#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c4f s LEU 465 N 0.00 4.37 0.44 4.31 1.02 -1.26 -5.08 118.68 122.48 3c4f s LEU 465 Ca 0.00 0.38 -0.25 0.00 0.02 0.00 0.00 54.13 54.28 3c4f s LEU 465 Cb 0.00 -2.57 -0.09 0.00 0.02 0.00 0.00 46.19 43.55 3c4f s LEU 465 CO 0.00 0.28 1.38 -2.65 0.02 0.00 0.00 176.35 175.37 3c4f n PRO 466 N 1.06 2.13 -2.86 1.29 -0.02 -1.26 -4.88 135.00 130.45 3c4f n PRO 466 Ca -0.12 0.76 -0.31 0.00 -2.02 0.00 0.00 63.50 61.81 3c4f n PRO 466 Cb 0.53 -2.55 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 3c4f n PRO 466 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3c4f s GLU 467 N -2.38 3.82 -0.39 -0.52 0.41 -1.26 -4.94 118.70 113.45 3c4f s GLU 467 Ca 0.61 0.53 0.04 0.00 -0.41 0.00 0.00 54.97 55.74 3c4f s GLU 467 Cb -0.47 -2.38 0.16 0.00 -1.78 0.00 0.00 34.13 29.66 3c4f s GLU 467 CO 0.57 -0.02 0.41 0.34 -0.49 0.00 0.00 175.26 176.07 3c4f s ASP 468 N -3.03 0.82 0.57 -0.19 -1.08 -1.26 -5.04 116.67 107.46 3c4f s ASP 468 Ca 0.52 -1.62 0.27 0.00 -0.52 0.00 0.00 52.55 51.20 3c4f s ASP 468 Cb -0.10 0.69 1.60 0.00 -1.46 0.00 0.00 42.92 43.64 3c4f s ASP 468 CO 0.29 -0.23 2.12 -0.65 0.52 0.00 0.00 175.17 177.22 3c4f h PRO 469 N 6.86 0.00 -0.95 4.34 0.11 -1.97 -1.90 132.00 138.49 3c4f h PRO 469 Ca 0.07 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.25 3c4f h PRO 469 Cb 1.06 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 3c4f h PRO 469 CO 0.19 0.00 0.61 0.00 -0.21 0.00 0.00 178.00 178.59 3c4f h ARG 470 N 0.00 1.05 0.00 1.05 3.08 -2.02 -3.21 114.38 114.32 3c4f h ARG 470 Ca 0.08 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3c4f h ARG 470 Cb 0.40 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3c4f h ARG 470 CO -0.00 0.69 -1.19 0.91 -1.07 0.00 0.00 179.97 179.31 3c4f n TRP 471 N -4.50 0.00 -1.96 3.04 7.02 -0.78 -5.03 117.44 115.23 3c4f n TRP 471 Ca 0.15 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.22 3c4f n TRP 471 Cb 0.21 -0.17 -0.01 0.00 -2.42 0.00 0.00 31.31 28.92 3c4f n TRP 471 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 3c4f s GLU 472 N -2.77 4.24 -0.07 -0.99 2.56 -0.81 -1.63 118.70 119.24 3c4f s GLU 472 Ca 0.01 2.39 0.02 0.00 0.00 0.00 0.00 54.97 57.38 3c4f s GLU 472 Cb 0.11 -3.04 0.01 0.00 2.00 0.00 0.00 34.13 33.22 3c4f s GLU 472 CO 0.65 -0.38 -0.13 -1.17 -0.56 0.00 0.00 175.26 173.67 3c4f s LEU 473 N -1.56 1.66 0.41 2.70 2.96 -0.60 -4.83 118.68 119.41 3c4f s LEU 473 Ca 0.53 -0.32 -0.26 0.00 -0.22 0.00 0.00 54.13 53.86 3c4f s LEU 473 Cb -0.43 -0.86 -0.10 0.00 0.50 0.00 0.00 46.19 45.30 3c4f s LEU 473 CO 0.55 0.03 1.34 -2.65 -1.32 0.00 0.00 176.35 174.30 3c4f n PRO 474 N 3.84 2.14 0.23 0.98 -0.02 -1.26 -4.44 135.00 136.47 3c4f n PRO 474 Ca -0.22 0.76 0.09 0.00 -2.02 0.00 0.00 63.50 62.10 3c4f n PRO 474 Cb 0.52 -2.47 0.53 0.00 -0.02 0.00 0.00 33.50 32.07 3c4f n PRO 474 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3c4f h ARG 475 N 2.33 0.00 0.00 -0.52 3.08 -1.95 -2.69 114.38 114.64 3c4f h ARG 475 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 3c4f h ARG 475 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3c4f h ARG 475 CO 0.61 0.23 0.00 -0.40 -1.07 0.00 0.00 179.97 179.35 3c4f n ASP 476 N -3.72 0.00 -1.90 7.04 5.75 -1.26 -2.68 116.55 119.79 3c4f n ASP 476 Ca -0.01 0.48 -0.07 0.00 -0.01 0.00 0.00 54.79 55.18 3c4f n ASP 476 Cb 0.35 -0.49 0.26 0.00 -1.03 0.00 0.00 41.12 40.20 3c4f n ASP 476 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3c4f n ARG 477 N -1.49 3.30 -3.61 0.11 5.12 -1.01 -4.87 116.66 114.20 3c4f n ARG 477 Ca 0.06 -2.71 -0.12 0.00 -1.93 0.00 0.00 57.85 53.15 3c4f n ARG 477 Cb 0.26 -2.11 -0.11 0.00 -1.16 0.00 0.00 32.46 29.34 3c4f n ARG 477 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3c4f s LEU 478 N -2.65 -0.43 -0.28 0.55 2.96 -1.09 -1.38 118.68 116.36 3c4f s LEU 478 Ca 0.49 0.61 -0.07 0.00 -0.22 0.00 0.00 54.13 54.95 3c4f s LEU 478 Cb 0.39 0.92 0.00 0.00 0.50 0.00 0.00 46.19 48.01 3c4f s LEU 478 CO 0.12 -0.25 0.07 -0.69 -1.32 0.00 0.00 176.35 174.27 3c4f s VAL 479 N 2.49 3.94 0.46 1.68 1.01 -0.54 -4.97 120.40 124.47 3c4f s VAL 479 Ca 0.02 -0.61 -0.22 0.00 0.00 0.00 0.00 61.98 61.18 3c4f s VAL 479 Cb -0.13 -2.99 -0.09 0.00 0.00 0.00 0.00 36.38 33.18 3c4f s VAL 479 CO -0.11 0.15 1.05 -0.76 0.00 0.00 0.00 175.10 175.43 3c4f s LEU 480 N 1.51 3.95 0.00 3.92 1.43 -1.26 -2.16 118.68 126.08 3c4f s LEU 480 Ca 0.03 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 3c4f s LEU 480 Cb -0.17 -4.42 0.00 0.00 0.03 0.00 0.00 46.19 41.64 3c4f s LEU 480 CO 0.02 -0.69 0.00 0.61 0.23 0.00 0.00 176.35 176.52 3c4f n GLY 481 N -0.01 5.42 3.77 -3.19 0.00 0.01 -4.96 105.19 106.22 3c4f n GLY 481 Ca 0.08 -1.23 -0.33 0.00 0.00 0.00 0.00 46.02 44.54 3c4f n GLY 481 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3c4f s LYS 482 N 2.63 2.69 0.64 1.61 -2.85 -1.26 -4.50 119.74 118.70 3c4f s LYS 482 Ca 0.00 1.32 -0.18 0.00 -1.00 0.00 0.00 55.97 56.12 3c4f s LYS 482 Cb 0.00 -1.94 -0.01 0.00 -2.06 0.00 0.00 37.83 33.82 3c4f s LYS 482 CO 0.00 -1.32 1.22 -2.14 0.10 0.00 0.00 175.35 173.20 3c4f s PRO 483 N -4.30 2.71 0.06 1.78 0.02 -1.26 -0.43 135.00 133.58 3c4f s PRO 483 Ca 0.65 1.82 0.07 0.00 0.02 0.00 0.00 61.00 63.56 3c4f s PRO 483 Cb -0.19 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 3c4f s PRO 483 CO 0.45 -1.41 -0.18 -0.51 -0.33 0.00 0.00 177.00 175.02 3c4f s LEU 484 N -4.41 2.22 0.00 -5.54 1.43 0.22 -4.72 118.68 107.87 3c4f s LEU 484 Ca 0.77 -0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 3c4f s LEU 484 Cb -0.31 -0.79 0.00 0.00 0.03 0.00 0.00 46.19 45.13 3c4f s LEU 484 CO 0.37 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.63 3c4f n GLY 485 N 1.59 0.50 3.10 -3.19 0.00 -1.26 -4.12 105.19 101.82 3c4f n GLY 485 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 3c4f n GLY 485 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3c4f n GLU 486 N -2.11 -4.23 -0.72 1.61 -0.58 -1.26 -1.87 120.64 111.48 3c4f n GLU 486 Ca 0.00 0.75 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 3c4f n GLU 486 Cb 0.08 -5.55 0.00 0.00 -0.57 0.00 0.00 31.44 25.40 3c4f n GLU 486 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3c4f n GLY 487 N -1.37 1.49 0.22 0.62 0.00 -1.26 -4.91 105.19 99.98 3c4f n GLY 487 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.99 3c4f n GLY 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c4f h ALA 488 N 0.00 1.50 -0.40 4.61 0.00 -1.67 -2.29 119.26 121.00 3c4f h ALA 488 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3c4f h ALA 488 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3c4f h ALA 488 CO 0.00 0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.74 3c4f n PHE 489 N -4.10 0.97 -1.78 0.00 3.01 -1.26 -5.08 117.46 109.22 3c4f n PHE 489 Ca -0.02 -0.68 0.00 0.00 1.01 0.00 0.00 57.45 57.76 3c4f n PHE 489 Cb 0.31 -0.21 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 3c4f n PHE 489 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3c4f n GLY 490 N 0.28 -1.26 3.55 1.37 0.00 -0.86 -4.72 105.19 103.55 3c4f n GLY 490 Ca 0.20 -1.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 3c4f n GLY 490 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3c4f s GLN 491 N 0.00 3.27 -0.06 1.61 0.74 -1.26 -4.28 119.66 119.68 3c4f s GLN 491 Ca 0.00 -0.45 0.03 0.00 0.05 0.00 0.00 55.36 55.00 3c4f s GLN 491 Cb 0.00 -4.52 0.01 0.00 1.10 0.00 0.00 33.01 29.60 3c4f s GLN 491 CO 0.00 -2.20 -0.14 0.08 -0.55 0.00 0.00 175.29 172.47 3c4f s VAL 492 N 5.72 1.24 0.12 1.34 1.01 -1.26 -1.99 120.40 126.59 3c4f s VAL 492 Ca 0.40 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.88 3c4f s VAL 492 Cb -0.06 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 3c4f s VAL 492 CO 0.08 0.37 -0.19 0.68 0.00 0.00 0.00 175.10 176.05 3c4f s VAL 493 N 0.39 1.66 0.54 2.92 -7.23 -0.46 -0.61 120.40 117.62 3c4f s VAL 493 Ca -0.10 -1.67 -0.18 0.00 -1.81 0.00 0.00 61.98 58.21 3c4f s VAL 493 Cb -0.14 -1.61 -0.06 0.00 0.56 0.00 0.00 36.38 35.13 3c4f s VAL 493 CO 0.03 -0.20 1.07 -0.22 -0.31 0.00 0.00 175.10 175.48 3c4f s LEU 494 N -2.21 3.69 0.12 1.32 2.96 0.43 -0.89 118.68 124.10 3c4f s LEU 494 Ca 0.09 1.96 -0.17 0.00 -0.22 0.00 0.00 54.13 55.80 3c4f s LEU 494 Cb -0.08 -4.56 0.04 0.00 0.50 0.00 0.00 46.19 42.09 3c4f s LEU 494 CO 0.05 -1.06 0.42 0.00 -1.32 0.00 0.00 176.35 174.43 3c4f s ALA 495 N -2.09 -0.98 -0.22 5.97 0.00 -0.16 -0.81 121.76 123.46 3c4f s ALA 495 Ca 0.68 0.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 3c4f s ALA 495 Cb -0.18 0.66 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 3c4f s ALA 495 CO 0.28 -0.63 0.00 -1.21 0.00 0.00 0.00 175.76 174.21 3c4f s GLU 496 N -3.62 3.57 -0.00 0.00 2.02 -0.92 -0.94 118.70 118.81 3c4f s GLU 496 Ca 0.02 -0.54 0.01 0.00 0.02 0.00 0.00 54.97 54.47 3c4f s GLU 496 Cb 0.01 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 3c4f s GLU 496 CO -0.11 -0.08 0.04 0.00 0.02 0.00 0.00 175.26 175.13 3c4f s ALA 497 N 1.25 3.43 -0.28 5.21 0.00 -0.54 -1.46 121.76 129.36 3c4f s ALA 497 Ca 0.04 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.10 3c4f s ALA 497 Cb -0.15 -1.45 0.06 0.00 0.00 0.00 0.00 23.12 21.58 3c4f s ALA 497 CO 0.01 0.67 -0.07 0.42 0.00 0.00 0.00 175.76 176.79 3c4f s ILE 498 N -1.14 2.36 0.00 0.00 1.09 -0.48 -1.20 121.20 121.84 3c4f s ILE 498 Ca 0.21 -1.67 0.00 0.00 -1.10 0.00 0.00 60.65 58.09 3c4f s ILE 498 Cb -0.12 -2.42 0.00 0.00 -1.06 0.00 0.00 42.46 38.86 3c4f s ILE 498 CO 0.12 -0.12 0.00 0.61 -0.10 0.00 0.00 174.94 175.45 3c4f n GLY 499 N 4.45 1.59 5.05 6.18 0.00 -1.16 -4.85 105.19 116.45 3c4f n GLY 499 Ca -0.12 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.19 3c4f n GLY 499 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c4f n LEU 500 N 0.00 0.00 -4.59 0.99 4.77 -1.26 -4.36 117.00 112.55 3c4f n LEU 500 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.57 3c4f n LEU 500 Cb 0.00 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.02 3c4f n LEU 500 CO 0.00 0.00 0.33 -0.62 -1.33 0.00 0.00 177.39 175.77 3c4f s ASP 501 N -1.75 6.43 0.00 -1.43 -1.08 -1.26 -4.98 116.67 