 492 Cb 0.16 0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 3cf0 n LEU 492 CO 0.11 0.17 -0.56 1.33 -1.33 0.00 0.00 177.39 177.11 3cf0 n VAL 493 N -2.53 0.10 0.32 4.08 0.24 -0.69 -4.69 118.33 115.15 3cf0 n VAL 493 Ca -0.14 -0.03 -0.12 0.00 -2.04 0.00 0.00 64.34 62.01 3cf0 n VAL 493 Cb 0.80 -1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 32.03 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 -0.03 -0.78 -0.51 7.34 1.08 -0.87 -3.23 115.11 118.10 3cf0 h GLN 494 Ca -0.04 0.05 0.10 0.00 -1.45 0.00 0.00 58.65 57.31 3cf0 h GLN 494 Cb 1.05 0.18 -0.09 0.00 -0.05 0.00 0.00 27.48 28.56 3cf0 h GLN 494 CO -0.02 -0.52 -0.08 1.88 -0.95 0.00 0.00 178.83 179.14 3cf0 h TYR 495 N -0.89 -0.19 -0.64 2.96 0.99 -1.77 0.28 116.97 117.71 3cf0 h TYR 495 Ca -0.08 0.04 0.03 0.00 2.00 0.00 0.00 58.73 60.72 3cf0 h TYR 495 Cb 0.62 0.16 -0.04 0.00 1.00 0.00 0.00 36.73 38.48 3cf0 h TYR 495 CO 0.07 -0.19 0.42 -1.00 -0.00 0.00 0.00 178.16 177.46 3cf0 h PRO 496 N 0.04 0.74 0.14 4.88 0.13 -1.81 -0.38 132.00 135.73 3cf0 h PRO 496 Ca 0.25 -0.04 -0.25 0.00 -0.87 0.00 0.00 66.00 65.09 3cf0 h PRO 496 Cb 0.39 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 31.36 3cf0 h PRO 496 CO -0.50 0.49 -1.23 -0.24 -0.23 0.00 0.00 178.00 176.30 3cf0 h VAL 497 N 0.76 1.21 -0.01 1.56 3.04 -1.16 -3.15 116.25 118.50 3cf0 h VAL 497 Ca 0.26 -2.47 0.00 0.00 -1.01 0.00 0.00 66.70 63.47 3cf0 h VAL 497 Cb 0.07 2.90 0.00 0.00 -2.01 0.00 0.00 31.29 32.25 3cf0 h VAL 497 CO -0.07 0.72 -0.26 -0.62 -1.01 0.00 0.00 177.57 176.33 3cf0 n GLU 498 N -3.97 1.05 -2.71 4.17 1.02 0.85 -4.14 120.64 116.91 3cf0 n GLU 498 Ca -0.21 -0.68 -0.06 0.00 -0.02 0.00 0.00 57.16 56.19 3cf0 n GLU 498 Cb 0.89 -1.49 0.04 0.00 -0.02 0.00 0.00 31.44 30.87 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 -0.38 1.12 0.04 -0.32 8.25 -0.15 -4.93 115.22 118.85 3cf0 n HIS 499 Ca 0.13 -2.59 0.20 0.00 -0.26 0.00 0.00 57.72 55.20 3cf0 n HIS 499 Cb 0.38 -0.30 0.72 0.00 1.12 0.00 0.00 29.99 31.91 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 2.87 0.00 -0.55 -0.41 0.11 -1.67 0.43 132.00 132.77 3cf0 h PRO 500 Ca -0.12 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.05 3cf0 h PRO 500 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 3cf0 h PRO 500 CO 0.40 0.00 0.26 0.38 -0.21 0.00 0.00 178.00 178.83 3cf0 h ASP 501 N 0.00 0.36 0.32 -2.05 -0.00 -1.91 -1.41 116.42 111.72 3cf0 h ASP 501 Ca 0.22 0.04 -0.10 0.00 -0.00 0.00 0.00 57.03 57.19 3cf0 h ASP 501 Cb 0.97 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 40.26 3cf0 h ASP 501 CO -0.00 0.24 -0.43 0.11 -0.00 0.00 0.00 179.24 179.16 3cf0 h LYS 502 N 0.50 0.15 -0.09 4.15 6.56 -1.28 0.18 116.57 126.74 3cf0 h LYS 502 Ca 0.25 -0.07 -0.22 0.00 -1.06 0.00 0.00 60.65 59.55 3cf0 h LYS 502 Cb 0.19 -0.00 0.01 0.00 -0.57 0.00 0.00 32.23 31.86 3cf0 h LYS 502 CO -0.19 0.56 -0.82 0.74 -2.06 0.00 0.00 179.45 177.67 3cf0 h PHE 503 N 0.12 0.85 -0.17 -1.35 0.04 -1.43 -1.99 116.94 113.02 3cf0 h PHE 503 Ca 0.01 -0.40 -0.16 0.00 2.80 0.00 0.00 57.97 60.22 3cf0 h PHE 503 Cb 0.81 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.84 3cf0 h PHE 503 CO 0.01 1.21 -0.55 -0.07 -0.60 0.00 0.00 178.31 178.31 3cf0 h LEU 504 N 0.40 0.58 0.50 1.54 4.07 -1.15 0.28 115.31 121.53 3cf0 h LEU 504 Ca -0.06 -0.31 -0.02 0.00 0.08 0.00 0.00 57.88 57.57 3cf0 h LEU 504 Cb 1.44 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 43.02 3cf0 h LEU 504 CO 0.16 1.01 -0.24 0.11 -1.08 0.00 0.00 178.44 178.39 3cf0 h LYS 505 N 0.40 -0.65 0.00 1.13 1.57 -0.60 -3.05 116.57 115.38 3cf0 h LYS 505 Ca 0.01 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3cf0 h LYS 505 Cb 1.08 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3cf0 h LYS 505 CO 0.10 -0.42 -0.07 1.19 -0.57 0.00 0.00 179.45 179.69 3cf0 n PHE 506 N -5.37 0.25 0.00 -1.35 3.72 -0.75 -4.96 117.46 109.00 3cf0 n PHE 506 Ca -0.12 0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 3cf0 n PHE 506 Cb 0.29 -0.60 0.00 0.00 -0.94 0.00 0.00 39.48 38.23 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 2.59 3.54 1.37 0.00 0.09 -5.02 105.19 109.21 3cf0 n GLY 507 Ca 0.06 -0.58 -0.51 0.00 0.00 0.00 0.00 46.02 44.99 3cf0 n GLY 507 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3cf0 n MET 508 N 0.00 0.76 -3.83 1.61 0.00 -1.22 -4.70 117.12 109.73 3cf0 n MET 508 Ca 0.00 0.27 -0.32 0.00 0.00 0.00 0.00 57.70 57.65 3cf0 n MET 508 Cb 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 33.22 31.45 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 -0.17 5.33 1.17 3.17 -4.23 -1.26 -4.64 115.64 115.00 3cf0 s THR 509 Ca 0.77 -0.18 -0.19 0.00 -1.18 0.00 0.00 61.69 60.91 3cf0 s THR 509 Cb -0.97 -3.61 0.28 0.00 1.34 0.00 0.00 72.50 69.54 3cf0 s THR 509 CO 0.53 0.17 1.14 -2.84 -0.54 0.00 0.00 174.62 173.08 3cf0 s PRO 510 N -2.38 -1.00 0.02 3.99 0.02 -1.26 -5.06 135.00 129.33 3cf0 s PRO 510 Ca 0.35 -0.13 -0.01 0.00 0.02 0.00 0.00 61.00 61.22 3cf0 s PRO 510 Cb -0.13 -1.63 -0.04 0.00 0.02 0.00 0.00 34.50 32.73 3cf0 s PRO 510 CO 0.24 -3.56 0.15 -1.54 -0.33 0.00 0.00 177.00 171.97 3cf0 s SER 511 N -4.05 6.08 0.46 2.53 1.04 -1.26 -5.02 113.70 113.47 3cf0 s SER 511 Ca 0.71 0.23 0.26 0.00 0.48 0.00 0.00 55.95 57.63 3cf0 s SER 511 Cb -0.09 -1.83 0.94 0.00 0.10 0.00 0.00 66.02 65.14 3cf0 s SER 511 CO 0.56 0.24 1.83 0.11 0.98 0.00 0.00 173.24 176.95 3cf0 h LYS 512 N 3.70 0.00 0.00 4.02 1.57 -1.90 -3.49 116.57 120.47 3cf0 h LYS 512 Ca -0.48 0.00 0.33 0.00 -1.87 0.00 0.00 60.65 58.63 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 0.68 0.17 0.87 0.41 -0.57 0.00 0.00 179.45 181.01 3cf0 n GLY 513 N 0.24 0.23 3.20 3.86 0.00 -1.23 -2.23 105.19 109.25 3cf0 n GLY 513 Ca 0.01 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.27 1.61 1.01 -0.49 -3.42 120.40 116.84 3cf0 s VAL 514 Ca 0.29 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.05 3cf0 s VAL 514 Cb -0.01 -0.49 0.06 0.00 0.00 0.00 0.00 36.38 35.94 3cf0 s VAL 514 CO -0.01 -0.14 -0.08 -0.22 0.00 0.00 0.00 175.10 174.66 3cf0 s LEU 515 N -0.54 3.65 -0.07 3.92 0.20 0.50 -0.71 118.68 125.62 3cf0 s LEU 515 Ca -0.06 -1.46 -0.28 0.00 0.69 0.00 0.00 54.13 53.02 3cf0 s LEU 515 Cb -0.04 -1.58 -0.02 0.00 -0.43 0.00 0.00 46.19 44.12 3cf0 s LEU 515 CO 0.02 -0.22 0.91 -0.36 -0.29 0.00 0.00 176.35 176.41 3cf0 s PHE 516 N 1.10 3.56 0.16 5.38 2.99 -0.36 -0.63 117.98 130.17 3cf0 s PHE 516 Ca -0.06 1.51 0.08 0.00 0.00 0.00 0.00 56.93 58.45 3cf0 s PHE 516 Cb -0.20 -3.06 -0.04 0.00 0.00 0.00 0.00 43.02 39.72 3cf0 s PHE 516 CO -0.05 -0.10 -0.17 1.52 -0.00 0.00 0.00 175.22 176.43 3cf0 s TYR 517 N 1.47 1.68 0.00 0.36 -0.85 -0.27 -1.69 117.35 118.04 3cf0 s TYR 517 Ca 0.46 -0.51 0.00 0.00 -0.52 0.00 0.00 57.07 56.50 3cf0 s TYR 517 Cb -0.19 -0.84 0.00 0.00 0.38 0.00 0.00 41.96 41.31 3cf0 s TYR 517 CO 0.20 0.27 0.00 0.41 -1.52 0.00 0.00 175.55 174.92 3cf0 n GLY 518 N 0.29 1.61 3.64 5.49 0.00 -1.07 -0.74 105.19 114.41 3cf0 n GLY 518 Ca -0.13 -1.04 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 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 0.62 0.19 1.61 0.04 -1.25 -4.04 135.00 130.16 3cf0 s PRO 519 Ca 0.00 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.05 3cf0 s PRO 519 Cb 0.00 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.76 3cf0 s PRO 519 CO 0.00 -2.83 1.21 -2.14 0.04 0.00 0.00 177.00 173.28 3cf0 s PRO 520 N -4.63 4.49 0.00 0.56 0.02 -1.26 -4.26 135.00 129.91 3cf0 s PRO 520 Ca 0.67 1.90 0.00 0.00 0.02 0.00 0.00 61.00 63.58 3cf0 s PRO 520 Cb -0.23 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.06 3cf0 s PRO 520 CO 0.59 -0.09 0.00 0.41 -0.33 0.00 0.00 177.00 177.58 3cf0 n GLY 521 N 2.12 0.96 0.00 0.52 0.00 -1.26 -4.82 105.19 102.71 3cf0 n GLY 521 Ca 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.02 1.33 0.36 0.00 0.00 -1.26 -4.84 105.19 100.75 3cf0 n GLY 523 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 3cf0 n GLY 523 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cf0 h LYS 524 N 0.26 1.17 -0.31 1.61 1.57 -1.94 0.61 116.57 119.54 3cf0 h LYS 524 Ca 0.00 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.53 3cf0 h LYS 524 Cb 0.00 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.07 3cf0 h LYS 524 CO 0.00 0.84 -0.33 1.15 -0.57 0.00 0.00 179.45 180.54 3cf0 h THR 525 N 1.19 1.29 -0.83 -0.16 2.02 -1.99 -2.71 112.91 111.71 3cf0 h THR 525 Ca 0.30 -1.51 -0.03 0.00 0.77 0.00 0.00 66.41 65.94 3cf0 h THR 525 Cb -0.01 1.