#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gen s GLY 462 N 0.00 1.58 0.51 -0.72 0.00 -1.26 -5.12 107.32 102.32 1gen s GLY 462 Ca 0.00 -1.59 -0.20 0.00 0.00 0.00 0.00 44.72 42.94 1gen s GLY 462 CO 0.00 -1.64 1.08 2.56 0.00 0.00 0.00 173.10 175.10 1gen s PRO 463 N -3.73 3.59 0.27 2.90 0.04 -1.26 -4.99 135.00 131.82 1gen s PRO 463 Ca 0.32 1.48 -0.31 0.00 0.04 0.00 0.00 61.00 62.53 1gen s PRO 463 Cb -0.07 -2.05 -0.13 0.00 0.04 0.00 0.00 34.50 32.30 1gen s PRO 463 CO 0.21 -0.63 1.49 0.28 0.04 0.00 0.00 177.00 178.39 1gen n VAL 464 N -1.13 1.03 -4.50 -0.36 0.31 -1.26 -5.03 118.33 107.40 1gen n VAL 464 Ca 0.10 -0.26 -0.23 0.00 -0.01 0.00 0.00 64.34 63.94 1gen n VAL 464 Cb 0.52 -1.70 -0.10 0.00 -0.91 0.00 0.00 33.84 31.65 1gen n VAL 464 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1gen s THR 465 N -0.08 1.30 0.59 2.52 -4.23 -1.26 -5.13 115.64 109.35 1gen s THR 465 Ca 0.66 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 59.00 1gen s THR 465 Cb -0.58 -2.78 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 1gen s THR 465 CO 0.50 0.00 1.08 -2.84 -0.54 0.00 0.00 174.62 172.81 1gen s PRO 466 N -3.84 3.24 -0.23 3.99 0.02 -1.26 -5.02 135.00 131.90 1gen s PRO 466 Ca 0.34 1.32 0.02 0.00 0.02 0.00 0.00 61.00 62.70 1gen s PRO 466 Cb 0.08 -2.02 0.05 0.00 0.02 0.00 0.00 34.50 32.64 1gen s PRO 466 CO 0.15 -0.89 -0.10 -1.21 -0.33 0.00 0.00 177.00 174.63 1gen s GLU 467 N -3.89 2.09 0.76 5.54 2.02 -1.26 -4.74 118.70 119.22 1gen s GLU 467 Ca 0.66 -1.11 -0.12 0.00 0.02 0.00 0.00 54.97 54.43 1gen s GLU 467 Cb -0.18 -2.68 0.05 0.00 0.10 0.00 0.00 34.13 31.42 1gen s GLU 467 CO 0.35 -0.52 1.11 0.96 0.02 0.00 0.00 175.26 177.18 1gen s ILE 468 N 1.26 3.11 0.00 -1.63 -4.36 -1.26 -2.13 121.20 116.19 1gen s ILE 468 Ca -0.05 0.40 0.00 0.00 -0.26 0.00 0.00 60.65 60.74 1gen s ILE 468 Cb -0.18 -2.85 0.00 0.00 1.25 0.00 0.00 42.46 40.68 1gen s ILE 468 CO -0.07 -0.43 0.00 0.00 0.24 0.00 0.00 174.94 174.68 1gen h LYS 470 N 0.00 0.00 -5.42 0.00 1.79 -2.00 -3.45 116.57 107.49 1gen h LYS 470 Ca 0.00 0.00 -0.50 0.00 -2.18 0.00 0.00 60.65 57.97 1gen h LYS 470 Cb 0.00 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 30.51 1gen h LYS 470 CO 0.00 0.00 -0.64 -0.65 -1.08 0.00 0.00 179.45 177.08 1gen s GLN 471 N -3.39 1.62 -0.57 3.15 -0.21 -0.91 -5.02 119.66 114.34 1gen s GLN 471 Ca 0.05 -1.86 -0.16 0.00 0.02 0.00 0.00 55.36 53.41 1gen s GLN 471 Cb 0.08 -1.10 0.14 0.00 1.00 0.00 0.00 33.01 33.13 1gen s GLN 471 CO 0.57 -0.05 0.52 -0.51 -2.12 0.00 0.00 175.29 173.70 1gen s ASP 472 N -3.48 6.23 -0.19 5.90 1.01 -1.26 -4.84 116.67 120.04 1gen s ASP 472 Ca 0.32 -1.88 -0.13 0.00 0.71 0.00 0.00 52.55 51.57 1gen s ASP 472 Cb 0.06 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.74 1gen s ASP 472 CO 0.14 -0.83 0.25 -0.63 0.21 0.00 0.00 175.17 174.31 1gen s ILE 473 N 1.45 5.33 -0.21 0.77 1.01 -1.26 -5.05 121.20 123.23 1gen s ILE 473 Ca 0.05 0.43 -0.08 0.00 0.00 0.00 0.00 60.65 61.05 1gen s ILE 473 Cb -0.28 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1gen s ILE 473 CO 0.02 0.38 0.08 0.68 0.00 0.00 0.00 174.94 176.10 1gen s VAL 474 N 0.62 4.74 0.53 2.92 -7.23 -1.26 -4.98 120.40 115.73 1gen s VAL 474 Ca 0.14 -0.04 -0.18 0.00 -1.81 0.00 0.00 61.98 60.09 1gen s VAL 474 Cb -0.13 -3.17 -0.07 0.00 0.56 0.00 0.00 36.38 33.57 1gen s VAL 474 CO 0.03 0.40 1.02 -0.36 -0.31 0.00 0.00 175.10 175.88 1gen s PHE 475 N 0.89 3.16 0.04 2.82 0.08 -1.26 -4.95 117.98 118.77 1gen s PHE 475 Ca 0.04 1.52 -0.16 0.00 0.12 0.00 0.00 56.93 58.46 1gen s PHE 475 Cb -0.14 -2.94 -0.29 0.00 -0.57 0.00 0.00 43.02 39.08 1gen s PHE 475 CO 0.03 -0.73 1.09 -0.44 -0.10 0.00 0.00 175.22 175.07 1gen h ASP 476 N 1.00 0.83 -5.02 1.36 3.32 -1.25 -3.44 116.42 113.23 1gen h ASP 476 Ca -0.48 -0.82 -0.04 0.00 0.02 0.00 0.00 57.03 55.71 1gen h ASP 476 Cb 1.21 -0.26 -0.14 0.00 0.22 0.00 0.00 39.33 40.35 1gen h ASP 476 CO 0.59 1.57 0.12 -0.83 -1.72 0.00 0.00 179.24 178.97 1gen s GLY 477 N -4.40 -0.51 -0.03 2.75 0.00 -1.25 -3.98 107.32 99.91 1gen s GLY 477 Ca -0.10 0.52 -0.02 0.00 0.00 0.00 0.00 44.72 45.12 1gen s GLY 477 CO 0.92 0.21 0.07 -0.42 0.00 0.00 0.00 173.10 173.87 1gen s ILE 478 N -3.12 -0.01 -0.14 0.90 1.01 -1.26 -1.36 121.20 117.21 1gen s ILE 478 Ca -0.02 0.05 -0.21 0.00 0.00 0.00 0.00 60.65 60.47 1gen s ILE 478 Cb -0.00 -0.11 0.05 0.00 0.01 0.00 0.00 42.46 42.41 1gen s ILE 478 CO -0.07 0.02 0.54 0.00 0.00 0.00 0.00 174.94 175.43 1gen s ALA 479 N 0.30 -1.35 -0.33 9.38 0.00 -0.99 -4.40 121.76 124.37 1gen s ALA 479 Ca -0.02 1.31 -0.16 0.00 0.00 0.00 0.00 51.96 53.09 1gen s ALA 479 Cb -0.03 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1gen s ALA 479 CO -0.01 -0.28 0.42 -1.14 0.00 0.00 0.00 175.76 174.75 1gen s GLN 480 N -0.27 3.68 -0.17 0.00 0.74 -1.26 0.04 119.66 122.42 1gen s GLN 480 Ca -0.04 -0.23 0.01 0.00 0.05 0.00 0.00 55.36 55.15 1gen s GLN 480 Cb -0.03 -3.78 0.02 0.00 1.10 0.00 0.00 33.01 30.32 1gen s GLN 480 CO 0.03 -0.52 -0.18 0.42 -0.55 0.00 0.00 175.29 174.49 1gen s ILE 481 N 2.17 1.92 -1.24 -2.34 1.01 0.14 -4.48 121.20 118.38 1gen s ILE 481 Ca 0.15 -0.87 -0.09 0.00 0.00 0.00 0.00 60.65 59.85 1gen s ILE 481 Cb -0.16 -1.76 -0.01 0.00 0.01 0.00 0.00 42.46 40.54 1gen s ILE 481 CO 0.12 0.50 0.70 0.54 0.00 0.00 0.00 174.94 176.80 1gen n ARG 482 N 4.66 -2.91 -0.98 2.79 1.74 -1.26 -1.44 116.66 119.25 1gen n ARG 482 Ca -0.20 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 1gen n ARG 482 Cb 0.50 -4.69 0.00 0.00 -1.02 0.00 0.00 32.46 27.25 1gen n ARG 482 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gen n GLY 483 N -1.67 0.17 3.40 -0.13 0.00 -1.26 -5.01 105.19 100.69 1gen n GLY 483 Ca -0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 1gen n GLY 483 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gen s GLU 484 N -1.31 2.14 -0.14 1.61 2.02 -0.52 -4.78 118.70 117.72 1gen s GLU 484 Ca 0.00 -0.92 -0.21 0.00 0.02 0.00 0.00 54.97 53.86 1gen s GLU 484 Cb 0.00 -2.15 -0.03 0.00 0.10 0.00 0.00 34.13 32.05 1gen s GLU 484 CO 0.00 0.56 0.60 0.42 0.02 0.00 0.00 175.26 176.86 1gen s ILE 485 N -0.76 5.08 -0.09 -1.63 1.01 0.14 0.28 121.20 125.25 1gen s ILE 485 Ca 0.12 1.18 0.00 0.00 0.00 0.00 0.00 60.65 61.95 1gen s ILE 485 Cb -0.10 -3.93 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1gen s ILE 485 CO 0.02 0.22 -0.08 -0.36 0.00 0.00 0.00 174.94 174.73 1gen s PHE 486 N 1.20 2.91 -0.15 3.97 0.40 0.11 -1.66 117.98 124.75 1gen s PHE 486 Ca 0.30 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.51 1gen s PHE 486 Cb -0.16 -1.75 -0.00 0.00 0.51 0.00 0.00 43.02 41.62 1gen s PHE 486 CO 0.12 0.20 -0.16 -0.06 0.70 0.00 0.00 175.22 176.02 1gen s PHE 487 N -0.50 2.77 -0.13 0.36 0.40 -0.37 -2.35 117.98 118.16 1gen s PHE 487 Ca 0.07 -1.03 -0.03 0.00 -0.60 0.00 0.00 56.93 55.34 1gen s PHE 487 Cb -0.12 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.50 1gen s PHE 487 CO 0.02 -0.46 -0.01 -0.06 0.70 0.00 0.00 175.22 175.41 1gen s PHE 488 N 0.76 3.09 -0.12 0.36 0.40 -0.46 -1.97 117.98 120.04 1gen s PHE 488 Ca -0.06 -0.08 -0.04 0.00 -0.60 0.00 0.00 56.93 56.15 1gen s PHE 488 Cb -0.15 -1.91 0.06 0.00 0.51 0.00 0.00 43.02 41.52 1gen s PHE 488 CO 0.01 0.16 0.18 0.21 0.70 0.00 0.00 175.22 176.47 1gen s LYS 489 N -0.06 0.08 3.13 0.44 2.47 -0.04 -0.80 119.74 124.96 1gen s LYS 489 Ca 0.03 0.43 0.00 0.00 -1.56 0.00 0.00 55.97 54.87 1gen s LYS 489 Cb -0.13 -0.61 0.00 0.00 -1.46 0.00 0.00 37.83 35.63 1gen s LYS 489 CO 0.02 -0.42 0.00 -0.25 0.16 0.00 0.00 175.35 174.86 1gen n ASP 490 N 5.32 0.00 -0.39 1.43 8.00 -1.26 -0.33 116.55 129.32 1gen n ASP 490 Ca -0.05 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.49 1gen n ASP 490 Cb 0.50 0.00 0.15 0.00 -0.02 0.00 0.00 41.12 41.75 1gen n ASP 490 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1gen n ARG 491 N 14.00 1.49 -4.36 -1.24 1.74 -1.09 -4.30 116.66 122.90 1gen n ARG 491 Ca 0.00 -0.76 -0.20 0.00 -0.77 0.00 0.00 57.85 56.11 1gen n ARG 491 Cb 0.00 -1.20 -0.10 0.00 -1.02 0.00 0.00 32.46 30.14 1gen n ARG 491 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1gen s PHE 492 N -1.73 1.82 0.04 -1.55 0.08 0.55 -1.10 117.98 116.09 1gen s PHE 492 Ca 0.17 -0.51 0.02 0.00 0.12 0.00 0.00 56.93 56.73 1gen s PHE 492 Cb 0.09 -0.85 -0.03 0.00 -0.57 0.00 0.00 43.02 41.66 1gen s PHE 492 CO 0.12 0.40 -0.07 0.96 -0.10 0.00 0.00 175.22 176.53 1gen s ILE 493 N -2.63 0.51 0.14 0.64 -5.25 -0.36 -0.86 121.20 113.38 1gen s ILE 493 Ca 0.21 -1.13 0.10 0.00 -0.99 0.00 0.00 60.65 58.85 1gen s ILE 493 Cb -0.03 -0.66 -0.04 0.00 2.95 0.00 0.00 42.46 44.68 1gen s ILE 493 CO 0.08 -0.44 -0.25 0.26 -1.79 0.00 0.00 174.94 172.81 1gen s TRP 494 N -1.58 2.18 0.04 1.37 0.51 -0.83 0.10 118.94 120.73 1gen s TRP 494 Ca -0.09 -0.39 -0.02 0.00 -2.12 0.00 0.00 56.10 53.48 1gen s TRP 494 Cb -0.09 -1.15 -0.03 0.00 -0.81 0.00 0.00 33.47 31.39 1gen s TRP 494 CO -0.00 0.34 0.00 -0.98 -0.51 0.00 0.00 176.95 175.81 1gen s ARG 495 N -2.19 0.50 0.28 4.98 1.70 -0.47 -1.24 118.95 122.50 1gen s ARG 495 Ca 0.14 -0.89 -0.15 0.00 -0.47 0.00 0.00 55.73 54.37 1gen s ARG 495 Cb -0.09 0.18 0.01 0.00 -0.57 0.00 0.00 34.95 34.48 1gen s ARG 495 CO 0.06 -0.10 0.57 -0.08 -1.08 0.00 0.00 175.30 174.68 1gen s THR 496 N -2.72 0.00 -0.04 4.99 -1.32 -0.67 -0.48 115.64 115.40 1gen s THR 496 Ca -0.04 -1.27 0.11 0.00 -1.21 0.00 0.00 61.69 59.27 1gen s THR 496 Cb -0.01 -2.23 -0.16 0.00 -1.51 0.00 0.00 72.50 68.59 1gen s THR 496 CO -0.05 0.00 0.18 0.52 -2.21 0.00 0.00 174.62 173.05 1gen n VAL 497 N -0.43 0.23 -3.91 5.08 0.31 -1.26 -0.68 118.33 117.66 1gen n VAL 497 Ca -0.03 -0.31 -0.14 0.00 -0.01 0.00 0.00 64.34 63.85 1gen n VAL 497 Cb 0.61 -0.07 -0.15 0.00 -0.91 0.00 0.00 33.84 33.32 1gen n VAL 497 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1gen s THR 498 N -2.61 0.09 0.17 2.52 2.01 -1.26 -4.75 115.64 111.82 1gen s THR 498 Ca -0.04 0.02 -0.26 0.00 0.31 0.00 0.00 61.69 61.71 1gen s THR 498 Cb 0.06 -0.13 0.02 0.00 0.01 0.00 0.00 72.50 72.46 1gen s THR 498 CO 0.45 0.06 1.56 1.55 -0.69 0.00 0.00 174.62 177.55 1gen h PRO 499 N 6.54 -0.18 -0.98 4.92 0.13 -1.88 -2.49 132.00 138.06 1gen h PRO 499 Ca -0.32 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1gen h PRO 499 Cb 1.18 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1gen h PRO 499 CO 0.50 -0.12 0.02 -2.13 -0.23 0.00 0.00 178.00 176.03 1gen n ARG 500 N -5.39 1.26 -4.40 0.86 0.63 -1.20 -4.25 116.66 104.18 1gen n ARG 500 Ca 0.02 -0.27 -0.34 0.00 -0.92 0.00 0.00 57.85 56.34 1gen n ARG 500 Cb 0.34 -1.42 -0.10 0.00 0.45 0.00 0.00 32.46 31.73 1gen n ARG 500 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1gen s ASP 501 N 0.21 5.06 -0.00 6.15 1.01 -0.94 -4.36 116.67 123.80 1gen s ASP 501 Ca 0.05 0.05 -0.30 0.00 0.71 0.00 0.00 52.55 53.06 1gen s ASP 501 Cb 0.04 -1.52 -0.08 0.00 1.01 0.00 0.00 42.92 42.37 1gen s ASP 501 CO 0.01 0.31 1.85 -0.75 0.21 0.00 0.00 175.17 176.81 1gen s LYS 502 N -0.51 4.14 0.66 8.23 2.20 -1.26 -4.63 119.74 128.58 1gen s LYS 502 Ca 0.08 2.45 -0.17 0.00 -0.36 0.00 0.00 55.97 57.97 1gen s LYS 502 Cb -0.12 -4.10 -0.00 0.00 -1.51 0.00 0.00 37.83 32.10 1gen s LYS 502 CO 0.02 -0.93 1.21 -2.14 -0.36 0.00 0.00 175.35 173.15 1gen s PRO 503 N 4.33 2.60 0.28 4.03 0.02 -1.26 -4.98 135.00 140.01 1gen s PRO 503 Ca 0.83 1.79 -0.23 0.00 0.02 0.00 0.00 61.00 63.41 1gen s PRO 503 Cb -0.39 -1.89 -0.09 0.00 0.02 0.00 0.00 34.50 32.15 1gen s PRO 503 CO 0.37 -1.49 0.84 -1.64 -0.33 0.00 0.00 177.00 174.75 1gen s MET 504 N -3.62 4.43 0.00 5.54 -1.94 0.37 -4.79 119.30 119.28 1gen s MET 504 Ca 0.76 1.11 0.00 0.00 -1.71 0.00 0.00 55.69 55.85 1gen s MET 504 Cb -0.30 -2.83 0.00 0.00 2.01 0.00 0.00 34.83 33.71 1gen s MET 504 CO 0.39 0.33 0.00 0.41 -0.01 0.00 0.00 175.02 176.14 1gen n GLY 505 N 0.63 -1.56 3.70 -0.03 0.00 -1.26 -1.37 105.19 105.30 1gen n GLY 505 Ca 0.00 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 1gen n GLY 505 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gen s PRO 506 N -1.70 4.38 0.63 1.61 0.04 -1.26 -5.03 135.00 133.67 1gen s PRO 506 Ca 0.00 1.80 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 1gen s PRO 506 Cb 0.00 -3.42 0.07 0.00 0.04 0.00 0.00 34.50 31.19 1gen s PRO 506 CO 0.00 -0.36 0.87 -0.51 0.04 0.00 0.00 177.00 177.05 1gen s LEU 507 N 1.52 3.12 -0.10 -3.56 2.01 0.12 -4.88 118.68 116.90 1gen s LEU 507 Ca 0.59 -0.11 -0.15 0.00 0.01 0.00 0.00 54.13 54.47 1gen s LEU 507 Cb -0.29 -2.55 -0.05 0.00 0.01 0.00 0.00 46.19 43.31 1gen s LEU 507 CO 0.27 -1.45 0.36 -0.76 1.01 0.00 0.00 176.35 175.79 1gen s LEU 508 N -4.94 4.32 0.49 1.79 1.43 -1.26 -1.22 118.68 119.29 1gen s LEU 508 Ca 0.61 0.71 0.16 0.00 -1.03 0.00 0.00 54.13 54.58 1gen s LEU 508 Cb -0.08 -2.50 1.16 0.00 0.03 0.00 0.00 46.19 44.80 1gen s LEU 508 CO 0.41 0.15 2.08 -0.37 0.23 0.00 0.00 176.35 178.85 1gen h VAL 509 N 4.39 1.04 -0.05 -1.59 -1.51 -1.40 -2.25 116.25 114.88 1gen h VAL 509 Ca -0.45 -0.31 0.01 0.00 -1.23 0.00 0.00 66.70 64.73 1gen h VAL 509 Cb 1.19 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.51 1gen h VAL 509 CO 0.71 0.09 0.09 0.00 -1.23 0.00 0.00 177.57 177.22 1gen h ALA 510 N 1.91 1.41 -0.07 5.19 0.00 -1.79 0.66 119.26 126.57 1gen h ALA 510 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gen h ALA 510 Cb 0.