112.60 3c4f s ASP 501 Ca 0.00 0.29 0.07 0.00 -0.52 0.00 0.00 52.55 52.39 3c4f s ASP 501 Cb 0.00 -2.31 0.42 0.00 -1.46 0.00 0.00 42.92 39.57 3c4f s ASP 501 CO 0.00 -0.47 0.97 2.29 0.52 0.00 0.00 175.17 178.48 3c4f n LYS 502 N 5.84 0.64 0.00 4.34 2.85 -1.26 -3.05 118.16 127.52 3c4f n LYS 502 Ca -0.02 0.00 0.12 0.00 -1.05 0.00 0.00 58.31 57.36 3c4f n LYS 502 Cb 0.49 -1.17 0.28 0.00 -0.65 0.00 0.00 35.03 33.98 3c4f n LYS 502 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3c4f n ASP 503 N -0.67 0.99 -3.04 -5.58 10.43 -1.26 -4.29 116.55 113.13 3c4f n ASP 503 Ca 0.05 -0.80 -0.17 0.00 2.57 0.00 0.00 54.79 56.45 3c4f n ASP 503 Cb 0.02 0.24 -0.01 0.00 1.84 0.00 0.00 41.12 43.22 3c4f n ASP 503 CO 0.00 0.00 0.00 2.29 -1.07 0.00 0.00 177.20 178.42 3c4f n LYS 504 N -0.85 0.84 0.00 -1.24 0.00 -1.17 -5.02 118.16 110.73 3c4f n LYS 504 Ca 0.10 -2.78 0.00 0.00 -0.00 0.00 0.00 58.31 55.63 3c4f n LYS 504 Cb 0.36 -1.38 0.00 0.00 -0.00 0.00 0.00 35.03 34.01 3c4f n LYS 504 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3c4f n PRO 505 N 0.98 0.00 0.00 -1.58 -0.02 -1.26 -2.14 135.00 130.98 3c4f n PRO 505 Ca 0.18 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.67 3c4f n PRO 505 Cb 0.61 -1.14 0.01 0.00 -0.02 0.00 0.00 33.50 32.96 3c4f n PRO 505 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3c4f n ASN 506 N -0.64 1.11 -4.72 2.55 4.13 -1.26 -4.06 115.26 112.37 3c4f n ASN 506 Ca 0.00 -1.06 -0.42 0.00 1.68 0.00 0.00 54.58 54.79 3c4f n ASN 506 Cb 0.00 0.16 -0.03 0.00 -1.54 0.00 0.00 39.78 38.37 3c4f n ASN 506 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 3c4f s ARG 507 N -0.46 4.56 -0.21 3.52 6.06 -0.91 -4.91 118.95 126.60 3c4f s ARG 507 Ca 0.04 1.54 -0.09 0.00 -2.50 0.00 0.00 55.73 54.72 3c4f s ARG 507 Cb 0.03 -3.40 -0.04 0.00 0.06 0.00 0.00 34.95 31.60 3c4f s ARG 507 CO 0.06 -0.03 0.10 0.14 -2.50 0.00 0.00 175.30 173.06 3c4f s VAL 508 N 0.69 5.00 -0.16 7.11 -7.23 -1.26 -3.00 120.40 121.55 3c4f s VAL 508 Ca 0.52 0.05 -0.04 0.00 -1.81 0.00 0.00 61.98 60.70 3c4f s VAL 508 Cb -0.24 -3.29 -0.03 0.00 0.56 0.00 0.00 36.38 33.38 3c4f s VAL 508 CO 0.29 0.41 -0.03 -0.89 -0.31 0.00 0.00 175.10 174.58 3c4f s THR 509 N 0.67 3.90 0.02 5.32 2.01 -0.34 -4.91 115.64 122.31 3c4f s THR 509 Ca 0.05 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.40 3c4f s THR 509 Cb -0.13 -2.72 -0.05 0.00 0.01 0.00 0.00 72.50 69.61 3c4f s THR 509 CO 0.01 0.48 1.30 -0.54 -0.69 0.00 0.00 174.62 175.18 3c4f s LYS 510 N 0.49 4.35 0.22 4.92 1.02 -1.26 -1.47 119.74 128.01 3c4f s LYS 510 Ca -0.03 1.86 0.00 0.00 0.02 0.00 0.00 55.97 57.82 3c4f s LYS 510 Cb -0.14 -3.45 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 3c4f s LYS 510 CO 0.03 -0.43 0.13 0.14 -0.92 0.00 0.00 175.35 174.30 3c4f s VAL 511 N 1.77 0.11 0.00 3.17 -7.23 -0.12 -4.31 120.40 113.79 3c4f s VAL 511 Ca 0.61 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.81 3c4f s VAL 511 Cb -0.30 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 3c4f s VAL 511 CO 0.27 0.00 -0.09 0.00 -0.31 0.00 0.00 175.10 174.97 3c4f s ALA 512 N -4.02 2.92 -0.10 1.32 0.00 -0.43 -0.99 121.76 120.45 3c4f s ALA 512 Ca 0.39 -1.04 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 3c4f s ALA 512 Cb 0.07 -1.06 0.03 0.00 0.00 0.00 0.00 23.12 22.15 3c4f s ALA 512 CO 0.13 0.60 -0.06 0.08 0.00 0.00 0.00 175.76 176.52 3c4f s VAL 513 N -0.95 0.86 -0.13 0.00 1.01 -0.07 -0.58 120.40 120.54 3c4f s VAL 513 Ca 0.16 -0.19 -0.05 0.00 0.00 0.00 0.00 61.98 61.90 3c4f s VAL 513 Cb -0.11 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 3c4f s VAL 513 CO 0.06 0.34 0.06 -0.75 0.00 0.00 0.00 175.10 174.81 3c4f s LYS 514 N 1.76 3.45 0.19 2.72 2.20 -0.50 -1.35 119.74 128.20 3c4f s LYS 514 Ca 0.05 -0.31 -0.08 0.00 -0.36 0.00 0.00 55.97 55.26 3c4f s LYS 514 Cb -0.12 -3.04 -0.01 0.00 -1.51 0.00 0.00 37.83 33.14 3c4f s LYS 514 CO -0.07 0.57 0.29 0.00 -0.36 0.00 0.00 175.35 175.78 3c4f s MET 515 N -0.48 1.25 0.74 4.03 0.23 -0.84 -1.20 119.30 123.03 3c4f s MET 515 Ca 0.10 -1.28 -0.11 0.00 -1.03 0.00 0.00 55.69 53.37 3c4f s MET 515 Cb -0.12 0.38 0.04 0.00 -1.53 0.00 0.00 34.83 33.59 3c4f s MET 515 CO 0.02 -0.46 1.08 -0.51 -2.03 0.00 0.00 175.02 173.12 3c4f s LEU 516 N -3.02 3.09 0.53 0.18 1.43 -1.26 -4.24 118.68 115.39 3c4f s LEU 516 Ca 0.22 1.77 -0.06 0.00 -1.03 0.00 0.00 54.13 55.04 3c4f s LEU 516 Cb 0.03 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.71 3c4f s LEU 516 CO 0.04 -1.82 0.85 -0.54 0.23 0.00 0.00 176.35 175.11 3c4f s LYS 517 N -4.88 3.40 0.23 1.70 1.02 -1.26 -4.94 119.74 115.02 3c4f s LYS 517 Ca 0.61 0.23 -0.06 0.00 0.02 0.00 0.00 55.97 56.77 3c4f s LYS 517 Cb -0.16 -2.31 0.38 0.00 -0.52 0.00 0.00 37.83 35.22 3c4f s LYS 517 CO 0.54 -0.37 1.77 0.77 -0.92 0.00 0.00 175.35 177.14 3c4f h SER 518 N 0.05 0.43 -0.96 2.83 0.02 -2.04 -2.65 113.55 111.22 3c4f h SER 518 Ca -0.46 0.07 -0.51 0.00 -0.84 0.00 0.00 61.79 60.05 3c4f h SER 518 Cb 1.21 0.01 -0.20 0.00 0.14 0.00 0.00 62.40 63.56 3c4f h SER 518 CO 0.61 0.23 0.59 -0.67 -1.14 0.00 0.00 176.83 176.45 3c4f n ASP 519 N -4.89 6.87 -4.87 3.07 -0.08 -1.26 -4.95 116.55 110.43 3c4f n ASP 519 Ca 0.12 -3.36 -0.31 0.00 -1.51 0.00 0.00 54.79 49.73 3c4f n ASP 519 Cb 0.32 -1.10 -0.04 0.00 2.34 0.00 0.00 41.12 42.64 3c4f n ASP 519 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3c4f s ALA 520 N -2.50 3.45 0.55 -1.67 0.00 -1.00 -5.09 121.76 115.49 3c4f s ALA 520 Ca 0.49 -0.23 0.07 0.00 0.00 0.00 0.00 51.96 52.30 3c4f s ALA 520 Cb 0.37 -2.58 0.06 0.00 0.00 0.00 0.00 23.12 20.97 3c4f s ALA 520 CO -0.13 0.25 0.56 0.95 0.00 0.00 0.00 175.76 177.39 3c4f s THR 521 N -2.09 1.89 0.47 0.00 -4.23 -1.26 -4.99 115.64 105.44 3c4f s THR 521 Ca 0.50 -1.29 0.15 0.00 -1.18 0.00 0.00 61.69 59.87 3c4f s THR 521 Cb -0.11 -2.18 0.22 0.00 1.34 0.00 0.00 72.50 71.78 3c4f s THR 521 CO 0.25 0.00 2.05 -0.33 -0.54 0.00 0.00 174.62 176.05 3c4f h GLU 522 N 0.53 0.02 -0.05 3.99 4.39 -2.00 -2.25 114.58 119.22 3c4f h GLU 522 Ca -0.34 -0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.12 3c4f h GLU 522 Cb 1.30 -0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.95 3c4f h GLU 522 CO 0.50 0.12 -0.90 -0.22 -1.16 0.00 0.00 179.01 177.36 3c4f h LYS 523 N 0.02 0.59 -0.65 2.33 1.63 -1.99 -2.38 116.57 116.12 3c4f h LYS 523 Ca 0.00 -0.57 0.00 0.00 -0.85 0.00 0.00 60.65 59.24 3c4f h LYS 523 Cb 0.19 0.15 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 3c4f h LYS 523 CO 0.01 1.19 0.41 -0.44 -3.45 0.00 0.00 179.45 177.17 3c4f h ASP 524 N 0.36 0.76 -0.11 4.20 3.32 -1.80 -2.01 116.42 121.15 3c4f h ASP 524 Ca -0.08 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 3c4f h ASP 524 Cb 1.53 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.89 3c4f h ASP 524 CO 0.17 0.57 -0.06 0.25 -1.72 0.00 0.00 179.24 178.45 3c4f h LEU 525 N 0.89 0.24 -0.90 1.55 5.85 -1.42 -1.87 115.31 119.65 3c4f h LEU 525 Ca 0.24 -0.42 0.09 0.00 0.84 0.00 0.00 57.88 58.62 3c4f h LEU 525 Cb -0.07 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.82 3c4f h LEU 525 CO -0.05 0.61 0.55 0.28 -0.34 0.00 0.00 178.44 179.50 3c4f h SER 526 N -0.13 0.84 -0.04 1.25 0.02 -1.24 -0.81 113.55 113.44 3c4f h SER 526 Ca 0.02 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3c4f h SER 526 Cb 0.52 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 3c4f h SER 526 CO 0.02 0.50 0.02 0.44 -1.14 0.00 0.00 176.83 176.67 3c4f h ASP 527 N 0.96 0.05 -0.66 3.07 5.19 -1.30 0.16 116.42 123.88 3c4f h ASP 527 Ca 0.42 -0.09 -0.06 0.00 -0.62 0.00 0.00 57.03 56.68 3c4f h ASP 527 Cb 0.30 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 3c4f h ASP 527 CO -0.22 0.13 0.19 0.25 -3.12 0.00 0.00 179.24 176.48 3c4f h LEU 528 N -0.03 0.99 -0.27 1.55 5.85 -0.96 -0.29 115.31 122.15 3c4f h LEU 528 Ca 0.01 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3c4f h LEU 528 Cb 0.09 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 3c4f h LEU 528 CO -0.00 0.94 0.12 0.40 -0.34 0.00 0.00 178.44 179.55 3c4f h ILE 529 N 1.01 1.17 -0.37 4.05 2.04 -1.01 -1.91 117.51 122.49 3c4f h ILE 529 Ca 0.22 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.59 3c4f h ILE 529 Cb 0.32 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3c4f h ILE 529 CO -0.00 0.17 0.25 0.28 0.00 0.00 0.00 178.15 178.84 3c4f h SER 530 N 0.29 0.42 -0.24 1.72 0.02 -0.19 -0.38 113.55 115.20 3c4f h SER 530 Ca 0.09 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 3c4f h SER 530 Cb 0.16 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 3c4f h SER 530 CO -0.01 0.30 0.07 -0.08 -1.14 0.00 0.00 176.83 175.98 3c4f h GLU 531 N 0.50 0.37 -0.32 3.45 4.81 -0.71 -1.93 114.58 120.75 3c4f h GLU 531 Ca 0.14 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3c4f h GLU 531 Cb -0.04 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 3c4f h GLU 531 CO -0.03 0.45 0.06 1.98 -0.73 0.00 0.00 179.01 180.74 3c4f h MET 532 N 0.22 0.52 -0.24 1.92 4.05 -0.54 -2.32 114.93 118.52 3c4f h MET 532 Ca 0.08 -0.13 -0.06 0.00 -0.28 0.00 0.00 59.70 59.30 3c4f h MET 532 Cb 0.23 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.96 3c4f h MET 532 CO -0.00 0.60 -0.10 0.93 0.23 0.00 0.00 176.91 178.56 3c4f h GLU 533 N 0.35 0.39 -0.36 0.39 4.39 -1.07 -2.03 114.58 116.65 3c4f h GLU 533 Ca 0.10 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 3c4f h GLU 533 Cb 0.33 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3c4f h GLU 533 CO 0.00 0.51 0.06 1.98 -1.16 0.00 0.00 179.01 180.40 3c4f h MET 534 N 0.37 0.60 -0.55 2.33 4.05 -1.21 -2.21 114.93 118.32 3c4f h MET 534 Ca 0.07 -0.16 -0.04 0.00 -0.28 0.00 0.00 59.70 59.29 3c4f h MET 534 Cb 0.42 -0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.12 3c4f h MET 534 CO 0.02 0.67 0.18 0.52 0.23 0.00 0.00 176.91 178.53 3c4f h MET 535 N 0.43 0.81 -0.41 0.39 2.86 -0.90 -1.32 114.93 116.79 3c4f h MET 535 Ca 0.11 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3c4f h MET 535 Cb 0.36 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 3c4f h MET 535 CO 0.01 0.69 0.22 0.87 1.06 0.00 0.00 176.91 179.76 3c4f h LYS 536 N 0.79 0.58 -0.43 