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.91 3cf0 h THR 525 CO -0.05 0.49 0.39 -0.07 0.37 0.00 0.00 175.52 176.65 3cf0 h LEU 526 N 0.54 1.09 -0.69 2.58 3.38 -1.76 0.44 115.31 120.88 3cf0 h LEU 526 Ca 0.05 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3cf0 h LEU 526 Cb 0.91 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 3cf0 h LEU 526 CO 0.08 0.93 0.06 -0.07 0.09 0.00 0.00 178.44 179.53 3cf0 h LEU 527 N 1.19 1.03 -0.82 1.67 3.38 -0.95 0.16 115.31 120.97 3cf0 h LEU 527 Ca 0.29 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 3cf0 h LEU 527 Cb 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3cf0 h LEU 527 CO -0.03 1.05 -0.36 0.00 0.09 0.00 0.00 178.44 179.18 3cf0 h ALA 528 N 1.06 0.99 0.06 1.53 0.00 -0.90 -2.25 119.26 119.75 3cf0 h ALA 528 Ca 0.19 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 3cf0 h ALA 528 Cb 0.49 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3cf0 h ALA 528 CO 0.02 0.61 -0.03 0.87 0.00 0.00 0.00 179.25 180.72 3cf0 h LYS 529 N 0.38 -0.08 -0.65 0.00 1.57 -0.64 -3.06 116.57 114.09 3cf0 h LYS 529 Ca 0.04 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.96 3cf0 h LYS 529 Cb 0.82 0.02 -0.12 0.00 0.08 0.00 0.00 32.23 33.02 3cf0 h LYS 529 CO 0.07 0.50 -0.12 0.00 -0.57 0.00 0.00 179.45 179.32 3cf0 h ALA 530 N -0.20 0.49 -0.52 3.86 0.00 -0.73 0.22 119.26 122.38 3cf0 h ALA 530 Ca -0.01 0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.18 3cf0 h ALA 530 Cb 0.62 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 3cf0 h ALA 530 CO 0.01 -0.42 0.28 0.97 0.00 0.00 0.00 179.25 180.09 3cf0 h ILE 531 N 0.02 0.99 -0.75 0.00 6.09 -1.53 0.32 117.51 122.66 3cf0 h ILE 531 Ca 0.32 -0.19 0.02 0.00 -1.37 0.00 0.00 64.86 63.64 3cf0 h ILE 531 Cb 0.51 0.40 -0.04 0.00 0.47 0.00 0.00 36.82 38.15 3cf0 h ILE 531 CO -0.65 0.10 0.48 0.00 -3.07 0.00 0.00 178.15 175.01 3cf0 h ALA 532 N 1.26 0.96 -0.24 0.18 0.00 -0.89 -1.45 119.26 119.08 3cf0 h ALA 532 Ca 0.22 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 3cf0 h ALA 532 Cb 0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3cf0 h ALA 532 CO -0.13 0.31 -0.41 -0.97 0.00 0.00 0.00 179.25 178.05 3cf0 h ASN 533 N 0.97 0.60 0.32 0.00 -1.24 0.12 0.96 115.58 117.31 3cf0 h ASN 533 Ca 0.29 -0.27 -0.01 0.00 0.71 0.00 0.00 56.30 57.02 3cf0 h ASN 533 Cb -0.05 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.83 3cf0 h ASN 533 CO -0.09 0.94 -0.20 -0.08 -1.29 0.00 0.00 177.43 176.71 3cf0 h GLU 534 N 0.46 -0.48 0.00 6.67 4.57 -0.08 -1.40 114.58 124.32 3cf0 h GLU 534 Ca 0.04 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 3cf0 h GLU 534 Cb 0.91 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.61 3cf0 h GLU 534 CO 0.08 -0.32 0.00 0.00 -1.18 0.00 0.00 179.01 177.59 3cf0 n GLN 536 N -0.64 -1.81 -4.57 0.00 1.13 -0.53 -4.97 117.38 106.00 3cf0 n GLN 536 Ca 0.03 0.25 -0.27 0.00 -1.94 0.00 0.00 57.00 55.06 3cf0 n GLN 536 Cb 0.01 -3.86 -0.11 0.00 0.11 0.00 0.00 30.24 26.39 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 -4.00 3.18 0.61 -1.58 0.00 0.29 -4.99 121.76 115.27 3cf0 s ALA 537 Ca 0.12 -2.27 -0.10 0.00 0.00 0.00 0.00 51.96 49.72 3cf0 s ALA 537 Cb -0.06 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 3cf0 s ALA 537 CO 0.94 -0.10 1.00 -0.80 0.00 0.00 0.00 175.76 176.80 3cf0 s ASN 538 N -3.71 6.18 -0.08 0.00 0.01 0.09 -4.46 114.94 112.96 3cf0 s ASN 538 Ca 0.35 1.33 -0.02 0.00 -0.71 0.00 0.00 52.86 53.81 3cf0 s ASN 538 Cb 0.09 -2.40 0.03 0.00 0.41 0.00 0.00 41.25 39.38 3cf0 s ASN 538 CO 0.18 -0.86 0.03 0.12 -1.51 0.00 0.00 177.10 175.06 3cf0 s PHE 539 N -3.13 0.52 -0.07 2.20 5.36 -0.68 -0.48 117.98 121.70 3cf0 s PHE 539 Ca 0.54 -0.15 0.01 0.00 -0.96 0.00 0.00 56.93 56.37 3cf0 s PHE 539 Cb -0.11 -0.74 -0.03 0.00 -0.34 0.00 0.00 43.02 41.80 3cf0 s PHE 539 CO 0.53 -0.34 -0.08 0.42 -1.46 0.00 0.00 175.22 174.29 3cf0 s ILE 540 N 2.02 3.62 -0.20 3.12 1.01 -0.37 -3.11 121.20 127.29 3cf0 s ILE 540 Ca 0.04 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.20 3cf0 s ILE 540 Cb -0.13 -2.48 0.04 0.00 0.01 0.00 0.00 42.46 39.90 3cf0 s ILE 540 CO -0.05 0.59 -0.11 -0.55 0.00 0.00 0.00 174.94 174.81 3cf0 s SER 541 N -0.68 3.44 -0.18 3.58 0.15 -1.26 -0.77 113.70 117.98 3cf0 s SER 541 Ca 0.10 -0.90 -0.06 0.00 0.70 0.00 0.00 55.95 55.80 3cf0 s SER 541 Cb -0.11 -1.28 -0.03 0.00 -1.71 0.00 0.00 66.02 62.88 3cf0 s SER 541 CO 0.02 -0.13 0.02 -0.63 1.20 0.00 0.00 173.24 173.71 3cf0 s ILE 542 N 1.36 4.31 0.38 6.45 1.09 -0.58 -4.92 121.20 129.29 3cf0 s ILE 542 Ca -0.01 -0.20 0.03 0.00 -1.10 0.00 0.00 60.65 59.37 3cf0 s ILE 542 Cb -0.16 -2.93 0.03 0.00 -1.06 0.00 0.00 42.46 38.34 3cf0 s ILE 542 CO -0.08 0.45 0.28 0.29 -0.10 0.00 0.00 174.94 175.78 3cf0 n LYS 543 N 3.78 0.93 0.40 2.79 5.02 -1.26 -1.64 118.16 128.17 3cf0 n LYS 543 Ca -0.17 -2.38 -0.19 0.00 -2.02 0.00 0.00 58.31 53.55 3cf0 n LYS 543 Cb 0.52 0.26 -0.09 0.00 -0.02 0.00 0.00 35.03 35.70 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 0.46 -1.13 0.91 0.72 0.00 -1.81 -2.28 103.07 99.93 3cf0 h GLY 544 Ca -0.24 0.45 0.12 0.00 0.00 0.00 0.00 47.33 47.66 3cf0 h GLY 544 CO 0.38 -0.40 0.43 -2.55 0.00 0.00 0.00 176.54 174.40 3cf0 h PRO 545 N -1.05 0.34 -0.22 4.80 0.11 -1.94 0.14 132.00 134.17 3cf0 h PRO 545 Ca -0.09 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.97 3cf0 h PRO 545 Cb 0.84 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 3cf0 h PRO 545 CO 0.12 0.22 0.04 1.49 -0.21 0.00 0.00 178.00 179.66 3cf0 h GLU 546 N 0.35 0.37 -0.18 1.05 4.81 -1.82 0.26 114.58 119.42 3cf0 h GLU 546 Ca 0.30 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.48 3cf0 h GLU 546 Cb 0.71 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.01 3cf0 h GLU 546 CO -0.08 0.50 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.56 3cf0 h LEU 547 N 0.17 -0.26 -0.79 1.64 3.38 -0.84 -2.59 115.31 116.02 3cf0 h LEU 547 Ca 0.07 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.15 3cf0 h LEU 547 Cb 0.31 0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 3cf0 h LEU 547 CO 0.00 -0.10 0.49 -0.07 0.09 0.00 0.00 178.44 178.85 3cf0 h LEU 548 N -0.05 0.78 -0.66 1.67 3.38 -0.50 -0.00 115.31 119.93 3cf0 h LEU 548 Ca 0.09 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.21 3cf0 h LEU 548 Cb 0.19 -0.16 -0.12 0.00 0.09 0.00 0.00 40.66 40.67 3cf0 h LEU 548 CO -0.21 0.52 -0.05 0.74 0.09 0.00 0.00 178.44 179.52 3cf0 h THR 549 N 0.92 0.41 0.00 0.22 2.02 -0.18 0.29 112.91 116.59 3cf0 h THR 549 Ca 0.33 -0.02 -0.09 0.00 0.77 0.00 0.00 66.41 67.39 3cf0 h THR 549 Cb 0.09 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3cf0 h THR 549 CO -0.14 0.01 -0.45 0.24 0.37 0.00 0.00 175.52 175.55 3cf0 h MET 550 N 0.07 0.00 0.03 6.66 2.86 -0.79 0.35 114.93 124.11 3cf0 h MET 550 Ca 0.34 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.98 3cf0 h MET 550 Cb 0.55 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 3cf0 h MET 550 CO -0.61 0.45 -0.01 2.35 1.06 0.00 0.00 176.91 180.15 3cf0 h TRP 551 N 0.00 -0.03 -0.38 -0.22 7.01 0.73 0.36 115.95 123.41 3cf0 h TRP 551 Ca -0.00 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 3cf0 h TRP 551 Cb 0.86 0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.92 3cf0 h TRP 551 CO 0.00 0.52 0.23 0.74 -2.79 0.00 0.00 178.44 177.14 3cf0 h PHE 552 N -0.62 0.51 -0.01 2.65 0.04 -0.40 -2.96 116.94 116.15 3cf0 h PHE 552 Ca -0.00 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3cf0 h PHE 552 Cb 0.57 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.55 3cf0 h PHE 552 CO 0.12 0.37 0.00 0.41 -0.60 0.00 0.00 178.31 178.61 3cf0 n GLY 553 N -1.07 -0.70 2.44 -1.45 0.00 0.10 -4.90 105.19 99.60 3cf0 n GLY 553 Ca 0.00 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.62 -1.67 -2.63 1.61 1.02 0.02 -4.87 120.64 113.50 3cf0 n GLU 554 Ca 0.21 1.01 -0.37 0.00 -0.02 0.00 0.00 57.16 57.99 3cf0 n GLU 554 Cb 0.17 -5.58 0.01 0.00 -0.02 0.00 0.00 31.44 26.01 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 -1.76 6.52 0.00 1.62 3.41 -0.62 -4.72 113.62 118.07 3cf0 n SER 555 Ca -0.22 -3.71 0.14 0.00 -0.26 0.00 0.00 58.87 54.82 3cf0 n SER 555 Cb 0.67 -0.97 0.56 0.00 -0.26 0.00 0.00 64.21 64.21 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 -0.18 0.01 0.04 4.33 0.00 -1.26 -2.73 120.64 120.84 3cf0 n GLU 556 Ca 0.43 0.00 0.20 0.00 0.00 0.00 0.00 57.16 57.80 3cf0 n GLU 556 Cb 0.31 -1.51 0.72 0.00 0.00 0.00 0.00 31.44 30.97 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 2.99 2.34 0.00 -1.84 0.00 -1.95 -0.10 119.26 120.71 3cf0 h ALA 557 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3cf0 h ALA 557 Cb 0.51 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3cf0 h ALA 557 CO 0.00 -0.64 0.02 -0.91 0.00 0.00 0.00 179.25 177.72 3cf0 h ASN 558 N 0.00 0.00 -0.05 0.00 4.21 -1.93 -1.83 115.58 115.99 3cf0 h ASN 558 Ca 0.23 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.66 3cf0 h ASN 558 Cb 1.00 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.19 3cf0 h ASN 558 CO -0.00 0.00 -0.20 0.58 -1.29 0.00 0.00 177.43 176.52 3cf0 h VAL 559 N 0.00 1.24 -0.17 2.81 2.07 -1.25 -1.53 116.25 119.42 3cf0 h VAL 559 Ca 0.00 -1.12 0.05 0.00 0.82 0.00 0.00 66.70 66.45 3cf0 h VAL 559 Cb 0.03 1.