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1gen h ALA 510 CO 0.01 -0.11 0.00 0.25 0.00 0.00 0.00 179.25 179.40 1gen n THR 511 N -3.48 0.09 0.00 0.00 -2.24 -0.85 -3.03 114.28 104.77 1gen n THR 511 Ca -0.02 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1gen n THR 511 Cb 0.17 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 1gen n THR 511 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1gen n PHE 512 N -0.35 0.00 -3.50 4.78 3.01 0.01 -4.94 117.46 116.47 1gen n PHE 512 Ca 0.11 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.31 1gen n PHE 512 Cb 0.13 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.50 1gen n PHE 512 CO 0.00 0.00 0.00 0.91 1.01 0.00 0.00 176.76 178.68 1gen n TRP 513 N -1.86 0.64 0.29 1.38 8.01 -0.00 -4.48 117.44 121.43 1gen n TRP 513 Ca 0.00 -3.68 0.19 0.00 -1.31 0.00 0.00 57.50 52.70 1gen n TRP 513 Cb 0.28 -0.13 1.03 0.00 -2.01 0.00 0.00 31.31 30.47 1gen n TRP 513 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1gen h PRO 514 N 5.21 0.00 0.00 -0.99 0.13 -1.76 -2.77 132.00 131.81 1gen h PRO 514 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1gen h PRO 514 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1gen h PRO 514 CO 0.51 0.00 -0.76 0.39 -0.23 0.00 0.00 178.00 177.92 1gen n GLU 515 N -2.85 0.22 -2.18 0.86 4.71 -1.26 -4.91 120.64 115.23 1gen n GLU 515 Ca -0.03 0.03 -0.40 0.00 -0.01 0.00 0.00 57.16 56.75 1gen n GLU 515 Cb 0.09 -1.60 -0.02 0.00 -1.01 0.00 0.00 31.44 28.89 1gen n GLU 515 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1gen s LEU 516 N -3.80 4.40 0.00 -4.62 1.02 -1.04 -5.01 118.68 109.63 1gen s LEU 516 Ca 0.06 2.58 -0.16 0.00 0.02 0.00 0.00 54.13 56.64 1gen s LEU 516 Cb 0.15 -3.71 0.24 0.00 0.02 0.00 0.00 46.19 42.89 1gen s LEU 516 CO 0.75 -0.52 0.71 -0.81 0.02 0.00 0.00 176.35 176.50 1gen n PRO 517 N 0.72 -3.21 0.00 1.29 -0.04 -1.26 -4.91 135.00 127.59 1gen n PRO 517 Ca 0.01 -1.16 0.10 0.00 -0.04 0.00 0.00 63.50 62.41 1gen n PRO 517 Cb 0.43 -1.25 0.47 0.00 -0.04 0.00 0.00 33.50 33.11 1gen n PRO 517 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1gen n GLU 518 N -4.26 0.10 -3.70 0.54 4.71 -1.26 -4.60 120.64 112.19 1gen n GLU 518 Ca 0.10 0.13 -0.10 0.00 -0.01 0.00 0.00 57.16 57.28 1gen n GLU 518 Cb 0.42 -1.50 -0.11 0.00 -1.01 0.00 0.00 31.44 29.25 1gen n GLU 518 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1gen s LYS 519 N -2.85 0.41 0.45 3.49 2.20 -1.26 -2.67 119.74 119.51 1gen s LYS 519 Ca 0.13 0.79 0.08 0.00 -0.36 0.00 0.00 55.97 56.62 1gen s LYS 519 Cb 0.14 0.00 0.02 0.00 -1.51 0.00 0.00 37.83 36.48 1gen s LYS 519 CO 0.35 -0.15 0.58 0.96 -0.36 0.00 0.00 175.35 176.73 1gen s ILE 520 N 1.32 2.77 -0.03 5.43 -4.36 -1.26 -4.77 121.20 120.30 1gen s ILE 520 Ca -0.09 -1.06 0.04 0.00 -0.26 0.00 0.00 60.65 59.28 1gen s ILE 520 Cb -0.08 -2.83 -0.05 0.00 1.25 0.00 0.00 42.46 40.75 1gen s ILE 520 CO -0.12 0.00 0.04 0.47 0.24 0.00 0.00 174.94 175.57 1gen n ASP 521 N -1.87 4.03 -3.53 4.36 8.00 0.53 -4.67 116.55 123.39 1gen n ASP 521 Ca 0.08 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.47 1gen n ASP 521 Cb 0.60 0.80 -0.04 0.00 -0.02 0.00 0.00 41.12 42.46 1gen n ASP 521 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gen s ALA 522 N -2.16 -1.85 -0.15 2.24 0.00 -1.23 -4.14 121.76 114.45 1gen s ALA 522 Ca -0.02 1.29 -0.14 0.00 0.00 0.00 0.00 51.96 53.09 1gen s ALA 522 Cb 0.02 -0.12 0.04 0.00 0.00 0.00 0.00 23.12 23.06 1gen s ALA 522 CO 0.17 -0.47 0.41 0.08 0.00 0.00 0.00 175.76 175.94 1gen s VAL 523 N -1.94 -0.00 0.21 0.00 1.01 -1.26 -1.73 120.40 116.68 1gen s VAL 523 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 1gen s VAL 523 Cb -0.01 -0.57 -0.00 0.00 0.00 0.00 0.00 36.38 35.80 1gen s VAL 523 CO -0.01 0.00 0.38 -0.72 0.00 0.00 0.00 175.10 174.75 1gen s TYR 524 N 0.23 0.38 -0.18 5.22 1.13 -0.71 -4.44 117.35 118.98 1gen s TYR 524 Ca -0.00 -0.73 -0.01 0.00 -1.41 0.00 0.00 57.07 54.92 1gen s TYR 524 Cb -0.03 0.06 0.00 0.00 -1.10 0.00 0.00 41.96 40.89 1gen s TYR 524 CO 0.00 -0.85 -0.13 -2.00 -2.51 0.00 0.00 175.55 170.06 1gen s GLU 525 N -3.99 3.22 -0.09 -3.49 2.12 -1.26 -0.56 118.70 114.64 1gen s GLU 525 Ca 0.20 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.51 1gen s GLU 525 Cb 0.01 -2.74 -0.03 0.00 0.26 0.00 0.00 34.13 31.63 1gen s GLU 525 CO 0.04 -0.11 1.39 0.00 -0.54 0.00 0.00 175.26 176.04 1gen s ALA 526 N 1.15 3.62 -0.03 6.30 0.00 0.83 -4.61 121.76 129.02 1gen s ALA 526 Ca 0.01 0.69 -0.26 0.00 0.00 0.00 0.00 51.96 52.40 1gen s ALA 526 Cb -0.14 -3.64 -0.21 0.00 0.00 0.00 0.00 23.12 19.13 1gen s ALA 526 CO -0.05 -1.14 1.24 -1.00 0.00 0.00 0.00 175.76 174.81 1gen h PRO 527 N 8.41 0.00 0.00 0.00 0.13 -1.93 0.13 132.00 138.74 1gen h PRO 527 Ca -0.33 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1gen h PRO 527 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1gen h PRO 527 CO 0.94 0.51 0.00 0.94 -0.23 0.00 0.00 178.00 180.17 1gen n GLN 528 N -4.84 0.00 0.15 0.86 7.27 -1.26 -2.25 117.38 117.31 1gen n GLN 528 Ca -0.09 0.57 0.12 0.00 0.07 0.00 0.00 57.00 57.68 1gen n GLN 528 Cb 0.26 -1.44 0.56 0.00 2.41 0.00 0.00 30.24 32.03 1gen n GLN 528 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1gen n GLU 529 N -2.07 0.17 -3.35 3.69 0.28 -1.21 -4.83 120.64 113.31 1gen n GLU 529 Ca 0.00 0.54 -0.22 0.00 -0.16 0.00 0.00 57.16 57.32 1gen n GLU 529 Cb 0.00 -1.94 -0.01 0.00 1.43 0.00 0.00 31.44 30.92 1gen n GLU 529 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1gen n GLU 530 N -2.28 -2.97 -3.67 3.44 1.02 0.45 -4.99 120.64 111.64 1gen n GLU 530 Ca 0.00 0.39 -0.34 0.00 -0.02 0.00 0.00 57.16 57.19 1gen n GLU 530 Cb 0.13 -5.05 -0.05 0.00 -0.02 0.00 0.00 31.44 26.44 1gen n GLU 530 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1gen s LYS 531 N -5.98 3.65 -0.17 3.49 1.02 -1.15 -4.76 119.74 115.85 1gen s LYS 531 Ca 0.38 0.01 -0.11 0.00 0.02 0.00 0.00 55.97 56.27 1gen s LYS 531 Cb -0.21 -2.99 -0.05 0.00 -0.52 0.00 0.00 37.83 34.06 1gen s LYS 531 CO 0.47 0.57 0.21 0.00 -0.92 0.00 0.00 175.35 175.68 1gen s ALA 532 N -1.42 3.67 -0.14 5.17 0.00 -0.82 -0.12 121.76 128.10 1gen s ALA 532 Ca 0.33 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.75 1gen s ALA 532 Cb -0.13 -2.25 0.01 0.00 0.00 0.00 0.00 23.12 20.75 1gen s ALA 532 CO 0.19 0.20 -0.21 0.08 0.00 0.00 0.00 175.76 176.02 1gen s VAL 533 N 0.18 2.16 -0.07 0.00 1.01 0.28 -1.22 120.40 122.74 1gen s VAL 533 Ca 0.13 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1gen s VAL 533 Cb -0.12 -1.86 -0.00 0.00 0.00 0.00 0.00 36.38 34.39 1gen s VAL 533 CO 0.02 0.55 -0.22 -0.36 0.00 0.00 0.00 175.10 175.09 1gen s PHE 534 N 0.76 2.22 -0.09 5.22 0.40 -0.41 -1.74 117.98 124.34 1gen s PHE 534 Ca -0.08 -0.76 -0.02 0.00 -0.60 0.00 0.00 56.93 55.47 1gen s PHE 534 Cb -0.16 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.85 1gen s PHE 534 CO -0.00 -0.28 -0.01 -0.06 0.70 0.00 0.00 175.22 175.57 1gen s PHE 535 N 0.12 3.11 -0.25 0.36 0.40 -0.71 -0.81 117.98 120.21 1gen s PHE 535 Ca -0.10 0.11 -0.04 0.00 -0.60 0.00 0.00 56.93 56.30 1gen s PHE 535 Cb -0.15 -1.80 0.14 0.00 0.51 0.00 0.00 43.02 41.72 1gen s PHE 535 CO 0.05 0.39 0.47 0.00 0.70 0.00 0.00 175.22 176.83 1gen s ALA 536 N -0.70 -1.50 0.00 5.36 0.00 -0.63 -0.34 121.76 123.94 1gen s ALA 536 Ca 0.11 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.53 1gen s ALA 536 Cb -0.12 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1gen s ALA 536 CO 0.02 