#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qr1 s LYS 451 N 0.00 1.73 -0.28 -3.83 2.20 -1.26 -5.11 119.74 113.20 2qr1 s LYS 451 Ca 0.00 -1.32 -0.29 0.00 -0.36 0.00 0.00 55.97 54.00 2qr1 s LYS 451 Cb 0.00 -2.02 0.01 0.00 -1.51 0.00 0.00 37.83 34.31 2qr1 s LYS 451 CO 0.00 0.44 1.05 -1.58 -0.36 0.00 0.00 175.35 174.91 2qr1 s TRP 452 N -1.43 3.24 0.31 4.03 0.52 -1.26 -5.05 118.94 119.31 2qr1 s TRP 452 Ca 0.20 1.32 0.10 0.00 0.02 0.00 0.00 56.10 57.74 2qr1 s TRP 452 Cb -0.09 -3.49 -0.06 0.00 -1.15 0.00 0.00 33.47 28.68 2qr1 s TRP 452 CO 0.11 -0.63 -0.12 -3.38 0.02 0.00 0.00 176.95 172.95 2qr1 s HIS 453 N 3.43 2.28 0.52 -1.98 -3.43 -1.26 -5.13 115.29 109.73 2qr1 s HIS 453 Ca 0.45 -0.49 -0.19 0.00 -0.80 0.00 0.00 55.06 54.02 2qr1 s HIS 453 Cb -0.14 -1.23 -0.07 0.00 -1.43 0.00 0.00 32.58 29.72 2qr1 s HIS 453 CO 0.11 0.56 1.06 -0.06 -2.00 0.00 0.00 174.74 174.40 2qr1 s PHE 454 N -2.66 2.95 0.05 0.38 0.40 -1.26 -4.93 117.98 112.91 2qr1 s PHE 454 Ca 0.31 1.56 0.00 0.00 -0.60 0.00 0.00 56.93 58.20 2qr1 s PHE 454 Cb 0.01 -3.08 0.00 0.00 0.51 0.00 0.00 43.02 40.46 2qr1 s PHE 454 CO 0.15 -1.00 0.00 0.41 0.70 0.00 0.00 175.22 175.48 2qr1 n GLY 455 N -0.38 -1.23 3.76 4.36 0.00 -1.26 -4.75 105.19 105.69 2qr1 n GLY 455 Ca 0.09 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 2qr1 n GLY 455 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qr1 s VAL 456 N -0.33 4.57 0.22 1.61 -7.23 -1.10 -4.90 120.40 113.24 2qr1 s VAL 456 Ca 0.00 -0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 59.37 2qr1 s VAL 456 Cb 0.00 -3.10 -0.08 0.00 0.56 0.00 0.00 36.38 33.76 2qr1 s VAL 456 CO 0.00 0.33 1.10 -0.13 -0.31 0.00 0.00 175.10 176.08 2qr1 s ARG 457 N -1.78 4.62 0.27 4.82 1.81 -1.26 -0.77 118.95 126.65 2qr1 s ARG 457 Ca 0.23 1.75 0.10 0.00 -1.72 0.00 0.00 55.73 56.09 2qr1 s ARG 457 Cb -0.12 -3.24 -0.05 0.00 -0.45 0.00 0.00 34.95 31.09 2qr1 s ARG 457 CO 0.14 0.14 -0.15 0.00 -0.68 0.00 0.00 175.30 174.75 2qr1 s ARG 459 N -3.59 0.56 0.00 0.00 1.70 -1.26 -1.91 118.95 114.44 2qr1 s ARG 459 Ca 0.28 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 54.66 2qr1 s ARG 459 Cb -0.01 -0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.20 2qr1 s ARG 459 CO 0.12 0.01 0.00 0.41 -1.08 0.00 0.00 175.30 174.76 2qr1 n GLY 460 N 1.08 1.03 3.52 3.88 0.00 -0.35 -4.92 105.19 109.44 2qr1 n GLY 460 Ca -0.20 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 2qr1 n GLY 460 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qr1 s ASP 461 N -4.00 5.17 0.23 1.61 -0.00 -1.26 -4.48 116.67 113.93 2qr1 s ASP 461 Ca 0.00 -0.09 -0.09 0.00 -0.00 0.00 0.00 52.55 52.38 2qr1 s ASP 461 Cb 