#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qlv s LYS 461 N 0.00 0.16 0.00 2.98 2.47 -1.26 -5.18 119.74 118.91 2qlv s LYS 461 Ca 0.00 0.01 0.00 0.00 -1.56 0.00 0.00 55.97 54.42 2qlv s LYS 461 Cb 0.00 0.07 0.00 0.00 -1.46 0.00 0.00 37.83 36.44 2qlv s LYS 461 CO 0.00 -0.06 0.00 -0.85 0.16 0.00 0.00 175.35 174.60 2qlv n GLU 462 N 0.37 0.00 0.00 4.03 0.28 -1.26 -5.18 120.64 118.88 2qlv n GLU 462 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2qlv n GLU 462 Cb 0.58 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.45 2qlv n GLU 462 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2qlv n GLU 463 N -0.78 0.00 -0.57 3.44 -0.58 -1.26 -4.84 120.64 116.06 2qlv n GLU 463 Ca 0.00 0.00 -0.15 0.00 -0.42 0.00 0.00 57.16 56.59 2qlv n GLU 463 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2qlv n GLU 463 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2qlv n ASP 464 N 0.00 3.60 -4.11 1.62 -0.08 -1.26 -4.81 116.55 111.52 2qlv n ASP 464 Ca 0.00 -2.18 -0.26 0.00 -1.51 0.00 0.00 54.79 50.84 2qlv n ASP 464 Cb 0.00 -0.90 -0.16 0.00 2.34 0.00 0.00 41.12 42.40 2qlv n ASP 464 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2qlv s SER 465 N 3.36 2.10 -0.37 1.67 0.15 -1.26 -5.02 113.70 114.34 2qlv s SER 465 Ca 0.32 -0.35 0.07 0.00 0.70 0.00 0.00 55.95 56.69 2qlv s SER 465 Cb 0.10 -0.73 0.61 0.00 -1.71 0.00 0.00 66.02 64.29 2qlv s SER 465 CO -0.02 0.12 1.71 0.35 1.20 0.00 0.00 173.24 176.60 2qlv n THR 466 N 3.38 2.89 -3.60 6.45 -2.24 -1.26 -4.93 114.28 114.97 2qlv n THR 466 Ca -0.20 -2.22 -0.36 0.00 -2.27 0.00 0.00 64.05 59.00 2qlv n THR 466 Cb 0.53 -0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 68.29 2qlv n THR 466 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qlv s VAL 467 N -3.24 5.33 0.08 2.28 1.01 -1.26 -5.05 120.40 119.55 2qlv s VAL 467 Ca 0.51 0.39 -0.27 0.00 0.00 0.00 0.00 61.98 62.62 2qlv s VAL 467 Cb 0.44 -3.57 0.08 0.00 0.00 0.00 0.00 36.38 33.33 2qlv s VAL 467 CO 0.07 0.37 0.97 -0.94 0.00 0.00 0.00 175.10 175.57 2qlv s SER 468 N 0.64 -0.22 -0.25 3.32 1.04 -1.26 -5.13 113.70 111.84 2qlv s SER 468 Ca 0.13 -0.24 -0.24 0.00 0.48 0.00 0.00 55.95 56.08 2qlv s SER 468 Cb -0.13 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.40 2qlv s SER 468 CO 0.03 -0.74 0.78 -0.63 0.98 0.00 0.00 173.24 173.66 2qlv s ILE 469 N -3.13 4.87 -0.25 -1.02 1.01 -1.26 -4.98 121.20 116.43 2qlv s ILE 469 Ca 0.10 1.45 -0.31 0.00 0.00 0.00 0.00 60.65 61.89 2qlv s ILE 469 Cb -0.01 -4.08 -0.07 0.00 0.01 0.00 0.00 42.46 38.31 2qlv s ILE 469 CO -0.02 -0.06 2.20 -0.11 0.00 0.00 0.00 174.94 176.95 2qlv n LEU 470 N 5.95 2.91 0.12 2.97 7.94 -1.26 -4.84 117.00 130.80 2qlv n LEU 470 Ca 0.04 0.31 0.18 0.00 -1.11 0.00 0.00 56.01 55.43 2qlv n LEU 470 Cb 0.48 -1.45 0.76 0.00 0.53 0.00 0.00 43.42 43.73 2qlv n LEU 470 CO 0.46 -0.67 1.16 1.55 -1.11 0.00 0.00 177.39 178.79 2qlv h PRO 471 N 13.91 0.00 0.00 1.96 0.13 -1.99 -1.13 132.00 144.88 2qlv h PRO 471 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2qlv h PRO 471 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2qlv h PRO 471 CO 0.98 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 179.00 2qlv n THR 472 N -4.01 0.51 0.51 1.56 -2.24 -1.26 -2.70 114.28 106.64 2qlv n THR 472 Ca 0.05 0.13 0.11 0.00 -2.27 0.00 0.00 64.05 62.07 2qlv n THR 472 Cb 0.46 -0.76 0.05 0.00 -2.10 0.00 0.00 70.33 67.98 2qlv n THR 472 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qlv n SER 473 N -1.47 0.63 -4.75 3.42 3.41 -0.43 -3.97 113.62 110.46 2qlv n SER 473 Ca 0.06 -0.08 -0.42 0.00 -0.26 0.00 0.00 58.87 58.17 2qlv n SER 473 Cb 0.24 0.66 -0.00 0.00 -0.26 0.00 0.00 64.21 64.85 2qlv n SER 473 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qlv n LEU 474 N -2.07 4.33 -0.19 1.04 4.77 -1.10 -4.79 117.00 118.99 2qlv n LEU 474 Ca 0.02 1.21 -0.00 0.00 -0.03 0.00 0.00 56.01 57.21 2qlv n LEU 474 Cb 0.45 -1.57 0.10 0.00 -2.33 0.00 0.00 43.42 40.07 2qlv n LEU 474 CO 0.39 -0.05 0.95 1.55 -1.33 0.00 0.00 177.39 178.91 2qlv h PRO 475 N 3.00 0.32 -0.36 3.23 0.13 -1.91 -0.83 132.00 135.60 2qlv h PRO 475 Ca -0.49 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 64.48 2qlv h PRO 475 Cb 1.25 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2qlv h PRO 475 CO 0.65 0.21 -0.34 1.96 -0.23 0.00 0.00 178.00 180.25 2qlv h GLN 476 N 0.33 0.81 -0.10 0.86 4.20 -1.97 -1.72 115.11 117.52 2qlv h GLN 476 Ca 0.30 -0.39 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 2qlv h GLN 476 Cb 0.39 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 2qlv h GLN 476 CO -0.33 1.02 -0.08 0.82 -0.67 0.00 0.00 178.83 179.59 2qlv h ILE 477 N 0.67 1.35 -0.30 2.54 2.04 -1.83 -2.03 