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.08 1gen n GLY 537 N 5.40 1.95 2.19 0.00 0.00 -1.26 -2.59 105.19 110.87 1gen n GLY 537 Ca -0.05 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 1gen n GLY 537 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gen n ASN 538 N 2.92 6.18 -4.16 1.61 0.23 -0.93 -3.93 115.26 117.18 1gen n ASN 538 Ca 0.00 -3.75 -0.12 0.00 -0.53 0.00 0.00 54.58 50.19 1gen n ASN 538 Cb 0.00 -0.85 -0.10 0.00 -2.08 0.00 0.00 39.78 36.75 1gen n ASN 538 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1gen s GLU 539 N -3.65 0.82 0.05 -3.83 2.02 -1.07 -1.11 118.70 111.93 1gen s GLU 539 Ca 0.60 -1.26 -0.00 0.00 0.02 0.00 0.00 54.97 54.33 1gen s GLU 539 Cb 0.48 -0.28 -0.04 0.00 0.10 0.00 0.00 34.13 34.40 1gen s GLU 539 CO 0.02 0.01 -0.04 1.52 0.02 0.00 0.00 175.26 176.79 1gen s TYR 540 N -3.21 0.54 -0.02 1.61 1.13 -0.80 -1.61 117.35 114.99 1gen s TYR 540 Ca 0.09 -0.89 0.05 0.00 -1.41 0.00 0.00 57.07 54.90 1gen s TYR 540 Cb 0.02 -0.37 -0.01 0.00 -1.10 0.00 0.00 41.96 40.50 1gen s TYR 540 CO -0.03 -0.28 -0.15 -1.58 -2.51 0.00 0.00 175.55 170.99 1gen s TRP 541 N -3.19 1.42 -0.03 -3.49 0.51 0.01 -2.23 118.94 111.93 1gen s TRP 541 Ca 0.02 -0.30 0.06 0.00 -2.12 0.00 0.00 56.10 53.76 1gen s TRP 541 Cb 0.03 -0.93 -0.01 0.00 -0.81 0.00 0.00 33.47 31.75 1gen s TRP 541 CO -0.07 -0.05 -0.21 0.42 -0.51 0.00 0.00 176.95 176.53 1gen s ILE 542 N -0.28 1.71 0.08 2.03 1.01 -1.26 -1.29 121.20 123.20 1gen s ILE 542 Ca 0.04 -0.90 0.06 0.00 0.00 0.00 0.00 60.65 59.85 1gen s ILE 542 Cb -0.07 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 1gen s ILE 542 CO -0.00 0.48 -0.16 -0.31 0.00 0.00 0.00 174.94 174.95 1gen s TYR 543 N -0.29 1.41 -0.30 3.97 1.51 -0.36 -1.88 117.35 121.40 1gen s TYR 543 Ca 0.03 -0.43 -0.01 0.00 -1.01 0.00 0.00 57.07 55.64 1gen s TYR 543 Cb -0.10 -0.79 0.05 0.00 -0.11 0.00 0.00 41.96 41.01 1gen s TYR 543 CO 0.01 0.10 0.00 -1.12 -1.11 0.00 0.00 175.55 173.43 1gen s SER 544 N -1.70 4.88 1.90 2.29 0.01 -0.20 -1.94 113.70 118.94 1gen s SER 544 Ca 0.01 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1gen s SER 544 Cb -0.10 -1.71 0.00 0.00 0.21 0.00 0.00 66.02 64.43 1gen s SER 544 CO 0.03 -0.27 0.00 0.00 0.41 0.00 0.00 173.24 173.41 1gen n ALA 545 N 4.60 0.00 -0.00 1.44 0.00 -1.26 -1.25 120.51 124.04 1gen n ALA 545 Ca -0.12 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.40 1gen n ALA 545 Cb 0.43 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.07 1gen n ALA 545 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1gen n SER 546 N 10.60 3.14 -4.57 0.00 7.64 -1.26 -4.92 113.62 124.25 1gen n SER 546 Ca 0.00 -1.92 -0.42 0.00 1.01 0.00 0.00 58.87 57.54 1gen n SER 546 Cb 0.00 -0.26 -0.06 0.00 -1.01 0.00 0.00 64.21 62.88 1gen n SER 546 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1gen s THR 547 N -1.11 4.86 0.26 0.44 2.01 -0.38 -4.81 115.64 116.90 1gen s THR 547 Ca 0.31 0.66 -0.29 0.00 0.31 0.00 0.00 61.69 62.68 1gen s THR 547 Cb 0.17 -4.10 -0.09 0.00 0.01 0.00 0.00 72.50 68.49 1gen s THR 547 CO 0.23 -0.33 1.26 -0.22 -0.69 0.00 0.00 174.62 174.88 1gen s LEU 548 N 2.78 4.45 0.68 4.42 2.96 -1.26 -1.03 118.68 131.67 1gen s LEU 548 Ca 0.26 2.48 -0.11 0.00 -0.22 0.00 0.00 54.13 56.53 1gen s LEU 548 Cb -0.14 -3.63 -0.00 0.00 0.50 0.00 0.00 46.19 42.92 1gen s LEU 548 CO 0.15 -0.45 1.06 -1.61 -1.32 0.00 0.00 176.35 174.18 1gen s GLU 549 N -1.01 3.04 -0.28 1.98 0.41 -0.79 -4.90 118.70 117.16 1gen s GLU 549 Ca 0.51 0.94 -0.14 0.00 -0.41 0.00 0.00 54.97 55.88 1gen s GLU 549 Cb -0.37 -2.00 -0.08 0.00 -1.78 0.00 0.00 34.13 29.90 1gen s GLU 549 CO 0.44 -1.02 0.89 2.89 -0.49 0.00 0.00 175.26 177.98 1gen n ARG 550 N -3.02 0.00 -1.90 1.61 1.85 -1.26 -2.23 116.66 111.71 1gen n ARG 550 Ca 0.07 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.82 1gen n ARG 550 Cb 0.54 -0.55 -0.02 0.00 -1.05 0.00 0.00 32.46 31.37 1gen n ARG 550 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1gen n GLY 551 N 2.59 0.34 3.84 2.89 0.00 -1.26 -5.04 105.19 108.55 1gen n GLY 551 Ca 0.22 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 1gen n GLY 551 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1gen s TYR 552 N -2.46 3.24 0.59 1.61 2.02 -0.95 -4.31 117.35 117.09 1gen s TYR 552 Ca 0.00 0.02 -0.19 0.00 -0.37 0.00 0.00 57.07 56.53 1gen s TYR 552 Cb 0.00 -1.56 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 1gen s TYR 552 CO 0.00 0.52 1.22 -1.25 -1.57 0.00 0.00 175.55 174.47 1gen s PRO 553 N -3.11 2.99 0.18 -1.71 0.04 -1.26 -4.96 135.00 127.18 1gen s PRO 553 Ca 0.32 1.88 0.09 0.00 0.04 0.00 0.00 61.00 63.33 1gen s PRO 553 Cb -0.10 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1gen s PRO 553 CO 0.25 -1.20 -0.13 0.15 0.04 0.00 0.00 177.00 176.11 1gen s LYS 554 N -3.27 1.94 0.73 4.56 1.02 -0.95 -4.94 119.74 118.84 1gen s LYS 554 Ca 0.77 -1.31 -0.13 0.00 0.02 0.00 0.00 55.97 55.32 1gen s LYS 554 Cb -0.32 -2.10 0.04 0.00 -0.52 0.00 0.00 37.83 34.93 1gen s LYS 554 CO 0.35 0.43 1.12 -1.25 -0.92 0.00 0.00 175.35 175.07 1gen s PRO 555 N -2.76 2.37 0.65 -1.68 0.04 -1.26 -1.91 135.00 130.46 1gen s PRO 555 Ca 0.24 1.35 0.39 0.00 0.04 0.00 0.00 61.00 63.02 1gen s PRO 555 Cb -0.09 -1.90 2.15 0.00 0.04 0.00 0.00 34.50 34.71 1gen s PRO 555 CO 0.14 -1.58 2.26 -0.07 0.04 0.00 0.00 177.00 177.79 1gen h LEU 556 N -0.61 0.00 -1.68 -3.56 3.38 -1.44 -0.20 115.31 111.20 1gen h LEU 556 Ca -0.45 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 1gen h LEU 556 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1gen h LEU 556 CO 0.51 0.00 -0.19 0.71 0.09 0.00 0.00 178.44 179.57 1gen h THR 557 N 0.00 0.83 0.00 0.22 1.35 -1.86 -1.46 112.91 111.99 1gen h THR 557 Ca 0.01 -0.73 0.00 0.00 -0.55 0.00 0.00 66.41 65.14 1gen h THR 557 Cb 0.15 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1gen h THR 557 CO -0.00 0.19 0.00 -1.20 -0.25 0.00 0.00 175.52 174.26 1gen n SER 558 N -3.87 0.63 -0.07 5.36 7.64 -0.09 -0.77 113.62 122.46 1gen n SER 558 Ca -0.02 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.64 1gen n SER 558 Cb 0.28 -0.79 0.34 0.00 -1.01 0.00 0.00 64.21 63.04 1gen n SER 558 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1gen n LEU 559 N -2.19 0.58 0.00 -3.43 7.94 -0.57 -4.89 117.00 114.43 1gen n LEU 559 Ca 0.02 -0.02 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1gen n LEU 559 Cb 0.23 -0.24 0.00 0.00 0.53 0.00 0.00 43.42 43.94 1gen n LEU 559 CO 0.20 0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.21 1gen n GLY 560 N 1.44 0.68 3.83 -3.96 0.00 0.05 -4.36 105.19 102.87 1gen n GLY 560 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1gen n GLY 560 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gen s LEU 561 N 0.00 3.81 0.64 0.99 2.01 -1.08 -4.93 118.68 120.12 1gen s LEU 561 Ca 0.00 1.67 -0.15 0.00 0.01 0.00 0.00 54.13 55.66 1gen s LEU 561 Cb 0.00 -4.53 -0.01 0.00 0.01 0.00 0.00 46.19 41.66 1gen s LEU 561 CO 