0.00 -1.89 0.37 0.00 -0.00 0.00 0.00 42.92 41.40 2qr1 s ASP 461 CO 0.00 0.10 1.66 0.00 -0.00 0.00 0.00 175.17 176.93 2qr1 h ALA 462 N 7.20 0.72 -0.84 5.23 0.00 -1.95 -1.75 119.26 127.88 2qr1 h ALA 462 Ca -0.35 0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.83 2qr1 h ALA 462 Cb 1.18 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 19.25 2qr1 h ALA 462 CO 0.64 -0.39 0.51 -1.35 0.00 0.00 0.00 179.25 178.65 2qr1 h PRO 463 N 0.14 0.88 -0.49 0.00 0.11 -2.00 -0.56 132.00 130.07 2qr1 h PRO 463 Ca 0.37 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.44 2qr1 h PRO 463 Cb 0.62 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 2qr1 h PRO 463 CO -0.57 0.58 0.30 0.93 -0.21 0.00 0.00 178.00 179.03 2qr1 h GLU 464 N 0.90 0.59 -0.78 1.05 5.08 -1.76 -2.29 114.58 117.38 2qr1 h GLU 464 Ca 0.38 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 2qr1 h GLU 464 Cb 0.23 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2qr1 h GLU 464 CO -0.19 0.39 0.45 0.82 -1.00 0.00 0.00 179.01 179.47 2qr1 h ILE 465 N 0.61 1.22 -0.20 3.13 2.04 -0.87 0.73 117.51 124.18 2qr1 h ILE 465 Ca 0.19 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 2qr1 h ILE 465 Cb -0.01 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 2qr1 h ILE 465 CO -0.07 0.24 0.08 0.25 0.00 0.00 0.00 178.15 178.64 2qr1 h LEU 466 N 1.07 0.27 -0.47 1.44 5.85 -0.83 0.81 115.31 123.46 2qr1 h LEU 466 Ca 0.28 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.92 2qr1 h LEU 466 Cb -0.01 -0.07 -0.10 0.00 0.37 0.00 0.00 40.66 40.85 2qr1 h LEU 466 CO -0.05 0.37 -0.26 0.25 -0.34 0.00 0.00 178.44 178.41 2qr1 h LEU 467 N 0.16 -0.87 -1.02 2.25 5.85 -0.74 -0.95 115.31 119.99 2qr1 h LEU 467 Ca 0.06 0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2qr1 h LEU 467 Cb 0.18 0.45 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 2qr1 h LEU 467 CO -0.00 -0.27 0.64 0.00 -0.34 0.00 0.00 178.44 178.47 2qr1 h ALA 468 N 1.07 1.29 -0.73 1.25 0.00 -0.27 -1.07 119.26 120.80 2qr1 h ALA 468 Ca 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qr1 h ALA 468 Cb 0.49 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2qr1 h ALA 468 CO -0.56 0.66 0.47 0.28 0.00 0.00 0.00 179.25 180.09 2qr1 h VAL 469 N 1.33 1.20 -0.34 0.00 2.07 0.14 -0.39 116.25 120.26 2qr1 h VAL 469 Ca 0.36 -0.39 -0.11 0.00 0.82 0.00 0.00 66.70 67.38 2qr1 h VAL 469 Cb -0.14 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 2qr1 h VAL 469 CO -0.08 0.19 -0.21 1.88 0.02 0.00 0.00 177.57 179.37 2qr1 h TYR 470 N 0.99 0.88 -0.85 1.57 -1.99 -0.18 -1.06 116.97 116.32 2qr1 h TYR 470 Ca 0.27 -0.23 0.03 0.00 2.00 0.00 0.00 58.73 60.80 2qr1 h TYR 