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 3cf0 h VAL 559 CO 0.00 0.36 -0.25 -0.09 0.02 0.00 0.00 177.57 177.61 3cf0 h ARG 560 N 0.39 -0.28 -0.18 1.57 2.43 -1.52 -0.53 114.38 116.27 3cf0 h ARG 560 Ca 0.07 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.30 3cf0 h ARG 560 Cb 0.57 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 3cf0 h ARG 560 CO 0.04 -0.19 -0.12 1.49 -1.51 0.00 0.00 179.97 179.68 3cf0 h GLU 561 N -0.29 -0.12 -0.57 0.20 4.22 -1.45 0.17 114.58 116.73 3cf0 h GLU 561 Ca 0.11 0.01 0.10 0.00 0.08 0.00 0.00 59.36 59.67 3cf0 h GLU 561 Cb 0.46 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.66 3cf0 h GLU 561 CO -0.34 -0.08 0.12 0.82 -2.18 0.00 0.00 179.01 177.35 3cf0 h ILE 562 N -0.13 0.66 -0.66 2.32 2.04 -1.11 0.11 117.51 120.75 3cf0 h ILE 562 Ca 0.11 -0.09 -0.07 0.00 1.00 0.00 0.00 64.86 65.81 3cf0 h ILE 562 Cb 0.28 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 3cf0 h ILE 562 CO -0.26 0.05 0.16 -0.26 0.00 0.00 0.00 178.15 177.84 3cf0 h PHE 563 N 0.25 1.11 0.03 1.37 0.04 -0.33 -1.96 116.94 117.45 3cf0 h PHE 563 Ca 0.30 -0.13 0.03 0.00 2.80 0.00 0.00 57.97 60.96 3cf0 h PHE 563 Cb 0.43 -0.31 -0.05 0.00 2.20 0.00 0.00 35.95 38.22 3cf0 h PHE 563 CO -0.24 0.92 -0.34 -0.44 -0.60 0.00 0.00 178.31 177.60 3cf0 h ASP 564 N 0.98 -1.02 -0.37 2.17 3.45 -0.24 0.85 116.42 122.24 3cf0 h ASP 564 Ca 0.21 0.13 0.11 0.00 0.43 0.00 0.00 57.03 57.90 3cf0 h ASP 564 Cb 0.37 0.40 -0.01 0.00 -0.56 0.00 0.00 39.33 39.53 3cf0 h ASP 564 CO 0.00 -0.41 0.33 0.50 -1.57 0.00 0.00 179.24 178.09 3cf0 h LYS 565 N -0.51 0.00 0.17 3.56 3.64 -0.58 0.24 116.57 123.09 3cf0 h LYS 565 Ca 0.05 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.11 3cf0 h LYS 565 Cb 0.59 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3cf0 h LYS 565 CO -0.26 0.00 -1.59 0.00 -2.27 0.00 0.00 179.45 175.33 3cf0 h ALA 566 N 1.69 0.15 -0.57 5.00 0.00 -0.55 -2.49 119.26 122.49 3cf0 h ALA 566 Ca 0.18 -1.07 -0.04 0.00 0.00 0.00 0.00 54.91 53.98 3cf0 h ALA 566 Cb 0.83 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3cf0 h ALA 566 CO -0.00 1.02 0.20 -0.09 0.00 0.00 0.00 179.25 180.37 3cf0 h ARG 567 N 0.10 0.87 0.00 0.00 2.43 0.87 -2.06 114.38 116.59 3cf0 h ARG 567 Ca -0.28 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 58.61 3cf0 h ARG 567 Cb 2.07 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 31.47 3cf0 h ARG 567 CO 0.19 0.77 -0.50 0.37 -1.51 0.00 0.00 179.97 179.29 3cf0 h GLN 568 N 0.79 0.00 -0.62 0.20 -0.00 -0.69 -2.74 115.11 112.04 3cf0 h GLN 568 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.84 3cf0 h GLN 568 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.73 3cf0 h GLN 568 CO -0.01 0.50 0.00 0.00 0.00 0.00 0.00 178.83 179.32 3cf0 n ALA 569 N -2.33 2.86 -1.74 3.38 0.00 -0.94 -4.98 120.51 116.75 3cf0 n ALA 569 Ca -0.00 -1.21 -0.42 0.00 0.00 0.00 0.00 53.44 51.80 3cf0 n ALA 569 Cb 0.59 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 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 0.95 2.15 -2.26 0.00 0.00 -0.81 -4.14 120.51 116.41 3cf0 n ALA 570 Ca 0.21 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.59 3cf0 n ALA 570 Cb 0.69 -2.40 -0.03 0.00 0.00 0.00 0.00 19.45 17.71 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 -1.38 4.50 -0.10 0.00 0.02 -1.26 -5.00 135.00 131.78 3cf0 s PRO 571 Ca 0.59 1.76 -0.05 0.00 0.02 0.00 0.00 61.00 63.31 3cf0 s PRO 571 Cb -0.51 -3.31 0.04 0.00 0.02 0.00 0.00 34.50 30.74 3cf0 s PRO 571 CO 0.57 -0.11 0.24 0.00 -0.33 0.00 0.00 177.00 177.37 3cf0 s VAL 573 N 1.18 5.00 -0.28 0.00 -7.23 0.37 0.15 120.40 119.59 3cf0 s VAL 573 Ca -0.09 0.43 -0.19 0.00 -1.81 0.00 0.00 61.98 60.33 3cf0 s VAL 573 Cb -0.10 -3.97 -0.02 0.00 0.56 0.00 0.00 36.38 32.86 3cf0 s VAL 573 CO -0.08 -0.20 0.57 -0.22 -0.31 0.00 0.00 175.10 174.86 3cf0 s LEU 574 N 2.43 4.10 -0.26 1.32 2.96 0.39 -1.24 118.68 128.38 3cf0 s LEU 574 Ca 0.20 0.48 0.02 0.00 -0.22 0.00 0.00 54.13 54.61 3cf0 s LEU 574 Cb -0.15 -2.73 0.06 0.00 0.50 0.00 0.00 46.19 43.87 3cf0 s LEU 574 CO 0.13 -0.37 -0.08 0.12 -1.32 0.00 0.00 176.35 174.83 3cf0 s PHE 575 N 2.43 3.07 -0.78 5.38 5.36 0.05 -1.37 117.98 132.13 3cf0 s PHE 575 Ca 0.23 -2.23 -0.16 0.00 -0.96 0.00 0.00 56.93 53.80 3cf0 s PHE 575 Cb -0.15 -1.92 0.16 0.00 -0.34 0.00 0.00 43.02 40.78 3cf0 s PHE 575 CO 0.10 -0.86 0.82 -0.06 -1.46 0.00 0.00 175.22 173.76 3cf0 s PHE 576 N 1.17 3.39 0.68 10.12 0.40 0.14 -1.53 117.98 132.35 3cf0 s PHE 576 Ca -0.06 -1.56 -0.11 0.00 -0.60 0.00 0.00 56.93 54.59 3cf0 s PHE 576 Cb -0.20 -3.98 -0.00 0.00 0.51 0.00 0.00 43.02 39.35 3cf0 s PHE 576 CO -0.06 -1.19 1.07 0.34 0.70 0.00 0.00 175.22 176.08 3cf0 s ASP 577 N 2.97 5.66 -1.57 1.36 2.15 -0.65 -1.55 116.67 125.05 3cf0 s ASP 577 Ca 0.19 1.33 -0.14 0.00 0.43 0.00 0.00 52.55 54.35 3cf0 s ASP 577 Cb -0.14 -2.23 0.10 0.00 -0.30 0.00 0.00 42.92 40.36 3cf0 s ASP 577 CO -0.05 -1.22 0.90 -0.62 -0.17 0.00 0.00 175.17 174.01 3cf0 n GLU 578 N -2.96 -4.80 0.22 4.34 1.02 -1.10 -3.91 120.64 113.45 3cf0 n GLU 578 Ca 0.07 0.53 0.07 0.00 -0.02 0.00 0.00 57.16 57.81 3cf0 n GLU 578 Cb 0.55 -5.34 0.39 0.00 -0.02 0.00 0.00 31.44 27.02 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 -1.91 -4.62 3.38 -1.52 -1.54 115.31 107.18 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 0.70 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.33 3cf0 n ASP 580 N -2.26 2.73 0.16 -0.43 5.75 -1.26 -4.59 116.55 116.64 3cf0 n ASP 580 Ca -0.01 -1.82 0.01 0.00 -0.01 0.00 0.00 54.79 52.96 3cf0 n ASP 580 Cb 0.46 -0.07 0.26 0.00 -1.03 0.00 0.00 41.12 40.74 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 3.63 0.00 -0.29 -1.12 4.64 -1.66 -1.54 113.55 117.21 3cf0 h SER 581 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3cf0 h SER 581 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3cf0 h SER 581 CO 0.00 0.50 -0.14 0.40 -0.87 0.00 0.00 176.83 176.72 3cf0 h ILE 582 N 0.00 1.29 -0.13 0.95 2.04 -1.83 -1.69 117.51 118.15 3cf0 h ILE 582 Ca -0.01 -1.24 0.03 0.00 1.00 0.00 0.00 64.86 64.64 3cf0 h ILE 582 Cb 0.93 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 38.43 3cf0 h ILE 582 CO 0.07 0.40 -0.51 0.00 0.00 0.00 0.00 178.15 178.11 3cf0 h ALA 583 N 0.75 -0.86 -0.61 1.87 0.00 -1.75 0.31 119.26 118.97 3cf0 h ALA 583 Ca 0.06 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.04 3cf0 h ALA 583 Cb 0.66 0.99 -0.12 0.00 0.00 0.00 0.00 17.79 19.32 3cf0 h ALA 583 CO 0.04 -1.05 -0.21 0.87 0.00 0.00 0.00 179.25 178.91 3cf0 h LYS 584 N -0.54 -0.05 -0.27 0.00 1.57 -1.37 -0.90 116.57 115.00 3cf0 h LYS 584 Ca 0.03 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 3cf0 h LYS 584 Cb 0.63 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 3cf0 h LYS 584 CO -0.41 -0.03 0.19 0.00 -0.57 0.00 0.00 179.45 178.63 3cf0 h ALA 585 N 1.45 2.11 -0.55 3.86 0.00 -0.04 0.05 119.26 126.14 3cf0 h ALA 585 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3cf0 h ALA 585 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3cf0 h ALA 585 CO -0.66 -0.17 0.00 2.89 0.00 0.00 0.00 179.25 181.31 3cf0 n ARG 586 N -4.48 2.56 0.00 0.00 1.85 -0.09 -4.87 116.66 111.63 3cf0 n ARG 586 Ca 0.03 -2.08 0.00 0.00 -1.00 0.00 0.00 57.85 54.80 3cf0 n ARG 586 Cb 0.27 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 30.14 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 1.25 