1.72 1.57 -1.24 -2.89 116.57 116.68 3c4f h LYS 536 Ca 0.18 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 3c4f h LYS 536 Cb 0.21 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3c4f h LYS 536 CO -0.01 0.48 -0.19 0.52 -0.57 0.00 0.00 179.45 179.67 3c4f h MET 537 N 0.53 0.83 -0.19 3.15 2.86 -0.90 -3.25 114.93 117.96 3c4f h MET 537 Ca 0.14 -0.33 -0.15 0.00 -2.06 0.00 0.00 59.70 57.31 3c4f h MET 537 Cb 0.07 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 3c4f h MET 537 CO -0.02 0.96 -0.50 0.82 1.06 0.00 0.00 176.91 179.23 3c4f h ILE 538 N 0.73 1.32 0.00 -1.22 2.04 -1.25 -3.50 117.51 115.64 3c4f h ILE 538 Ca 0.11 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.25 3c4f h ILE 538 Cb 0.71 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 38.50 3c4f h ILE 538 CO 0.05 0.53 0.00 0.61 0.00 0.00 0.00 178.15 179.35 3c4f n GLY 539 N 0.14 -2.36 3.85 5.37 0.00 -1.09 -4.96 105.19 106.13 3c4f n GLY 539 Ca -0.03 -1.64 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 3c4f n GLY 539 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c4f s LYS 540 N -0.43 3.98 -0.26 1.61 1.02 -1.26 -4.95 119.74 119.44 3c4f s LYS 540 Ca 0.00 0.50 -0.20 0.00 0.02 0.00 0.00 55.97 56.29 3c4f s LYS 540 Cb 0.00 -2.85 0.07 0.00 -0.52 0.00 0.00 37.83 34.53 3c4f s LYS 540 CO 0.00 0.43 0.67 -1.58 -0.92 0.00 0.00 175.35 173.95 3c4f s HIS 541 N -1.55 -0.87 0.61 3.18 2.46 -1.26 -5.05 115.29 112.80 3c4f s HIS 541 Ca 0.41 1.93 0.29 0.00 0.47 0.00 0.00 55.06 58.16 3c4f s HIS 541 Cb -0.14 0.41 1.59 0.00 -0.13 0.00 0.00 32.58 34.31 3c4f s HIS 541 CO 0.20 -0.43 1.98 -0.22 -2.47 0.00 0.00 174.74 173.79 3c4f h LYS 542 N 5.94 0.00 -0.46 2.88 3.64 -1.98 -2.27 116.57 124.32 3c4f h LYS 542 Ca -0.30 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 58.93 3c4f h LYS 542 Cb 1.19 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.92 3c4f h LYS 542 CO 0.12 0.00 0.09 0.09 -2.27 0.00 0.00 179.45 177.47 3c4f n ASN 543 N -3.55 3.56 -4.24 4.20 5.03 -1.26 -4.78 115.26 114.23 3c4f n ASN 543 Ca 0.04 -3.39 -0.15 0.00 0.87 0.00 0.00 54.58 51.95 3c4f n ASN 543 Cb 0.48 -0.65 -0.10 0.00 -1.02 0.00 0.00 39.78 38.49 3c4f n ASN 543 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3c4f s ILE 544 N -3.06 1.17 -0.28 2.41 -4.36 -0.86 -1.78 121.20 114.44 3c4f s ILE 544 Ca 0.47 -1.97 -0.29 0.00 -0.26 0.00 0.00 60.65 58.60 3c4f s ILE 544 Cb 0.40 -1.75 -0.00 0.00 1.25 0.00 0.00 42.46 42.36 3c4f s ILE 544 CO 0.07 -0.68 1.30 -0.63 0.24 0.00 0.00 174.94 175.23 3c4f s ILE 545 N -3.06 4.16 0.23 8.37 -1.09 -0.29 -4.71 121.20 124.81 3c4f s ILE 545 Ca 0.14 1.33 -0.11 0.00 -2.23 0.00 0.00 60.65 59.78 3c4f s ILE 545 Cb 0.01 -4.13 -0.07 0.00 -1.58 0.00 0.00 42.46 36.68 3c4f s ILE 545 CO 0.01 -0.42 0.58 0.20 -1.23 0.00 0.00 174.94 174.08 3c4f s ASN 546 N 2.66 6.69 0.03 3.58 0.01 -1.26 -4.87 114.94 121.79 3c4f s ASN 546 Ca 0.56 1.02 -0.30 0.00 -0.71 0.00 0.00 52.86 53.42 3c4f s ASN 546 Cb -0.17 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 3c4f s ASN 546 CO 0.22 -0.06 1.07 -0.22 -1.51 0.00 0.00 177.10 176.59 3c4f s LEU 547 N -2.68 4.38 -0.01 0.60 2.96 -1.26 -1.81 118.68 120.85 3c4f s LEU 547 Ca 0.47 1.82 0.08 0.00 -0.22 0.00 0.00 54.13 56.28 3c4f s LEU 547 Cb -0.12 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.88 3c4f s LEU 547 CO 0.20 -0.33 0.21 0.18 -1.32 0.00 0.00 176.35 175.29 3c4f n LEU 548 N 3.81 0.07 0.00 -0.68 4.77 -0.07 -4.96 117.00 119.94 3c4f n LEU 548 Ca 0.07 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3c4f n LEU 548 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3c4f n LEU 548 CO 0.53 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3c4f n GLY 549 N 1.87 -1.95 3.58 -0.72 0.00 -1.07 -4.99 105.19 101.92 3c4f n GLY 549 Ca -0.01 -1.16 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 3c4f n GLY 549 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c4f s ALA 550 N -1.66 -1.79 -0.38 4.61 0.00 -0.64 -0.83 121.76 121.07 3c4f s ALA 550 Ca 0.00 1.71 -0.09 0.00 0.00 0.00 0.00 51.96 53.58 3c4f s ALA 550 Cb 0.00 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.49 3c4f s ALA 550 CO 0.00 -0.35 0.19 0.00 0.00 0.00 0.00 175.76 175.61 3c4f n THR 552 N 4.91 0.00 -4.01 0.00 -2.24 -1.26 -1.07 114.28 110.62 3c4f n THR 552 Ca -0.11 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.13 3c4f n THR 552 Cb 0.45 0.54 -0.06 0.00 -2.10 0.00 0.00 70.33 69.16 3c4f n THR 552 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3c4f s GLN 553 N -2.21 3.23 -1.38 -0.78 -1.52 -1.26 -4.54 119.66 111.20 3c4f s GLN 553 Ca -0.01 -0.41 -0.01 0.00 -1.95 0.00 0.00 55.36 52.98 3c4f s GLN 553 Cb 0.04 -2.97 -0.00 0.00 -0.22 0.00 0.00 33.01 29.87 3c4f s GLN 553 CO 0.27 0.66 0.46 -0.25 -0.25 0.00 0.00 175.29 176.19 3c4f n ASP 554 N 1.06 -0.54 0.00 5.90 10.43 -1.26 -4.83 116.55 127.32 3c4f n ASP 554 Ca -0.12 -0.98 0.00 0.00 2.57 0.00 0.00 54.79 56.26 3c4f n ASP 554 Cb 0.53 -3.21 0.00 0.00 1.84 0.00 0.00 41.12 40.28 3c4f n ASP 554 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3c4f n GLY 555 N -1.92 -1.77 3.75 0.44 0.00 -1.26 -5.11 105.19 99.32 3c4f n GLY 555 Ca -0.31 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 43.85 3c4f n GLY 555 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3c4f s PRO 556 N -1.73 3.07 -0.04 1.61 0.04 -1.26 -4.86 135.00 131.83 3c4f s PRO 556 Ca 0.00 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 3c4f s PRO 556 Cb 0.00 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 3c4f s PRO 556 CO 0.00 -1.14 1.31 -1.17 0.04 0.00 0.00 177.00 176.04 3c4f s LEU 557 N -3.90 4.29 -0.16 -3.56 2.96 -1.26 -4.70 118.68 112.34 3c4f s LEU 557 Ca 0.75 1.95 -0.00 0.00 -0.22 0.00 0.00 54.13 56.61 3c4f s LEU 557 Cb -0.31 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 42.82 3c4f s LEU 557 CO 0.35 -0.67 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.26 3c4f s TYR 558 N 2.47 2.81 -0.33 5.38 2.02 -0.23 -4.32 117.35 125.16 3c4f s TYR 558 Ca 0.60 -0.99 -0.09 0.00 -0.37 0.00 0.00 57.07 56.21 3c4f s TYR 558 Cb -0.28 -1.92 0.01 0.00 -0.40 0.00 0.00 41.96 39.38 3c4f s TYR 558 CO 0.23 -0.46 0.15 0.08 -1.57 0.00 0.00 175.55 173.99 3c4f s VAL 559 N 0.87 4.41 -0.35 0.71 1.01 -0.34 -1.27 120.40 125.44 3c4f s VAL 559 Ca -0.04 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.09 3c4f s VAL 559 Cb -0.15 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 3c4f s VAL 559 CO -0.00 -0.06 0.44 -0.63 0.00 0.00 0.00 175.10 174.85 3c4f s ILE 560 N 1.56 5.09 0.44 2.22 1.01 -0.01 -1.41 121.20 130.09 3c4f s ILE 560 Ca 0.03 0.21 0.05 0.00 0.00 0.00 0.00 60.65 60.94 3c4f s ILE 560 Cb -0.18 -3.90 -0.06 0.00 0.01 0.00 0.00 42.46 38.33 3c4f s ILE 560 CO 0.05 -0.16 0.01 0.68 0.00 0.00 0.00 174.94 175.52 3c4f s VAL 561 N 2.22 1.70 0.39 2.92 -7.23 0.25 -0.90 120.40 119.75 3c4f s VAL 561 Ca 0.16 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.05 3c4f s VAL 561 Cb -0.16 -2.72 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 3c4f s VAL 561 CO 0.12 0.00 1.45 -1.61 -0.31 0.00 0.00 175.10 174.76 3c4f s GLU 562 N -3.77 4.04 -0.00 4.82 2.02 -0.75 -1.32 118.70 123.73 3c4f s GLU 562 Ca 0.25 2.50 -0.15 0.00 0.02 0.00 0.00 54.97 57.59 3c4f s GLU 562 Cb 0.07 -2.91 -0.06 0.00 0.10 0.00 0.00 34.13 31.34 3c4f s GLU 562 CO 0.13 -0.56 0.42 -0.47 0.02 0.00 0.00 175.26 174.79 3c4f s TYR 563 N -1.14 3.72 -0.44 1.61 5.04 -1.26 -4.44 117.35 120.44 3c4f s TYR 563 Ca 0.54 1.00 0.04 0.00 -2.44 0.00 0.00 57.07 56.21 3c4f s TYR 563 Cb -0.45 -2.31 0.12 0.00 0.35 0.00 0.00 41.96 39.66 3c4f s TYR 563 CO 0.61 0.61 0.17 0.00 -1.34 0.00 0.00 175.55 175.60 3c4f s ALA 564 N -0.98 3.03 0.13 3.97 0.00 -1.26 -4.80 121.76 121.85 3c4f s ALA 564 Ca 0.24 -2.89 0.33 0.00 0.00 0.00 0.00 51.96 49.64 3c4f s ALA 564 Cb -0.17 -2.05 1.63 0.00 0.00 0.00 0.00 23.12 22.53 3c4f s ALA 564 CO 0.13 -1.88 2.00 0.66 0.00 0.00 0.00 175.76 176.68 3c4f h SER 565 N 7.01 0.00 -0.65 0.00 4.64 -1.85 -3.00 113.55 119.70 3c4f h SER 565 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3c4f h SER 565 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3c4f h SER 565 CO 0.60 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.85 3c4f n LYS 566 N -2.76 3.83 0.00 4.77 5.02 -0.67 -4.95 118.16 123.41 3c4f n LYS 566 Ca -0.01 -2.88 0.00 0.00 -2.02 0.00 0.00 58.31 53.40 3c4f n LYS 566 Cb 0.15 -1.93 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 3c4f n LYS 566 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3c4f n GLY 567 N 1.11 -1.30 3.83 0.72 0.00 -1.14 -4.48 105.19 103.94 3c4f n GLY 567 Ca 0.26 -1.23 -0.30 0.00 0.00 0.00 0.00 46.02 44.75 3c4f n GLY 567 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c4f s ASN 568 N -4.00 5.12 0.35 1.61 2.20 -1.26 -1.40 114.94 117.56 3c4f s ASN 568 Ca 0.00 1.37 0.12 0.00 -0.94 0.00 0.00 52.86 53.41 3c4f s ASN 568 Cb 0.00 -2.19 0.63 0.00 -2.00 0.00 0.00 41.25 37.69 3c4f s ASN 568 CO 0.00 -1.58 1.78 0.25 -2.94 0.00 0.00 177.10 174.61 3c4f h LEU 569 N -0.81 0.01 0.46 3.54 5.85 -0.46 -1.89 115.31 122.01 3c4f h LEU 569 Ca -0.45 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.24 3c4f h LEU 569 Cb 1.24 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.27 3c4f h LEU 569 CO 0.60 0.44 -0.22 -0.09 -0.34 0.00 0.00 178.44 178.82 3c4f h ARG 570 N 0.01 -0.59 -0.88 1.25 2.43 -1.85 -0.90 114.38 113.85 3c4f h ARG 570 Ca -0.00 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3c4f h ARG 570 Cb 0.76 0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.40 3c4f h ARG 570 CO 0.06 -0.37 0.58 0.93 -1.51 0.00 0.00 179.97 179.65 3c4f h GLU 571 N -0.65 1.16 -0.29 0.20 5.08 -1.89 -1.57 114.58 116.62 3c4f h GLU 571 Ca -0.06 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3c4f h GLU 571 Cb 0.49 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3c4f h GLU 571 CO 0.10 0.77 0.18 -0.92 -1.00 0.00 0.00 179.01 178.14 3c4f h TYR 572 N 1.20 0.38 -0.16 4.33 5.03 -1.20 -1.05 116.97 125.49 3c4f h TYR 572 Ca 0.32 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.58 3c4f h TYR 572 Cb -0.13 -0.12 -0.00 0.00 1.55 0.00 0.00 36.73 38.02 3c4f