470 Cb -0.08 -0.20 -0.05 0.00 2.00 0.00 0.00 36.73 38.40 2qr1 h TYR 470 CO -0.02 0.97 0.56 0.00 -0.00 0.00 0.00 178.16 179.67 2qr1 h ARG 471 N 0.53 1.02 0.26 4.88 3.08 -1.01 -0.42 114.38 122.72 2qr1 h ARG 471 Ca 0.07 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 2qr1 h ARG 471 Cb 0.77 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2qr1 h ARG 471 CO 0.06 0.68 -0.12 0.00 -1.07 0.00 0.00 179.97 179.51 2qr1 h ALA 472 N 1.51 -0.34 -0.78 0.04 0.00 -0.55 -1.42 119.26 117.70 2qr1 h ALA 472 Ca 0.34 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 55.24 2qr1 h ALA 472 Cb 0.03 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 17.84 2qr1 h ALA 472 CO -0.10 -0.51 0.22 -0.07 0.00 0.00 0.00 179.25 178.79 2qr1 h LEU 473 N -0.72 0.06 -0.18 0.00 3.38 -0.98 0.29 115.31 117.15 2qr1 h LEU 473 Ca -0.04 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2qr1 h LEU 473 Cb 0.49 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2qr1 h LEU 473 CO 0.06 -0.04 0.08 -0.61 0.09 0.00 0.00 178.44 178.01 2qr1 h GLN 474 N 0.29 0.27 0.00 1.13 4.15 -0.99 -0.70 115.11 119.25 2qr1 h GLN 474 Ca 0.45 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.83 2qr1 h GLN 474 Cb 0.80 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.45 2qr1 h GLN 474 CO -0.53 0.32 0.00 0.54 -1.93 0.00 0.00 178.83 177.23 2qr1 n ARG 475 N -4.86 0.20 -0.09 1.69 1.74 -0.42 -2.20 116.66 112.70 2qr1 n ARG 475 Ca -0.04 0.44 0.12 0.00 -0.77 0.00 0.00 57.85 57.60 2qr1 n ARG 475 Cb 0.11 -1.89 0.28 0.00 -1.02 0.00 0.00 32.46 29.95 2qr1 n ARG 475 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qr1 n ALA 476 N -1.78 2.48 0.00 7.54 0.00 0.90 -4.96 120.51 124.69 2qr1 n ALA 476 Ca 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.74 2qr1 n ALA 476 Cb 0.22 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.70 2qr1 n ALA 476 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qr1 n GLY 477 N 1.32 2.84 3.33 0.00 0.00 -0.83 -5.02 105.19 106.82 2qr1 n GLY 477 Ca 0.17 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2qr1 n GLY 477 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qr1 n ALA 478 N 0.00 -3.52 -2.55 4.61 0.00 -0.92 -4.89 120.51 113.24 2qr1 n ALA 478 Ca 0.00 -0.99 -0.26 0.00 0.00 0.00 0.00 53.44 52.19 2qr1 n ALA 478 Cb 0.00 -1.63 -0.10 0.00 0.00 0.00 0.00 19.45 17.72 2qr1 n ALA 478 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2qr1 s GLN 479 N -3.49 1.86 0.07 0.00 -0.21 0.66 -4.64 119.66 113.92 2qr1 s GLN 479 Ca 0.56 -1.93 -0.26 0.00 0.02 0.00 0.00 55.36 53.75 2qr1 s GLN 479 Cb -0.16 -1.73 0.09 0.00 1.00 0.00 0.00 33.01 32.21 2qr1 s GLN 479 CO 0.67 0.12 0.76 -0.59 -2.12 0.00 0.00 175.29 174.13 2qr1 s PHE 480 N -2.61 -0.43 0.20 0.91 -0.12 -1.26 -0.55 117.98 114.13 2qr1 s PHE 480 Ca 0.33 0.25 -0.22 0.00 -0.05 0.00 0.00 56.93 57.24 2qr1 s PHE 480 Cb 0.03 0.55 -0.08 0.00 -0.63 0.00 0.00 43.02 42.89 2qr1 s PHE 480 CO 0.17 -0.69 0.75 0.95 -0.05 0.00 0.00 175.22 176.35 2qr1 s THR 481 N -3.40 4.48 0.04 -4.49 -4.23 -0.77 -5.01 115.64 102.25 2qr1 s THR 481 Ca 0.03 1.47 -0.12 0.00 -1.18 0.00 0.00 61.69 61.89 2qr1 s THR 481 Cb -0.01 -3.97 -0.06 0.00 1.34 0.00 0.00 72.50 69.80 2qr1 s THR 481 CO -0.10 0.33 0.40 -0.69 -0.54 0.00 0.00 174.62 174.01 2qr1 s VAL 482 N -1.38 5.07 0.09 2.29 1.01 -1.26 -4.77 120.40 121.45 2qr1 s VAL 482 Ca 0.40 0.62 -0.35 0.00 0.00 0.00 0.00 61.98 62.66 2qr1 s VAL 482 Cb -0.19 -3.67 -0.14 0.00 0.00 0.00 0.00 36.38 32.38 2qr1 s VAL 482 CO 0.23 0.42 1.59 -0.81 0.00 0.00 0.00 175.10 176.53 2qr1 n PRO 483 N 1.32 1.93 -3.59 2.72 -0.04 -1.26 -4.94 135.00 131.13 2qr1 n PRO 483 Ca -0.11 0.70 -0.37 0.00 -0.04 0.00 0.00 63.50 63.68 2qr1 n PRO 483 Cb 0.52 -2.45 -0.09 0.00 -0.04 0.00 0.00 33.50 31.44 2qr1 n PRO 483 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2qr1 s LYS 484 N 1.43 4.10 0.53 0.54 -0.14 -1.26 -5.09 119.74 119.85 2qr1 s LYS 484 Ca 0.83 -0.14 -0.18 0.00 -1.36 0.00 0.00 55.97 55.12 2qr1 s LYS 484 Cb -0.75 -3.54 -0.07 0.00 -1.68 0.00 0.00 37.83 31.80 2qr1 s LYS 484 CO 0.43 0.04 1.02 -1.25 -0.76 0.00 0.00 175.35 174.83 2qr1 s PRO 485 N 1.11 3.71 -0.09 -1.68 0.04 -1.26 -4.70 135.00 132.13 2qr1 s PRO 485 Ca 0.11 1.17 0.03 0.00 0.04 0.00 0.00 61.00 62.35 2qr1 s PRO 485 Cb -0.14 -2.09 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 2qr1 s PRO 485 CO 0.05 -0.48 -0.20 0.08 0.04 0.00 0.00 177.00 176.49 2qr1 s VAL 486 N -2.34 2.46 -1.54 -0.36 1.01 0.04 -4.77 120.40 114.89 2qr1 s VAL 486 Ca 0.63 -0.90 -0.12 0.00 0.00 0.00 0.00 61.98 61.59 2qr1 s VAL 486 Cb -0.14 -1.96 0.09 0.00 0.00 0.00 0.00 36.38 34.37 2qr1 s VAL 486 CO 0.28 0.56 0.86 0.59 0.00 0.00 0.00 175.10 177.40 2qr1 n ASN 487 N 3.18 -3.72 0.00 3.32 3.02 -1.26 -1.69 115.26 118.11 2qr1 n ASN 487 Ca -0.18 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 2qr1 n ASN 487 Cb 0.52 -3.58 0.00 0.00 -0.61 0.00 0.00 39.78 36.12 2qr1 n ASN 487 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qr1 n GLY 488 N -1.64 2.38 3.21 7.41 0.00 -1.26 -5.01 105.19 110.27 2qr1 n GLY 488 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 2qr1 n GLY 488 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qr1 s LYS 489 N -0.53 0.92 0.32 1.61 1.02 -0.68 -5.07 119.74 117.32 2qr1 s LYS 489 Ca 0.00 -1.07 -0.26 0.00 0.02 0.00 0.00 55.97 54.67 2qr1 s LYS 489 