1.14 7.00 2.89 0.00 0.00 -3.12 105.19 114.36 3cf0 n GLY 587 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 3.31 0.35 -0.02 0.00 -0.45 -3.19 105.19 105.18 3cf0 n GLY 588 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.03 0.00 1.61 2.35 -1.93 -2.98 115.58 113.60 3cf0 h ASN 589 Ca 0.00 0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 56.01 3cf0 h ASN 589 Cb 0.00 0.62 -0.00 0.00 0.05 0.00 0.00 38.32 38.99 3cf0 h ASN 589 CO 0.00 -0.30 -0.37 0.16 -1.65 0.00 0.00 177.43 175.27 3cf0 h ILE 590 N -0.01 0.23 0.00 2.81 3.07 -1.98 -3.52 117.51 118.11 3cf0 h ILE 590 Ca 0.41 -1.22 0.00 0.00 1.55 0.00 0.00 64.86 65.60 3cf0 h ILE 590 Cb 0.65 0.48 0.00 0.00 -0.27 0.00 0.00 36.82 37.68 3cf0 h ILE 590 CO -0.95 0.08 0.00 0.61 -1.05 0.00 0.00 178.15 176.84 3cf0 n GLY 591 N 1.66 -1.80 0.00 0.16 0.00 -1.13 -5.02 105.19 99.05 3cf0 n GLY 591 Ca -0.07 -1.80 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 0.21 0.47 0.25 1.61 5.75 -1.18 -4.75 116.55 118.91 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 -0.64 -0.39 6.12 0.00 -1.95 -3.47 103.07 102.74 3cf0 h GLY 593 Ca 0.00 0.24 -0.19 0.00 0.00 0.00 0.00 47.33 47.38 3cf0 h GLY 593 CO 0.00 -0.23 0.17 0.61 0.00 0.00 0.00 176.54 177.09 3cf0 n GLY 594 N -0.86 -1.45 0.00 4.60 0.00 -1.26 -5.10 105.19 101.13 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 0.90 -0.36 0.22 -0.02 0.00 -1.26 -4.96 105.19 99.71 3cf0 n GLY 595 Ca 0.07 -1.74 0.08 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.65 1.23 -2.77 4.61 0.00 -1.96 -3.44 119.26 115.28 3cf0 h ALA 596 Ca 0.00 -0.22 -0.56 0.00 0.00 0.00 0.00 54.91 54.13 3cf0 h ALA 596 Cb 0.00 -0.04 0.12 0.00 0.00 0.00 0.00 17.79 17.87 3cf0 h ALA 596 CO 0.00 0.30 0.57 0.00 0.00 0.00 0.00 179.25 180.12 3cf0 n ALA 597 N -2.33 1.58 -2.68 0.00 0.00 -1.26 -4.61 120.51 111.21 3cf0 n ALA 597 Ca -0.01 0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.62 3cf0 n ALA 597 Cb 0.35 -2.31 -0.09 0.00 0.00 0.00 0.00 19.45 17.41 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 -0.44 0.16 0.27 0.00 1.47 -1.26 -5.06 116.67 111.81 3cf0 s ASP 598 Ca 0.59 -0.54 -0.01 0.00 1.18 0.00 0.00 52.55 53.77 3cf0 s ASP 598 Cb -0.50 0.26 0.46 0.00 -0.34 0.00 0.00 42.92 42.79 3cf0 s ASP 598 CO 0.59 -0.56 1.87 0.08 0.68 0.00 0.00 175.17 177.83 3cf0 h ARG 599 N 3.43 1.09 0.12 2.11 0.11 -1.98 -1.51 114.38 117.75 3cf0 h ARG 599 Ca -0.33 -0.07 -0.01 0.00 0.10 0.00 0.00 59.98 59.68 3cf0 h ARG 599 Cb 1.19 -0.25 0.00 0.00 1.11 0.00 0.00 29.97 32.02 3cf0 h ARG 599 CO 0.52 0.72 -0.06 0.28 0.10 0.00 0.00 179.97 181.53 3cf0 h VAL 600 N 1.12 1.07 -0.37 0.08 2.07 -1.94 -2.04 116.25 116.24 3cf0 h VAL 600 Ca 0.45 -1.13 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 3cf0 h VAL 600 Cb 0.25 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3cf0 h VAL 600 CO -0.19 0.26 0.15 0.40 0.02 0.00 0.00 177.57 178.21 3cf0 h ILE 601 N -0.73 1.14 -0.49 4.57 1.08 -1.96 -1.99 117.51 119.14 3cf0 h ILE 601 Ca -0.02 -0.44 -0.01 0.00 -0.39 0.00 0.00 64.86 64.00 3cf0 h ILE 601 Cb 0.54 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.96 3cf0 h ILE 601 CO 0.03 0.17 0.27 -1.13 -0.69 0.00 0.00 178.15 176.79 3cf0 h ASN 602 N 0.53 0.61 -0.05 1.72 -1.24 -1.21 -0.89 115.58 115.05 3cf0 h ASN 602 Ca 0.13 -0.09 0.04 0.00 0.71 0.00 0.00 56.30 57.09 3cf0 h ASN 602 Cb 0.10 -0.15 -0.06 0.00 0.73 0.00 0.00 38.32 38.94 3cf0 h ASN 602 CO -0.01 0.52 -0.40 -0.61 -1.29 0.00 0.00 177.43 175.64 3cf0 h GLN 603 N 0.64 -0.50 -0.96 6.67 5.75 -0.90 -1.03 115.11 124.78 3cf0 h GLN 603 Ca 0.17 0.03 0.31 0.00 -0.15 0.00 0.00 58.65 59.01 3cf0 h GLN 603 Cb 0.05 0.11 -0.16 0.00 1.07 0.00 0.00 27.48 28.56 3cf0 h GLN 603 CO -0.03 -0.34 0.38 0.82 -2.65 0.00 0.00 178.83 177.02 3cf0 h ILE 604 N -0.52 0.21 -0.43 2.39 2.04 -0.56 0.13 117.51 120.76 3cf0 h ILE 604 Ca 0.06 -0.06 -0.09 0.00 1.00 0.00 0.00 64.86 65.77 3cf0 h ILE 604 Cb 0.63 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3cf0 h ILE 604 CO -0.34 0.03 -0.09 -0.07 0.00 0.00 0.00 178.15 177.69 3cf0 h LEU 605 N 0.18 0.82 0.38 1.44 3.38 0.03 -2.26 115.31 119.27 3cf0 h LEU 605 Ca 0.68 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 3cf0 h LEU 605 Cb 1.54 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.08 3cf0 h LEU 605 CO -0.70 0.98 -0.18 0.74 0.09 0.00 0.00 178.44 179.37 3cf0 h THR 606 N 0.64 0.63 0.00 0.22 2.02 0.17 -1.33 112.91 115.27 3cf0 h THR 606 Ca 0.11 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.00 3cf0 h THR 606 Cb 0.61 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3cf0 h THR 606 CO 0.04 0.06 0.03 -0.62 0.37 0.00 0.00 175.52 175.39 3cf0 n GLU 607 N -5.24 0.00 -0.01 6.66 -0.58 0.21 0.26 120.64 121.94 3cf0 n GLU 607 Ca -0.10 0.05 0.01 0.00 -0.42 0.00 0.00 57.16 56.70 3cf0 n GLU 607 Cb 0.26 -1.53 -0.03 0.00 -0.57 0.00 0.00 31.44 29.57 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 -0.92 0.72 -0.00 3.49 1.56 -0.70 -3.71 117.12 117.55 3cf0 n MET 608 Ca 0.00 -0.03 -0.17 0.00 -0.27 0.00 0.00 57.70 57.23 3cf0 n MET 608 Cb 0.03 -1.10 -0.12 0.00 2.15 0.00 0.00 33.22 34.17 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 0.37 0.88 6.12 3.32 0.88 -3.29 116.42 124.70 3cf0 h ASP 609 Ca -0.02 -0.82 0.00 0.00 0.02 0.00 0.00 57.03 56.21 3cf0 h ASP 609 Cb 0.39 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3cf0 h ASP 609 CO 0.00 1.15 0.00 0.61 -1.72 0.00 0.00 179.24 179.28 3cf0 n GLY 610 N 1.22 -1.34 3.53 2.75 0.00 -0.15 -4.67 105.19 106.54 3cf0 n GLY 610 Ca -0.11 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 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 -3.14 3.35 0.06 1.61 0.00 -1.24 -4.97 119.30 114.97 3cf0 s MET 611 Ca 0.08 -0.20 -0.36 0.00 0.00 0.00 0.00 55.69 55.21 3cf0 s MET 611 Cb 0.12 -4.05 -0.15 0.00 0.00 0.00 0.00 34.83 30.74 3cf0 s MET 611 CO 0.43 -1.54 1.49 0.45 0.00 0.00 0.00 175.02 175.85 3cf0 n SER 612 N 7.65 2.28 -0.21 1.11 2.88 -1.26 -4.81 113.62 121.26 3cf0 n SER 612 Ca 0.03 1.09 0.31 0.00 -1.33 0.00 0.00 58.87 58.97 3cf0 n SER 612 Cb 0.48 -1.27 0.69 0.00 -0.75 0.00 0.00 64.21 63.36 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 3.77 0.29 -0.05 2.46 1.03 -1.93 -2.33 112.91 116.15 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 1.31 0.37 0.00 0.00 -1.07 0.00 0.00 68.15 68.75 3cf0 h THR 613 CO 0.84 0.00 0.00 0.29 -0.01 0.00 0.00 175.52 176.64 3cf0 n LYS 614 N -3.84 1.69 0.00 0.00 5.02 -1.26 -4.77 118.16 115.00 3cf0 n LYS 614 Ca 0.21 -1.01 0.00 0.00 -2.02 0.00 0.00 58.31 55.50 3cf0 n LYS 614 Cb 1.18 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.73 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 0.22 -0.30 -1.87 1.97 4.76 -0.88 -5.00 118.16 117.06 3cf0 n LYS 615 Ca 0.18 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.46 3cf0 n LYS 615 Cb 0.35 0.00 0.05 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 -2.65 4.05 -4.52 4.39 2.85 -1.26 -5.01 115.26 113.11 3cf0 n ASN 616 Ca 0.00 -3.58 -0.37 0.00 -0.11 0.00 0.00 54.58 50.53 3cf0 n ASN 616 Cb 0.00 -0.38 -0.12 0.00 1.24 0.00 0.00 39.78 40.52 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 -4.23 4.73 -0.21 3.44 1.01 -1.26 -2.07 120.40 121.80 3cf0 s VAL 617 Ca 0.46 -0.03 -0.06 0.00 0.00 0.00 0.00 61.98 62.36 3cf0 s VAL 617 Cb 0.40 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 3cf0 s VAL 617 CO 0.01 0.33 0.02 0.12 0.00 0.00 0.00 175.10 175.57 3cf0 s PHE 618 N 1.49 3.05 -0.18 5.22 5.36 0.12 -4.96 117.98 128.08 3cf0 s PHE 618 Ca 0.06 -0.48 -0.13 0.00 -0.96 0.00 0.00 56.93 55.43 3cf0 s PHE 618 Cb -0.15 -2.12 -0.05 0.00 -0.34 0.00 0.00 43.02 40.36 3cf0 s PHE 618 CO 0.06 -0.29 0.24 0.42 -1.46 0.00 0.00 175.22 174.20 3cf0 s ILE 619 N 1.18 5.33 -0.11 3.12 1.01 -0.95 -0.46 121.20 130.33 3cf0 s ILE 619 Ca 0.03 0.43 0.01 0.00 0.00 0.00 0.00 60.65 61.12 3cf0 s ILE 619 Cb -0.14 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.76 3cf0 s ILE 619 CO 0.02 0.39 -0.11 -0.63 0.00 0.00 0.00 174.94 174.61 3cf0 s ILE 620 N 0.52 1.21 0.20 2.92 1.01 -0.47 -1.40 121.20 125.18 3cf0 s ILE 620 Ca 0.14 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.35 3cf0 s ILE 620 Cb -0.12 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.15 3cf0 s ILE 620 CO 0.02 0.39 0.37 -0.83 0.00 0.00 0.00 174.94 174.89 3cf0 s GLY 621 N 1.30 1.71 -0.01 6.18 0.00 0.11 0.25 107.32 116.85 3cf0 s GLY 621 Ca -0.02 -0.91 -0.02 0.00 0.00 0.00 0.00 44.72 43.77 3cf0 s GLY 621 CO -0.05 -0.88 0.05 0.00 0.00 0.00 0.00 173.10 172.23 3cf0 s ALA 622 N -1.87 -0.12 -0.02 3.20 0.00 -0.59 -1.23 121.76 121.13 3cf0 s ALA 622 Ca 0.37 -0.04 -0.26 0.00 0.00 0.00 0.00 51.96 52.03 3cf0 s ALA 622 Cb -0.11 -0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.05 3cf0 s ALA 622 CO 0.29 -0.08 0.58 -0.08 0.00 0.00 0.00 175.76 176.47 3cf0 s THR 623 N -0.49 0.02 -0.19 0.00 -1.32 -0.68 -1.82 115.64 111.15 3cf0 s THR 623 Ca -0.06 -0.13 0.15 0.00 -1.21 0.00 0.00 61.69 60.44 3cf0 s THR 623 Cb -0.04 -0.93 0.31 0.00 -1.51 0.00 0.00 72.50 70.34 3cf0 s THR 623 CO 0.00 -0.07 1.21 -0.46 -2.21 0.00 0.00 174.62 173.09 3cf0 n ASN 624 N 0.85 2.75 -3.19 8.08 2.04 -1.26 -2.59 115.26 121.94 3cf0 n ASN 624 Ca -0.19 -2.80 -0.24 0.00 -0.44 0.00 0.00 54.58 50.91 3cf0 n ASN 624 Cb 0.58 -0.37 -0.07 0.00 -2.53 0.00 0.00 39.78 37.39 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 -0.87 0.76 0.13 -3.83 5.12 -1.26 -4.83 116.66 111.88 3cf0 n ARG 625 Ca 0.14 -3.25 -0.01 0.00 -1.93 0.00 0.00 57.85 52.81 3cf0 n ARG 625 Cb 0.62 -1.26 0.25 0.00 -1.16 0.00 0.00 32.46 30.92 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 3.94 0.12 -1.29 5.56 0.13 -1.95 -1.44 132.00 137.06 3cf0 h PRO 626 Ca 0.07 -0.06 0.38 0.00 -0.87 0.00 0.00 66.00 65.52 3cf0 h PRO 626 Cb 0.88 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.96 3cf0 h PRO 626 CO 0.47 0.54 1.09 0.38 -0.23 0.00 0.00 178.00 180.25 3cf0 h ASP 627 N 0.10 0.00 -0.01 1.44 2.03 -1.99 -2.08 116.42 115.92 3cf0 h ASP 627 Ca 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 3cf0 h ASP 627 Cb 0.83 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.33 3cf0 h ASP 627 CO 0.06 0.00 -0.31 2.30 -1.03 0.00 0.00 179.24 180.26 3cf0 n ILE 628 N -3.77 0.00 -1.70 4.15 -5.35 -0.54 -4.98 119.36 107.17 3cf0 n ILE 628 Ca 0.29 -0.35 -0.43 0.00 -0.27 0.00 0.00 62.75 61.99 3cf0 n ILE 628 Cb 1.49 1.14 -0.01 0.00 -1.74 0.00 0.00 39.64 40.52 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 -0.30 1.71 -1.85 7.28 2.08 -0.78 -4.88 119.36 122.61 3cf0 n ILE 629 Ca 0.05 -0.43 -0.42 0.00 0.56 0.00 0.00 62.75 62.51 3cf0 n ILE 629 Cb 0.27 -1.60 -0.03 0.00 -0.75 0.00 0.00 39.64 37.53 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 -0.11 6.55 0.32 4.38 2.15 -1.26 -4.91 116.67 123.78 3cf0 s ASP 630 Ca 0.59 2.52 0.10 0.00 0.43 0.00 0.00 52.55 56.18 3cf0 s ASP 630 Cb -0.57 -2.55 0.90 0.00 -0.30 0.00 0.00 42.92 40.40 3cf0 s ASP 630 CO 0.59 -0.96 1.72 -0.65 -0.17 0.00 0.00 175.17 175.70 3cf0 h PRO 631 N 9.24 0.55 -1.13 4.34 0.11 -1.95 -1.90 132.00 141.26 3cf0 h PRO 631 Ca -0.44 -0.03 0.33 0.00 0.11 0.00 0.00 66.00 65.96 3cf0 h PRO 631 Cb 1.21 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 3cf0 h PRO 631 CO 0.94 0.36 0.99 0.00 -0.21 0.00 0.00 178.00 180.08 3cf0 h ALA 632 N 1.74 3.01 0.00 -0.75 0.00 -1.99 0.78 119.26 122.05 3cf0 h ALA 632 Ca 0.65 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.52 3cf0 h ALA 632 Cb 1.26 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 3cf0 h ALA 632 CO -0.49 -1.57 -0.00 0.82 0.00 0.00 0.00 179.25 178.01 3cf0 h ILE 633 N 0.00 0.01 0.00 0.00 2.04 -1.73 -3.01 117.51 114.82 3cf0 h ILE 633 Ca 0.54 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 66.13 3cf0 h ILE 633 Cb 2.50 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 39.84 3cf0 h ILE 633 CO -0.01 0.00 -1.17 0.18 0.00 0.00 0.00 178.15 177.15 3cf0 n LEU 634 N -3.10 0.64 -4.47 1.44 4.77 0.27 -1.64 117.00 114.91 3cf0 n LEU 634 Ca -0.01 -0.36 -0.37 0.00 -0.03 0.00 0.00 56.01 55.24 3cf0 n LEU 634 Cb 0.19 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.34 3cf0 n LEU 634 CO 0.24 0.16 0.09 0.54 -1.33 0.00 0.00 177.39 177.09 3cf0 n ARG 635 N -1.65 0.39 -1.53 3.23 1.74 -1.14 -4.41 116.66 113.28 3cf0 n ARG 635 Ca 0.02 0.17 -0.48 0.00 -0.77 0.00 0.00 57.85 56.79 3cf0 n ARG 635 Cb 0.36 -1.82 -0.03 0.00 -1.02 0.00 0.00 32.46 29.94 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 -0.59 0.84 -0.56 5.56 -0.02 -1.26 -2.23 135.00 136.74 3cf0 n PRO 636 Ca 0.11 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3cf0 n PRO 636 Cb 0.49 -1.61 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 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 1.69 0.74 0.00 -1.23 0.00 -1.26 -4.97 105.19 100.15 3cf0 n GLY 637 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3cf0 n GLY 637 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cf0 n ARG 638 N -2.38 0.00 -2.90 1.61 1.74 -0.95 -4.83 116.66 108.95 3cf0 n ARG 638 Ca 0.00 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 3cf0 n ARG 638 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 3cf0 n ARG 638 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3cf0 s LEU 639 N 0.00 4.90 0.12 0.55 1.43 -0.65 -3.58 118.68 121.45 3cf0 s LEU 639 Ca 0.00 -2.62 -0.04 0.00 -1.03 0.00 0.00 54.13 50.44 3cf0 s LEU 639 Cb 0.00 -2.42 -0.13 0.00 0.03 0.00 0.00 46.19 43.67 3cf0 s LEU 639 CO 0.00 -0.90 1.28 0.44 0.23 0.00 0.00 176.35 177.40 3cf0 h ASP 640 N 7.77 0.51 -2.91 2.29 5.19 -1.77 -3.39 116.42 124.11 3cf0 h ASP 640 Ca 0.28 -0.43 -0.66 0.00 -0.62 0.00 0.00 57.03 55.60 3cf0 h ASP 640 Cb 0.92 -0.16 -0.16 0.00 0.18 0.00 0.00 39.33 40.11 3cf0 h ASP 640 CO 1.23 1.24 0.33 -1.10 -3.12 0.00 0.00 179.24 177.83 3cf0 s GLN 641 N -3.16 3.12 0.14 3.56 -1.52 -1.22 -4.94 119.66 115.64 3cf0 s GLN 641 Ca -0.05 -0.91 -0.30 0.00 -1.95 0.00 0.00 55.36 52.15 3cf0 s GLN 641 Cb 0.08 -4.19 -0.07 0.00 -0.22 0.00 0.00 33.01 28.61 3cf0 s GLN 641 CO 0.87 -1.59 1.25 -0.51 -0.25 0.00 0.00 175.29 175.06 3cf0 s LEU 642 N 3.40 4.41 -0.03 2.90 2.01 -1.26 -0.37 118.68 129.73 3cf0 s LEU 642 Ca 0.19 2.21 0.01 0.00 0.01 0.00 0.00 54.13 56.54 3cf0 s LEU 642 Cb -0.19 -3.60 0.02 0.00 0.01 0.00 0.00 46.19 42.44 3cf0 s LEU 642 CO 0.11 -0.47 -0.01 -0.63 1.01 0.00 0.00 176.35 176.35 3cf0 s ILE 643 N 0.50 0.22 -0.26 -0.59 1.01 0.20 -4.91 121.20 117.37 3cf0 s ILE 643 Ca 0.57 0.03 -0.17 0.00 0.00 0.00 0.00 60.65 61.09 3cf0 s ILE 643 Cb -0.33 -0.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.82 3cf0 s ILE 643 CO 0.33 0.14 0.47 -0.47 0.00 0.00 0.00 174.94 175.41 3cf0 s TYR 644 N 0.83 3.27 -0.46 3.97 5.04 -1.26 -1.11 117.35 127.63 3cf0 s TYR 644 Ca -0.09 0.57 -0.13 0.00 -2.44 0.00 0.00 57.07 54.98 3cf0 s TYR 644 Cb -0.12 -2.66 0.08 0.00 0.35 0.00 0.00 41.96 39.61 3cf0 s TYR 644 CO -0.01 -0.25 0.35 0.42 -1.34 0.00 0.00 175.55 174.72 3cf0 s ILE 645 N 2.18 4.77 0.72 3.14 1.09 0.09 -4.96 121.20 128.22 3cf0 s ILE 645 Ca 0.19 -1.29 -0.07 0.00 -1.10 0.00 0.00 60.65 58.39 3cf0 s ILE 645 Cb -0.16 -3.91 0.07 0.00 -1.06 0.00 0.00 42.46 37.40 3cf0 s ILE 645 CO 0.09 -0.59 1.03 -2.16 -0.10 0.00 0.00 174.94 173.21 3cf0 s PRO 646 N 1.53 2.15 0.57 2.79 0.04 -1.26 -3.97 135.00 136.85 3cf0 s PRO 646 Ca 0.04 -0.25 -0.20 0.00 0.04 0.00 0.00 61.00 60.63 3cf0 s PRO 646 Cb -0.24 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 3cf0 s PRO 646 CO 0.04 -1.28 1.11 1.28 0.04 0.00 0.00 177.00 178.19 3cf0 n LEU 647 N -2.96 4.31 -4.76 -3.56 4.32 -1.26 -4.93 117.00 108.16 3cf0 n LEU 647 Ca 0.08 0.88 -0.41 0.00 -0.02 0.00 0.00 56.01 56.55 3cf0 n LEU 647 Cb 0.60 -1.45 -0.03 0.00 -1.62 0.00 0.00 43.42 40.92 3cf0 n LEU 647 CO 0.52 -1.37 0.87 -2.16 -1.22 0.00 0.00 177.39 174.03 3cf0 s PRO 648 N -2.77 4.52 0.79 3.23 0.04 -1.26 -5.03 135.00 134.53 3cf0 s PRO 648 Ca 0.74 1.96 -0.08 0.00 0.04 0.00 0.00 61.00 63.65 3cf0 s PRO 648 Cb -0.43 -3.15 0.12 0.00 0.04 0.00 0.00 34.50 31.08 3cf0 s PRO 648 CO 0.48 0.04 1.11 0.16 0.04 0.00 0.00 177.00 178.83 3cf0 s ASP 649 N -0.61 4.15 0.00 6.66 -4.77 -1.26 -4.73 116.67 116.11 3cf0 s ASP 649 Ca 0.47 0.19 -0.01 0.00 -3.30 0.00 0.00 52.55 49.91 3cf0 s ASP 649 Cb -0.35 -0.58 -0.00 0.00 -1.09 0.00 0.00 42.92 40.91 3cf0 s ASP 649 CO 0.45 -2.03 0.17 -0.62 0.70 0.00 0.00 175.17 173.83 3cf0 n GLU 650 N -3.18 -0.01 -0.06 2.11 4.71 -1.26 -0.81 120.64 122.14 3cf0 n GLU 650 Ca 0.12 0.17 -0.11 0.00 -0.01 0.00 0.00 57.16 57.33 3cf0 n GLU 650 Cb 0.60 -0.25 -0.05 0.00 -1.01 0.00 0.00 31.44 30.73 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 0.33 -0.69 3.49 1.57 -1.95 -3.15 116.57 116.17 3cf0 h LYS 651 Ca 0.00 -0.10 0.07 0.00 -1.87 0.00 0.00 60.65 58.75 3cf0 h LYS 651 Cb 0.01 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 3cf0 