0.00 -0.49 1.09 -2.84 1.01 0.00 0.00 176.35 175.11 1gen s PRO 562 N -3.51 2.97 0.00 1.29 0.02 -1.26 -3.93 135.00 130.58 1gen s PRO 562 Ca 0.61 1.29 0.17 0.00 0.02 0.00 0.00 61.00 63.09 1gen s PRO 562 Cb -0.10 -1.98 0.80 0.00 0.02 0.00 0.00 34.50 33.24 1gen s PRO 562 CO 0.20 -1.10 1.51 -0.35 -0.33 0.00 0.00 177.00 176.94 1gen n PRO 563 N -2.36 0.15 0.09 5.54 -0.04 -1.26 -1.82 135.00 135.30 1gen n PRO 563 Ca 0.10 0.16 -0.01 0.00 -0.04 0.00 0.00 63.50 63.70 1gen n PRO 563 Cb 0.52 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.44 1gen n PRO 563 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1gen h ASP 564 N 0.00 0.00 -3.43 3.54 3.04 -2.03 -3.42 116.42 114.11 1gen h ASP 564 Ca 0.00 0.00 -0.60 0.00 -3.24 0.00 0.00 57.03 53.19 1gen h ASP 564 Cb 0.20 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 38.40 1gen h ASP 564 CO 0.00 0.67 0.54 0.54 -2.04 0.00 0.00 179.24 178.95 1gen s VAL 565 N -2.87 4.67 -0.97 4.15 0.11 -0.76 -4.87 120.40 119.87 1gen s VAL 565 Ca 0.01 1.27 0.23 0.00 -2.93 0.00 0.00 61.98 60.57 1gen s VAL 565 Cb 0.08 -4.26 -0.13 0.00 -1.53 0.00 0.00 36.38 30.55 1gen s VAL 565 CO 0.78 -0.39 1.12 0.00 -3.33 0.00 0.00 175.10 173.28 1gen n GLN 566 N 6.51 0.02 -3.51 1.54 1.13 -1.26 -4.90 117.38 116.91 1gen n GLN 566 Ca 0.06 -0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.99 1gen n GLN 566 Cb 0.48 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.28 1gen n GLN 566 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 1gen s ARG 567 N -3.01 0.96 0.38 -1.09 1.70 -1.25 -2.19 118.95 114.44 1gen s ARG 567 Ca 0.09 -0.05 0.08 0.00 -0.47 0.00 0.00 55.73 55.38 1gen s ARG 567 Cb 0.17 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.96 1gen s ARG 567 CO 0.80 -0.36 0.23 0.14 -1.08 0.00 0.00 175.30 175.03 1gen s VAL 568 N -2.15 2.84 -0.26 4.99 -7.23 -1.26 -4.87 120.40 112.46 1gen s VAL 568 Ca -0.03 -1.56 -0.16 0.00 -1.81 0.00 0.00 61.98 58.42 1gen s VAL 568 Cb -0.01 -3.02 -0.13 0.00 0.56 0.00 0.00 36.38 33.78 1gen s VAL 568 CO -0.01 -0.09 -0.23 0.47 -0.31 0.00 0.00 175.10 174.93 1gen n ASP 569 N -1.30 1.93 -3.66 4.85 8.00 0.27 -4.56 116.55 122.08 1gen n ASP 569 Ca -0.01 0.36 -0.15 0.00 0.71 0.00 0.00 54.79 55.70 1gen n ASP 569 Cb 0.62 -0.85 -0.08 0.00 -0.02 0.00 0.00 41.12 40.79 1gen n ASP 569 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gen s ALA 570 N -2.49 -1.21 -0.10 2.24 0.00 -1.19 -4.25 121.76 114.76 1gen s ALA 570 Ca -0.36 0.78 -0.16 0.00 0.00 0.00 0.00 51.96 52.22 1gen s ALA 570 Cb 0.12 0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.29 1gen s ALA 570 CO 0.51 -0.30 0.41 0.00 0.00 0.00 0.00 175.76 176.37 1gen s ALA 571 N -1.20 -1.03 0.14 0.00 0.00 -1.26 -0.64 121.76 117.78 1gen s ALA 571 Ca -0.12 0.92 -0.17 0.00 0.00 0.00 0.00 51.96 52.59 1gen s ALA 571 Cb -0.03 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.75 1gen s ALA 571 CO 0.06 -0.23 0.44 -0.59 0.00 0.00 0.00 175.76 175.44 1gen s PHE 572 N -0.41 -0.24 -0.24 0.00 -0.71 -0.42 -4.21 117.98 111.75 1gen s PHE 572 Ca -0.05 -0.06 -0.10 0.00 -1.04 0.00 0.00 56.93 55.67 1gen s PHE 572 Cb -0.03 0.32 -0.05 0.00 -1.21 0.00 0.00 43.02 42.04 1gen s PHE 572 CO 0.03 -0.75 0.16 1.21 -1.34 0.00 0.00 175.22 174.53 1gen s ASN 573 N -2.80 6.09 -0.31 1.98 2.47 -1.26 -0.12 114.94 120.99 1gen s ASN 573 Ca 0.03 0.10 -0.20 0.00 0.42 0.00 0.00 52.86 53.21 1gen s ASN 573 Cb 0.01 -2.10 -0.01 0.00 -1.45 0.00 0.00 41.25 37.70 1gen s ASN 573 CO -0.11 0.06 0.62 0.86 -3.72 0.00 0.00 177.10 174.80 1gen s TRP 574 N 1.12 3.20 0.51 0.43 -0.00 0.06 -4.61 118.94 119.65 1gen s TRP 574 Ca 0.07 0.53 0.29 0.00 -0.00 0.00 0.00 56.10 56.99 1gen s TRP 574 Cb -0.14 -2.99 1.65 0.00 -0.00 0.00 0.00 33.47 31.99 1gen s TRP 574 CO 0.05 -0.49 2.17 0.66 -0.00 0.00 0.00 176.95 179.34 1gen h SER 575 N 8.24 0.00 -0.62 5.86 4.64 -1.93 0.28 113.55 130.02 1gen h SER 575 Ca -0.27 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.23 1gen h SER 575 Cb 1.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.18 1gen h SER 575 CO 0.80 0.06 0.50 0.50 -0.87 0.00 0.00 176.83 177.82 1gen h LYS 576 N 0.00 0.00 0.00 4.77 3.64 -1.94 -3.23 116.57 119.81 1gen h LYS 576 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1gen h LYS 576 Cb 0.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1gen h LYS 576 CO 0.01 0.00 0.00 0.27 -2.27 0.00 0.00 179.45 177.46 1gen n ASN 577 N -4.09 0.00 -1.52 4.20 2.04 -0.69 -5.02 115.26 110.18 1gen n ASN 577 Ca 0.12 -1.00 -0.09 0.00 -0.44 0.00 0.00 54.58 53.17 1gen n ASN 577 Cb 0.74 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.96 1gen n ASN 577 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1gen n LYS 578 N 0.00 -1.47 -3.41 -3.83 4.76 0.91 -4.97 118.16 110.15 1gen n LYS 578 Ca 0.00 0.49 -0.32 0.00 -2.87 0.00 0.00 58.31 55.61 1gen n LYS 578 Cb 0.43 -4.75 -0.05 0.00 -1.84 0.00 0.00 35.03 28.82 1gen n LYS 578 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1gen s LYS 579 N -3.24 3.83 -0.09 1.97 3.01 -1.24 -4.59 119.74 119.38 1gen s LYS 579 Ca 0.00 0.30 -0.17 0.00 -1.01 0.00 0.00 55.97 55.10 1gen s LYS 579 Cb 0.00 -2.68 -0.05 0.00 -1.01 0.00 0.00 37.83 34.09 1gen s LYS 579 CO 0.00 0.34 0.44 0.99 0.51 0.00 0.00 175.35 177.63 1gen s THR 580 N -1.77 5.16 -0.10 2.17 2.01 -0.13 -0.76 115.64 122.21 1gen s THR 580 Ca 0.46 0.88 -0.00 0.00 0.31 0.00 0.00 61.69 63.34 1gen s THR 580 Cb -0.12 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.60 1gen s THR 580 CO 0.21 0.40 -0.08 -0.31 -0.69 0.00 0.00 174.62 174.15 1gen s TYR 581 N 0.19 2.92 -0.14 4.92 1.51 0.83 -0.56 117.35 127.01 1gen s TYR 581 Ca 0.24 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 56.10 1gen s TYR 581 Cb -0.15 -1.80 0.01 0.00 -0.11 0.00 0.00 41.96 39.91 1gen s TYR 581 CO 0.10 0.11 -0.19 0.42 -1.11 0.00 0.00 175.55 174.88 1gen s ILE 582 N -0.24 1.91 -0.11 2.71 1.01 -0.77 -1.30 121.20 124.41 1gen s ILE 582 Ca 0.03 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.78 1gen s ILE 582 Cb -0.13 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 1gen s ILE 582 CO 0.03 0.52 -0.02 -0.36 0.00 0.00 0.00 174.94 175.11 1gen s PHE 583 N 1.03 3.09 -0.18 3.97 0.08 0.19 -1.10 117.98 125.06 1gen s PHE 583 Ca -0.03 0.01 -0.04 0.00 0.12 0.00 0.00 56.93 56.99 1gen s PHE 583 Cb -0.15 -1.85 0.09 0.00 -0.57 0.00 0.00 43.02 40.55 1gen s PHE 583 CO -0.05 0.27 0.28 0.00 -0.10 0.00 0.00 175.22 175.62 1gen s ALA 584 N -0.41 -0.59 0.00 5.36 0.00 -0.37 -0.57 121.76 125.19 1gen s ALA 584 Ca 0.07 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.76 1gen s ALA 584 Cb -0.12 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.74 1gen s ALA 584 CO 0.02 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1gen n GLY 585 N 5.34 3.67 0.95 0.00 0.00 -1.26 -1.29 105.19 112.60 1gen n GLY 585 Ca -0.06 0.22 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1gen n GLY 585 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gen