Cb 0.00 -0.94 -0.10 0.00 -0.52 0.00 0.00 37.83 36.27 2qr1 s LYS 489 CO 0.00 0.20 0.93 0.71 -0.92 0.00 0.00 175.35 176.27 2qr1 s TYR 490 N -1.49 3.69 0.53 3.18 1.51 -1.26 -0.78 117.35 122.72 2qr1 s TYR 490 Ca 0.02 1.75 0.03 0.00 -1.01 0.00 0.00 57.07 57.87 2qr1 s TYR 490 Cb -0.09 -2.90 0.02 0.00 -0.11 0.00 0.00 41.96 38.88 2qr1 s TYR 490 CO 0.03 0.22 0.22 1.03 -1.11 0.00 0.00 175.55 175.94 2qr1 s ARG 491 N -2.05 2.23 0.56 -0.62 1.81 -1.26 -4.95 118.95 114.67 2qr1 s ARG 491 Ca 0.50 -2.19 0.30 0.00 -1.72 0.00 0.00 55.73 52.61 2qr1 s ARG 491 Cb -0.18 -1.84 1.46 0.00 -0.45 0.00 0.00 34.95 33.94 2qr1 s ARG 491 CO 0.23 -0.50 1.88 0.77 -0.68 0.00 0.00 175.30 177.00 2qr1 h SER 492 N 1.02 0.00 -0.70 0.23 0.02 -2.00 0.58 113.55 112.70 2qr1 h SER 492 Ca -0.40 0.00 0.20 0.00 -0.84 0.00 0.00 61.79 60.75 2qr1 h SER 492 Cb 1.31 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.82 2qr1 h SER 492 CO 0.65 0.00 1.02 -2.24 -1.14 0.00 0.00 176.83 175.12 2qr1 h ASP 493 N 0.00 0.00 -0.70 3.07 2.03 -1.96 0.68 116.42 119.55 2qr1 h ASP 493 Ca 0.34 0.00 0.13 0.00 -0.73 0.00 0.00 57.03 56.77 2qr1 h ASP 493 Cb 1.52 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.93 2qr1 h ASP 493 CO -0.00 0.00 0.24 -0.03 -1.03 0.00 0.00 179.24 178.42 2qr1 h MET 494 N 0.00 0.37 -0.88 4.15 4.05 -1.24 -2.76 114.93 118.62 2qr1 h MET 494 Ca 0.33 -0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.71 2qr1 h MET 494 Cb 2.38 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 33.08 2qr1 h MET 494 CO -0.00 0.24 0.02 0.66 0.23 0.00 0.00 176.91 178.06 2qr1 n TYR 495 N -5.04 0.69 -3.97 1.39 4.02 0.23 -4.53 117.16 109.94 2qr1 n TYR 495 Ca 0.12 -0.30 -0.31 0.00 -0.01 0.00 0.00 57.90 57.41 2qr1 n TYR 495 Cb 0.38 -0.25 -0.15 0.00 -0.02 0.00 0.00 39.34 39.29 2qr1 n TYR 495 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2qr1 s THR 496 N -1.50 1.96 -0.24 -0.72 2.01 -1.04 -1.77 115.64 114.35 2qr1 s THR 496 Ca 0.17 -1.99 -0.09 0.00 0.31 0.00 0.00 61.69 60.09 2qr1 s THR 496 Cb 0.13 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 2qr1 s THR 496 CO 0.05 -0.49 0.12 -0.63 -0.69 0.00 0.00 174.62 172.97 2qr1 s ILE 497 N 1.09 4.93 -0.15 1.82 1.01 -1.03 -4.96 121.20 123.91 2qr1 s ILE 497 Ca 0.07 0.03 -0.18 0.00 0.00 0.00 0.00 60.65 60.57 2qr1 s ILE 497 Cb -0.19 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 2qr1 s ILE 497 CO -0.10 0.35 0.49 -0.54 0.00 0.00 0.00 174.94 175.14 2qr1 s LYS 498 N 1.16 4.28 0.21 2.79 1.02 -1.26 0.32 119.74 128.26 2qr1 s LYS 498 Ca 0.06 0.43 0.08 0.00 0.02 0.00 0.00 55.97 56.57 2qr1 s LYS 498 Cb -0.14 -3.49 -0.05 0.00 -0.52 0.00 0.00 37.83 33.64 2qr1 s LYS 498 