117.51 119.96 2qlv h ILE 477 Ca 0.07 -1.21 -0.06 0.00 1.00 0.00 0.00 64.86 64.66 2qlv h ILE 477 Cb 0.89 1.94 -0.02 0.00 -0.74 0.00 0.00 36.82 38.89 2qlv h ILE 477 CO 0.08 0.34 -0.09 -0.74 0.00 0.00 0.00 178.15 177.74 2qlv h HIS 478 N -0.17 0.52 0.00 1.37 2.76 -1.16 0.15 115.15 118.61 2qlv h HIS 478 Ca 0.02 -0.07 -0.05 0.00 -2.20 0.00 0.00 60.37 58.07 2qlv h HIS 478 Cb 0.58 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.39 2qlv h HIS 478 CO 0.08 0.57 -0.24 -0.09 -1.30 0.00 0.00 177.93 176.96 2qlv h ARG 479 N 0.46 0.00 0.20 5.26 2.43 -1.24 -1.53 114.38 119.95 2qlv h ARG 479 Ca 0.09 0.00 -0.27 0.00 -0.81 0.00 0.00 59.98 58.99 2qlv h ARG 479 Cb 0.44 0.00 0.03 0.00 -0.42 0.00 0.00 29.97 30.02 2qlv h ARG 479 CO 0.02 0.24 -1.23 0.00 -1.51 0.00 0.00 179.97 177.49 2qlv h ALA 480 N 1.76 -0.09 -0.48 2.80 0.00 -0.37 -2.50 119.26 120.38 2qlv h ALA 480 Ca -0.00 -0.83 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 2qlv h ALA 480 Cb 0.54 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2qlv h ALA 480 CO 0.03 0.59 0.18 -0.91 0.00 0.00 0.00 179.25 179.15 2qlv h ASN 481 N -0.10 0.63 -0.27 0.00 2.35 -0.75 0.23 115.58 117.68 2qlv h ASN 481 Ca -0.22 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.34 2qlv h ASN 481 Cb 1.93 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 40.12 2qlv h ASN 481 CO 0.21 0.58 -0.25 0.24 -1.65 0.00 0.00 177.43 176.56 2qlv h MET 482 N 0.69 0.75 -0.24 0.81 2.86 -1.34 -0.60 114.93 117.87 2qlv h MET 482 Ca 0.17 -0.31 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 2qlv h MET 482 Cb 0.16 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 2qlv h MET 482 CO -0.01 0.92 -0.30 -0.07 1.06 0.00 0.00 176.91 178.51 2qlv h LEU 483 N 0.65 0.67 -2.37 1.22 3.38 -0.88 -2.88 115.31 115.10 2qlv h LEU 483 Ca 0.09 -0.50 -0.00 0.00 0.09 0.00 0.00 57.88 57.55 2qlv h LEU 483 Cb 0.76 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 2qlv h LEU 483 CO 0.06 1.04 -0.02 0.00 0.09 0.00 0.00 178.44 179.61 2qlv h ALA 484 N 0.66 1.53 0.00 1.53 0.00 -0.32 0.55 119.26 123.20 2qlv h ALA 484 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2qlv h ALA 484 Cb 0.87 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2qlv h ALA 484 CO 0.07 0.02 0.00 1.04 0.00 0.00 0.00 179.25 180.38 2qlv n GLN 485 N -3.87 0.22 -1.09 0.00 1.13 -0.25 -4.95 117.38 108.57 2qlv n GLN 485 Ca -0.03 0.26 -0.03 0.00 -1.94 0.00 0.00 57.00 55.26 2qlv n GLN 485 Cb 0.10 -1.80 -0.01 0.00 0.11 0.00 0.00 30.24 28.64 2qlv n GLN 485 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qlv n GLY 486 N 0.92 0.61 3.69 1.08 0.00 0.18 -4.98 105.19 106.69 2qlv n GLY 486 Ca 0.05 -0.40 -0.44 0.00 0.00 0.00 0.00 46.02 45.22 2qlv n GLY 486 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qlv n SER 487 N 0.39 3.26 0.02 1.61 7.64 -1.25 -4.80 113.62 120.49 2qlv n SER 487 Ca -0.03 1.11 0.08 0.00 1.01 0.00 0.00 58.87 61.04 2qlv n SER 487 Cb 0.17 -1.48 0.34 0.00 -1.01 0.00 0.00 64.21 62.22 2qlv n SER 487 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2qlv n PRO 488 N 2.74 0.03 0.01 1.43 -0.04 -1.26 -2.45 135.00 135.46 2qlv n PRO 488 Ca 0.13 0.28 -0.22 0.00 -0.04 0.00 0.00 63.50 63.66 2qlv n PRO 488 Cb 0.32 -1.56 -0.14 0.00 -0.04 0.00 0.00 33.50 32.08 2qlv n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qlv h ALA 489 N 2.45 0.19 -0.07 0.55 0.00 -1.99 -3.36 119.26 117.03 2qlv h ALA 489 Ca 0.00 -1.12 0.02 0.00 0.00 0.00 0.00 54.91 53.82 2qlv h ALA 489 Cb 0.26 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 18.55 2qlv h ALA 489 CO 0.00 0.88 0.33 0.00 0.00 0.00 0.00 179.25 180.46 2qlv h ALA 490 N -0.03 1.46 -0.00 0.00 0.00 -1.82 -0.25 119.26 118.63 2qlv h ALA 490 Ca -0.32 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2qlv h ALA 490 Cb 1.82 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2qlv h ALA 490 CO 0.07 -0.37 -0.24 -1.13 0.00 0.00 0.00 179.25 177.58 2qlv n SER 491 N -3.07 0.52 -0.05 0.00 3.41 -1.24 -3.93 113.62 109.27 2qlv n SER 491 Ca -0.00 -0.38 -0.01 0.00 -0.26 0.00 0.00 58.87 58.22 2qlv n SER 491 Cb 0.40 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.23 2qlv n SER 491 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qlv n LYS 492 N -1.14 1.07 -2.34 4.33 4.76 -0.11 -4.99 118.16 119.73 2qlv n LYS 492 Ca 0.10 -0.07 -0.42 0.00 -2.87 0.00 0.00 58.31 55.06 2qlv n LYS 492 Cb 0.32 -1.40 -0.03 0.00 -1.84 0.00 0.00 35.03 32.08 2qlv n LYS 492 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2qlv s ILE 493 N -2.70 3.64 -0.00 -0.18 1.01 -1.16 -5.04 121.20 116.77 2qlv s ILE 493 Ca -0.07 1.27 0.07 0.00 0.00 0.00 0.00 60.65 61.92 2qlv s ILE 493 Cb 0.07 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 