n ASP 586 N 9.48 2.87 -4.47 1.61 5.68 -1.26 -1.67 116.55 128.79 1gen n ASP 586 Ca 0.00 -1.91 -0.24 0.00 -0.50 0.00 0.00 54.79 52.14 1gen n ASP 586 Cb 0.00 -0.15 -0.10 0.00 -1.14 0.00 0.00 41.12 39.73 1gen n ASP 586 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1gen s LYS 587 N -1.69 1.68 0.09 0.11 1.02 -0.41 -1.13 119.74 119.40 1gen s LYS 587 Ca 0.35 -1.76 -0.03 0.00 0.02 0.00 0.00 55.97 54.55 1gen s LYS 587 Cb 0.21 -1.78 -0.03 0.00 -0.52 0.00 0.00 37.83 35.72 1gen s LYS 587 CO 0.30 0.33 0.07 -0.59 -0.92 0.00 0.00 175.35 174.54 1gen s PHE 588 N -2.47 0.50 0.08 3.18 -0.71 0.06 -1.24 117.98 117.38 1gen s PHE 588 Ca 0.30 -0.97 0.09 0.00 -1.04 0.00 0.00 56.93 55.31 1gen s PHE 588 Cb -0.05 -0.30 -0.03 0.00 -1.21 0.00 0.00 43.02 41.42 1gen s PHE 588 CO 0.15 -0.48 -0.24 -1.58 -1.34 0.00 0.00 175.22 171.73 1gen s TRP 589 N -3.94 2.05 -0.16 3.49 0.51 -0.26 -0.92 118.94 119.72 1gen s TRP 589 Ca 0.11 -0.39 -0.00 0.00 -2.12 0.00 0.00 56.10 53.70 1gen s TRP 589 Cb 0.07 -1.18 0.00 0.00 -0.81 0.00 0.00 33.47 31.55 1gen s TRP 589 CO -0.07 0.19 -0.15 0.50 -0.51 0.00 0.00 176.95 176.91 1gen s ARG 590 N -1.57 3.20 -0.15 4.98 3.52 -1.26 -1.85 118.95 125.82 1gen s ARG 590 Ca 0.10 -0.75 -0.05 0.00 -0.13 0.00 0.00 55.73 54.90 1gen s ARG 590 Cb -0.10 -2.65 -0.03 0.00 -1.56 0.00 0.00 34.95 30.61 1gen s ARG 590 CO 0.03 -0.03 -0.00 -0.47 -0.81 0.00 0.00 175.30 174.02 1gen s TYR 591 N 0.94 3.12 -0.37 5.12 5.04 0.27 -0.52 117.35 130.95 1gen s TYR 591 Ca -0.03 -0.11 -0.24 0.00 -2.44 0.00 0.00 57.07 54.25 1gen s TYR 591 Cb -0.15 -1.97 0.01 0.00 0.35 0.00 0.00 41.96 40.20 1gen s TYR 591 CO -0.02 0.10 0.82 1.21 -1.34 0.00 0.00 175.55 176.32 1gen s ASN 592 N 0.18 6.58 0.24 4.32 3.04 0.29 -0.95 114.94 128.64 1gen s ASN 592 Ca 0.01 0.41 0.10 0.00 0.04 0.00 0.00 52.86 53.41 1gen s ASN 592 Cb -0.13 -2.41 0.21 0.00 -1.54 0.00 0.00 41.25 37.37 1gen s ASN 592 CO 0.02 -0.77 1.52 -0.33 -3.04 0.00 0.00 177.10 174.50 1gen h GLU 593 N 8.48 0.00 0.12 0.43 4.39 -1.85 -1.83 114.58 124.33 1gen h GLU 593 Ca -0.24 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.28 1gen h GLU 593 Cb 1.09 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.76 1gen h GLU 593 CO 0.93 0.70 -0.76 -0.39 -1.16 0.00 0.00 179.01 178.34 1gen h VAL 594 N 0.00 1.52 0.00 3.13 -1.51 -1.92 -3.18 116.25 114.29 1gen h VAL 594 Ca -0.01 -2.48 0.00 0.00 -1.23 0.00 0.00 66.70 62.98 1gen h VAL 594 Cb 1.29 3.15 0.00 0.00 -2.13 0.00 0.00 31.29 33.60 1gen h VAL 594 CO 0.09 0.70 0.00 0.29 -1.23 0.00 0.00 177.57 177.42 1gen n LYS 595 N -4.15 0.21 -4.10 5.19 5.02 -1.25 -4.90 118.16 114.18 1gen n LYS 595 Ca -0.13 0.08 -0.31 0.00 -2.02 0.00 0.00 58.31 55.93 1gen n LYS 595 Cb 0.79 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.28 1gen n LYS 595 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1gen n LYS 596 N -1.36 -3.19 -3.78 1.97 5.02 -0.71 -4.97 118.16 111.14 1gen n LYS 596 Ca 0.09 0.38 -0.10 0.00 -2.02 0.00 0.00 58.31 56.66 1gen n LYS 596 Cb 0.21 -4.77 -0.07 0.00 -0.02 0.00 0.00 35.03 30.38 1gen n LYS 596 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1gen s LYS 597 N -6.78 0.83 0.43 1.97 -2.85 -1.10 -5.00 119.74 107.25 1gen s LYS 597 Ca 0.36 -0.67 -0.25 0.00 -1.00 0.00 0.00 55.97 54.41 1gen s LYS 597 Cb -0.20 0.35 -0.08 0.00 -2.06 0.00 0.00 37.83 35.85 1gen s LYS 597 CO 0.91 -0.27 1.24 -1.64 0.10 0.00 0.00 175.35 175.69 1gen s MET 598 N -3.06 3.85 0.62 1.78 -1.94 -1.26 -0.55 119.30 118.73 1gen s MET 598 Ca -0.01 2.00 -0.15 0.00 -1.71 0.00 0.00 55.69 55.82 1gen s MET 598 Cb 0.01 -2.60 -0.02 0.00 2.01 0.00 0.00 34.83 34.22 1gen s MET 598 CO -0.07 -0.54 1.07 -0.51 -0.01 0.00 0.00 175.02 174.96 1gen s ASP 599 N -1.00 5.61 0.60 3.03 1.01 0.32 -4.80 116.67 121.43 1gen s ASP 599 Ca 0.60 1.83 -0.15 0.00 0.71 0.00 0.00 52.55 55.54 1gen s ASP 599 Cb -0.34 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.02 1gen s ASP 599 CO 0.43 -1.29 1.05 -2.84 0.21 0.00 0.00 175.17 172.73 1gen s PRO 600 N -4.17 3.36 0.00 8.23 0.02 -1.26 -4.14 135.00 137.03 1gen s PRO 600 Ca 0.64 1.13 0.00 0.00 0.02 0.00 0.00 61.00 62.78 1gen s PRO 600 Cb -0.17 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.31 1gen s PRO 600 CO 0.40 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 1gen n GLY 601 N -1.24 0.87 3.24 0.52 0.00 -1.26 -5.07 105.19 102.24 1gen n GLY 601 Ca 0.08 -0.59 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 1gen n GLY 601 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gen s PHE 602 N -2.29 1.22 0.66 1.61 0.08 -1.26 -4.50 117.98 113.50 1gen s PHE 602 Ca 0.00 -0.77 -0.16 0.00 0.12 0.00 0.00 56.93 56.12 1gen s PHE 602 Cb 0.00 -0.63 0.00 0.00 -0.57 0.00 0.00 43.02 41.83 1gen s PHE 602 CO 0.00 0.06 1.16 -1.25 -0.10 0.00 0.00 175.22 175.09 1gen s PRO 603 N -3.69 2.64 0.36 0.24 0.04 -1.26 -5.06 135.00 128.27 1gen s PRO 603 Ca 0.15 1.61 0.08 0.00 0.04 0.00 0.00 61.00 62.88 1gen s PRO 603 Cb 0.02 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1gen s PRO 603 CO -0.00 -1.42 0.22 0.15 0.04 0.00 0.00 177.00 176.00 1gen s LYS 604 N -3.84 2.45 0.02 4.56 1.02 -0.09 -4.89 119.74 118.97 1gen s LYS 604 Ca 0.72 -1.54 -0.23 0.00 0.02 0.00 0.00 55.97 54.93 1gen s LYS 604 Cb -0.25 -2.25 -0.05 0.00 -0.52 0.00 0.00 37.83 34.76 1gen s LYS 604 CO 0.40 0.02 0.71 -0.51 -0.92 0.00 0.00 175.35 175.04 1gen s LEU 605 N -3.94 4.43 0.19 3.17 1.43 -1.26 -0.76 118.68 121.94 1gen s LEU 605 Ca 0.41 1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 54.73 1gen s LEU 605 Cb -0.02 -3.12 0.21 0.00 0.03 0.00 0.00 46.19 43.29 1gen s LEU 605 CO 0.24 0.03 1.75 0.40 0.23 0.00 0.00 176.35 179.01 1gen h ILE 606 N 4.17 0.81 -0.52 -0.59 2.04 -1.42 0.06 117.51 122.06 1gen h ILE 606 Ca -0.44 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.33 1gen h ILE 606 Cb 1.20 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1gen h ILE 606 CO 0.71 0.07 0.35 0.00 0.00 0.00 0.00 178.15 179.27 1gen h ALA 607 N 1.37 1.78 0.00 1.87 0.00 -1.80 0.13 119.26 122.60 1gen h ALA 607 Ca 0.27 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 1gen h ALA 607 Cb 0.30 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1gen h ALA 607 CO -0.27 0.16 -0.70 -0.44 0.00 0.00 0.00 179.25 178.00 1gen h ASP 608 N 0.57 0.00 0.00 0.00 3.32 -1.61 -3.39 116.42 115.32 1gen h ASP 608 Ca 0.21 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.20 1gen h ASP 608 Cb 0.14 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1gen h ASP 608 CO -0.06 0.50 -1.50 0.00 -1.72 0.00 0.00 179.24 176.46 1gen n ALA 609 N -2.26 2.12 -2.73 3.45 0.00 -0.11 -5.00 120.51 115.99 1gen n ALA 609 Ca -0.00 -0.37 -0.24 0.00 0.00 0.00 0.00 53.44 52.82 1gen n ALA 609 Cb 0.75 -0.17 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 1gen n ALA 609 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1gen s TRP 610 N -2.48 2.93 -0.35 0.00 0.52 0.39 -5.07 118.94 114.89 1gen s TRP 