h TYR 572 CO -0.01 0.27 -0.11 -0.07 -1.32 0.00 0.00 178.16 176.92 3c4f h LEU 573 N 0.37 0.37 -0.73 2.82 3.38 -1.04 -3.08 115.31 117.41 3c4f h LEU 573 Ca 0.10 -0.44 0.07 0.00 0.09 0.00 0.00 57.88 57.70 3c4f h LEU 573 Cb 0.00 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 3c4f h LEU 573 CO -0.02 0.74 0.41 1.56 0.09 0.00 0.00 178.44 181.21 3c4f h GLN 574 N 0.01 0.71 0.00 1.13 4.20 -1.20 0.36 115.11 120.33 3c4f h GLN 574 Ca 0.03 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.70 3c4f h GLN 574 Cb 0.61 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.23 3c4f h GLN 574 CO 0.03 0.47 0.00 0.00 -0.67 0.00 0.00 178.83 178.66 3c4f n ALA 575 N -2.36 1.84 -1.18 3.87 0.00 -0.41 -2.92 120.51 119.35 3c4f n ALA 575 Ca 0.10 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.53 3c4f n ALA 575 Cb 0.20 -1.29 0.22 0.00 0.00 0.00 0.00 19.45 18.58 3c4f n ALA 575 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3c4f n ARG 576 N -1.45 2.20 -2.61 0.00 1.74 0.10 -2.58 116.66 114.05 3c4f n ARG 576 Ca 0.05 -2.91 -0.34 0.00 -0.77 0.00 0.00 57.85 53.88 3c4f n ARG 576 Cb 0.19 -1.76 -0.04 0.00 -1.02 0.00 0.00 32.46 29.83 3c4f n ARG 576 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3c4f s ARG 577 N -2.98 3.92 0.93 5.56 0.52 -1.13 -4.34 118.95 121.42 3c4f s ARG 577 Ca 0.41 1.28 -0.12 0.00 -0.52 0.00 0.00 55.73 56.78 3c4f s ARG 577 Cb 0.35 -2.12 0.15 0.00 0.52 0.00 0.00 34.95 33.85 3c4f s ARG 577 CO 0.04 -0.32 1.10 -1.25 0.02 0.00 0.00 175.30 174.89 3c4f s PRO 578 N -3.24 0.97 0.00 3.54 0.04 -1.26 -5.02 135.00 130.03 3c4f s PRO 578 Ca 0.66 0.64 0.00 0.00 0.04 0.00 0.00 61.00 62.33 3c4f s PRO 578 Cb -0.14 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3c4f s PRO 578 CO 0.18 -2.39 0.16 -2.30 0.04 0.00 0.00 177.00 172.69 3c4f n PRO 579 N -3.96 0.00 -0.10 0.56 -0.02 -1.26 -5.21 135.00 125.01 3c4f n PRO 579 Ca 0.06 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.37 3c4f n PRO 579 Cb 0.56 -0.49 -0.08 0.00 -0.02 0.00 0.00 33.50 33.47 3c4f n PRO 579 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3c4f n GLU 592 N 1.55 0.46 -1.68 -0.52 0.00 -1.07 -5.32 120.64 114.05 3c4f n GLU 592 Ca 0.00 0.14 -0.50 0.00 0.00 0.00 0.00 57.16 56.80 3c4f n GLU 592 Cb 0.08 -1.31 -0.05 0.00 0.00 0.00 0.00 31.44 30.15 3c4f n GLU 592 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3c4f n GLU 593 N -3.41 1.87 -3.08 5.31 0.28 -1.26 -4.83 120.64 115.52 3c4f n GLU 593 Ca -0.36 0.69 -0.39 0.00 -0.16 0.00 0.00 57.16 56.93 3c4f n GLU 593 Cb 0.83 -2.47 -0.05 0.00 1.43 0.00 0.00 31.44 31.17 3c4f n GLU 593 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 3c4f s GLN 594 N 3.29 4.42 0.15 3.44 -0.21 -1.26 -4.74 119.66 124.76 3c4f s GLN 594 Ca 0.92 0.95 -0.21 0.00 0.02 0.00 0.00 55.36 57.04 3c4f s GLN 594 Cb -0.79 -3.33 -0.08 0.00 1.00 0.00 0.00 33.01 29.81 3c4f s GLN 594 CO 0.53 0.40 0.68 -0.51 -2.12 0.00 0.00 175.29 174.26 3c4f s LEU 595 N -0.40 4.48 0.00 2.90 1.43 -1.26 -5.08 118.68 120.75 3c4f s LEU 595 Ca 0.35 1.42 -0.06 0.00 -1.03 0.00 0.00 54.13 54.81 3c4f s LEU 595 Cb -0.20 -3.26 0.15 0.00 0.03 0.00 0.00 46.19 42.90 3c4f s LEU 595 CO 0.21 0.17 0.93 -1.54 0.23 0.00 0.00 176.35 176.35 3c4f n SER 596 N 1.31 0.68 -0.07 2.29 3.41 -1.26 -4.94 113.62 115.04 3c4f n SER 596 Ca -0.06 -1.71 -0.09 0.00 -0.26 0.00 0.00 58.87 56.75 3c4f n SER 596 Cb 0.50 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 63.86 3c4f n SER 596 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3c4f h SER 597 N -0.88 0.80 -0.10 4.04 0.02 -1.84 -2.88 113.55 112.71 3c4f h SER 597 Ca -0.30 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.30 3c4f h SER 597 Cb 0.98 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 63.30 3c4f h SER 597 CO 0.27 1.06 0.02 0.50 -1.14 0.00 0.00 176.83 177.54 3c4f h LYS 598 N 0.64 0.17 -0.66 3.45 3.64 -1.86 -2.58 116.57 119.38 3c4f h LYS 598 Ca 0.07 -0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.53 3c4f h LYS 598 Cb 0.86 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 32.57 3c4f h LYS 598 CO 0.08 0.37 0.14 -0.44 -2.27 0.00 0.00 179.45 177.33 3c4f h ASP 599 N -0.06 -0.01 -0.30 4.20 3.32 -1.91 0.27 116.42 121.93 3c4f h ASP 599 Ca 0.03 0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 3c4f h ASP 599 Cb 0.29 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 3c4f h ASP 599 CO 0.00 -0.01 0.06 -0.07 -1.72 0.00 0.00 179.24 177.49 3c4f h LEU 600 N 0.26 0.48 -0.76 1.55 3.38 -1.41 0.49 115.31 119.30 3c4f h LEU 600 Ca 0.36 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.98 3c4f h LEU 600 Cb 0.57 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3c4f h LEU 600 CO -0.45 0.61 -0.10 0.58 0.09 0.00 0.00 178.44 179.16 3c4f h VAL 601 N 0.33 1.26 -0.56 1.22 2.07 -1.05 -2.53 116.25 116.99 3c4f h VAL 601 Ca 0.09 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.39 3c4f h VAL 601 Cb 0.33 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3c4f h VAL 601 CO 0.00 0.41 0.16 -1.28 0.02 0.00 0.00 177.57 176.88 3c4f h SER 602 N 0.77 0.78 -0.65 0.57 0.87 -0.18 0.23 113.55 115.94 3c4f h SER 602 Ca 0.13 -0.13 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 3c4f h SER 602 Cb 0.60 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 3c4f h SER 602 CO 0.04 0.75 0.11 0.00 -0.53 0.00 0.00 176.83 177.19 3c4f h ALA 604 N 1.09 1.14 -0.40 0.00 0.00 -0.92 -2.46 119.26 117.72 3c4f h ALA 604 Ca 0.20 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 3c4f h ALA 604 Cb 0.43 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3c4f h ALA 604 CO 0.01 0.55 0.07 -0.92 0.00 0.00 0.00 179.25 178.96 3c4f h TYR 605 N 0.34 0.70 -0.60 0.00 3.20 -0.54 -1.96 116.97 118.10 3c4f h TYR 605 Ca 0.05 -0.10 -0.10 0.00 3.14 0.00 0.00 58.73 61.72 3c4f h TYR 605 Cb 0.68 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 3c4f h TYR 605 CO 0.02 0.69 -0.02 1.96 -1.64 0.00 0.00 178.16 179.16 3c4f h GLN 606 N 0.51 1.07 -0.15 1.82 4.20 -1.11 -2.04 115.11 119.41 3c4f h GLN 606 Ca 0.12 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.46 3c4f h GLN 606 Cb 0.36 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 3c4f h GLN 606 CO 0.01 1.05 0.02 0.28 -0.67 0.00 0.00 178.83 179.52 3c4f h VAL 607 N 0.97 1.22 -0.19 -0.54 2.07 -1.37 -1.93 116.25 116.48 3c4f h VAL 607 Ca 0.17 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3c4f h VAL 607 Cb 0.58 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 3c4f h VAL 607 CO 0.03 0.21 -0.06 0.00 0.02 0.00 0.00 177.57 177.77 3c4f h ALA 608 N 0.80 1.54 -0.48 1.67 0.00 -1.30 -1.27 119.26 120.23 3c4f h ALA 608 Ca 0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3c4f h ALA 608 Cb 0.30 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3c4f h ALA 608 CO 0.00 0.33 0.16 0.00 0.00 0.00 0.00 179.25 179.74 3c4f h ARG 609 N 0.28 0.74 -0.47 0.00 3.08 -1.20 0.21 114.38 117.03 3c4f h ARG 609 Ca 0.06 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 3c4f h ARG 609 Cb 0.30 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3c4f h ARG 609 CO 0.01 0.69 0.01 0.78 -1.07 0.00 0.00 179.97 180.39 3c4f h GLY 610 N 0.64 0.82 1.84 0.04 0.00 -0.83 -1.13 103.07 104.45 3c4f h GLY 610 Ca 0.16 -0.53 -0.19 0.00 0.00 0.00 0.00 47.33 46.76 3c4f h GLY 610 CO -0.01 0.49 -0.86 -0.33 0.00 0.00 0.00 176.54 175.83 3c4f h MET 611 N 0.71 0.14 -0.34 4.80 2.86 -1.01 -1.30 114.93 120.79 3c4f h MET 611 Ca 0.14 -0.16 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 3c4f h MET 611 Cb 0.42 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 3c4f h MET 611 CO 0.02 0.92 -0.06 1.49 1.06 0.00 0.00 176.91 180.33 3c4f h GLU 612 N 0.08 0.64 0.38 1.72 4.81 -0.32 -0.31 114.58 121.58 3c4f h GLU 612 Ca -0.03 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 3c4f h GLU 612 Cb 1.49 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.83 3c4f h GLU 612 CO 0.13 0.80 -0.24 -0.92 -0.73 0.00 0.00 179.01 178.05 3c4f h TYR 613 N 0.44 -0.62 -0.32 0.92 3.20 -1.12 -1.43 116.97 118.04 3c4f h TYR 613 Ca 0.09 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.99 3c4f h TYR 613 Cb 0.55 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 39.00 3c4f h TYR 613 CO 0.05 -0.36 0.10 -0.07 -1.64 0.00 0.00 178.16 176.23 3c4f h LEU 614 N -0.59 0.10 -1.09 2.82 3.38 -1.15 -1.60 115.31 117.18 3c4f h LEU 614 Ca -0.04 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.05 3c4f h LEU 614 Cb 0.49 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 3c4f h LEU 614 CO 0.04 0.09 0.62 0.00 0.09 0.00 0.00 178.44 179.28 3c4f h ALA 615 N 1.21 1.51 0.00 1.53 0.00 -1.01 -0.02 119.26 122.48 3c4f h ALA 615 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3c4f h ALA 615 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3c4f h ALA 615 CO -0.16 0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.27 3c4f n SER 616 N -4.53 0.74 -1.64 0.00 3.41 -0.54 -1.68 113.62 109.37 3c4f n SER 616 Ca 0.16 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 3c4f n SER 616 Cb 0.26 -0.82 0.30 0.00 -0.26 0.00 0.00 64.21 63.69 3c4f n SER 616 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3c4f n LYS 617 N -2.29 3.58 -1.29 4.33 4.76 -0.40 -4.96 118.16 121.90 3c4f n LYS 617 Ca 0.03 -3.06 -0.10 0.00 -2.87 0.00 0.00 58.31 52.31 3c4f n LYS 617 Cb 0.27 -2.10 -0.04 0.00 -1.84 0.00 0.00 35.03 31.31 3c4f n LYS 617 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3c4f n LYS 618 N -0.19 -1.38 -3.31 1.97 4.01 -0.68 -4.93 118.16 113.66 3c4f n LYS 618 Ca 0.33 0.81 -0.39 0.00 -0.51 0.00 0.00 58.31 58.56 3c4f n LYS 618 Cb 1.21 -5.04 -0.07 0.00 -0.51 0.00 0.00 35.03 30.61 3c4f n LYS 618 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3c4f s ILE 620 N 1.67 4.90 -0.02 0.00 1.01 -1.26 -3.68 121.20 123.82 3c4f s ILE 620 Ca 0.21 0.02 -0.23 0.00 0.00 0.00 0.00 60.65 60.65 3c4f s ILE 620 Cb -0.15 -3.29 -0.16 0.00 0.01 0.00 0.00 42.46 38.87 3c4f s ILE 620 CO 0.09 0.34 1.07 -0.74 0.00 0.00 0.00 174.94 175.70 3c4f h HIS 621 N 7.81 -0.26 0.00 3.97 -0.00 -1.90 -3.48 115.15 121.29 3c4f h HIS 621 Ca -0.37 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 3c4f