CO 0.05 0.04 -0.16 -1.54 -0.92 0.00 0.00 175.35 172.82 2qr1 s SER 499 N 0.84 2.73 0.00 2.83 1.04 0.20 -1.85 113.70 119.49 2qr1 s SER 499 Ca 0.25 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2qr1 s SER 499 Cb -0.15 -0.16 -0.00 0.00 0.10 0.00 0.00 66.02 65.80 2qr1 s SER 499 CO 0.10 -0.13 -0.01 -0.60 0.98 0.00 0.00 173.24 173.59 2qr1 s ARG 500 N -3.55 0.06 -0.08 4.02 3.52 0.29 -2.12 118.95 121.08 2qr1 s ARG 500 Ca 0.23 -0.07 0.00 0.00 -0.13 0.00 0.00 55.73 55.76 2qr1 s ARG 500 Cb -0.02 -0.01 0.02 0.00 -1.56 0.00 0.00 34.95 33.38 2qr1 s ARG 500 CO 0.08 0.00 -0.06 -1.58 -0.81 0.00 0.00 175.30 172.93 2qr1 s TRP 501 N -0.16 1.15 -0.27 5.12 0.52 -0.91 -0.24 118.94 124.14 2qr1 s TRP 501 Ca -0.01 -0.47 -0.29 0.00 0.02 0.00 0.00 56.10 55.34 2qr1 s TRP 501 Cb -0.01 -1.00 -0.06 0.00 -1.15 0.00 0.00 33.47 31.25 2qr1 s TRP 501 CO -0.00 -0.37 2.25 0.39 0.02 0.00 0.00 176.95 179.24 2qr1 n GLU 502 N 4.65 1.72 -2.07 4.98 1.02 -1.26 -1.67 120.64 128.01 2qr1 n GLU 502 Ca -0.15 0.43 -0.43 0.00 -0.02 0.00 0.00 57.16 56.99 2qr1 n GLU 502 Cb 0.50 -3.16 -0.03 0.00 -0.02 0.00 0.00 31.44 28.74 2qr1 n GLU 502 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2qr1 s ILE 503 N 8.73 3.67 0.00 -3.67 1.10 -0.89 -4.93 121.20 125.20 2qr1 s ILE 503 Ca 1.02 0.78 0.00 0.00 -0.51 0.00 0.00 60.65 61.94 2qr1 s ILE 503 Cb -0.38 -3.59 0.00 0.00 0.15 0.00 0.00 42.46 38.63 2qr1 s ILE 503 CO 0.36 -0.17 0.90 -2.65 -2.11 0.00 0.00 174.94 171.28 2qr1 n PRO 504 N 7.37 0.00 0.32 3.50 -0.02 -1.26 -2.67 135.00 142.24 2qr1 n PRO 504 Ca 0.18 0.90 0.20 0.00 -2.02 0.00 0.00 63.50 62.77 2qr1 n PRO 504 Cb 0.44 -1.37 1.07 0.00 -0.02 0.00 0.00 33.50 33.62 2qr1 n PRO 504 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 2qr1 h HIS 505 N 0.00 0.00 -0.18 6.00 2.07 -1.99 -1.56 115.15 119.49 2qr1 h HIS 505 Ca 0.00 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.42 2qr1 h HIS 505 Cb 0.00 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.98 2qr1 h HIS 505 CO -0.82 0.01 -0.26 0.00 -3.07 0.00 0.00 177.93 173.79 2qr1 h LYS 507 N 0.14 -0.71 -0.92 0.00 1.63 -1.25 0.93 116.57 116.39 2qr1 h LYS 507 Ca 0.02 0.05 0.27 0.00 -0.85 0.00 0.00 60.65 60.13 2qr1 h LYS 507 Cb 0.83 0.16 -0.15 0.00 -0.60 0.00 0.00 32.23 32.48 2qr1 h LYS 507 CO 0.06 -0.47 0.32 0.00 -3.45 0.00 0.00 179.45 175.90 2qr1 h ARG 508 N -0.74 0.21 -0.81 1.90 3.08 -1.57 1.12 114.38 117.57 2qr1 h ARG 508 Ca -0.00 -0.01 -0.20 0.00 0.07 0.00 0.00 59.98 59.83 2qr1 h ARG 508 Cb 0.71 -0.05 -0.12 0.00 0.08 0.00 0.00 29.97 30.60 2qr1 h ARG 508 CO -0.17 0.14 0.25 0.39 -1.07 0.00 0.00 179.97 179.52 2qr1 n GLU 509 N -5.20 3.25 -3.58 0.04 4.71 -0.72 -4.96 120.64 114.18 2qr1 n GLU 509 Ca 0.25 -2.58 -0.21 0.00 -0.01 0.00 0.00 57.16 54.60 2qr1 n GLU 509 Cb 0.79 -2.07 0.05 0.00 -1.01 0.00 0.00 31.44 29.19 2qr1 n GLU 509 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qr1 n GLY 510 N -0.12 -0.56 2.82 0.62 0.00 0.39 -4.95 105.19 103.38 2qr1 n GLY 510 Ca 0.36 0.25 -0.26 0.00 0.00 0.00 0.00 46.02 46.37 2qr1 n GLY 510 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qr1 s LYS 511 N -5.62 0.98 -1.16 1.61 1.02 0.21 -4.95 119.74 111.84 2qr1 s LYS 511 Ca 0.15 -0.23 -0.21 0.00 0.02 0.00 0.00 55.97 55.70 2qr1 s LYS 511 Cb -0.04 -1.60 -0.06 0.00 -0.52 0.00 0.00 37.83 35.62 2qr1 s LYS 511 CO 0.80 -0.41 1.91 0.09 -0.92 0.00 0.00 175.35 176.82 2qr1 n ASN 512 N 5.02 3.43 -4.12 2.83 5.03 -1.26 -3.80 115.26 122.39 2qr1 n ASN 512 Ca -0.10 -2.75 -0.23 0.00 0.87 0.00 0.00 54.58 52.37 2qr1 n ASN 512 Cb 0.49 -1.63 -0.15 0.00 -1.02 0.00 0.00 39.78 37.46 2qr1 n ASN 512 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2qr1 s THR 513 N 8.11 1.20 0.31 3.41 -4.23 -1.26 -1.74 115.64 121.43 2qr1 s THR 513 Ca 0.62 -0.64 0.09 0.00 -1.18 0.00 0.00 61.69 60.58 2qr1 s THR 513 Cb 0.04 -1.00 -0.06 0.00 1.34 0.00 0.00 72.50 72.82 2qr1 s THR 513 CO 0.11 0.34 -0.11 -0.31 -0.54 0.00 0.00 174.62 174.11 2qr1 s TYR 514 N -0.31 2.23 -0.08 3.99 1.51 -0.83 -2.09 117.35 121.78 2qr1 s TYR 514 Ca 0.05 -0.51 0.03 0.00 -1.01 0.00 0.00 57.07 55.62 2qr1 s TYR 514 Cb -0.06 -1.20 0.01 0.00 -0.11 0.00 0.00 41.96 40.59 2qr1 s TYR 514 CO -0.00 0.53 -0.16 0.00 -1.11 0.00 0.00 175.55 174.81 2qr1 s ALA 515 N -2.70 1.53 -0.26 3.71 0.00 -0.67 -2.72 121.76 120.64 2qr1 s ALA 515 Ca 0.31 -0.58 -0.09 0.00 0.00 0.00 0.00 51.96 51.59 2qr1 s ALA 515 Cb 0.01 -0.65 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 2qr1 s ALA 515 CO 0.15 0.15 0.12 0.71 0.00 0.00 0.00 175.76 176.89 2qr1 s TYR 516 N 0.60 3.14 -0.10 0.00 2.02 0.48 -2.15 117.35 121.34 2qr1 s TYR 516 Ca -0.15 -0.19 -0.00 0.00 -0.37 0.00 0.00 57.07 56.36 2qr1 s TYR 516 Cb -0.16 -2.30 0.02 0.00 -0.40 0.00 0.00 41.96 39.12 2qr1 s TYR 516 CO 0.05 -0.27 -0.08 0.42 -1.57 0.00 0.00 175.55 174.09 2qr1 s ILE 517 N 1.68 1.01 -0.30 2.71 1.01 -0.90 0.11 121.20 126.52 2qr1 s ILE 517 Ca 0.07 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.27 2qr1 s ILE 517 Cb -0.15 -1.02 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 2qr1 s ILE 517 CO 0.07 0.36 0.34 -0.70 0.00 0.00 0.00 174.94 175.01 2qr1 s GLU 518 N 1.56 3.84 0.34 2.79 2.12 -0.60 -0.63 118.70 128.12 2qr1 s GLU 518 Ca 0.02 -0.18 -0.01 0.00 0.36 0.00 0.00 54.97 55.16 2qr1 s GLU 518 Cb -0.13 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.51 