610 Ca -0.04 -0.13 -0.12 0.00 0.02 0.00 0.00 56.10 55.83 1gen s TRP 610 Cb 0.05 -1.36 -0.00 0.00 -1.15 0.00 0.00 33.47 31.01 1gen s TRP 610 CO 0.38 0.55 0.22 1.21 0.02 0.00 0.00 176.95 179.32 1gen s ASN 611 N -3.43 5.85 -1.60 2.95 3.84 -1.26 -4.34 114.94 116.95 1gen s ASN 611 Ca 0.31 -0.62 0.00 0.00 0.21 0.00 0.00 52.86 52.75 1gen s ASN 611 Cb -0.08 -2.08 0.00 0.00 -0.55 0.00 0.00 41.25 38.54 1gen s ASN 611 CO 0.22 -0.28 0.00 0.00 -2.79 0.00 0.00 177.10 174.25 1gen n ALA 612 N 5.06 -0.41 -2.74 1.71 0.00 -1.26 -4.91 120.51 117.97 1gen n ALA 612 Ca -0.13 0.19 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 1gen n ALA 612 Cb 0.48 -1.84 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 1gen n ALA 612 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1gen s ILE 613 N -2.76 5.14 0.71 0.00 -1.09 -1.26 -5.07 121.20 116.86 1gen s ILE 613 Ca 0.00 0.10 -0.13 0.00 -2.23 0.00 0.00 60.65 58.39 1gen s ILE 613 Cb 0.00 -3.38 0.02 0.00 -1.58 0.00 0.00 42.46 37.52 1gen s ILE 613 CO 0.00 0.37 1.10 -2.16 -1.23 0.00 0.00 174.94 173.02 1gen s PRO 614 N 0.93 2.59 0.72 2.79 0.04 -1.26 -4.55 135.00 136.26 1gen s PRO 614 Ca 0.06 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.31 1gen s PRO 614 Cb -0.13 -1.93 0.07 0.00 0.04 0.00 0.00 34.50 32.55 1gen s PRO 614 CO 0.03 -1.40 1.03 -0.51 0.04 0.00 0.00 177.00 176.19 1gen s ASP 615 N -2.98 4.72 -1.16 6.66 1.01 -1.26 -4.36 116.67 119.29 1gen s ASP 615 Ca 0.64 0.42 -0.13 0.00 0.71 0.00 0.00 52.55 54.19 1gen s ASP 615 Cb -0.19 -1.03 -0.02 0.00 1.01 0.00 0.00 42.92 42.69 1gen s ASP 615 CO 0.48 -1.66 0.78 0.59 0.21 0.00 0.00 175.17 175.57 1gen n ASN 616 N -2.96 -4.58 -4.74 0.27 3.02 -0.67 -4.97 115.26 100.63 1gen n ASN 616 Ca 0.09 -0.92 -0.33 0.00 -0.03 0.00 0.00 54.58 53.38 1gen n ASN 616 Cb 0.60 -3.84 0.08 0.00 -0.61 0.00 0.00 39.78 36.02 1gen n ASN 616 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1gen s LEU 617 N -6.32 3.26 -0.17 3.41 1.43 -1.26 -4.94 118.68 114.09 1gen s LEU 617 Ca 0.36 2.15 -0.07 0.00 -1.03 0.00 0.00 54.13 55.54 1gen s LEU 617 Cb -0.11 -4.57 -0.23 0.00 0.03 0.00 0.00 46.19 41.32 1gen s LEU 617 CO 0.83 -2.10 0.19 0.47 0.23 0.00 0.00 176.35 175.97 1gen n ASP 618 N -2.86 2.06 -3.46 2.29 8.00 -0.03 -4.42 116.55 118.12 1gen n ASP 618 Ca 0.12 0.17 -0.12 0.00 0.71 0.00 0.00 54.79 55.67 1gen n ASP 618 Cb 0.51 -0.79 -0.03 0.00 -0.02 0.00 0.00 41.12 40.80 1gen n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gen s ALA 619 N -2.52 -1.70 -0.03 2.24 0.00 -1.18 -4.21 121.76 114.36 1gen s ALA 619 Ca -0.27 0.81 -0.12 0.00 0.00 0.00 0.00 51.96 52.38 1gen s ALA 619 Cb 0.07 0.54 0.02 0.00 0.00 0.00 0.00 23.12 23.76 1gen s ALA 619 CO 0.70 -0.66 0.26 0.08 0.00 0.00 0.00 175.76 176.14 1gen s VAL 620 N -3.03 0.05 0.01 0.00 1.01 -1.26 -1.14 120.40 116.03 1gen s VAL 620 Ca -0.00 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.34 1gen s VAL 620 Cb -0.01 -0.53 0.04 0.00 0.00 0.00 0.00 36.38 35.89 1gen s VAL 620 CO -0.07 -0.24 0.45 0.54 0.00 0.00 0.00 175.10 175.78 1gen s VAL 621 N -1.04 0.04 -0.16 2.92 0.11 -0.91 -4.49 120.40 116.87 1gen s VAL 621 Ca -0.11 -0.34 0.00 0.00 -2.93 0.00 0.00 61.98 58.60 1gen s VAL 621 Cb -0.05 -0.87 0.03 0.00 -1.53 0.00 0.00 36.38 33.96 1gen s VAL 621 CO 0.03 -0.19 -0.09 -0.62 -3.33 0.00 0.00 175.10 170.90 1gen s ASP 622 N -1.64 2.76 -0.01 3.54 -1.08 -1.26 -1.11 116.67 117.87 1gen s ASP 622 Ca -0.09 -0.58 -0.24 0.00 -0.52 0.00 0.00 52.55 51.13 1gen s ASP 622 Cb -0.02 -1.04 -0.05 0.00 -1.46 0.00 0.00 42.92 40.36 1gen s ASP 622 CO 0.02 -0.12 0.73 -0.76 0.52 0.00 0.00 175.17 175.55 1gen s LEU 623 N 1.56 4.39 0.00 -1.34 1.43 -1.26 -4.85 118.68 118.61 1gen s LEU 623 Ca 0.03 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.44 1gen s LEU 623 Cb -0.14 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.93 1gen s LEU 623 CO -0.09 -0.03 0.00 0.00 0.23 0.00 0.00 176.35 176.46 1gen n GLN 624 N 3.21 0.00 -3.61 1.70 6.02 -1.26 -1.81 117.38 121.63 1gen n GLN 624 Ca -0.02 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.61 1gen n GLN 624 Cb 0.51 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.70 1gen n GLN 624 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1gen n GLY 625 N 0.00 4.20 0.04 1.08 0.00 -1.26 -4.70 105.19 104.55 1gen n GLY 625 Ca 0.00 -2.61 -0.04 0.00 0.00 0.00 0.00 46.02 43.37 1gen n GLY 625 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gen n GLY 626 N 2.17 -0.42 2.05 -0.02 0.00 -0.75 -5.04 105.19 103.18 1gen n GLY 626 Ca 0.22 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1gen n GLY 626 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gen n GLY 627 N 2.49 0.42 3.04 -0.02 0.00 -1.26 -5.03 105.19 104.82 1gen n GLY 627 Ca -0.14 -0.90 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 1gen n GLY 627 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gen s HIS 628 N -2.09 0.87 0.06 1.61 3.76 -1.26 -1.58 115.29 116.66 1gen s HIS 628 Ca 0.00 -0.18 0.02 0.00 -0.15 0.00 0.00 55.06 54.75 1gen s HIS 628 Cb 0.00 -0.56 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 1gen s HIS 628 CO 0.00 -0.01 0.07 -1.12 -0.85 0.00 0.00 174.74 172.82 1gen s SER 629 N -0.32 5.49 -0.15 1.40 0.01 -0.70 -3.99 113.70 115.44 1gen s SER 629 Ca 0.03 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1gen s SER 629 Cb -0.04 -1.48 0.02 0.00 0.21 0.00 0.00 66.02 64.73 1gen s SER 629 CO -0.00 0.20 -0.14 -0.31 0.41 0.00 0.00 173.24 173.40 1gen s TYR 630 N -1.32 2.16 -0.21 2.43 2.02 -0.26 -0.78 117.35 121.39 1gen s TYR 630 Ca 0.27 -1.21 -0.06 0.00 -0.37 0.00 0.00 57.07 55.70 1gen s TYR 630 Cb -0.12 -1.59 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 1gen s TYR 630 CO 0.19 -0.66 0.03 -0.06 -1.57 0.00 0.00 175.55 173.47 1gen s PHE 631 N 1.48 3.08 -0.18 2.71 0.40 -0.03 -2.15 117.98 123.29 1gen s PHE 631 Ca 0.05 -0.37 -0.06 0.00 -0.60 0.00 0.00 56.93 55.95 1gen s PHE 631 Cb -0.13 -2.12 -0.03 0.00 0.51 0.00 0.00 43.02 41.25 1gen s PHE 631 CO -0.10 -0.21 0.02 -0.06 0.70 0.00 0.00 175.22 175.56 1gen s PHE 632 N 1.05 3.13 -0.11 0.36 0.40 -0.29 0.11 117.98 122.63 1gen s PHE 632 Ca 0.03 -0.14 -0.06 0.00 -0.60 0.00 0.00 56.93 56.16 1gen s PHE 632 Cb -0.14 -2.04 0.04 0.00 0.51 0.00 0.00 43.02 41.39 1gen s PHE 632 CO 0.02 0.03 0.27 0.21 0.70 0.00 0.00 175.22 176.44 1gen s LYS 633 N 0.47 0.25 6.90 0.44 2.20 -0.06 -0.85 119.74 129.08 1gen s LYS 633 Ca 0.00 0.52 0.00 0.00 -0.36 0.00 0.00 55.97 56.13 1gen s LYS 633 Cb -0.13 -0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.13 1gen s LYS 633 CO 0.02 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.28 1gen n GLY 634 N 3.94 3.90 0.91 5.54 0.00 -1.26 -1.90 105.19 116.33 1gen n GLY 634 Ca -0.22 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1gen n GLY 634 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gen n ALA 635 N 12.18 2.47 -2.44 4.61 0.00 -1.26 -4.84 120.51 131.23 1gen n ALA 635 Ca 