2qlv s ILE 493 CO 0.66 0.15 -0.21 -0.44 0.00 0.00 0.00 174.94 175.10 2qlv s SER 494 N 0.62 3.53 0.69 3.58 0.01 -1.26 -5.03 113.70 115.84 2qlv s SER 494 Ca 0.57 -0.40 -0.16 0.00 1.31 0.00 0.00 55.95 57.27 2qlv s SER 494 Cb -0.33 -0.54 0.02 0.00 0.21 0.00 0.00 66.02 65.38 2qlv s SER 494 CO 0.33 0.30 1.22 -2.16 0.41 0.00 0.00 173.24 173.34 2qlv s PRO 495 N -0.97 2.37 0.61 12.44 0.04 -1.26 -5.00 135.00 143.24 2qlv s PRO 495 Ca 0.12 1.82 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 2qlv s PRO 495 Cb -0.10 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 2qlv s PRO 495 CO 0.02 -1.67 1.02 -1.17 0.04 0.00 0.00 177.00 175.23 2qlv s LEU 496 N -4.82 3.25 0.17 -3.56 2.96 -1.26 -5.10 118.68 110.31 2qlv s LEU 496 Ca 0.76 1.38 -0.01 0.00 -0.22 0.00 0.00 54.13 56.04 2qlv s LEU 496 Cb -0.31 -4.42 -0.04 0.00 0.50 0.00 0.00 46.19 41.92 2qlv s LEU 496 CO 0.42 -0.86 0.11 -0.69 -1.32 0.00 0.00 176.35 174.00 2qlv s VAL 497 N -3.16 0.05 0.25 1.68 1.01 -1.26 -5.31 120.40 113.66 2qlv s VAL 497 Ca 0.55 -1.93 0.00 0.00 0.00 0.00 0.00 61.98 60.60 2qlv s VAL 497 Cb -0.11 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.01 2qlv s VAL 497 CO 0.53 -0.23 0.00 0.41 0.00 0.00 0.00 175.10 175.82 2qlv n THR 498 N -0.19 0.00 0.00 3.92 -1.04 -1.26 -5.34 114.28 110.37 2qlv n THR 498 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2qlv n THR 498 Cb 0.65 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 2qlv n THR 498 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2qlv n THR 503 N -2.43 0.00 -3.89 12.58 -1.04 -1.26 -5.38 114.28 112.86 2qlv n THR 503 Ca 0.00 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.66 2qlv n THR 503 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 2qlv n THR 503 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qlv s ARG 504 N 1.20 2.58 0.20 -2.82 1.70 -1.26 -5.11 118.95 115.45 2qlv s ARG 504 Ca 0.00 -1.17 -0.18 0.00 -0.47 0.00 0.00 55.73 53.91 2qlv s ARG 504 Cb 0.00 -3.19 -0.08 0.00 -0.57 0.00 0.00 34.95 31.11 2qlv s ARG 504 CO 0.00 -0.57 0.68 -1.58 -1.08 0.00 0.00 175.30 172.76 2qlv s TRP 505 N 1.30 3.64 -0.02 5.89 0.52 -1.26 -5.08 118.94 123.94 2qlv s TRP 505 Ca -0.03 1.31 0.05 0.00 0.02 0.00 0.00 56.10 57.45 2qlv s TRP 505 Cb -0.19 -2.56 -0.01 0.00 -1.15 0.00 0.00 33.47 29.56 2qlv s TRP 505 CO -0.01 0.36 -0.16 -1.01 0.02 0.00 0.00 176.95 176.15 2qlv s HIS 506 N -1.51 1.47 0.15 -1.98 3.76 -1.26 -5.12 115.29 110.81 2qlv s HIS 506 Ca 0.42 -0.30 -0.30 0.00 -0.15 0.00 0.00 55.06 54.73 2qlv s HIS 506 Cb -0.16 -0.95 -0.07 0.00 1.11 0.00 0.00 32.58 32.50 2qlv s HIS 506 CO 0.21 -0.04 1.19 0.12 -0.85 0.00 0.00 174.74 175.37 2qlv s PHE 507 N -0.32 3.44 0.00 1.40 5.36 -1.26 -4.82 117.98 121.78 2qlv s PHE 507 Ca 0.05 1.40 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 2qlv s PHE 507 Cb -0.07 -3.42 0.00 0.00 -0.34 0.00 0.00 43.02 39.19 2qlv s PHE 507 CO -0.00 -1.19 0.00 0.41 -1.46 0.00 0.00 175.22 172.98 2qlv n GLY 508 N 2.44 2.39 3.10 13.12 0.00 -1.26 -4.69 105.19 120.29 2qlv n GLY 508 Ca 0.05 -0.21 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 2qlv n GLY 508 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qlv s ILE 509 N 0.00 0.80 0.01 -0.61 1.01 -0.04 -4.96 121.20 117.42 2qlv s ILE 509 Ca 0.00 -1.06 0.03 0.00 0.00 0.00 0.00 60.65 59.61 2qlv s ILE 509 Cb 0.00 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 2qlv s ILE 509 CO 0.00 -0.22 -0.03 -0.13 0.00 0.00 0.00 174.94 174.56 2qlv s ARG 510 N -1.43 2.65 -0.24 2.79 0.52 -1.26 -1.04 118.95 120.93 2qlv s ARG 510 Ca -0.05 -0.69 -0.14 0.00 -0.52 0.00 0.00 55.73 54.33 2qlv s ARG 510 Cb -0.09 -2.58 0.07 0.00 0.52 0.00 0.00 34.95 32.87 2qlv s ARG 510 CO 0.01 0.60 0.60 0.45 0.02 0.00 0.00 175.30 176.99 2qlv s SER 511 N -1.60 -0.81 -0.20 0.23 0.15 -0.89 -5.03 113.70 105.55 2qlv s SER 511 Ca 0.19 1.32 0.07 0.00 0.70 0.00 0.00 55.95 58.23 2qlv s SER 511 Cb -0.11 1.20 0.50 0.00 -1.71 0.00 0.00 66.02 65.90 2qlv s SER 511 CO 0.10 -0.22 1.41 -2.11 1.20 0.00 0.00 173.24 173.61 2qlv n ARG 512 N 4.23 2.98 -2.55 5.44 1.85 -1.26 -2.35 116.66 124.99 2qlv n ARG 512 Ca -0.21 -2.02 -0.22 0.00 -1.00 0.00 0.00 57.85 54.40 2qlv n ARG 512 Cb 0.58 -1.92 0.06 0.00 -1.05 0.00 0.00 32.46 30.12 2qlv n ARG 512 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2qlv s SER 513 N -0.50 4.96 0.06 2.89 0.01 -1.26 -4.83 113.70 115.04 2qlv s SER 513 Ca 0.36 -0.02 -0.31 0.00 1.31 0.00 0.00 55.95 57.29 2qlv s SER 513 Cb 0.28 -0.70 -0.07 0.00 0.21 0.00 0.00 66.02 65.74 2qlv s SER 513 CO 0.09 -1.40 1.49 -0.31 0.41 0.00 0.00 173.24 173.53 2qlv s TYR 514 N -2.94 2.82 0.00 2.43 1.51 -1.26 -4.84 117.35 115.07 2qlv s TYR 514 Ca 