h HIS 621 Cb 1.18 0.09 0.00 0.00 -0.00 0.00 0.00 27.41 28.67 3c4f h HIS 621 CO 0.67 0.13 0.00 0.54 -0.00 0.00 0.00 177.93 179.27 3c4f n ARG 622 N -5.01 0.00 -2.49 5.26 1.74 -1.26 -4.75 116.66 110.15 3c4f n ARG 622 Ca -0.09 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.78 3c4f n ARG 622 Cb 0.26 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.71 3c4f n ARG 622 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3c4f n ASP 623 N 1.05 3.84 -4.69 0.55 2.03 -1.26 -4.93 116.55 113.14 3c4f n ASP 623 Ca 0.00 -3.42 -0.42 0.00 0.52 0.00 0.00 54.79 51.47 3c4f n ASP 623 Cb 0.00 -0.47 -0.03 0.00 -0.72 0.00 0.00 41.12 39.91 3c4f n ASP 623 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3c4f s LEU 624 N -3.46 4.33 0.15 -2.67 2.96 -1.26 -4.76 118.68 113.98 3c4f s LEU 624 Ca 0.43 2.27 -0.24 0.00 -0.22 0.00 0.00 54.13 56.36 3c4f s LEU 624 Cb 0.41 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.61 3c4f s LEU 624 CO -0.11 -0.79 0.77 0.00 -1.32 0.00 0.00 176.35 174.90 3c4f s ALA 625 N 2.55 -1.57 0.50 5.97 0.00 -1.26 -4.71 121.76 123.24 3c4f s ALA 625 Ca 0.68 0.34 0.15 0.00 0.00 0.00 0.00 51.96 53.13 3c4f s ALA 625 Cb -0.35 0.72 1.21 0.00 0.00 0.00 0.00 23.12 24.70 3c4f s ALA 625 CO 0.29 -0.87 2.13 0.00 0.00 0.00 0.00 175.76 177.30 3c4f h ALA 626 N 2.00 1.98 0.00 0.00 0.00 -1.92 -0.98 119.26 120.34 3c4f h ALA 626 Ca -0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3c4f h ALA 626 Cb 1.26 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 3c4f h ALA 626 CO 0.30 0.01 -0.09 0.07 0.00 0.00 0.00 179.25 179.55 3c4f h ARG 627 N 0.09 0.00 -0.77 0.00 0.11 -1.95 -2.77 114.38 109.09 3c4f h ARG 627 Ca 0.04 0.00 -0.35 0.00 0.10 0.00 0.00 59.98 59.77 3c4f h ARG 627 Cb 0.04 0.00 -0.21 0.00 1.11 0.00 0.00 29.97 30.91 3c4f h ARG 627 CO -0.01 0.09 0.38 0.09 0.10 0.00 0.00 179.97 180.62 3c4f n ASN 628 N -4.08 3.73 -3.93 0.08 3.02 -0.37 -4.79 115.26 108.92 3c4f n ASN 628 Ca -0.03 -3.53 -0.27 0.00 -0.03 0.00 0.00 54.58 50.72 3c4f n ASN 628 Cb 0.17 -0.76 -0.17 0.00 -0.61 0.00 0.00 39.78 38.41 3c4f n ASN 628 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3c4f s VAL 629 N -3.20 1.13 0.19 2.41 1.01 -1.07 -0.57 120.40 120.30 3c4f s VAL 629 Ca 0.53 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 62.19 3c4f s VAL 629 Cb 0.45 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 3c4f s VAL 629 CO 0.09 0.39 0.32 -0.76 0.00 0.00 0.00 175.10 175.14 3c4f s LEU 630 N 1.66 4.32 -0.13 3.92 1.43 0.70 -0.38 118.68 130.21 3c4f s LEU 630 Ca 0.05 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 3c4f s LEU 630 Cb -0.13 -2.90 0.02 0.00 0.03 0.00 0.00 46.19 43.21 3c4f s LEU 630 CO -0.09 -0.01 -0.14 -0.69 0.23 0.00 0.00 176.35 175.66 3c4f s VAL 631 N -1.85 1.47 1.03 -1.59 1.01 -0.49 -0.71 120.40 119.26 3c4f s VAL 631 Ca 0.34 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 3c4f s VAL 631 Cb -0.10 -1.37 0.24 0.00 0.00 0.00 0.00 36.38 35.15 3c4f s VAL 631 CO 0.29 0.44 1.28 0.35 0.00 0.00 0.00 175.10 177.45 3c4f n THR 632 N 4.56 0.00 -0.22 3.92 -2.24 -0.87 -1.66 114.28 117.76 3c4f n THR 632 Ca -0.17 -0.87 -0.01 0.00 -2.27 0.00 0.00 64.05 60.73 3c4f n THR 632 Cb 0.50 -1.45 0.21 0.00 -2.10 0.00 0.00 70.33 67.49 3c4f n THR 632 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3c4f h GLU 633 N 0.00 1.00 -0.84 -0.78 4.57 -1.91 -1.97 114.58 114.64 3c4f h GLU 633 Ca -0.43 -0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 57.64 3c4f h GLU 633 Cb 1.20 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 29.56 3c4f h GLU 633 CO 0.30 0.71 0.03 -0.25 -1.18 0.00 0.00 179.01 178.62 3c4f n ASP 634 N -4.38 3.03 -2.27 1.04 8.00 -1.26 -4.89 116.55 115.82 3c4f n ASP 634 Ca 0.08 -2.42 -0.19 0.00 0.71 0.00 0.00 54.79 52.96 3c4f n ASP 634 Cb 0.08 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 3c4f n ASP 634 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3c4f n ASN 635 N 0.21 -5.44 -4.72 -2.24 3.02 -0.74 -4.99 115.26 100.36 3c4f n ASN 635 Ca 0.13 -0.08 -0.38 0.00 -0.03 0.00 0.00 54.58 54.22 3c4f n ASN 635 Cb 0.69 -4.44 -0.06 0.00 -0.61 0.00 0.00 39.78 35.35 3c4f n ASN 635 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3c4f s VAL 636 N -2.97 5.18 0.09 2.41 1.01 -1.26 -4.84 120.40 120.03 3c4f s VAL 636 Ca 0.07 0.98 -0.29 0.00 0.00 0.00 0.00 61.98 62.73 3c4f s VAL 636 Cb -0.03 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 3c4f s VAL 636 CO 0.09 0.32 0.93 -0.04 0.00 0.00 0.00 175.10 176.40 3c4f s MET 637 N 0.63 4.66 -0.04 2.72 -1.94 -1.26 -2.05 119.30 122.02 3c4f s MET 637 Ca 0.27 1.39 -0.02 0.00 -1.71 0.00 0.00 55.69 55.62 3c4f s MET 637 Cb -0.15 -3.38 0.03 0.00 2.01 0.00 0.00 34.83 33.34 3c4f s MET 637 CO 0.11 0.21 0.05 0.15 -0.01 0.00 0.00 175.02 175.53 3c4f s LYS 638 N 0.05 -0.03 0.17 2.03 1.02 0.11 -4.26 119.74 118.83 3c4f s LYS 638 Ca 0.46 0.35 -0.30 0.00 0.02 0.00 0.00 55.97 56.49 3c4f s LYS 638 Cb -0.23 -0.53 -0.08 0.00 -0.52 0.00 0.00 37.83 36.47 3c4f s LYS 638 CO 0.29 -0.32 1.34 0.42 -0.92 0.00 0.00 175.35 176.16 3c4f s ILE 639 N 2.08 3.22 0.29 2.17 1.01 -0.74 -0.21 121.20 129.01 3c4f s ILE 639 Ca 0.04 0.96 0.10 0.00 0.00 0.00 0.00 60.65 61.75 3c4f s ILE 639 Cb -0.12 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 3c4f s ILE 639 CO -0.03 0.12 -0.00 0.00 0.00 0.00 0.00 174.94 175.03 3c4f s ALA 640 N 0.42 3.17 -1.41 9.38 0.00 0.27 -1.14 121.76 132.44 3c4f s ALA 640 Ca 0.59 -1.73 -0.07 0.00 0.00 0.00 0.00 51.96 50.75 3c4f s ALA 640 Cb -0.37 -0.67 0.04 0.00 0.00 0.00 0.00 23.12 22.12 3c4f s ALA 640 CO 0.36 0.22 0.87 -0.25 0.00 0.00 0.00 175.76 176.96 3c4f n ASP 641 N -0.91 -3.22 0.05 0.00 9.92 -1.26 -4.81 116.55 116.32 3c4f n ASP 641 Ca -0.06 -0.78 0.12 0.00 -0.53 0.00 0.00 54.79 53.55 3c4f n ASP 641 Cb 0.60 -4.07 0.17 0.00 -0.64 0.00 0.00 41.12 37.17 3c4f n ASP 641 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55 3c4f n PHE 642 N -4.51 0.47 -1.23 1.24 1.16 -1.26 -4.17 117.46 109.16 3c4f n PHE 642 Ca -0.12 0.14 0.05 0.00 -1.87 0.00 0.00 57.45 55.64 3c4f n PHE 642 Cb 0.60 -0.60 0.21 0.00 -1.61 0.00 0.00 39.48 38.08 3c4f n PHE 642 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3c4f n GLY 643 N 1.36 4.65 3.75 4.97 0.00 -1.26 -4.69 105.19 113.98 3c4f n GLY 643 Ca 0.03 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 3c4f n GLY 643 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3c4f s LEU 644 N -3.02 3.75 -0.91 0.99 1.02 -1.26 -4.21 118.68 115.04 3c4f s LEU 644 Ca 0.40 2.46 -0.00 0.00 0.02 0.00 0.00 54.13 57.01 3c4f s LEU 644 Cb 0.35 -4.48 0.29 0.00 0.02 0.00 0.00 46.19 42.37 3c4f s LEU 644 CO 0.03 -1.51 1.24 0.00 0.02 0.00 0.00 176.35 176.13 3c4f n ALA 645 N -1.33 4.86 -1.99 4.21 0.00 -1.26 -5.01 120.51 119.99 3c4f n ALA 645 Ca 0.12 -4.78 -0.24 0.00 0.00 0.00 0.00 53.44 48.54 3c4f n ALA 645 Cb 0.48 -1.78 0.12 0.00 0.00 0.00 0.00 19.45 18.27 3c4f n ALA 645 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3c4f s ARG 646 N -2.84 1.51 -0.05 0.00 3.03 -1.26 -4.96 118.95 114.38 3c4f s ARG 646 Ca 0.35 -1.09 0.03 0.00 2.03 0.00 0.00 55.73 57.05 3c4f s ARG 646 Cb 0.10 -2.28 0.01 0.00 -1.03 0.00 0.00 34.95 31.75 3c4f s ARG 646 CO 0.04 -1.60 -0.13 0.34 -1.13 0.00 0.00 175.30 172.82 3c4f s ASP 647 N -4.78 1.78 0.00 -2.89 -1.08 -1.26 -5.05 116.67 103.40 3c4f s ASP 647 Ca 0.68 -0.29 -0.11 0.00 -0.52 0.00 0.00 52.55 52.30 3c4f s ASP 647 Cb -0.05 -0.64 -0.32 0.00 -1.46 0.00 0.00 42.92 40.45 3c4f s ASP 647 CO 0.46 0.08 0.88 0.16 0.52 0.00 0.00 175.17 177.27 3c4f h ILE 648 N 5.59 1.16 -0.56 4.11 -2.65 -2.00 -3.34 117.51 119.83 3c4f h ILE 648 Ca -0.32 -2.69 0.16 0.00 1.03 0.00 0.00 64.86 63.05 3c4f h ILE 648 Cb 1.18 2.90 -0.02 0.00 -2.05 0.00 0.00 36.82 38.83 3c4f h ILE 648 CO 0.48 0.84 0.40 0.45 0.03 0.00 0.00 178.15 180.35 3c4f h HIS 649 N 0.12 0.00 -2.29 0.16 3.86 -2.01 -3.03 115.15 111.96 3c4f h HIS 649 Ca -0.27 0.00 -0.60 0.00 -1.16 0.00 0.00 60.37 58.34 3c4f h HIS 649 Cb 2.11 -0.00 -0.41 0.00 1.06 0.00 0.00 27.41 30.17 3c4f h HIS 649 CO 0.10 0.00 -0.68 0.72 0.86 0.00 0.00 177.93 178.93 3c4f n HIS 650 N -4.37 2.80 -4.54 2.45 8.25 -1.25 -5.08 115.22 113.48 3c4f n HIS 650 Ca 0.10 -4.06 -0.32 0.00 -0.26 0.00 0.00 57.72 53.19 3c4f n HIS 650 Cb 0.63 -0.51 -0.11 0.00 1.12 0.00 0.00 29.99 31.12 3c4f n HIS 650 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 3c4f s ILE 651 N -2.05 3.34 -0.43 1.59 2.07 -1.15 -4.80 121.20 119.78 3c4f s ILE 651 Ca 0.37 -0.92 -0.06 0.00 -1.41 0.00 0.00 60.65 58.63 3c4f s ILE 651 Cb 0.12 -2.44 0.11 0.00 0.13 0.00 0.00 42.46 40.38 3c4f s ILE 651 CO -0.06 0.38 0.26 -0.62 -1.91 0.00 0.00 174.94 172.99 3c4f s ASP 652 N -1.42 5.47 0.35 4.50 -1.08 -1.26 -4.95 116.67 118.28 3c4f s ASP 652 Ca 0.16 -1.87 0.04 0.00 -0.52 0.00 0.00 52.55 50.36 3c4f s ASP 652 Cb -0.11 -1.92 0.64 0.00 -1.46 0.00 0.00 42.92 40.07 3c4f s ASP 652 CO 0.07 -0.59 1.92 1.88 0.52 0.00 0.00 175.17 178.97 3c4f h TYR 653 N 8.26 0.59 0.00 -5.34 0.05 -2.02 -3.08 116.97 115.44 3c4f h TYR 653 Ca -0.18 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.56 3c4f h TYR 653 Cb 1.06 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.62 3c4f h TYR 653 CO 0.60 0.51 -0.34 0.66 -1.05 0.00 0.00 178.16 178.53 3c4f n TYR 654 N -4.34 0.66 -1.99 4.88 4.02 -1.26 -4.69 117.16 114.45 3c4f n TYR 654 Ca 0.02 0.19 -0.42 0.00 -0.01 0.00 0.00 57.90 57.69 3c4f n TYR 654 Cb 0.18 -0.75 -0.03 0.00 -0.02 0.00 0.00 39.34 38.73 3c4f n TYR 654 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 176.86 176.06 3c4f s LYS 655 N -3.13 4.21 0.41 -0.72 2.47 -1.16 -5.01 119.74 116.81 3c4f s LYS 655 Ca 0.09 2.24 -0.01 0.00 -1.56 0.00 0.00 55.97 56.73 3c4f s LYS 655 Cb 0.13 -3.62 -0.03 0.00 -1.46 0.00 0.00 37.83 32.85 3c4f s LYS 655 CO 0.66 -0.71 0.64 0.15 0.16 0.00 0.00 175.35 176.25 3c4f s LYS 656 N 2.69 3.40 0.65 4.03 1.02 -1.26 -4.42 119.74 125.85 3c4f s LYS 656 Ca 0.72 -0.22 -0.11 0.00 0.02 0.00 0.00 55.97 56.37 3c4f s LYS 656 Cb -0.38 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.35 3c4f s LYS 656 CO 0.31 -0.04 1.05 0.95 -0.92 0.00 0.00 175.35 176.70 3c4f s THR 657 N -2.49 4.26 -2.00 2.17 -4.23 -0.09 -4.90 115.64 108.37 3c4f s THR 657 Ca 0.44 0.74 0.05 0.00 -1.18 0.00 0.00 61.69 61.73 3c4f s THR 657 Cb -0.10 -3.72 0.15 0.00 1.34 0.00 0.00 72.50 70.17 3c4f s THR 657 CO 0.39 -0.96 0.73 0.35 -0.54 0.00 0.00 174.62 174.59 3c4f n THR 658 N -2.85 0.00 -0.09 3.99 -2.24 -1.26 -0.67 114.28 111.15 3c4f n THR 658 Ca 0.06 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.73 3c4f n THR 658 Cb 0.55 -0.83 -0.15 0.00 -2.10 0.00 0.00 70.33 67.80 3c4f n THR 658 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3c4f n ASN 659 N -0.93 0.32 0.00 3.42 5.15 -1.26 -5.03 115.26 116.94 3c4f n ASN 659 Ca 0.04 0.03 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 3c4f n ASN 659 Cb 0.02 0.72 0.00 0.00 -0.53 0.00 0.00 39.78 39.99 3c4f n ASN 659 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3c4f n GLY 660 N 1.79 1.43 3.84 8.20 0.00 0.15 -5.14 105.19 115.45 3c4f n GLY 660 Ca -0.33 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 3c4f n GLY 660 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3c4f s ARG 661 N -0.17 2.73 -0.36 1.61 0.52 -1.26 -4.81 118.95 117.21 3c4f s ARG 661 Ca 0.00 -1.27 -0.11 0.00 -0.52 0.00 0.00 55.73 53.83 3c4f s ARG 661 Cb 0.00 -2.47 0.02 0.00 0.52 0.00 0.00 34.95 33.02 3c4f s ARG 661 CO 0.00 0.15 0.20 -0.51 0.02 0.00 0.00 175.30 175.16 3c4f s LEU 662 N -3.96 4.58 0.54 2.53 1.43 -1.26 -0.91 118.68 121.63 3c4f s LEU 662 Ca 0.39 -0.85 0.34 0.00 -1.03 0.00 0.00 54.13 52.98 3c4f s LEU 662 Cb -0.06 -2.03 1.51 0.00 0.03 0.00 0.00 46.19 45.64 3c4f s LEU 662 CO 0.26 -0.34 1.84 -0.65 0.23 0.00 0.00 176.35 177.70 3c4f h PRO 663 N 8.43 0.02 0.00 1.29 0.11 -1.88 -2.11 132.00 137.86 3c4f h PRO 663 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3c4f h PRO 663 Cb 1.12 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3c4f h PRO 663 CO 0.66 0.01 0.14 -0.39 -0.21 0.00 0.00 178.00 178.21 3c4f h VAL 664 N 0.02 0.00 0.00 3.15 -1.51 -1.92 -1.95 116.25 114.03 3c4f h VAL 664 Ca 0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.97 3c4f h VAL 664 Cb 1.99 0.66 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 3c4f h VAL 664 CO -0.02 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.61 3c4f n LYS 665 N -2.64 0.21 0.00 5.19 5.02 -0.79 -2.45 118.16 122.70 3c4f n LYS 665 Ca -0.02 0.09 0.07 0.00 -2.02 0.00 0.00 58.31 56.43 3c4f n LYS 665 Cb 0.19 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.62 3c4f n LYS 665 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3c4f n TRP 666 N -1.36 0.00 -2.78 2.13 8.01 -0.73 -5.00 117.44 117.71 3c4f n TRP 666 Ca 0.09 0.00 -0.40 0.00 -1.31 0.00 0.00 57.50 55.87 3c4f n TRP 666 Cb 0.20 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.45 3c4f n TRP 666 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 3c4f s MET 667 N -2.36 4.75 0.58 -0.99 -1.94 -1.02 -3.59 119.30 114.74 3c4f s MET 667 Ca 0.06 1.42 -0.19 0.00 -1.71 0.00 0.00 55.69 55.26 3c4f s MET 667 Cb 0.11 -3.32 -0.04 0.00 2.01 0.00 0.00 34.83 33.60 3c4f s MET 667 CO 0.59 0.41 1.20 0.00 -0.01 0.00 0.00 175.02 177.21 3c4f s ALA 668 N -0.72 2.58 0.20 3.03 0.00 -1.26 -4.82 121.76 120.76 3c4f s ALA 668 Ca 0.42 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.27 3c4f s ALA 668 Cb -0.24 -3.44 0.17 0.00 0.00 0.00 0.00 23.12 19.61 3c4f s ALA 668 CO 0.30 -1.11 1.82 -1.35 0.00 0.00 0.00 175.76 175.43 3c4f h PRO 669 N 0.96 0.70 -0.39 0.00 0.11 -1.96 -1.29 132.00 130.14 3c4f h PRO 669 Ca -0.50 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.57 3c4f h PRO 669 Cb 1.29 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3c4f h PRO 669 CO 0.55 0.46 0.26 1.05 -0.21 0.00 0.00 178.00 180.12 3c4f h GLU 670 N 0.72 0.49 -0.05 1.05 9.09 -1.90 -1.39 114.58 122.58 3c4f h GLU 670 Ca 0.26 -0.03 -0.20 0.00 0.05 0.00 0.00 59.36 59.44 3c4f h GLU 670 Cb 0.07 -0.11 -0.00 0.00 -1.65 0.00 0.00 28.75 27.06 3c4f h GLU 670 CO -0.13 0.33 -0.80 0.00 0.05 0.00 0.00 179.01 178.46 3c4f h ALA 671 N 1.76 0.52 -0.03 1.06 0.00 -1.24 -1.81 119.26 119.52 3c4f h ALA 671 Ca 0.15 -0.64 -0.08 0.00 0.00 0.00 0.00 54.91 54.34 3c4f h ALA 671 Cb -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3c4f h ALA 671 CO -0.03 0.78 -0.28 1.25 0.00 0.00 0.00 179.25 180.98 3c4f h LEU 672 N 0.26 0.30 0.00 0.00 5.85 -0.79 -2.97 115.31 117.96 3c4f h LEU 672 Ca -0.05 -0.70 -0.17 0.00 0.84 0.00 0.00 57.88 57.81 3c4f h LEU 672 Cb 1.40 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 3c4f h LEU 672 CO 0.14 0.95 -0.92 -0.26 -0.34 0.00 0.00 178.44 178.01 3c4f h PHE 673 N -0.34 0.00 -0.18 1.25 0.04 -1.40 -3.41 116.94 112.90 3c4f h PHE 673 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 3c4f h PHE 673 Cb 0.97 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.12 3c4f h PHE 673 CO 0.15 1.32 0.00 -0.25 -0.60 0.00 0.00 178.31 178.94 3c4f n ASP 674 N -4.48 3.06 -3.94 2.17 8.00 -0.78 -5.00 116.55 115.58 3c4f n ASP 674 Ca -0.26 -1.93 -0.30 0.00 0.71 0.00 0.00 54.79 53.02 3c4f n ASP 674 Cb 0.62 -0.11 0.01 0.00 -0.02 0.00 0.00 41.12 41.62 3c4f n ASP 674 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3c4f n ARG 675 N 1.29 -4.88 -3.60 -1.24 1.74 -0.75 -4.93 116.66 104.29 3c4f n ARG 675 Ca 0.15 0.55 -0.38 0.00 -0.77 0.00 0.00 57.85 57.40 3c4f n ARG 675 Cb 0.56 -5.30 -0.11 0.00 -1.02 0.00 0.00 32.46 26.59 3c4f n ARG 675 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3c4f s ILE 676 N -3.41 5.32 -0.25 0.55 1.01 -0.92 -4.93 121.20 118.57 3c4f s ILE 676 Ca 0.53 0.18 0.02 0.00 0.00 0.00 0.00 60.65 61.37 3c4f s ILE 676 Cb -0.27 -3.53 0.06 0.00 0.01 0.00 0.00 42.46 38.73 3c4f s ILE 676 CO 0.85 0.27 -0.09 -0.31 0.00 0.00 0.00 174.94 175.65 3c4f s TYR 677 N 1.63 2.95 0.26 3.97 1.51 -1.26 -3.05 117.35 123.36 3c4f s TYR 677 Ca 0.07 -2.11 0.03 0.00 -1.01 0.00 0.00 57.07 54.05 3c4f s TYR 677 Cb -0.16 -1.81 -0.01 0.00 -0.11 0.00 0.00 41.96 39.88 3c4f s TYR 677 CO 0.10 -0.84 0.12 0.25 -1.11 0.00 0.00 175.55 174.06 3c4f n THR 678 N 4.52 0.00 0.22 -0.71 -2.24 -1.26 -5.00 114.28 109.80 3c4f n THR 678 Ca -0.14 -1.57 0.10 0.00 -2.27 0.00 0.00 64.05 60.18 3c4f n THR 678 Cb 0.43 0.61 0.38 0.00 -2.10 0.00 0.00 70.33 69.65 3c4f n THR 678 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3c4f h HIS 679 N 1.50 0.00 0.00 4.78 3.86 -1.99 -2.84 115.15 120.47 3c4f h HIS 679 Ca -0.20 0.00 -0.18 0.00 -1.16 0.00 0.00 60.37 58.83 3c4f h HIS 679 Cb 0.80 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.25 3c4f h HIS 679 CO 0.00 0.19 -0.84 1.96 0.86 0.00 0.00 177.93 180.10 3c4f h GLN 680 N 0.00 0.06 -0.25 2.45 1.08 -1.93 -2.18 115.11 114.33 3c4f h GLN 680 Ca -0.00 -0.06 -0.10 0.00 -1.45 0.00 0.00 58.65 57.03 3c4f h GLN 680 Cb 0.85 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.29 3c4f h GLN 680 CO 0.02 0.86 -0.28 0.66 -0.95 0.00 0.00 178.83 179.14 3c4f h SER 681 N 0.03 0.51 0.28 1.46 4.64 -1.87 -2.03 113.55 116.57 3c4f h SER 681 Ca -0.02 -0.18 -0.06 0.00 -0.47 0.00 0.00 61.79 61.06 3c4f h SER 681 Cb 1.46 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 3c4f h SER 681 CO 0.11 0.77 -0.28 0.44 -0.87 0.00 0.00 176.83 177.00 3c4f h ASP 682 N 0.44 0.00 -0.44 4.97 3.32 -1.39 -2.76 116.42 120.56 3c4f h ASP 682 Ca 0.06 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 3c4f h ASP 682 Cb 0.71 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.24 3c4f h ASP 682 CO 0.05 0.28 0.03 0.58 -1.72 0.00 0.00 179.24 178.46 3c4f h VAL 683 N 0.00 1.24 -0.62 -1.35 2.07 -0.71 -0.41 116.25 116.47 3c4f h VAL 683 Ca -0.00 -0.98 -0.05 0.00 0.82 0.00 0.00 66.70 66.49 3c4f h VAL 683 Cb 0.50 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3c4f h VAL 683 CO 0.04 0.35 0.21 -0.25 0.02 0.00 0.00 177.57 177.94 3c4f h TRP 684 N 0.78 0.99 -0.86 1.57 2.91 -1.23 -1.97 115.95 118.14 3c4f h TRP 684 Ca 0.15 -0.09 -0.02 0.00 1.13 0.00 0.00 58.89 60.06 3c4f h TRP 684 Cb 0.43 -0.29 -0.04 0.00 -0.51 0.00 0.00 29.16 28.75 3c4f h TRP 684 CO 0.02 0.81 0.45 0.77 -1.03 0.00 0.00 178.44 179.46 3c4f h SER 685 N 0.89 1.08 -0.00 2.65 0.02 -1.26 -1.80 113.55 115.13 3c4f h SER 685 Ca 0.20 -0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 3c4f h SER 685 Cb 0.27 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3c4f h SER 685 CO -0.01 0.88 -0.05 0.15 -1.14 0.00 0.00 176.83 176.66 3c4f h PHE 686 N 1.20 0.15 -0.33 3.45 3.57 -0.38 -1.09 116.94 123.51 3c4f h PHE 686 Ca 0.30 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.79 3c4f h PHE 686 Cb 0.05 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 3c4f h PHE 686 CO 0.01 0.21 0.22 0.78 -2.23 0.00 0.00 178.31 177.30 3c4f h GLY 687 N 0.46 0.46 1.11 2.40 0.00 -0.67 0.68 103.07 107.50 3c4f h GLY 687 Ca 0.03 -0.17 -0.11 0.00 0.00 0.00 0.00 47.33 47.08 3c4f h GLY 687 CO 0.01 0.17 -0.07 -2.08 0.00 0.00 0.00 176.54 174.57 3c4f h VAL 688 N 0.44 1.27 -0.62 4.60 2.07 -1.29 -1.91 116.25 120.82 3c4f h VAL 688 Ca 0.12 -1.23 -0.04 0.00 0.82 0.00 0.00 66.70 66.37 3c4f h VAL 688 Cb -0.05 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 3c4f h VAL 688 CO -0.03 0.44 0.21 0.25 0.02 0.00 0.00 177.57 178.47 3c4f h LEU 689 N 0.94 0.85 -0.76 2.57 6.46 -0.76 0.13 115.31 124.74 3c4f h LEU 689 Ca 0.15 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.77 3c4f h LEU 689 Cb 0.64 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 40.31 3c4f h LEU 689 CO 0.04 0.78 0.44 -0.07 -0.62 0.00 0.00 178.44 179.01 3c4f h LEU 690 N 0.90 0.93 -0.56 2.25 3.38 -0.49 -0.03 115.31 121.69 3c4f h LEU 690 Ca 0.21 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3c4f h LEU 690 Cb 0.23 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 3c4f h LEU 690 CO -0.01 0.74 0.27 -0.25 0.09 0.00 0.00 178.44 179.27 3c4f h TRP 691 N 1.04 0.81 -0.98 1.13 7.01 -0.54 -1.82 115.95 122.60 3c4f h TRP 691 Ca 0.27 -0.04 0.02 0.00 2.11 0.00 0.00 58.89 61.25 3c4f h TRP 691 Cb -0.00 -0.25 -0.05 0.00 -2.10 0.00 0.00 29.16 26.76 3c4f h TRP 691 CO -0.00 0.63 0.65 0.93 -2.79 0.00 0.00 178.44 177.85 3c4f h GLU 692 N 0.76 1.26 -0.34 2.65 5.08 -0.03 -2.23 114.58 121.73 3c4f h GLU 692 Ca 0.19 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3c4f h GLU 692 Cb 0.12 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3c4f h GLU 692 CO -0.02 0.83 0.11 0.82 -1.00 0.00 0.00 179.01 179.75 3c4f h ILE 693 N 1.29 1.20 -0.00 3.13 2.04 -0.58 0.12 117.51 124.71 3c4f h ILE 693 Ca 0.37 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3c4f h ILE 693 Cb -0.10 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3c4f h ILE 693 CO -0.09 0.23 -0.08 0.49 0.00 0.00 0.00 178.15 178.69 3c4f n PHE 694 N -4.66 0.00 -0.30 1.37 3.72 -0.73 -1.74 117.46 115.12 3c4f n PHE 694 Ca -0.01 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.46 3c4f n PHE 694 Cb 0.17 -0.16 0.21 0.00 -0.94 0.00 0.00 39.48 38.76 3c4f n PHE 694 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3c4f n THR 695 N -0.92 1.13 -3.81 4.37 -2.24 -0.86 -4.82 114.28 107.13 3c4f n THR 695 Ca 0.16 -1.07 -0.31 0.00 -2.27 0.00 0.00 64.05 60.56 3c4f n THR 695 Cb 0.26 0.43 0.02 0.00 -2.10 0.00 0.00 70.33 68.94 3c4f n THR 695 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3c4f n LEU 696 N 0.76 -2.36 0.00 3.22 4.77 -0.71 -3.04 117.00 119.63 3c4f n LEU 696 Ca 0.16 -1.