h LYS 651 CO -0.02 0.52 0.38 0.77 -0.57 0.00 0.00 179.45 180.54 3cf0 h SER 652 N 0.11 0.56 -0.96 0.86 0.02 -1.67 -1.13 113.55 111.34 3cf0 h SER 652 Ca 0.06 0.03 0.11 0.00 -0.84 0.00 0.00 61.79 61.16 3cf0 h SER 652 Cb 0.36 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.75 3cf0 h SER 652 CO 0.01 0.35 0.59 0.03 -1.14 0.00 0.00 176.83 176.67 3cf0 h ARG 653 N 0.70 0.92 0.33 3.45 3.08 -0.93 0.12 114.38 122.04 3cf0 h ARG 653 Ca 0.32 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.31 3cf0 h ARG 653 Cb 0.22 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3cf0 h ARG 653 CO -0.20 0.61 -0.37 0.28 -1.07 0.00 0.00 179.97 179.22 3cf0 h VAL 654 N 0.94 0.24 -0.59 2.04 2.07 -1.27 -1.59 116.25 118.09 3cf0 h VAL 654 Ca 0.47 0.00 0.10 0.00 0.82 0.00 0.00 66.70 68.09 3cf0 h VAL 654 Cb 0.46 0.24 -0.08 0.00 -1.52 0.00 0.00 31.29 30.39 3cf0 h VAL 654 CO -0.26 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.50 3cf0 h ALA 655 N -0.29 0.73 -0.84 1.67 0.00 -0.85 -0.47 119.26 119.22 3cf0 h ALA 655 Ca -0.02 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3cf0 h ALA 655 Cb 0.68 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 3cf0 h ALA 655 CO -0.09 -0.25 0.53 0.82 0.00 0.00 0.00 179.25 180.26 3cf0 h ILE 656 N 0.33 1.09 -0.38 0.00 2.04 -0.67 0.23 117.51 120.15 3cf0 h ILE 656 Ca 0.30 -0.34 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 3cf0 h ILE 656 Cb 0.41 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3cf0 h ILE 656 CO -0.35 0.18 -0.10 -0.07 0.00 0.00 0.00 178.15 177.82 3cf0 h LEU 657 N 1.00 0.75 -0.16 1.44 3.38 -0.12 -0.02 115.31 121.58 3cf0 h LEU 657 Ca 0.35 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3cf0 h LEU 657 Cb 0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3cf0 h LEU 657 CO -0.14 0.94 0.11 0.11 0.09 0.00 0.00 178.44 179.55 3cf0 h LYS 658 N 0.55 0.21 -0.50 1.13 1.57 -0.61 -1.41 116.57 117.51 3cf0 h LYS 658 Ca 0.10 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3cf0 h LYS 658 Cb 0.62 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.84 3cf0 h LYS 658 CO 0.04 0.14 0.28 0.00 -0.57 0.00 0.00 179.45 179.35 3cf0 h ALA 659 N 1.06 0.64 0.00 3.86 0.00 -0.45 0.14 119.26 124.50 3cf0 h ALA 659 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3cf0 h ALA 659 Cb -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3cf0 h ALA 659 CO -0.01 -0.03 0.00 -0.91 0.00 0.00 0.00 179.25 178.29 3cf0 h ASN 660 N 0.56 0.00 -0.03 0.00 4.21 -0.75 -3.05 115.58 116.52 3cf0 h ASN 660 Ca 0.21 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.72 3cf0 h ASN 660 Cb 0.06 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.26 3cf0 h ASN 660 CO -0.11 0.00 0.00 0.18 -1.29 0.00 0.00 177.43 176.21 3cf0 n LEU 661 N -2.82 1.69 -0.33 1.61 4.77 -0.33 -4.68 117.00 116.90 3cf0 n LEU 661 Ca -0.00 -1.09 0.23 0.00 -0.03 0.00 0.00 56.01 55.12 3cf0 n LEU 661 Cb 0.21 -0.01 0.44 0.00 -2.33 0.00 0.00 43.42 41.73 3cf0 n LEU 661 CO 0.22 0.35 0.95 0.03 -1.33 0.00 0.00 177.39 177.61 3cf0 h ARG 662 N 1.40 0.03 -1.23 3.23 3.08 -0.69 -0.09 114.38 120.12 3cf0 h ARG 662 Ca 0.00 -0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 3cf0 h ARG 662 Cb 0.33 -0.01 -0.32 0.00 0.08 0.00 0.00 29.97 30.06 3cf0 h ARG 662 CO 0.00 0.02 0.52 1.63 -1.07 0.00 0.00 179.97 181.07 3cf0 n LYS 663 N -5.35 2.91 -3.89 0.04 5.02 -1.26 -4.98 118.16 110.65 3cf0 n LYS 663 Ca 0.31 -3.58 -0.11 0.00 -2.02 0.00 0.00 58.31 52.91 3cf0 n LYS 663 Cb 1.03 -2.28 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 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 -2.08 0.05 -1.31 4.39 0.01 -0.05 -5.09 113.70 109.64 3cf0 s SER 664 Ca 0.58 -0.18 -0.18 0.00 1.31 0.00 0.00 55.95 57.49 3cf0 s SER 664 Cb 0.47 0.17 0.04 0.00 0.21 0.00 0.00 66.02 66.91 3cf0 s SER 664 CO -0.11 -0.25 1.86 -2.65 0.41 0.00 0.00 173.24 172.50 3cf0 n PRO 665 N 1.95 2.94 -2.48 12.44 -0.02 -1.26 -4.96 135.00 143.61 3cf0 n PRO 665 Ca -0.20 -3.03 -0.43 0.00 -2.02 0.00 0.00 63.50 57.82 3cf0 n PRO 665 Cb 0.56 -3.46 -0.02 0.00 -0.02 0.00 0.00 33.50 30.56 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 4.67 4.36 0.37 -1.45 -7.23 -1.26 -0.48 120.40 119.38 3cf0 s VAL 666 Ca 0.54 1.65 -0.27 0.00 -1.81 0.00 0.00 61.98 62.09 3cf0 s VAL 666 Cb 0.06 -4.07 -0.12 0.00 0.56 0.00 0.00 36.38 32.82 3cf0 s VAL 666 CO 0.05 -0.12 1.26 0.00 -0.31 0.00 0.00 175.10 175.99 3cf0 n ALA 667 N 6.27 1.18 -0.31 1.32 0.00 -0.41 -4.90 120.51 123.67 3cf0 n ALA 667 Ca 0.13 0.33 -0.05 0.00 0.00 0.00 0.00 53.44 53.85 3cf0 n ALA 667 Cb 0.45 -2.24 0.07 0.00 0.00 0.00 0.00 19.45 17.74 3cf0 n ALA 667 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3cf0 h LYS 668 N 2.35 1.17 -0.65 0.00 1.57 -1.94 -3.02 116.57 116.05 3cf0 h LYS 668 Ca -0.46 -0.14 -0.07 0.00 -1.87 0.00 0.00 60.65 58.11 3cf0 h LYS 668 Cb 1.29 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 33.35 3cf0 h LYS 668 CO 0.61 0.86 0.14 0.38 -0.57 0.00 0.00 179.45 180.87 3cf0 h ASP 669 N 1.16 1.00 -1.01 0.86 2.03 -1.98 -3.45 116.42 115.03 3cf0 h ASP 669 Ca 0.29 -0.24 -0.82 0.00 -0.73 0.00 0.00 57.03 55.53 3cf0 h ASP 669 Cb 0.04 -0.26 0.00 0.00 -0.83 0.00 0.00 39.33 38.28 3cf0 h ASP 669 CO -0.05 0.99 0.86 0.52 -1.03 0.00 0.00 179.24 180.54 3cf0 n VAL 670 N -4.28 0.09 -3.48 4.15 0.31 -1.14 -4.91 118.33 109.06 3cf0 n VAL 670 Ca 0.04 -0.03 -0.43 0.00 -0.01 0.00 0.00 64.34 63.92 3cf0 n VAL 670 Cb 0.26 -0.74 -0.09 0.00 -0.91 0.00 0.00 33.84 32.37 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 3.75 5.96 0.05 4.52 -1.08 -1.26 -4.93 116.67 123.68 3cf0 s ASP 671 Ca 1.06 -1.26 -0.13 0.00 -0.52 0.00 0.00 52.55 51.69 3cf0 s ASP 671 Cb -1.36 -2.11 -0.31 0.00 -1.46 0.00 0.00 42.92 37.68 3cf0 s ASP 671 CO 0.74 -0.56 1.08 -0.07 0.52 0.00 0.00 175.17 176.89 3cf0 h LEU 672 N 8.61 0.77 -1.99 -1.34 3.38 -1.98 -2.99 115.31 119.77 3cf0 h LEU 672 Ca -0.26 -0.77 0.12 0.00 0.09 0.00 0.00 57.88 57.05 3cf0 h LEU 672 Cb 1.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 3cf0 h LEU 672 CO 0.80 1.59 0.43 -0.33 0.09 0.00 0.00 178.44 181.02 3cf0 h GLU 673 N 0.18 0.00 0.00 1.13 3.07 -1.95 0.14 114.58 117.15 3cf0 h GLU 673 Ca -0.20 0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.59 3cf0 h GLU 673 Cb 2.02 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.92 3cf0 h GLU 673 CO 0.25 0.00 -0.39 0.35 -1.40 0.00 0.00 179.01 177.81 3cf0 h PHE 674 N 0.00 0.00 -1.05 4.33 3.57 -1.97 -3.11 116.94 118.70 3cf0 h PHE 674 Ca 0.19 0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.97 3cf0 h PHE 674 Cb 1.05 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.68 3cf0 h PHE 674 CO 0.00 0.97 0.65 -0.07 -2.23 0.00 0.00 178.31 177.63 3cf0 h LEU 675 N -1.00 0.51 -0.75 0.59 3.38 -1.10 0.90 115.31 117.83 3cf0 h LEU 675 Ca -0.10 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3cf0 h LEU 675 Cb 0.94 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 3cf0 h LEU 675 CO -0.06 0.05 0.26 0.00 0.09 0.00 0.00 178.44 178.77 3cf0 h ALA 676 N 1.68 0.97 0.00 1.53 0.00 -0.85 -2.11 119.26 120.48 3cf0 h ALA 676 Ca 0.64 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.31 3cf0 h ALA 676 Cb 1.53 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3cf0 h ALA 676 CO -0.39 0.63 -0.15 0.87 0.00 0.00 0.00 179.25 180.21 3cf0 h LYS 677 N 1.09 0.00 -0.00 0.00 1.79 -0.79 -3.03 116.57 115.64 3cf0 h LYS 677 Ca 0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 3cf0 h LYS 677 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 3cf0 h LYS 677 CO -0.01 0.15 -0.10 -1.33 -1.08 0.00 0.00 179.45 177.07 3cf0 n MET 678 N -3.78 0.16 -4.96 3.15 2.81 -0.60 -4.85 117.12 109.06 3cf0 n MET 678 Ca -0.02 -0.03 -0.27 0.00 -1.81 0.00 0.00 57.70 55.56 3cf0 n MET 678 Cb 0.26 -1.50 -0.16 0.00 -0.71 0.00 0.00 33.22 31.11 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 -2.86 1.60 0.00 2.03 -4.23 -1.14 -5.08 115.64 105.96 3cf0 s THR 679 Ca 0.18 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 59.87 3cf0 s THR 679 Cb 0.19 -1.36 0.00 0.00 1.34 0.00 0.00 72.50 72.67 3cf0 s THR 679 CO 0.54 0.46 0.00 0.59 -0.54 0.00 0.00 174.62 175.67 3cf0 n ASN 680 N 3.00 0.00 -0.39 3.99 3.02 -1.26 -4.74 115.26 118.88 3cf0 n ASN 680 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 3cf0 n ASN 680 Cb 0.53 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 4.12 0.00 3.68 7.41 0.00 -1.26 -4.48 105.19 114.65 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 -0.86 3.45 0.36 1.61 0.40 -1.26 -3.86 117.98 117.82 3cf0 s PHE 682 Ca 0.00 1.50 0.02 0.00 -0.60 0.00 0.00 56.93 57.85 3cf0 s PHE 682 Cb 0.00 -3.18 -0.02 0.00 0.51 0.00 0.00 43.02 40.33 3cf0 s PHE 682 CO 0.00 -0.29 0.54 -1.54 0.70 0.00 0.00 175.22 174.63 3cf0 s SER 683 N 1.14 6.10 0.23 1.36 1.04 -1.26 -4.30 113.70 118.00 3cf0 s SER 683 Ca 0.45 0.22 -0.12 0.00 0.48 0.00 0.00 55.95 56.98 3cf0 s SER 683 Cb -0.17 -1.70 0.30 0.00 0.10 0.00 0.00 66.02 64.55 3cf0 s SER 683 CO 0.14 -0.41 1.61 1.23 0.98 0.00 0.00 173.24 176.79 3cf0 h GLY 684 N 0.74 0.52 -0.33 7.32 0.00 -1.23 0.54 103.07 110.63 3cf0 h GLY 684 Ca -0.48 0.25 0.09 0.00 0.00 0.00 0.00 47.33 47.18 3cf0 h GLY 684 CO 0.58 -0.28 -0.37 0.00 0.00 0.00 0.00 176.54 176.47 3cf0 h ALA 685 N 1.72 -0.23 -0.82 3.60 0.00 -0.92 -0.50 119.26 122.11 3cf0 h ALA 685 Ca 0.35 0.11 0.16 0.00 0.00 0.00 0.00 54.91 55.53 3cf0 h ALA 685 Cb 0.54 0.82 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 3cf0 h ALA 685 CO -0.76 -0.77 0.54 -0.44 0.00 0.00 0.00 179.25 177.83 3cf0 h ASP 686 N -0.24 0.44 0.02 0.00 3.32 -1.20 -0.30 116.42 118.44 3cf0 h ASP 686 Ca 0.18 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 3cf0 h ASP 686 Cb 0.56 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3cf0 h ASP 686 CO -0.62 0.21 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.04 3cf0 h LEU 687 N 0.46 -0.02 -0.96 1.55 3.38 -0.07 -2.98 115.31 116.67 3cf0 h LEU 687 Ca 0.41 -0.75 0.19 0.00 0.09 0.00 0.00 57.88 57.81 3cf0 h LEU 687 Cb 0.91 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.49 3cf0 h LEU 687 CO -0.15 0.78 -0.25 0.74 0.09 0.00 0.00 178.44 179.65 3cf0 h THR 688 N -0.85 0.04 -0.98 0.22 2.02 -0.96 0.15 112.91 112.55 3cf0 h THR 688 Ca -0.00 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.35 3cf0 h THR 688 Cb 0.77 0.04 -0.09 0.00 -1.74 0.00 0.00 68.15 67.13 3cf0 h THR 688 CO 0.00 0.00 0.61 -0.08 0.37 0.00 0.00 175.52 176.43 3cf0 h GLU 689 N -0.00 0.75 0.52 6.66 4.57 -0.95 -1.70 114.58 124.42 3cf0 h GLU 689 Ca 0.45 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.56 3cf0 h GLU 689 Cb 0.69 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 29.12 3cf0 h GLU 689 CO -0.99 0.50 -0.25 0.82 -1.18 0.00 0.00 179.01 177.91 3cf0 h ILE 690 N 0.77 0.36 -0.71 2.32 2.04 -0.57 -2.05 117.51 119.67 3cf0 h ILE 690 Ca 0.53 -0.38 0.09 0.00 1.00 0.00 0.00 64.86 66.09 3cf0 h ILE 690 Cb 0.81 0.49 -0.11 0.00 -0.74 0.00 0.00 36.82 37.27 3cf0 h ILE 690 CO -0.30 0.05 -0.50 0.00 0.00 0.00 0.00 178.15 177.39 3cf0 h GLN 692 N -0.18 0.27 -0.59 0.00 4.20 -1.26 0.35 115.11 117.90 3cf0 h GLN 692 Ca 0.17 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 3cf0 h GLN 692 Cb 0.53 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 3cf0 h GLN 692 CO -0.77 0.18 0.08 0.00 -0.67 0.00 0.00 178.83 177.65 3cf0 h ARG 693 N 0.27 0.96 0.03 1.46 3.08 -0.17 -0.21 114.38 119.81 3cf0 h ARG 693 Ca 0.50 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.31 3cf0 h ARG 693 Cb 0.94 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.87 3cf0 h ARG 693 CO -0.58 0.90 -0.03 0.00 -1.07 0.00 0.00 179.97 179.19 3cf0 h ALA 694 N 1.18 -0.06 0.17 0.04 0.00 0.15 -0.17 119.26 120.57 3cf0 h ALA 694 Ca 0.18 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3cf0 h ALA 694 Cb 0.41 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 3cf0 h ALA 694 CO 0.01 -0.54 -0.50 0.00 0.00 0.00 0.00 179.25 178.22 3cf0 h LYS 696 N -0.76 0.06 -0.05 0.00 1.57 -0.83 0.39 116.57 116.95 3cf0 h LYS 696 Ca -0.01 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.66 3cf0 h LYS 696 Cb 0.74 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 33.04 3cf0 h LYS 696 CO -0.24 0.04 -0.36 -0.07 -0.57 0.00 0.00 179.45 178.24 3cf0 h LEU 697 N 0.06 0.40 -0.32 2.94 3.38 -0.31 -1.92 115.31 119.54 3cf0 h LEU 697 Ca 0.44 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 3cf0 h LEU 697 Cb 1.68 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 42.29 3cf0 h LEU 697 CO -0.03 1.03 0.17 0.00 0.09 0.00 0.00 178.44 179.69 3cf0 h ALA 698 N 0.39 0.41 0.26 1.53 0.00 0.97 0.21 119.26 123.03 3cf0 h ALA 698 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3cf0 h ALA 698 Cb 1.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3cf0 h ALA 698 CO 0.07 -0.04 -0.28 0.82 0.00 0.00 0.00 179.25 179.82 3cf0 h ILE 699 N 0.39 0.40 -0.47 0.00 2.04 -0.69 0.67 117.51 119.85 3cf0 h ILE 699 Ca 0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 3cf0 h ILE 699 Cb 0.09 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 3cf0 h ILE 699 CO -0.02 0.00 0.31 -0.09 0.00 0.00 0.00 178.15 178.36 3cf0 h ARG 700 N -0.58 0.38 0.00 2.37 2.43 -1.26 0.14 114.38 117.86 3cf0 h ARG 700 Ca -0.00 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.98 3cf0 h ARG 700 Cb 0.54 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 3cf0 h ARG 700 CO -0.08 0.25 -0.77 1.49 -1.51 0.00 0.00 179.97 179.36 3cf0 h GLU 701 N 0.39 0.00 0.00 0.20 4.22 -0.09 -2.64 114.58 116.66 3cf0 h GLU 701 Ca 0.20 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.64 3cf0 h GLU 701 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3cf0 h GLU 701 CO -0.05 0.77 0.00 0.45 -2.18 0.00 0.00 179.01 178.00 3cf0 n SER 702 N -3.46 0.00 -0.54 1.04 2.88 0.23 -3.41 113.62 110.36 3cf0 n SER 702 Ca -0.00 0.59 0.45 0.00 -1.33 0.00 0.00 58.87 58.58 3cf0 n SER 702 Cb 0.79 -0.48 0.79 0.00 -0.75 0.00 0.00 64.21 64.56 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 0.18 0.48 2.46 2.04 -0.97 0.22 117.51 121.92 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 0.00 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 3cf0 h ILE 703 CO 0.00 0.00 -0.26 -0.08 0.00 0.00 0.00 178.15 177.81 3cf0 h GLU 704 N 0.00 -0.66 -0.82 2.37 4.81 -1.59 -3.25 114.58 115.45 3cf0 h GLU 704 Ca 0.78 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 60.09 3cf0 h GLU 704 Cb 3.11 0.15 -0.05 0.00 0.63 0.00 0.00 28.75 32.59 3cf0 h GLU 704 CO -0.01 -0.44 0.52 0.66 -0.73 0.00 0.00 179.01 179.01 3cf0 h SER 705 N -0.68 0.85 0.74 1.04 4.64 -0.58 -3.20 113.55 116.36 3cf0 h SER 705 Ca -0.06 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 3cf0 h SER 705 Cb 0.54 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3cf0 h SER 705 CO 0.09 0.57 -0.36 -0.33 -0.87 0.00 0.00 176.83 175.93 3cf0 h GLU 706 N 0.99 -0.96 0.00 4.77 5.08 -1.65 -3.53 114.58 119.28 3cf0 h GLU 706 Ca 0.33 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 3cf0 h GLU 706 Cb 0.05 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3cf0 h GLU 706 CO -0.13 -0.64 0.00 -0.89 -1.00 0.00 0.00 179.01 176.35 3cf0 n ILE 707 N -4.92 0.00 0.00 3.13 2.08 -1.21 -5.17 119.36 113.27 3cf0 n ILE 707 Ca -0.12 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.19 3cf0 n ILE 707 Cb 0.39 -0.51 0.00 0.00 -0.75 0.00 0.00 39.64 38.78 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 -0.88 0.00 -3.31 1.39 0.31 -1.26 -5.04 118.33 109.54 3cf0 n VAL 728 Ca 0.14 0.00 -0.46 0.00 -0.01 0.00 0.00 64.34 64.01 3cf0 n VAL 728 Cb 0.06 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 -0.65 3.15 -0.12 5.55 0.04 -1.26 -4.94 135.00 136.78 3cf0 s PRO 729 Ca 0.00 -1.90 -0.04 0.00 0.04 0.00 0.00 61.00 59.10 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 1.25 0.12 -0.27 4.56 8.01 -1.26 -4.94 118.70 126.17 3cf0 s GLU 730 Ca 0.07 0.68 -0.29 0.00 0.01 0.00 0.00 54.97 55.44 3cf0 s GLU 730 Cb -0.25 -0.10 -0.02 0.00 -4.31 0.00 0.00 34.13 29.45 3cf0 s GLU 730 CO -0.00 -0.28 1.75 -1.50 0.01 0.00 0.00 175.26 175.24 3cf0 s ILE 731 N 2.28 3.52 0.44 -1.63 -1.16 0.37 -4.72 121.20 120.31 3cf0 s ILE 731 Ca 0.01 0.56 0.05 0.00 -0.51 0.00 0.00 60.65 60.76 3cf0 s ILE 731 Cb -0.12 -3.62 -0.05 0.00 0.61 0.00 0.00 42.46 39.28 3cf0 s ILE 731 CO -0.08 -0.33 0.06 0.00 -2.81 0.00 0.00 174.94 171.78 3cf0 s ARG 732 N 5.25 2.08 0.07 3.50 1.70 -1.26 -1.29 118.95 129.00 3cf0 s ARG 732 Ca 0.78 -2.13 -0.13 0.00 -0.47 0.00 0.00 55.73 53.78 3cf0 s ARG 732 Cb -0.25 -1.70 -0.03 0.00 -0.57 0.00 0.00 34.95 32.41 3cf0 s ARG 732 CO 0.32 -0.17 0.86 -2.13 -1.08 0.00 0.00 175.30 173.10 3cf0 n ARG 733 N -1.13 -0.18 0.28 3.89 0.63 -1.26 -0.56 116.66 118.32 3cf0 n ARG 733 Ca -0.08 0.84 0.19 0.00 -0.92 0.00 0.00 57.85 57.88 3cf0 n ARG 733 Cb 0.66 -1.25 0.89 0.00 