0.60 0.67 0.00 0.00 -1.01 0.00 0.00 57.07 57.33 2qlv s TYR 514 Cb -0.09 -3.79 0.00 0.00 -0.11 0.00 0.00 41.96 37.97 2qlv s TYR 514 CO 0.41 -2.98 0.00 -0.35 -1.11 0.00 0.00 175.55 171.52 2qlv n PRO 515 N 4.99 0.00 0.00 -1.71 -0.04 -1.26 -0.37 135.00 136.61 2qlv n PRO 515 Ca 0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 2qlv n PRO 515 Cb 0.42 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 2qlv n PRO 515 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2qlv n LEU 516 N 1.54 0.00 -0.06 1.53 4.77 -1.26 -4.67 117.00 118.84 2qlv n LEU 516 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 2qlv n LEU 516 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 2qlv n LEU 516 CO 0.00 0.00 0.25 0.44 -1.33 0.00 0.00 177.39 176.75 2qlv h ASP 517 N 0.00 0.05 0.48 -1.43 3.32 -1.08 -2.84 116.42 114.92 2qlv h ASP 517 Ca 0.00 -0.94 -0.01 0.00 0.02 0.00 0.00 57.03 56.10 2qlv h ASP 517 Cb 0.00 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 2qlv h ASP 517 CO 0.00 1.10 -0.40 0.58 -1.72 0.00 0.00 179.24 178.80 2qlv h VAL 518 N -0.94 0.19 -0.24 -1.35 2.07 -1.88 0.60 116.25 114.71 2qlv h VAL 518 Ca -0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.53 2qlv h VAL 518 Cb 1.10 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2qlv h VAL 518 CO -0.01 0.00 0.36 -0.03 0.02 0.00 0.00 177.57 177.92 2qlv h MET 519 N -0.87 0.00 0.11 1.57 -1.53 -1.83 0.67 114.93 113.05 2qlv h MET 519 Ca -0.05 0.00 -0.36 0.00 -3.44 0.00 0.00 59.70 55.85 2qlv h MET 519 Cb 0.75 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.78 2qlv h MET 519 CO -0.02 0.00 -1.97 0.41 0.14 0.00 0.00 176.91 175.47 2qlv n GLY 520 N -1.38 -0.60 0.37 1.39 0.00 -0.60 -3.82 105.19 100.53 2qlv n GLY 520 Ca 0.03 -0.26 0.02 0.00 0.00 0.00 0.00 46.02 45.81 2qlv n GLY 520 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qlv h GLU 521 N 0.06 1.14 -0.16 1.61 5.08 0.24 -1.44 114.58 121.13 2qlv h GLU 521 Ca -0.41 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 2qlv h GLU 521 Cb 2.03 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 31.02 2qlv h GLU 521 CO 0.09 0.76 -0.03 0.82 -1.00 0.00 0.00 179.01 179.64 2qlv h ILE 522 N 1.18 1.28 -0.45 3.13 2.04 -1.44 0.86 117.51 124.10 2qlv h ILE 522 Ca 0.42 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 2qlv h ILE 522 Cb 0.14 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2qlv h ILE 522 CO -0.17 0.28 0.15 1.88 0.00 0.00 0.00 178.15 180.30 2qlv h TYR 523 N 0.01 0.67 0.29 1.37 -1.99 -1.61 0.69 116.97 116.40 2qlv h TYR 523 Ca 0.04 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2qlv h TYR 523 Cb 0.45 -0.20 0.00 0.00 2.00 0.00 0.00 36.73 38.98 2qlv h TYR 523 CO 0.05 0.55 -0.14 0.82 -0.00 0.00 0.00 178.16 179.44 2qlv h ILE 524 N 0.65 0.72 -0.80 -2.88 2.04 -1.08 0.02 117.51 116.18 2qlv h ILE 524 Ca 0.15 -0.61 0.14 0.00 1.00 0.00 0.00 64.86 65.55 2qlv h ILE 524 Cb 0.19 1.03 -0.09 0.00 -0.74 0.00 0.00 36.82 37.20 2qlv h ILE 524 CO -0.01 0.12 0.38 0.00 0.00 0.00 0.00 178.15 178.64 2qlv h ALA 525 N -0.18 1.16 -0.24 1.87 0.00 0.13 -2.33 119.26 119.68 2qlv h ALA 525 Ca -0.04 0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2qlv h ALA 525 Cb 0.50 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2qlv h ALA 525 CO 0.07 -0.12 -0.12 -0.07 0.00 0.00 0.00 179.25 179.00 2qlv h LEU 526 N 0.56 0.53 -1.77 0.00 3.38 0.46 -2.17 115.31 116.30 2qlv h LEU 526 Ca 0.43 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 58.02 2qlv h LEU 526 Cb 0.60 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2qlv h LEU 526 CO -0.36 0.82 0.22 0.07 0.09 0.00 0.00 178.44 179.28 2qlv h LYS 527 N 0.23 0.29 0.19 1.13 2.10 -0.47 0.26 116.57 120.29 2qlv h LYS 527 Ca 0.05 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 58.68 2qlv h LYS 527 Cb 0.63 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 2qlv h LYS 527 CO 0.04 0.19 -0.09 -0.91 -2.00 0.00 0.00 179.45 176.68 2qlv h ASN 528 N 0.29 -0.21 0.00 7.07 2.35 -1.34 -3.20 115.58 120.54 2qlv h ASN 528 Ca 0.14 -0.32 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2qlv h ASN 528 Cb 0.18 0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2qlv h ASN 528 CO -0.03 0.32 0.00 0.18 -1.65 0.00 0.00 177.43 176.25 2qlv n LEU 529 N -4.95 0.54 -1.77 1.61 4.77 -0.82 -4.68 117.00 111.69 2qlv n LEU 529 Ca -0.08 -0.27 -0.21 0.00 -0.03 0.00 0.00 56.01 55.42 2qlv n LEU 529 Cb 0.26 -0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 2qlv n LEU 529 CO 0.25 0.10 -0.21 0.61 -1.33 0.00 0.00 177.39 176.81 2qlv n GLY 530 N 0.63 1.45 3.79 -0.72 0.00 -1.13 -4.96 105.19 104.25 2qlv n GLY 530 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2qlv n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlv s ALA 531 N -2.81 3.36 -0.05 4.61 0.00 0.89 -4.73 121.76 123.02 2qlv s ALA 531 Ca 0.00 0.35 0.06 0.00 0.00 0.00 0.00 51.96 52.38 2qlv s ALA 531 Cb 0.00 -2.