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.10 3c4f n LEU 696 Cb 0.53 -2.25 0.00 0.00 -2.33 0.00 0.00 43.42 39.37 3c4f n LEU 696 CO 0.11 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 3c4f n GLY 697 N -1.83 0.89 3.72 -0.72 0.00 0.36 -3.56 105.19 104.06 3c4f n GLY 697 Ca -0.17 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 44.99 3c4f n GLY 697 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3c4f s GLY 698 N -2.53 2.15 -0.29 -0.02 0.00 -1.17 -4.94 107.32 100.52 3c4f s GLY 698 Ca 0.00 0.74 -0.15 0.00 0.00 0.00 0.00 44.72 45.31 3c4f s GLY 698 CO 0.00 1.14 0.37 -0.45 0.00 0.00 0.00 173.10 174.17 3c4f s SER 699 N -2.32 6.24 0.25 1.64 0.15 -1.26 -4.78 113.70 113.62 3c4f s SER 699 Ca 0.71 0.17 -0.30 0.00 0.70 0.00 0.00 55.95 57.23 3c4f s SER 699 Cb -0.26 -2.21 -0.10 0.00 -1.71 0.00 0.00 66.02 61.75 3c4f s SER 699 CO 0.48 -0.23 1.34 -2.84 1.20 0.00 0.00 173.24 173.19 3c4f s PRO 700 N 2.07 4.35 -1.04 5.44 0.02 -1.26 -3.85 135.00 140.75 3c4f s PRO 700 Ca 0.14 2.16 -0.15 0.00 0.02 0.00 0.00 61.00 63.17 3c4f s PRO 700 Cb -0.16 -3.14 -0.00 0.00 0.02 0.00 0.00 34.50 31.22 3c4f s PRO 700 CO 0.11 -0.27 0.75 0.66 -0.33 0.00 0.00 177.00 177.92 3c4f n TYR 701 N 2.06 -2.06 -2.01 6.54 4.01 -1.26 -4.85 117.16 119.60 3c4f n TYR 701 Ca 0.05 0.59 -0.42 0.00 -0.16 0.00 0.00 57.90 57.96 3c4f n TYR 701 Cb 0.42 -3.40 -0.03 0.00 -0.31 0.00 0.00 39.34 36.02 3c4f n TYR 701 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3c4f s PRO 702 N -5.46 4.26 0.00 -0.72 0.04 -1.25 -2.03 135.00 129.84 3c4f s PRO 702 Ca 0.34 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.67 3c4f s PRO 702 Cb -0.12 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.28 3c4f s PRO 702 CO 0.86 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.82 3c4f n GLY 703 N 2.84 0.55 3.58 0.56 0.00 -1.26 -5.01 105.19 106.45 3c4f n GLY 703 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 3c4f n GLY 703 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c4f s VAL 704 N -2.39 5.21 0.80 1.61 1.01 -0.86 -5.08 120.40 120.70 3c4f s VAL 704 Ca 0.00 0.30 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 3c4f s VAL 704 Cb 0.00 -3.69 0.08 0.00 0.00 0.00 0.00 36.38 32.77 3c4f s VAL 704 CO 0.00 0.10 1.17 -2.16 0.00 0.00 0.00 175.10 174.21 3c4f s PRO 705 N 1.97 1.99 0.15 2.72 0.05 -1.26 -4.82 135.00 135.80 3c4f s PRO 705 Ca 0.12 0.09 -0.19 0.00 0.05 0.00 0.00 61.00 61.07 3c4f s PRO 705 Cb -0.16 -1.97 0.03 0.00 0.05 0.00 0.00 34.50 32.45 3c4f s PRO 705 CO 0.11 -1.57 1.68 0.28 0.05 0.00 0.00 177.00 177.55 3c4f h VAL 706 N -1.02 0.67 -0.15 -0.36 2.07 -1.98 -1.45 116.25 114.02 3c4f h VAL 706 Ca -0.46 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 3c4f h VAL 706 Cb 1.33 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 3c4f h VAL 706 CO 0.66 0.00 -0.01 -0.33 0.02 0.00 0.00 177.57 177.90 3c4f h GLU 707 N -0.03 0.22 0.01 1.57 5.08 -2.00 -1.48 114.58 117.95 3c4f h GLU 707 Ca 0.14 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.25 3c4f h GLU 707 Cb 0.25 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.46 3c4f h GLU 707 CO -0.31 0.26 -0.96 0.93 -1.00 0.00 0.00 179.01 177.92 3c4f h GLU 708 N 0.22 0.35 -0.29 2.33 4.39 -1.81 -2.99 114.58 116.79 3c4f h GLU 708 Ca 0.05 -0.40 0.02 0.00 0.34 0.00 0.00 59.36 59.37 3c4f h GLU 708 Cb 0.17 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 3c4f h GLU 708 CO 0.00 1.09 0.14 1.25 -1.16 0.00 0.00 179.01 180.33 3c4f h LEU 709 N 0.19 0.21 -0.87 1.33 5.85 -0.30 -0.04 115.31 121.68 3c4f h LEU 709 Ca -0.08 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.72 3c4f h LEU 709 Cb 1.61 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.55 3c4f h LEU 709 CO 0.16 0.16 0.54 -0.26 -0.34 0.00 0.00 178.44 178.70 3c4f h PHE 710 N 0.30 0.99 -0.43 1.25 0.04 -1.37 -0.66 116.94 117.06 3c4f h PHE 710 Ca 0.12 0.03 0.03 0.00 2.80 0.00 0.00 57.97 60.95 3c4f h PHE 710 Cb 0.04 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 37.84 3c4f h PHE 710 CO -0.10 0.49 0.23 -0.22 -0.60 0.00 0.00 178.31 178.11 3c4f h LYS 711 N 0.97 0.44 -0.51 1.51 3.64 -1.19 -1.14 116.57 120.28 3c4f h LYS 711 Ca 0.38 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.67 3c4f h LYS 711 Cb 0.20 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 3c4f h LYS 711 CO -0.18 0.29 0.04 -0.07 -2.27 0.00 0.00 179.45 177.26 3c4f h LEU 712 N 0.45 0.80 -0.45 5.20 3.38 0.12 -2.28 115.31 122.53 3c4f h LEU 712 Ca 0.18 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 3c4f h LEU 712 Cb 0.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3c4f h LEU 712 CO -0.12 0.84 -0.40 -0.07 0.09 0.00 0.00 178.44 178.79 3c4f h LEU 713 N 0.79 0.91 -1.38 1.67 3.38 -0.79 0.36 115.31 120.25 3c4f h LEU 713 Ca 0.16 -0.42 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3c4f h LEU 713 Cb 0.42 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3c4f h LEU 713 CO 0.01 1.19 0.13 0.11 0.09 0.00 0.00 178.44 179.98 3c4f h LYS 714 N 0.69 0.55 -0.00 1.13 1.57 -0.98 -2.00 116.57 117.53 3c4f h LYS 714 Ca 0.05 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3c4f h LYS 714 Cb 0.97 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.18 3c4f h LYS 714 CO 0.09 0.48 -0.02 0.39 -0.57 0.00 0.00 179.45 179.83 3c4f n GLU 715 N -4.36 1.13 -1.76 3.15 1.02 -0.88 -4.90 120.64 114.04 3c4f n GLU 715 Ca 0.02 -0.32 -0.06 0.00 -0.02 0.00 0.00 57.16 56.78 3c4f n GLU 715 Cb 0.16 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.07 3c4f n GLU 715 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3c4f n GLY 716 N 1.10 0.40 3.77 0.62 0.00 -0.75 -4.99 105.19 105.34 3c4f n GLY 716 Ca 0.21 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.15 3c4f n GLY 716 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3c4f s HIS 717 N -2.29 3.04 -0.03 1.61 5.04 0.09 -5.03 115.29 117.71 3c4f s HIS 717 Ca 0.00 1.46 0.01 0.00 -1.54 0.00 0.00 55.06 54.99 3c4f s HIS 717 Cb 0.00 -3.61 0.02 0.00 0.04 0.00 0.00 32.58 29.03 3c4f s HIS 717 CO 0.00 -1.74 -0.04 1.03 -2.34 0.00 0.00 174.74 171.65 3c4f s ARG 718 N -1.95 0.63 0.59 2.88 1.81 -1.26 -4.73 118.95 116.93 3c4f s ARG 718 Ca 0.52 -0.10 -0.19 0.00 -1.72 0.00 0.00 55.73 54.23 3c4f s ARG 718 Cb -0.37 -0.66 -0.04 0.00 -0.45 0.00 0.00 34.95 33.42 3c4f s ARG 718 CO 0.49 -0.03 1.15 -1.33 -0.68 0.00 0.00 175.30 174.89 3c4f n MET 719 N 3.75 1.15 -1.88 3.54 2.81 -1.26 -4.95 117.12 120.28 3c4f n MET 719 Ca -0.23 0.44 -0.32 0.00 -1.81 0.00 0.00 57.70 55.78 3c4f n MET 719 Cb 0.53 -2.35 0.03 0.00 -0.71 0.00 0.00 33.22 30.71 3c4f n MET 719 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3c4f s ASP 720 N -1.19 5.61 0.06 7.83 1.01 -1.26 -4.98 116.67 123.76 3c4f s ASP 720 Ca 0.76 1.77 -0.31 0.00 0.71 0.00 0.00 52.55 55.48 3c4f s ASP 720 Cb -0.41 -2.52 -0.07 0.00 1.01 0.00 0.00 42.92 40.92 3c4f s ASP 720 CO 0.46 -1.28 1.49 -0.75 0.21 0.00 0.00 175.17 175.30 3c4f s LYS 721 N -4.36 4.26 0.56 8.23 2.20 -1.26 -4.98 119.74 124.38 3c4f s LYS 721 Ca 0.62 2.14 -0.18 0.00 -0.36 0.00 0.00 55.97 58.19 3c4f s LYS 721 Cb -0.16 -3.46 -0.05 0.00 -1.51 0.00 0.00 37.83 32.65 3c4f s LYS 721 CO 0.43 -0.60 1.09 -1.25 -0.36 0.00 0.00 175.35 174.66 3c4f s PRO 722 N 2.05 3.35 0.55 4.03 0.04 -1.26 -4.99 135.00 138.77 3c4f s PRO 722 Ca 0.68 1.42 -0.19 0.00 0.04 0.00 0.00 61.00 62.95 3c4f s PRO 722 Cb -0.36 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.10 3c4f s PRO 722 CO 0.30 -0.81 1.09 -1.54 0.04 0.00 0.00 177.00 176.07 3c4f s SER 723 N -2.20 5.82 -0.84 6.66 1.04 -1.26 -3.60 113.70 119.32 3c4f s SER 723 Ca 0.68 2.04 -0.00 0.00 0.48 0.00 0.00 55.95 59.14 3c4f s SER 723 Cb -0.20 -2.56 -0.00 0.00 0.10 0.00 0.00 66.02 63.35 3c4f s SER 723 CO 0.30 -1.15 0.70 0.59 0.98 0.00 0.00 173.24 174.67 3c4f n ASN 724 N -1.46 -2.33 -3.70 7.02 3.02 -1.26 -4.90 115.26 111.65 3c4f n ASN 724 Ca 0.10 -0.45 -0.11 0.00 -0.03 0.00 0.00 54.58 54.10 3c4f n ASN 724 Cb 0.52 -3.79 -0.11 0.00 -0.61 0.00 0.00 39.78 35.79 3c4f n ASN 724 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c4f s THR 726 N 1.19 4.09 0.35 0.00 -4.23 -1.26 -4.91 115.64 110.87 3c4f s THR 726 Ca -0.08 0.86 0.08 0.00 -1.18 0.00 0.00 61.69 61.37 3c4f s THR 726 Cb -0.07 -3.49 0.31 0.00 1.34 0.00 0.00 72.50 70.59 3c4f s THR 726 CO -0.10 -0.71 1.89 0.78 -0.54 0.00 0.00 174.62 175.93 3c4f h ASN 727 N 0.08 0.69 0.32 3.99 2.35 -1.99 -2.16 115.58 118.85 3c4f h ASN 727 Ca -0.46 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.32 3c4f h ASN 727 Cb 1.21 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.47 3c4f h ASN 727 CO 0.58 0.37 -0.19 -0.08 -1.65 0.00 0.00 177.43 176.47 3c4f h GLU 728 N 0.74 -0.47 0.00 0.81 4.81 -1.99 -1.48 114.58 117.00 3c4f h GLU 728 Ca 0.42 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.65 3c4f h GLU 728 Cb 0.60 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 3c4f h GLU 728 CO -0.19 -0.31 -0.17 -0.07 -0.73 0.00 0.00 179.01 177.54 3c4f h LEU 729 N -0.49 0.00 -0.33 1.64 3.38 -1.85 -0.41 115.31 117.26 3c4f h LEU 