0.00 -0.71 -0.22 0.00 0.00 0.00 0.00 53.44 52.51 1gen n ALA 635 Cb 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 19.45 18.46 1gen n ALA 635 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1gen s TYR 636 N -1.89 2.05 0.13 0.00 -0.85 -0.80 -1.40 117.35 114.60 1gen s TYR 636 Ca 0.32 -0.57 0.06 0.00 -0.52 0.00 0.00 57.07 56.36 1gen s TYR 636 Cb 0.21 -1.08 -0.04 0.00 0.38 0.00 0.00 41.96 41.42 1gen s TYR 636 CO 0.31 0.43 -0.15 1.52 -1.52 0.00 0.00 175.55 176.14 1gen s TYR 637 N -2.84 1.49 -0.07 -3.49 1.13 -0.87 -0.88 117.35 111.82 1gen s TYR 637 Ca 0.29 -0.54 0.02 0.00 -1.41 0.00 0.00 57.07 55.43 1gen s TYR 637 Cb 0.01 -0.77 -0.02 0.00 -1.10 0.00 0.00 41.96 40.08 1gen s TYR 637 CO 0.12 0.18 -0.13 -0.51 -2.51 0.00 0.00 175.55 172.71 1gen s LEU 638 N -2.53 2.81 -0.19 -3.49 1.02 0.12 -1.79 118.68 114.62 1gen s LEU 638 Ca 0.11 -0.19 0.01 0.00 0.02 0.00 0.00 54.13 54.08 1gen s LEU 638 Cb -0.05 -1.59 0.03 0.00 0.02 0.00 0.00 46.19 44.60 1gen s LEU 638 CO 0.04 0.31 -0.17 -0.75 0.02 0.00 0.00 176.35 175.80 1gen s LYS 639 N -0.53 2.70 -0.15 1.70 2.20 0.13 -0.85 119.74 124.94 1gen s LYS 639 Ca 0.07 -0.91 -0.06 0.00 -0.36 0.00 0.00 55.97 54.72 1gen s LYS 639 Cb -0.12 -2.58 -0.04 0.00 -1.51 0.00 0.00 37.83 33.59 1gen s LYS 639 CO 0.02 -0.30 0.05 -1.17 -0.36 0.00 0.00 175.35 173.58 1gen s LEU 640 N 1.28 3.80 -0.34 5.43 2.96 0.04 -0.62 118.68 131.23 1gen s LEU 640 Ca 0.02 0.14 -0.28 0.00 -0.22 0.00 0.00 54.13 53.79 1gen s LEU 640 Cb -0.15 -1.93 0.02 0.00 0.50 0.00 0.00 46.19 44.63 1gen s LEU 640 CO -0.11 0.26 1.02 -0.70 -1.32 0.00 0.00 176.35 175.51 1gen s GLU 641 N -0.17 3.99 0.38 1.98 2.56 -0.98 -1.73 118.70 124.74 1gen s GLU 641 Ca 0.07 0.89 0.11 0.00 0.00 0.00 0.00 54.97 56.04 1gen s GLU 641 Cb -0.12 -3.76 0.77 0.00 2.00 0.00 0.00 34.13 33.01 1gen s GLU 641 CO 0.01 -0.92 1.88 -0.91 -0.56 0.00 0.00 175.26 174.76 1gen h ASN 642 N 8.25 0.11 0.43 -1.70 2.35 -1.65 -2.04 115.58 121.33 1gen h ASN 642 Ca -0.22 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1gen h ASN 642 Cb 1.07 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.41 1gen h ASN 642 CO 1.01 0.37 -0.20 1.67 -1.65 0.00 0.00 177.43 178.64 1gen n GLN 643 N -4.20 0.52 -3.26 0.81 0.00 -1.26 -4.49 117.38 105.50 1gen n GLN 643 Ca -0.02 -0.22 -0.16 0.00 -0.00 0.00 0.00 57.00 56.60 1gen n GLN 643 Cb 0.33 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.01 1gen n GLN 643 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1gen s SER 644 N -2.63 0.66 0.45 1.69 1.04 -0.77 -4.99 113.70 109.15 1gen s SER 644 Ca 0.23 -1.90 0.31 0.00 0.48 0.00 0.00 55.95 55.07 1gen s SER 644 Cb 0.19 0.63 1.52 0.00 0.10 0.00 0.00 66.02 68.47 1gen s SER 644 CO 0.53 -0.20 1.94 -0.07 0.98 0.00 0.00 173.24 176.42 1gen h LEU 645 N 6.39 0.00 -1.02 2.42 3.38 -1.77 0.08 115.31 124.79 1gen h LEU 645 Ca 0.10 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1gen h LEU 645 Cb 1.04 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.74 1gen h LEU 645 CO 0.20 0.00 0.66 0.07 0.09 0.00 0.00 178.44 179.46 1gen h LYS 646 N 0.00 1.29 -4.78 1.13 2.10 -1.94 -3.42 116.57 110.95 1gen h LYS 646 Ca 0.00 -0.08 -0.69 0.00 -2.00 0.00 0.00 60.65 57.88 1gen h LYS 646 Cb 0.19 -0.29 -0.19 0.00 -0.90 0.00 0.00 32.23 31.03 1gen h LYS 646 CO 0.00 0.86 0.11 -1.54 -2.00 0.00 0.00 179.45 176.88 1gen s SER 647 N -6.09 6.19 -0.17 7.07 1.04 0.01 -5.01 113.70 116.74 1gen s SER 647 Ca -0.13 -1.29 -0.02 0.00 0.48 0.00 0.00 55.95 54.99 1gen s SER 647 Cb 0.18 -2.30 -0.01 0.00 0.10 0.00 0.00 66.02 63.99 1gen s SER 647 CO 0.82 -1.07 -0.09 -0.69 0.98 0.00 0.00 173.24 173.19 1gen s VAL 648 N 2.72 3.21 0.25 5.02 1.01 -1.26 -2.31 120.40 129.05 1gen s VAL 648 Ca 0.13 -0.57 0.12 0.00 0.00 0.00 0.00 61.98 61.65 1gen s VAL 648 Cb -0.23 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.70 1gen s VAL 648 CO 0.08 0.48 -0.19 -0.54 0.00 0.00 0.00 175.10 174.92 1gen s LYS 649 N 0.88 1.69 0.25 2.72 1.02 0.21 -4.92 119.74 121.60 1gen s LYS 649 Ca -0.02 -1.66 0.11 0.00 0.02 0.00 0.00 55.97 54.42 1gen s LYS 649 Cb -0.15 -1.83 -0.05 0.00 -0.52 0.00 0.00 37.83 35.28 1gen s LYS 649 CO 0.00 0.36 -0.19 -0.59 -0.92 0.00 0.00 175.35 174.01 1gen s PHE 650 N -2.22 2.16 0.19 3.18 -0.12 -1.26 0.20 117.98 120.11 1gen s PHE 650 Ca 0.27 -0.38 -0.06 0.00 -0.05 0.00 0.00 56.93 56.71 1gen s PHE 650 Cb -0.06 -0.96 0.02 0.00 -0.63 0.00 0.00 43.02 41.39 1gen s PHE 650 CO 0.14 0.62 0.36 0.41 -0.05 0.00 0.00 175.22 176.69 1gen n GLY 651 N -0.47 1.71 3.60 1.99 0.00 -0.74 -4.97 105.19 106.32 1gen n GLY 651 Ca -0.06 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.41 1gen n GLY 651 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gen s SER 652 N -2.02 5.27 0.11 1.61 0.15 -1.26 -2.05 113.70 115.52 1gen s SER 652 Ca 0.09 0.03 -0.18 0.00 0.70 0.00 0.00 55.95 56.59 1gen s SER 652 Cb -0.02 -1.80 -0.05 0.00 -1.71 0.00 0.00 66.02 62.45 1gen s SER 652 CO 0.07 0.23 1.67 0.40 1.20 0.00 0.00 173.24 176.80 1gen h ILE 653 N 4.78 1.17 -0.56 6.45 2.04 -1.54 -0.30 117.51 129.55 1gen h ILE 653 Ca -0.38 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 1gen h ILE 653 Cb 1.18 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1gen h ILE 653 CO 0.64 0.18 0.34 0.11 0.00 0.00 0.00 178.15 179.41 1gen h LYS 654 N 0.33 0.76 0.12 2.37 1.57 -1.95 0.18 116.57 119.95 1gen h LYS 654 Ca 0.10 -0.07 -0.27 0.00 -1.87 0.00 0.00 60.65 58.54 1gen h LYS 654 Cb 0.16 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1gen h LYS 654 CO -0.01 0.55 -1.20 0.66 -0.57 0.00 0.00 179.45 178.88 1gen h SER 655 N 0.76 0.54 0.14 0.86 4.64 -1.80 -1.60 113.55 117.08 1gen h SER 655 Ca 0.20 -0.53 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1gen h SER 655 Cb -0.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 1gen h SER 655 CO -0.04 1.39 -1.86 0.47 -0.87 0.00 0.00 176.83 175.92 1gen n ASP 656 N -3.63 0.12 -0.05 4.97 9.92 -0.13 -3.82 116.55 123.93 1gen n ASP 656 Ca -0.09 0.04 -0.06 0.00 -0.53 0.00 0.00 54.79 54.14 1gen n ASP 656 Cb 0.99 1.78 -0.07 0.00 -0.64 0.00 0.00 41.12 43.18 1gen n ASP 656 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1gen n TRP 657 N -2.31 0.00 1.02 1.24 7.02 0.59 -3.21 117.44 121.78 1gen n TRP 657 Ca -0.03 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.55 1gen n TRP 657 Cb 0.57 -0.49 -0.01 0.00 -2.42 0.00 0.00 31.31 28.95 1gen n TRP 657 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1gen n LEU 658 N -2.53 1.46 -3.56 -0.99 4.77 -1.03 -4.51 117.00 110.62 1gen n LEU 658 Ca -0.18 -0.58 -0.22 0.00 -0.03 0.00 0.00 56.01 55.00 1gen n LEU 658 Cb 0.80 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.91 1gen n LEU 658 CO 0.18 0.30 -0.03 0.61 -1.33 0.00 0.00 177.39 177.12 1gen n GLY 659 N 1.45 -0.73 0.40 -0.72 0.00 -1.04 -4.08 105.19 100.47 1gen n GLY 659 Ca 0.07 0.34 0.14 0.00 0.00 0.00 0.00 46.02 46.58 1gen n GLY 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32