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.12 2qlv s ALA 531 CO 0.00 0.27 -0.25 -1.83 0.00 0.00 0.00 175.76 173.94 2qlv s GLU 532 N -1.71 2.47 0.11 0.00 -1.05 -1.25 -4.25 118.70 113.01 2qlv s GLU 532 Ca 0.43 -0.91 0.01 0.00 -0.15 0.00 0.00 54.97 54.35 2qlv s GLU 532 Cb -0.20 -2.14 -0.00 0.00 -0.44 0.00 0.00 34.13 31.35 2qlv s GLU 532 CO 0.24 0.42 0.03 -2.67 0.95 0.00 0.00 175.26 174.23 2qlv n TRP 533 N 2.85 0.06 -4.82 4.83 2.14 -1.26 0.57 117.44 121.81 2qlv n TRP 533 Ca -0.17 -0.68 -0.31 0.00 2.07 0.00 0.00 57.50 58.41 2qlv n TRP 533 Cb 0.52 -0.01 -0.13 0.00 -0.81 0.00 0.00 31.31 30.88 2qlv n TRP 533 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2qlv s ALA 534 N -2.28 2.54 0.09 -1.67 0.00 -0.64 -4.94 121.76 114.86 2qlv s ALA 534 Ca 0.05 -1.13 -0.31 0.00 0.00 0.00 0.00 51.96 50.57 2qlv s ALA 534 Cb 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 23.12 22.27 2qlv s ALA 534 CO 0.03 0.56 1.60 0.15 0.00 0.00 0.00 175.76 178.10 2qlv s LYS 535 N -1.13 4.22 0.00 0.00 1.02 -1.26 -4.55 119.74 118.03 2qlv s LYS 535 Ca 0.13 2.29 0.00 0.00 0.02 0.00 0.00 55.97 58.41 2qlv s LYS 535 Cb -0.10 -3.48 0.00 0.00 -0.52 0.00 0.00 37.83 33.73 2qlv s LYS 535 CO 0.03 -0.68 0.00 -2.30 -0.92 0.00 0.00 175.35 171.48 2qlv n PRO 536 N 5.12 3.22 0.00 -1.68 -0.02 -1.26 -5.07 135.00 135.31 2qlv n PRO 536 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2qlv n PRO 536 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 2qlv n PRO 536 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2qlv n SER 537 N 0.00 0.00 0.00 2.55 2.88 -1.26 -5.20 113.62 112.59 2qlv n SER 537 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2qlv n SER 537 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2qlv n SER 537 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2qlv n LEU 541 N 0.00 0.00 -1.48 2.46 7.94 -1.26 -5.18 117.00 119.48 2qlv n LEU 541 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2qlv n LEU 541 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2qlv n LEU 541 CO 0.00 0.00 0.77 0.79 -1.11 0.00 0.00 177.39 177.84 2qlv n TRP 542 N 0.00 0.00 -4.36 1.96 7.02 -1.26 -4.78 117.44 116.02 2qlv n TRP 542 Ca 0.00 -0.77 -0.19 0.00 -1.02 0.00 0.00 57.50 55.52 2qlv n TRP 542 Cb 0.00 -0.42 -0.14 0.00 -2.42 0.00 0.00 31.31 28.33 2qlv n TRP 542 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2qlv s THR 543 N 0.30 0.99 -0.12 -0.99 2.01 -1.26 -2.21 115.64 114.36 2qlv s THR 543 Ca 0.00 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.16 2qlv s THR 543 Cb 0.00 -0.89 0.02 0.00 0.01 0.00 0.00 72.50 71.64 2qlv s THR 543 CO 0.00 0.04 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.20 2qlv s ILE 544 N -0.72 1.45 -0.89 1.82 1.01 -0.48 -4.81 121.20 118.58 2qlv s ILE 544 Ca 0.01 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 60.00 2qlv s ILE 544 Cb -0.07 -1.35 0.22 0.00 0.01 0.00 0.00 42.46 41.28 2qlv s ILE 544 CO 0.01 0.43 0.80 -0.54 0.00 0.00 0.00 174.94 175.64 2qlv s LYS 545 N 1.17 3.47 0.33 2.79 3.01 -1.26 -2.08 119.74 127.17 2qlv s LYS 545 Ca -0.03 -2.93 0.07 0.00 -1.01 0.00 0.00 55.97 52.07 2qlv s LYS 545 Cb -0.14 -4.19 -0.02 0.00 -1.01 0.00 0.00 37.83 32.48 2qlv s LYS 545 CO -0.04 -1.25 0.42 -0.48 0.51 0.00 0.00 175.35 174.51 2qlv s LEU 546 N -0.73 3.90 0.00 3.17 0.05 -1.07 -1.62 118.68 122.38 2qlv s LEU 546 Ca 0.24 -0.25 0.00 0.00 0.05 0.00 0.00 54.13 54.17 2qlv s LEU 546 Cb -0.11 -2.62 0.00 0.00 -2.05 0.00 0.00 46.19 41.41 2qlv s LEU 546 CO -0.09 -0.39 0.00 -1.14 -0.55 0.00 0.00 176.35 174.19 2qlv n ARG 547 N -1.55 2.10 0.00 1.48 0.63 0.19 -2.53 116.66 116.98 2qlv n ARG 547 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 2qlv n ARG 547 Cb 0.58 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.49 2qlv n ARG 547 CO 0.00 0.00 0.00 1.87 -2.51 0.00 0.00 177.63 176.99 2qlv n TRP 548 N 0.00 0.00 -3.82 -0.14 -0.00 -0.69 -3.92 117.44 108.87 2qlv n TRP 548 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 57.50 57.28 2qlv n TRP 548 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 31.31 31.27 2qlv n TRP 548 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 177.69 176.10 2qlv s LYS 549 N -0.41 2.58 0.00 5.87 -2.85 -1.26 0.10 119.74 123.76 2qlv s LYS 549 Ca 0.00 -1.44 0.00 0.00 -1.00 0.00 0.00 55.97 53.53 2qlv s LYS 549 Cb 0.00 -2.36 0.00 0.00 -2.06 0.00 0.00 37.83 33.41 2qlv s LYS 549 CO 0.00 0.01 0.00 -0.25 0.10 0.00 0.00 175.35 175.21 2qlv n ASP 564 N -1.37 0.00 -4.10 0.03 8.00 -1.26 -4.82 116.55 113.03 2qlv n ASP 564 Ca -0.01 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.34 2qlv n ASP 564 Cb 0.61 -0.03 -0.12 0.00 -0.02 0.00 0.00 41.12 41.56 2qlv n ASP 564 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qlv s LEU 565 N -0.06 2.23 0.18 0.64 1.02 -1.26 -4.95 118.68 116.49 2qlv s LEU 565 Ca 0.00 -0.53 0.06 0.00 0.02 0.00 0.00 54.13 53.68 2qlv s LEU 565 Cb 0.00 -0.34 -0.04 0.00 0.02 0.00 0.00 46.19 45.83 2qlv s LEU 565 CO 0.00 -0.11 0.13 -0.32 0.02 0.00 0.00 176.35 176.07 2qlv s MET 566 N -1.47 2.86 -0.05 1.70 1.75 0.28 -2.87 119.30 121.49 2qlv s MET 566 Ca -0.05 -0.93 0.04 0.00 -1.25 0.00 0.00 55.69 53.50 2qlv s MET 566 Cb -0.09 -2.60 0.00 0.00 2.84 0.00 0.00 34.83 34.98 2qlv s MET 566 CO 0.01 0.47 -0.15 0.15 -0.65 0.00 0.00 175.02 174.84 2qlv s LYS 567 N -3.22 1.76 0.18 4.11 1.02 -0.47 -1.70 119.74 121.42 2qlv s LYS 567 Ca 0.31 -0.54 0.03 0.00 0.02 0.00 0.00 55.97 55.78 2qlv s LYS 567 Cb -0.10 -1.49 -0.05 0.00 -0.52 0.00 0.00 37.83 35.67 2qlv s LYS 567 CO 0.23 0.17 -0.01 -1.64 -0.92 0.00 0.00 175.35 173.18 2qlv s MET 568 N 0.24 1.15 -0.29 1.68 -1.94 -1.05 0.13 119.30 119.22 2qlv s MET 568 Ca -0.08 -1.55 -0.04 0.00 -1.71 0.00 0.00 55.69 52.31 2qlv s MET 568 Cb -0.13 -0.39 0.10 0.00 2.01 0.00 0.00 34.83 36.42 2qlv s MET 568 CO 0.03 -0.10 0.14 0.08 -0.01 0.00 0.00 175.02 175.16 2qlv s VAL 569 N -3.56 -0.09 0.43 -6.03 1.01 -0.49 -2.59 120.40 109.08 2qlv s VAL 569 Ca 0.24 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.39 2qlv s VAL 569 Cb 0.06 -0.97 -0.06 0.00 0.00 0.00 0.00 36.38 35.40 2qlv s VAL 569 CO 0.05 -0.71 0.78 -0.63 0.00 0.00 0.00 175.10 174.59 2qlv s ILE 570 N 2.12 4.80 -0.08 2.22 1.01 -0.88 -2.41 121.20 127.98 2qlv s ILE 570 Ca 0.09 0.56 -0.22 0.00 0.00 0.00 0.00 60.65 61.08 2qlv s ILE 570 Cb -0.16 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.60 2qlv s ILE 570 CO -0.36 -0.60 0.51 -1.10 0.00 0.00 0.00 174.94 173.39 2qlv s GLN 571 N -4.05 0.80 0.04 2.79 -0.21 -0.38 -1.38 119.66 117.28 2qlv s GLN 571 Ca 0.51 0.23 0.03 0.00 0.02 0.00 0.00 55.36 56.15 2qlv s GLN 571 Cb -0.10 0.37 -0.04 0.00 1.00 0.00 0.00 33.01 34.24 2qlv s GLN 571 CO 0.34 -0.21 -0.02 -1.17 -2.12 0.00 0.00 175.29 172.11 2qlv s LEU 572 N -0.85 3.39 0.12 2.90 2.96 -0.94 -0.77 118.68 125.50 2qlv s LEU 572 Ca -0.09 -0.13 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 2qlv s LEU 572 Cb -0.03 -2.03 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 2qlv s LEU 572 CO 0.05 0.23 0.10 -0.36 -1.32 0.00 0.00 176.35 175.05 2qlv s PHE 573 N -1.16 0.67 0.41 5.38 0.08 0.88 -4.96 117.98 119.29 2qlv s PHE 573 Ca 0.22 -1.08 -0.15 0.00 0.12 0.00 0.00 56.93 56.04 2qlv s PHE 573 Cb -0.11 -0.36 -0.08 0.00 -0.57 0.00 0.00 43.02 41.90 2qlv s PHE 573 CO 0.13 -0.54 0.84 -1.14 -0.10 0.00 0.00 175.22 174.41 2qlv s GLN 574 N -4.00 3.96 1.39 0.44 2.00 -1.26 -1.94 119.66 120.25 2qlv s GLN 574 Ca 0.19 0.75 0.00 0.00 -2.00 0.00 0.00 55.36 54.30 2qlv s GLN 574 Cb 0.07 -2.31 0.00 0.00 0.80 0.00 0.00 33.01 31.57 2qlv s GLN 574 CO -0.01 -0.03 0.00 -1.71 -0.50 0.00 0.00 175.29 173.03 2qlv n ASN 578 N -0.98 -0.87 -4.54 6.67 2.85 -1.26 -4.88 115.26 112.25 2qlv n ASN 578 Ca 0.04 0.00 -0.30 0.00 -0.11 0.00 0.00 54.58 54.21 2qlv n ASN 578 Cb 0.54 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 41.45 2qlv n ASN 578 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 2qlv s ASN 579 N -4.00 4.23 0.04 1.20 0.01 -1.26 -4.68 114.94 110.48 2qlv s ASN 579 Ca 0.00 -0.37 0.04 0.00 -0.71 0.00 0.00 52.86 51.81 2qlv s ASN 579 Cb 0.00 -0.79 -0.02 0.00 0.41 0.00 0.00 41.25 40.85 2qlv s ASN 579 CO 0.00 0.21 -0.11 -0.31 -1.51 0.00 0.00 177.10 175.39 2qlv s TYR 580 N -1.10 0.93 0.00 2.20 1.51 -0.99 -5.03 117.35 114.87 2qlv s TYR 580 Ca 0.19 -0.40 0.07 0.00 -1.01 0.00 0.00 57.07 55.92 2qlv s TYR 580 Cb -0.11 -0.55 -0.02 0.00 -0.11 0.00 0.00 41.96 41.17 2qlv s TYR 580 CO 0.10 -0.01 -0.22 -1.17 -1.11 0.00 0.00 175.55 173.14 2qlv s LEU 581 N -1.31 2.08 -0.14 -1.29 0.20 -0.82 -2.10 118.68 115.31 2qlv s LEU 581 Ca -0.03 -0.45 0.01 0.00 0.69 0.00 0.00 54.13 54.35 2qlv s LEU 581 Cb -0.08 -1.11 0.02 0.00 -0.43 0.00 0.00 46.19 44.59 2qlv s LEU 581 CO 0.01 0.24 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.47 2qlv s VAL 582 N -0.61 1.61 0.09 1.68 1.01 -0.21 -0.08 120.40 123.89 2qlv s VAL 582 Ca 0.09 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.49 2qlv s VAL 582 Cb -0.09 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 2qlv s VAL 582 CO 0.00 0.46 -0.22 -0.62 0.00 0.00 0.00 175.10 174.72 2qlv s ASP 583 N 1.35 3.54 -0.10 3.32 -1.08 0.05 -0.86 116.67 122.89 2qlv s ASP 583 Ca 0.02 -0.59 -0.01 0.00 -0.52 