0.45 0.00 0.00 32.46 33.21 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 0.17 6.15 2.03 -1.98 -0.71 116.42 122.09 3cf0 h ASP 734 Ca 0.07 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.36 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 -0.21 -0.84 4.15 3.86 -1.20 -1.21 115.15 119.71 3cf0 h HIS 735 Ca 0.00 -0.01 0.09 0.00 -1.16 0.00 0.00 60.37 59.29 3cf0 h HIS 735 Cb 0.25 0.07 -0.07 0.00 1.06 0.00 0.00 27.41 28.72 3cf0 h HIS 735 CO 0.00 0.21 0.49 0.74 0.86 0.00 0.00 177.93 180.23 3cf0 h PHE 736 N -0.76 0.89 -0.08 2.45 0.04 -1.30 0.23 116.94 118.42 3cf0 h PHE 736 Ca -0.02 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.80 3cf0 h PHE 736 Cb 0.52 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.37 3cf0 h PHE 736 CO 0.07 0.38 -0.05 0.93 -0.60 0.00 0.00 178.31 179.04 3cf0 h GLU 737 N 0.84 -0.05 0.00 1.51 5.08 -1.14 0.68 114.58 121.49 3cf0 h GLU 737 Ca 0.40 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.76 3cf0 h GLU 737 Cb 0.33 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 3cf0 h GLU 737 CO -0.23 -0.04 -0.01 1.49 -1.00 0.00 0.00 179.01 179.23 3cf0 h GLU 738 N -0.06 0.00 -0.23 2.33 4.22 -0.83 -2.51 114.58 117.51 3cf0 h GLU 738 Ca 0.05 0.00 -0.17 0.00 0.08 0.00 0.00 59.36 59.32 3cf0 h GLU 738 Cb 0.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 3cf0 h GLU 738 CO -0.11 0.01 -0.53 0.00 -2.18 0.00 0.00 179.01 176.19 3cf0 h ALA 739 N 1.99 0.64 0.00 2.92 0.00 0.46 -3.11 119.26 122.16 3cf0 h ALA 739 Ca -0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 3cf0 h ALA 739 Cb 0.73 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3cf0 h ALA 739 CO 0.00 0.68 -0.01 0.52 0.00 0.00 0.00 179.25 180.44 3cf0 h MET 740 N 0.51 0.00 0.00 0.00 2.86 -0.44 -2.62 114.93 115.24 3cf0 h MET 740 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3cf0 h MET 740 Cb 1.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.75 3cf0 h MET 740 CO 0.11 0.01 0.00 0.54 1.06 0.00 0.00 176.91 178.63 3cf0 n ARG 741 N -3.95 0.03 -1.51 1.72 5.12 -1.18 -1.98 116.66 114.91 3cf0 n ARG 741 Ca -0.03 0.34 -0.01 0.00 -1.93 0.00 0.00 57.85 56.22 3cf0 n ARG 741 Cb 0.09 -1.50 0.09 0.00 -1.16 0.00 0.00 32.46 29.98 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 -1.39 0.66 -2.86 -1.55 3.01 -0.99 -5.07 117.46 109.29 3cf0 n PHE 742 Ca 0.01 -1.39 -0.41 0.00 1.01 0.00 0.00 57.45 56.67 3cf0 n PHE 742 Cb 0.04 -0.23 -0.04 0.00 -0.01 0.00 0.00 39.48 39.24 3cf0 n PHE 742 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3cf0 s ALA 743 N -2.30 3.27 0.46 4.37 0.00 -0.84 -5.03 121.76 121.70 3cf0 s ALA 743 Ca 0.37 0.33 0.07 0.00 0.00 0.00 0.00 51.96 52.73 3cf0 s ALA 743 Cb 0.37 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 20.31 3cf0 s ALA 743 CO -0.08 -0.23 0.35 1.03 0.00 0.00 0.00 175.76 176.83 3cf0 s ARG 744 N 1.07 2.37 -0.16 0.00 1.81 -1.26 -5.12 118.95 117.66 3cf0 s ARG 744 Ca 0.45 -1.76 0.01 0.00 -1.72 0.00 0.00 55.73 52.70 3cf0 s ARG 744 Cb -0.19 -2.21 0.02 0.00 -0.45 0.00 0.00 34.95 32.12 3cf0 s ARG 744 CO 0.22 -0.33 -0.16 1.03 -0.68 0.00 0.00 175.30 175.38 3cf0 s ARG 745 N -4.14 2.54 0.18 3.54 0.52 -1.26 -4.88 118.95 115.45 3cf0 s ARG 745 Ca 0.42 -0.66 -0.06 0.00 -0.52 0.00 0.00 55.73 54.92 3cf0 s ARG 745 Cb -0.01 -2.28 0.08 0.00 0.52 0.00 0.00 34.95 33.26 3cf0 s ARG 745 CO 0.25 -0.23 1.51 0.66 0.02 0.00 0.00 175.30 177.51 3cf0 h SER 746 N 8.01 0.75 -3.40 0.23 4.64 -1.96 -3.42 113.55 118.40 3cf0 h SER 746 Ca -0.41 -0.37 -0.60 0.00 -0.47 0.00 0.00 61.79 59.94 3cf0 h SER 746 Cb 1.14 -0.21 -0.12 0.00 -0.31 0.00 0.00 62.40 62.89 3cf0 h SER 746 CO 0.57 1.10 -0.41 -0.69 -0.87 0.00 0.00 176.83 176.53 3cf0 s VAL 747 N -4.17 5.34 0.32 0.95 1.01 -1.25 -5.07 120.40 117.52 3cf0 s VAL 747 Ca -0.09 0.35 -0.08 0.00 0.00 0.00 0.00 61.98 62.17 3cf0 s VAL 747 Cb 0.11 -3.56 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 3cf0 s VAL 747 CO 0.85 0.37 0.63 -0.94 0.00 0.00 0.00 175.10 176.02 3cf0 s SER 748 N 0.70 6.50 0.32 3.32 1.04 -1.26 -4.81 113.70 119.50 3cf0 s SER 748 Ca 0.12 0.89 0.09 0.00 0.48 0.00 0.00 55.95 57.53 3cf0 s SER 748 Cb -0.13 -2.22 0.87 0.00 0.10 0.00 0.00 66.02 64.64 3cf0 s SER 748 CO 0.03 -0.25 1.74 -2.24 0.98 0.00 0.00 173.24 173.49 3cf0 h ASP 749 N 1.64 0.69 0.20 7.02 3.04 -1.97 -0.66 116.42 126.37 3cf0 h ASP 749 Ca -0.47 0.13 0.01 0.00 -3.24 0.00 0.00 57.03 53.46 3cf0 h ASP 749 Cb 1.19 0.02 -0.03 0.00 -1.04 0.00 0.00 39.33 39.46 3cf0 h ASP 749 CO 0.66 0.13 -0.33 0.78 -2.04 0.00 0.00 179.24 178.43 3cf0 h ASN 750 N 0.60 -0.93 -0.33 4.15 2.35 -1.99 0.19 115.58 119.62 3cf0 h ASN 750 Ca 0.64 0.10 0.07 0.00 -0.55 0.00 0.00 56.30 56.56 3cf0 h ASN 750 Cb 1.18 0.34 -0.07 0.00 0.05 0.00 0.00 38.32 39.82 3cf0 h ASN 750 CO -0.46 -0.43 -0.14 0.44 -1.65 0.00 0.00 177.43 175.18 3cf0 h ASP 751 N -0.61 -0.49 -0.27 5.81 3.32 -1.61 0.17 116.42 122.74 3cf0 h ASP 751 Ca 0.01 0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.25 3cf0 h ASP 751 Cb 0.60 0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.36 3cf0 h ASP 751 CO -0.14 -0.18 -0.26 0.40 -1.72 0.00 0.00 179.24 177.34 3cf0 h ILE 752 N -0.09 0.35 -0.40 0.35 2.04 -0.69 -0.28 117.51 118.81 3cf0 h ILE 752 Ca 0.17 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.11 3cf0 h ILE 752 Cb 0.34 0.35 -0.09 0.00 -0.74 0.00 0.00 36.82 36.69 3cf0 h ILE 752 CO -0.39 0.00 -0.23 0.03 0.00 0.00 0.00 178.15 177.55 3cf0 h ARG 753 N -0.26 -0.16 -1.00 2.37 3.08 0.32 0.87 114.38 119.60 3cf0 h ARG 753 Ca 0.14 0.01 0.20 0.00 0.07 0.00 0.00 59.98 60.40 3cf0 h ARG 753 Cb 0.48 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.46 3cf0 h ARG 753 CO -0.42 -0.11 0.61 0.87 -1.07 0.00 0.00 179.97 179.86 3cf0 h LYS 754 N -0.17 0.70 -0.41 0.04 1.57 0.62 -1.30 116.57 117.62 3cf0 h LYS 754 Ca 0.19 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 3cf0 h LYS 754 Cb 0.46 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 3cf0 h LYS 754 CO -0.50 0.46 -0.17 1.88 -0.57 0.00 0.00 179.45 180.55 3cf0 h TYR 755 N 0.72 0.86 -0.70 -1.35 -1.99 0.80 -0.85 116.97 114.46 3cf0 h TYR 755 Ca 0.58 -0.18 0.02 0.00 2.00 0.00 0.00 58.73 61.15 3cf0 h TYR 755 Cb 0.96 -0.21 -0.04 0.00 2.00 0.00 0.00 36.73 39.44 3cf0 h TYR 755 CO -0.00 0.88 0.46 0.93 -0.00 0.00 0.00 178.16 180.43 3cf0 h GLU 756 N 0.68 0.87 0.22 4.88 4.39 -0.72 1.56 114.58 126.47 3cf0 h GLU 756 Ca 0.11 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 3cf0 h GLU 756 Cb 0.67 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 3cf0 h GLU 756 CO 0.05 0.58 -0.11 0.52 -1.16 0.00 0.00 179.01 178.89 3cf0 h MET 757 N 0.90 -0.29 -0.18 2.33 2.86 -0.78 0.27 114.93 120.04 3cf0 h MET 757 Ca 0.27 0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.97 3cf0 h MET 757 Cb -0.03 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 3cf0 h MET 757 CO -0.07 -0.03 -0.10 0.74 1.06 0.00 0.00 176.91 178.51 3cf0 h PHE 758 N -0.52 -0.24 0.00 -0.22 0.05 -0.53 -2.31 116.94 113.17 3cf0 h PHE 758 Ca -0.03 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.78 3cf0 h PHE 758 Cb 0.39 0.14 -0.00 0.00 2.00 0.00 0.00 35.95 38.48 3cf0 h PHE 758 CO 0.00 -0.16 -0.00 0.00 -0.18 0.00 0.00 178.31 177.97 3cf0 h ALA 759 N 1.06 1.69 0.24 2.45 0.00 0.26 0.34 119.26 125.30 3cf0 h ALA 759 Ca 0.10 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3cf0 h ALA 759 Cb 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3cf0 h ALA 759 CO -0.24 0.01 -0.12 0.37 0.00 0.00 0.00 179.25 179.27 3cf0 h GLN 760 N 0.00 -0.31 0.05 0.00 4.15 0.11 -2.51 115.11 116.59 3cf0 h GLN 760 Ca -0.00 0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 3cf0 h GLN 760 Cb 0.01 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.77 3cf0 h GLN 760 CO 0.00 -0.21 -0.03 1.79 -1.93 0.00 0.00 178.83 178.45 3cf0 h THR 761 N -0.68 0.92 -0.09 2.39 1.35 -1.44 -3.00 112.91 112.36 3cf0 h THR 761 Ca -0.03 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.85 3cf0 h THR 761 Cb 0.25 0.92 -0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3cf0 h THR 761 CO 0.05 0.00 0.07 -0.07 -0.25 0.00 0.00 175.52 175.32 3cf0 h LEU 762 N -0.09 0.00 -1.45 3.87 3.38 -1.07 -3.52 115.31 116.44 3cf0 h LEU 762 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3cf0 h LEU 762 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3cf0 h LEU 762 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53