729 Ca -0.03 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 3c4f h LEU 729 Cb 0.40 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 3c4f h LEU 729 CO 0.04 0.17 -0.80 0.22 0.09 0.00 0.00 178.44 178.16 3c4f h TYR 730 N 0.00 0.54 -0.14 1.13 3.20 -1.16 -1.79 116.97 118.75 3c4f h TYR 730 Ca -0.00 -0.26 -0.12 0.00 3.14 0.00 0.00 58.73 61.48 3c4f h TYR 730 Cb 0.31 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 3c4f h TYR 730 CO 0.00 1.04 -0.45 1.98 -1.64 0.00 0.00 178.16 179.09 3c4f h MET 731 N 0.25 0.35 -0.62 1.82 4.05 -0.65 0.82 114.93 120.95 3c4f h MET 731 Ca -0.05 -0.18 -0.00 0.00 -0.28 0.00 0.00 59.70 59.19 3c4f h MET 731 Cb 1.40 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 32.18 3c4f h MET 731 CO 0.14 0.73 0.37 1.98 0.23 0.00 0.00 176.91 180.36 3c4f h MET 732 N 0.28 0.84 -0.06 0.39 1.85 -0.74 0.72 114.93 118.21 3c4f h MET 732 Ca 0.02 -0.08 -0.00 0.00 -0.61 0.00 0.00 59.70 59.03 3c4f h MET 732 Cb 0.91 -0.18 -0.00 0.00 0.43 0.00 0.00 31.60 32.76 3c4f h MET 732 CO 0.08 0.60 0.02 0.52 -0.40 0.00 0.00 176.91 177.72 3c4f h MET 733 N 0.83 0.09 -0.59 0.39 2.07 -0.95 -0.70 114.93 116.07 3c4f h MET 733 Ca 0.22 -0.02 -0.01 0.00 -2.07 0.00 0.00 59.70 57.82 3c4f h MET 733 Cb -0.02 -0.01 -0.03 0.00 -1.87 0.00 0.00 31.60 29.67 3c4f h MET 733 CO -0.04 0.26 0.32 0.00 1.07 0.00 0.00 176.91 178.52 3c4f h ARG 734 N -0.10 0.81 -0.00 1.72 2.47 -0.56 -1.15 114.38 117.58 3c4f h ARG 734 Ca 0.02 -0.08 -0.00 0.00 -1.26 0.00 0.00 59.98 58.65 3c4f h ARG 734 Cb 0.21 -0.17 -0.00 0.00 -1.65 0.00 0.00 29.97 28.36 3c4f h ARG 734 CO -0.00 0.60 0.00 -0.44 0.56 0.00 0.00 179.97 180.69 3c4f h ASP 735 N 0.82 0.00 0.02 7.04 3.32 0.80 -2.32 116.42 126.10 3c4f h ASP 735 Ca 0.21 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 3c4f h ASP 735 Cb 0.03 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3c4f h ASP 735 CO -0.03 0.04 -0.01 0.00 -1.72 0.00 0.00 179.24 177.52 3c4f n TRP 737 N -4.00 1.69 -1.94 0.00 8.01 -0.49 -3.77 117.44 116.93 3c4f n TRP 737 Ca -0.03 -0.71 -0.41 0.00 -1.31 0.00 0.00 57.50 55.04 3c4f n TRP 737 Cb 0.09 -0.47 -0.01 0.00 -2.01 0.00 0.00 31.31 28.91 3c4f n TRP 737 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 3c4f s HIS 738 N -2.34 2.84 0.48 -5.99 2.46 -0.81 -4.89 115.29 107.04 3c4f s HIS 738 Ca 0.41 1.17 0.14 0.00 0.47 0.00 0.00 55.06 57.25 3c4f s HIS 738 Cb 0.32 -3.88 1.14 0.00 -0.13 0.00 0.00 32.58 30.03 3c4f s HIS 738 CO 0.11 -2.63 2.11 0.00 -2.47 0.00 0.00 174.74 171.86 3c4f h ALA 739 N 3.75 1.89 -2.83 1.58 0.00 -1.92 -3.40 119.26 118.34 3c4f h ALA 739 Ca -0.49 -0.02 -0.65 0.00 0.00 0.00 0.00 54.91 53.75 3c4f h ALA 739 Cb 1.23 -0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.80 3c4f h ALA 739 CO 0.69 0.09 -0.50 0.08 0.00 0.00 0.00 179.25 179.62 3c4f s VAL 740 N -5.13 5.30 0.29 0.00 1.01 -1.26 -4.91 120.40 115.70 3c4f s VAL 740 Ca -0.06 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.00 3c4f s VAL 740 Cb 0.17 -3.60 0.28 0.00 0.00 0.00 0.00 36.38 33.23 3c4f s VAL 740 CO 0.69 0.15 1.79 -0.65 0.00 0.00 0.00 175.10 177.09 3c4f h PRO 741 N 8.41 0.80 0.00 2.72 0.11 -1.96 -1.92 132.00 140.15 3c4f h PRO 741 Ca -0.34 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.73 3c4f h PRO 741 Cb 1.18 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3c4f h PRO 741 CO 0.58 0.53 -0.00 0.66 -0.21 0.00 0.00 178.00 179.56 3c4f h SER 742 N 0.82 0.00 0.61 -2.05 4.64 -1.95 -2.24 113.55 113.38 3c4f h SER 742 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3c4f h SER 742 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3c4f h SER 742 CO -0.34 0.00 -0.23 0.00 -0.87 0.00 0.00 176.83 175.39 3c4f n GLN 743 N -3.10 0.22 -2.50 4.77 1.13 -0.72 -4.83 117.38 112.35 3c4f n GLN 743 Ca -0.00 -0.09 -0.32 0.00 -1.94 0.00 0.00 57.00 54.65 3c4f n GLN 743 Cb 0.25 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.06 3c4f n GLN 743 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3c4f s ARG 744 N -2.84 3.95 0.96 -1.09 0.52 -0.84 -4.92 118.95 114.69 3c4f s ARG 744 Ca 0.17 0.90 -0.12 0.00 -0.52 0.00 0.00 55.73 56.17 3c4f s ARG 744 Cb 0.19 -2.18 0.16 0.00 0.52 0.00 0.00 34.95 33.65 3c4f s ARG 744 CO 0.58 -0.21 1.09 -1.25 0.02 0.00 0.00 175.30 175.52 3c4f s PRO 745 N -3.95 0.76 0.42 3.54 0.04 -1.26 -5.04 135.00 129.51 3c4f s PRO 745 Ca 0.58 0.94 0.05 0.00 0.04 0.00 0.00 61.00 62.61 3c4f s PRO 745 Cb -0.10 -1.74 0.01 0.00 0.04 0.00 0.00 34.50 32.70 3c4f s PRO 745 CO 0.30 -2.62 0.59 0.95 0.04 0.00 0.00 177.00 176.26 3c4f s THR 746 N -2.79 3.49 0.48 1.26 -4.23 -1.26 -4.94 115.64 107.65 3c4f s THR 746 Ca 0.65 -0.84 0.27 0.00 -1.18 0.00 0.00 61.69 60.58 3c4f s THR 746 Cb -0.20 -3.23 0.30 0.00 1.34 0.00 0.00 72.50 70.71 3c4f s THR 746 CO 0.59 -0.12 2.13 -0.26 -0.54 0.00 0.00 174.62 176.42 3c4f h PHE 747 N 0.57 0.00 0.10 3.99 0.04 -1.93 -1.01 116.94 118.70 3c4f h PHE 747 Ca -0.43 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.33 3c4f h PHE 747 Cb 1.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.42 3c4f h PHE 747 CO 0.41 0.08 -0.05 -0.22 -0.60 0.00 0.00 178.31 177.94 3c4f h LYS 748 N 0.00 -0.13 -0.75 1.51 3.64 -1.93 -1.48 116.57 117.43 3c4f h LYS 748 Ca -0.00 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 3c4f h LYS 748 Cb 0.22 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 3c4f h LYS 748 CO 0.01 0.14 0.24 1.96 -2.27 0.00 0.00 179.45 179.53 3c4f h GLN 749 N -0.39 1.15 -0.77 1.90 4.20 -1.81 -2.65 115.11 116.74 3c4f h GLN 749 Ca -0.01 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.42 3c4f h GLN 749 Cb 0.32 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 3c4f h GLN 749 CO 0.02 0.97 0.34 -0.07 -0.67 0.00 0.00 178.83 179.42 3c4f h LEU 750 N 1.11 1.03 -0.64 1.46 3.38 -1.11 -0.61 115.31 119.93 3c4f h LEU 750 Ca 0.24 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3c4f h LEU 750 Cb 0.29 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3c4f h LEU 750 CO -0.01 0.89 0.14 0.58 0.09 0.00 0.00 178.44 180.13 3c4f h VAL 751 N 1.11 1.26 -0.10 1.22 2.07 -1.14 -0.11 116.25 120.56 3c4f h VAL 751 Ca 0.26 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 3c4f h VAL 751 Cb 0.16 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3c4f h VAL 751 CO -0.03 0.36 -0.02 -0.33 0.02 0.00 0.00 177.57 177.57 3c4f h GLU 752 N 0.95 0.19 -0.85 1.57 5.08 -1.05 -2.18 114.58 118.30 3c4f h GLU 752 Ca 0.20 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3c4f h GLU 752 Cb 0.39 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 3c4f h GLU 752 CO 0.01 0.50 0.39 -0.44 -1.00 0.00 0.00 179.01 178.47 3c4f h ASP 753 N -0.13 1.12 0.38 1.42 3.32 -1.07 -2.58 116.42 118.88 3c4f h ASP 753 Ca 0.03 -0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.82 3c4f h ASP 753 Cb 0.42 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 3c4f h ASP 753 CO 0.01 0.95 -0.47 -0.07 -1.72 0.00 0.00 179.24 177.94 3c4f h LEU 754 N 1.21 0.12 -0.35 1.55 3.38 -1.00 -0.26 115.31 119.97 3c4f h LEU 754 Ca 0.29 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 3c4f h LEU 754 Cb 0.14 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3c4f h LEU 754 CO -0.03 0.58 -0.01 -0.78 0.09 0.00 0.00 178.44 178.28 3c4f h ASP 755 N 0.09 0.61 -0.31 -0.43 3.58 -1.10 -1.08 116.42 117.79 3c4f h ASP 755 Ca 0.00 -0.32 -0.03 0.00 0.42 0.00 0.00 57.03 57.11 3c4f h ASP 755 Cb 0.87 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 3c4f h ASP 755 CO 0.07 0.78 0.08 -0.09 -2.88 0.00 0.00 179.24 177.20 3c4f h ARG 756 N 0.43 0.49 -0.72 0.28 2.43 -1.28 -2.75 114.38 113.26 3c4f h ARG 756 Ca 0.10 -0.12 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 3c4f h ARG 756 Cb 0.47 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 3c4f h ARG 756 CO 0.02 0.56 0.21 0.82 -1.51 0.00 0.00 179.97 180.06 3c4f h ILE 757 N 0.33 1.26 -0.72 1.20 2.04 -0.99 -2.54 117.51 118.09 3c4f h ILE 757 Ca 0.10 -0.93 0.01 0.00 1.00 0.00 0.00 64.86 65.04 3c4f h ILE 757 Cb 0.29 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 3c4f h ILE 757 CO 0.00 0.36 0.47 0.58 0.00 0.00 0.00 178.15 179.56 3c4f h VAL 758 N 1.08 1.17 -0.36 1.67 2.07 -1.14 -1.77 116.25 118.97 3c4f h VAL 758 Ca 0.23 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 3c4f h VAL 758 Cb 0.33 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 3c4f h VAL 758 CO -0.00 0.17 -0.06 0.00 0.02 0.00 0.00 177.57 177.70 3c4f h ALA 759 N 1.27 1.23 -0.49 1.67 0.00 -1.27 -2.89 119.26 118.77 3c4f h ALA 759 Ca 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3c4f h ALA 759 Cb -0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3c4f h ALA 759 CO -0.07 0.51 0.00 1.28 0.00 0.00 0.00 179.25 180.97 3c4f n LEU 760 N -4.22 3.50 -4.64 0.00 4.77 -0.92 -4.90 117.00 110.59 3c4f n LEU 760 Ca 0.01 -1.76 -0.35 0.00 -0.03 0.00 0.00 56.01 53.89 3c4f n LEU 760 Cb 0.30 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 40.82 3c4f n LEU 760 CO 0.40 0.64 -0.27 -0.89 -1.33 0.00 0.00 177.39 175.95 3c4f s THR 761 N -1.68 4.65 0.06 -5.08 2.01 -0.71 -5.04 115.64 109.86 3c4f s THR 761 Ca 0.37 -0.09 -0.32 0.00 0.31 0.00 0.00 61.69 61.96 3c4f s THR 761 Cb 0.23 -3.06 -0.11 0.00 0.01 0.00 0.00 72.50 69.56 3c4f s THR 761 CO 0.19 0.50 1.83 -1.20 -0.69 0.00 0.00 174.62 175.25 3c4f n SER 762 N 3.23 3.74 0.21 3.53 7.64 -1.26 -4.80 113.62 125.90 3c4f n SER 762 Ca -0.17 0.99 0.07 0.00 1.01 0.00 0.00 58.87 60.76 3c4f n SER 762 Cb 0.53 -1.47 0.46 0.00 -1.01 0.00 0.00 64.21 62.71 3c4f n SER 762 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 3c4f h ASN 763 N 8.61 0.00 0.00 6.43 -0.00 -1.97 -3.29 115.58 125.36 3c4f h ASN 763 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.83 3c4f h ASN 763 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.56 3c4f h ASN 763 CO 0.94 0.29 0.00 1.67 -0.00 0.00 0.00 177.43 180.33 3c4f n GLN 764 N -3.73 0.00 0.00 6.67 -0.06 -1.26 -4.70 117.38 114.30 3c4f n GLN 764 Ca -0.01 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.10 3c4f n GLN 764 Cb 0.40 0.00 0.69 0.00 -4.06 0.00 0.00 30.24 27.26 3c4f n GLN 764 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01