0.00 0.00 52.55 51.46 2qlv s ASP 583 Cb -0.13 -0.41 -0.03 0.00 -1.46 0.00 0.00 42.92 40.89 2qlv s ASP 583 CO -0.09 0.22 -0.06 -0.36 0.52 0.00 0.00 175.17 175.40 2qlv s PHE 584 N -0.99 2.96 -0.18 -5.34 0.40 -1.26 -1.25 117.98 112.32 2qlv s PHE 584 Ca 0.15 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.35 2qlv s PHE 584 Cb -0.10 -1.80 0.04 0.00 0.51 0.00 0.00 43.02 41.66 2qlv s PHE 584 CO 0.06 0.17 -0.12 0.21 0.70 0.00 0.00 175.22 176.24 2qlv s LYS 585 N -0.34 2.13 0.29 0.44 2.20 -1.01 -4.95 119.74 118.49 2qlv s LYS 585 Ca 0.05 -0.75 -0.30 0.00 -0.36 0.00 0.00 55.97 54.61 2qlv s LYS 585 Cb -0.12 -2.32 -0.11 0.00 -1.51 0.00 0.00 37.83 33.76 2qlv s LYS 585 CO 0.02 -0.37 1.57 0.12 -0.36 0.00 0.00 175.35 176.34 2qlv s PHE 586 N 1.42 2.79 -0.33 4.03 5.36 -1.26 -1.39 117.98 128.60 2qlv s PHE 586 Ca 0.01 0.82 0.11 0.00 -0.96 0.00 0.00 56.93 56.91 2qlv s PHE 586 Cb -0.15 -4.03 0.46 0.00 -0.34 0.00 0.00 43.02 38.95 2qlv s PHE 586 CO -0.09 -3.45 1.13 -3.47 -1.46 0.00 0.00 175.22 167.88 2qlv n ASP 587 N 2.17 3.88 -0.19 6.13 4.64 0.34 -4.90 116.55 128.62 2qlv n ASP 587 Ca 0.08 -3.32 0.00 0.00 -1.38 0.00 0.00 54.79 50.17 2qlv n ASP 587 Cb 0.38 -0.42 0.00 0.00 -1.04 0.00 0.00 41.12 40.04 2qlv n ASP 587 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2qlv n GLY 588 N -0.56 -1.84 3.44 0.27 0.00 -1.25 -4.67 105.19 100.58 2qlv n GLY 588 Ca 0.32 -1.34 -0.22 0.00 0.00 0.00 0.00 46.02 44.78 2qlv n GLY 588 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qlv s TRP 589 N 0.00 2.10 -0.46 1.61 0.52 -1.26 -1.37 118.94 120.08 2qlv s TRP 589 Ca 0.00 -0.48 0.04 0.00 0.02 0.00 0.00 56.10 55.68 2qlv s TRP 589 Cb 0.00 -1.01 0.23 0.00 -1.15 0.00 0.00 33.47 31.53 2qlv s TRP 589 CO 0.00 0.54 0.92 0.39 0.02 0.00 0.00 176.95 178.81 2qlv n GLU 590 N -0.57 0.54 0.22 4.98 1.02 -1.14 -4.98 120.64 120.71 2qlv n GLU 590 Ca -0.06 -1.57 0.17 0.00 -0.02 0.00 0.00 57.16 55.68 2qlv n GLU 590 Cb 0.61 -1.12 0.73 0.00 -0.02 0.00 0.00 31.44 31.64 2qlv n GLU 590 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2qlv h SER 591 N 4.19 0.00 -1.44 1.62 4.64 -1.93 -3.41 113.55 117.22 2qlv h SER 591 Ca -0.08 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.81 2qlv h SER 591 Cb 1.09 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 63.32 2qlv h SER 591 CO 0.11 0.00 -0.91 1.21 -0.87 0.00 0.00 176.83 176.37 2qlv n GLU 606 N -3.20 0.00 0.00 4.77 2.13 -1.26 -4.91 120.64 118.17 2qlv n GLU 606 Ca 0.03 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.90 2qlv n GLU 606 Cb 0.55 -0.72 0.27 0.00 0.27 0.00 0.00 31.44 31.81 2qlv n GLU 606 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 2qlv n MET 607 N 1.19 0.15 0.22 5.31 0.00 -1.26 -1.83 117.12 120.89 2qlv n MET 607 Ca 0.05 0.19 0.08 0.00 -0.00 0.00 0.00 57.70 58.01 2qlv n MET 607 Cb 0.35 -1.50 0.50 0.00 0.00 0.00 0.00 33.22 32.57 2qlv n MET 607 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 2qlv h SER 608 N 0.00 0.00 0.07 6.12 0.02 -2.01 -3.05 113.55 114.70 2qlv h SER 608 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 2qlv h SER 608 Cb 0.11 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.66 2qlv h SER 608 CO 0.00 0.26 -0.43 0.74 -1.14 0.00 0.00 176.83 176.25 2qlv h THR 609 N 0.00 1.63 0.00 -2.27 2.02 -1.82 -3.27 112.91 109.20 2qlv h THR 609 Ca -0.00 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.74 2qlv h THR 609 Cb 0.59 3.27 0.00 0.00 -1.74 0.00 0.00 68.15 70.27 2qlv h THR 609 CO 0.03 0.65 0.29 0.49 0.37 0.00 0.00 175.52 177.36 2qlv n PHE 610 N -4.37 0.37 -2.39 3.16 0.99 -1.16 -1.67 117.46 112.40 2qlv n PHE 610 Ca -0.13 0.20 -0.03 0.00 -0.00 0.00 0.00 57.45 57.48 2qlv n PHE 610 Cb 0.65 -0.61 0.06 0.00 -1.00 0.00 0.00 39.48 38.58 2qlv n PHE 610 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 2qlv n SER 611 N -1.93 2.19 -0.18 4.37 3.41 -1.22 -4.88 113.62 115.38 2qlv n SER 611 Ca -0.01 -2.68 -0.10 0.00 -0.26 0.00 0.00 58.87 55.82 2qlv n SER 611 Cb 0.30 -0.41 0.01 0.00 -0.26 0.00 0.00 64.21 63.85 2qlv n SER 611 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qlv h ALA 612 N 1.87 0.72 0.06 7.33 0.00 -1.37 -3.11 119.26 124.76 2qlv h ALA 612 Ca -0.03 -0.35 -0.24 0.00 0.00 0.00 0.00 54.91 54.29 2qlv h ALA 612 Cb 1.45 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2qlv h ALA 612 CO 0.26 0.63 -1.11 1.88 0.00 0.00 0.00 179.25 180.91 2qlv h TYR 613 N 0.87 0.21 0.00 0.00 -1.99 -1.90 -2.71 116.97 111.46 2qlv h TYR 613 Ca 0.13 -0.16 -0.06 0.00 2.00 0.00 0.00 58.73 60.65 2qlv h TYR 613 Cb 0.68 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.39 2qlv h TYR 613 CO 0.05 1.12 -0.29 -1.35 -0.00 0.00 0.00 178.16 177.69 2qlv h PRO 614 N 0.03 0.00 0.08 4.88 0.11 -1.92 -0.56 132.00 134.62 2qlv h PRO 614 Ca -0.07 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 2qlv h PRO 614 Cb 1.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.97 2qlv h PRO 614 CO 0.16 0.29 -0.04 0.35 -0.21 0.00 0.00 178.00 178.55 2qlv h PHE 615 N 0.00 -0.10 -0.05 0.65 3.57 -1.54 -2.63 116.94 116.84 2qlv h PHE 615 Ca -0.00 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 2qlv h PHE 615 Cb 0.56 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 2qlv h PHE 615 CO 0.00 0.36 0.04 -0.07 -2.23 0.00 0.00 178.31 176.41 2qlv h LEU 616 N -0.60 0.00 0.02 0.59 3.38 -1.26 -2.13 115.31 115.31 2qlv h LEU 616 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qlv h LEU 616 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2qlv h LEU 616 CO 0.02 0.00 -0.01 -0.74 0.09 0.00 0.00 178.44 177.80 2qlv h HIS 617 N 0.00 -0.03 -0.20 1.13 2.76 -0.99 -2.27 115.15 115.54 2qlv h HIS 617 Ca 0.02 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2qlv h HIS 617 Cb 0.10 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.06 2qlv h HIS 617 CO 0.00 0.36 0.08 -0.07 -1.30 0.00 0.00 177.93 177.00 2qlv h LEU 618 N -0.43 0.28 -2.70 0.26 3.38 -1.11 -0.07 115.31 114.92 2qlv h LEU 618 Ca -0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 2qlv h LEU 618 Cb 0.40 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2qlv h LEU 618 CO 0.01 0.36 -0.00 0.71 0.09 0.00 0.00 178.44 179.60 2qlv h THR 619 N 0.18 0.05 -0.01 0.22 1.35 -1.46 0.22 112.91 113.47 2qlv h THR 619 Ca 0.07 -0.09 -0.12 0.00 -0.55 0.00 0.00 66.41 65.72 2qlv h THR 619 Cb 0.17 1.09 0.01 0.00 -1.73 0.00 0.00 68.15 67.68 2qlv h THR 619 CO -0.01 0.00 -0.45 0.74 -0.25 0.00 0.00 175.52 175.56 2qlv h THR 620 N 0.00 1.47 -0.35 6.82 2.02 -0.59 -2.01 112.91 120.27 2qlv h THR 620 Ca -0.00 -2.01 -0.04 0.00 0.77 0.00 0.00 66.41 65.13 2qlv h THR 620 Cb 0.09 2.65 -0.02 0.00 -1.74 0.00 0.00 68.15 69.13 2qlv h THR 620 CO 0.00 0.57 0.04 0.11 0.37 0.00 0.00 175.52 176.61 2qlv h LYS 621 N -0.26 0.53 0.00 6.66 1.57 0.89 -0.80 116.57 125.15 2qlv h LYS 621 Ca -0.05 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.51 2qlv h LYS 621 Cb 1.17 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 2qlv h LYS 621 CO 0.09 0.52 -0.53 1.25 -0.57 0.00 0.00 179.45 180.21 2qlv h LEU 622 N 0.52 0.00 0.01 2.94 5.85 -0.68 -2.83 115.31 121.12 2qlv h LEU 622 Ca 0.12 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.62 2qlv h LEU 622 Cb 0.27 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.32 2qlv h LEU 622 CO 0.00 0.53 -0.86 0.40 -0.34 0.00 0.00 178.44 178.17 2qlv h ILE 623 N 0.00 1.35 -0.09 4.05 2.04 -0.70 -3.16 117.51 120.99 2qlv h ILE 623 Ca -0.01 -2.20 0.04 0.00 1.00 0.00 0.00 64.86 63.69 2qlv h ILE 623 Cb 0.94 2.53 -0.04 0.00 -0.74 0.00 0.00 36.82 39.51 2qlv h ILE 623 CO 0.07 0.66 -0.16 -0.03 0.00 0.00 0.00 178.15 178.69 2qlv h MET 624 N 0.15 -0.21 -0.58 2.37 4.05 -1.08 -1.23 114.93 118.40 2qlv h MET 624 Ca -0.11 0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.39 2qlv h MET 624 Cb 1.55 0.05 -0.06 0.00 -0.80 0.00 0.00 31.60 32.34 2qlv h MET 624 CO 0.17 -0.14 0.25 1.49 0.23 0.00 0.00 176.91 178.92 2qlv h GLU 625 N -0.21 0.46 0.03 0.39 4.57 -1.61 -1.86 114.58 116.34 2qlv h GLU 625 Ca 0.08 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 2qlv h GLU 625 Cb 0.33 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 2qlv h GLU 625 CO -0.22 0.30 -0.14 -0.07 -1.18 0.00 0.00 179.01 177.70 2qlv h LEU 626 N 0.47 -0.41 -0.36 1.64 3.38 -1.40 -0.86 115.31 117.77 2qlv h LEU 626 Ca 0.28 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.34 2qlv h LEU 626 Cb 0.27 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 2qlv h LEU 626 CO -0.24 -0.20 -0.34 0.00 0.09 0.00 0.00 178.44 177.75 2qlv h ALA 627 N 0.66 -0.50 -0.49 1.53 0.00 -0.44 0.60 119.26 120.62 2qlv h ALA 627 Ca 0.04 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2qlv h ALA 627 Cb 0.30 1.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2qlv h ALA 627 CO -0.12 -0.69 0.17 -0.39 0.00 0.00 0.00 179.25 178.22 2qlv h VAL 628 N -0.16 0.83 -0.15 0.00 -1.51 -1.33 -2.03 116.25 111.89 2qlv h VAL 628 Ca 0.06 -0.12 -0.01 0.00 -1.23 0.00 0.00 66.70 65.40 2qlv h VAL 628 Cb 0.32 0.45 -0.01 0.00 -2.13 0.00 0.00 31.29 29.92 2qlv h VAL 628 CO -0.42 0.06 0.05 0.78 -1.23 0.00 0.00 177.57 176.81 2qlv h ASN 629 N 0.34 0.18 -0.03 4.19 4.21 0.21 -3.52 115.58 121.17 2qlv h ASN 629 Ca 0.24 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.74 2qlv h ASN 629 Cb 0.25 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 37.41 2qlv h ASN 629 CO -0.25 0.18 0.00 -1.54 -1.29 0.00 0.00 177.43 174.54