2qr1 s GLU 518 CO -0.06 -0.35 0.56 -0.51 -0.54 0.00 0.00 175.26 174.36 2qr1 s LEU 519 N 2.01 4.00 -0.29 2.70 2.01 0.15 -2.00 118.68 127.26 2qr1 s LEU 519 Ca 0.13 0.54 -0.14 0.00 0.01 0.00 0.00 54.13 54.67 2qr1 s LEU 519 Cb -0.16 -3.40 0.10 0.00 0.01 0.00 0.00 46.19 42.74 2qr1 s LEU 519 CO 0.11 -0.29 0.70 -1.58 1.01 0.00 0.00 176.35 176.29 2qr1 s GLN 520 N -4.16 0.65 -0.05 1.70 2.00 -0.30 -2.46 119.66 117.03 2qr1 s GLN 520 Ca 0.41 1.26 -0.11 0.00 -2.00 0.00 0.00 55.36 54.92 2qr1 s GLN 520 Cb -0.10 0.36 -0.05 0.00 0.80 0.00 0.00 33.01 34.02 2qr1 s GLN 520 CO 0.35 -0.16 0.29 -1.17 -0.50 0.00 0.00 175.29 174.10 2qr1 s LEU 521 N 2.01 4.44 -0.01 3.68 2.96 -0.73 -0.40 118.68 130.64 2qr1 s LEU 521 Ca -0.09 0.74 0.03 0.00 -0.22 0.00 0.00 54.13 54.59 2qr1 s LEU 521 Cb -0.07 -2.37 -0.00 0.00 0.50 0.00 0.00 46.19 44.25 2qr1 s LEU 521 CO -0.19 0.36 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.80 2qr1 s TYR 522 N -1.06 0.78 0.20 5.38 2.02 -0.59 -4.96 117.35 119.11 2qr1 s TYR 522 Ca 0.20 -0.15 -0.28 0.00 -0.37 0.00 0.00 57.07 56.47 2qr1 s TYR 522 Cb -0.15 -0.51 -0.08 0.00 -0.40 0.00 0.00 41.96 40.82 2qr1 s TYR 522 CO 0.09 -0.03 0.87 -2.00 -1.57 0.00 0.00 175.55 172.91 2qr1 s GLU 523 N -0.14 4.72 -0.15 -0.62 2.12 -1.26 -0.76 118.70 122.62 2qr1 s GLU 523 Ca 0.02 1.34 0.02 0.00 0.36 0.00 0.00 54.97 56.71 2qr1 s GLU 523 Cb -0.04 -3.28 -0.10 0.00 0.26 0.00 0.00 34.13 30.97 2qr1 s GLU 523 CO -0.00 0.53 -0.13 0.28 -0.54 0.00 0.00 175.26 175.40 2qr1 n VAL 524 N 1.59 0.87 -3.70 3.70 0.31 0.44 -4.92 118.33 116.62 2qr1 n VAL 524 Ca -0.04 -0.35 -0.09 0.00 -0.01 0.00 0.00 64.34 63.86 2qr1 n VAL 524 Cb 0.48 -1.02 -0.02 0.00 -0.91 0.00 0.00 33.84 32.37 2qr1 n VAL 524 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qr1 s MET 525 N -2.31 1.59 -0.17 5.55 0.00 -1.17 -5.04 119.30 117.75 2qr1 s MET 525 Ca -0.20 -0.79 -0.38 0.00 0.00 0.00 0.00 55.69 54.32 2qr1 s MET 525 Cb 0.05 0.59 -0.15 0.00 0.00 0.00 0.00 34.83 35.33 2qr1 s MET 525 CO 0.36 -0.72 1.71 -0.35 0.00 0.00 0.00 175.02 176.03 2qr1 n PRO 526 N -0.43 1.42 -0.34 3.16 -0.04 -1.26 -0.93 135.00 136.57 2qr1 n PRO 526 Ca -0.09 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 2qr1 n PRO 526 Cb 0.61 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2qr1 n PRO 526 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qr1 n GLY 527 N 3.98 1.49 3.09 0.55 0.00 -1.26 -5.03 105.19 108.00 2qr1 n GLY 527 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 2qr1 n GLY 527 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qr1 s PHE 529 N -0.19 1.28 -0.01 0.00 0.40 -0.80 -0.42 117.98 118.24 2qr1 s PHE 529 Ca 0.03 -1.34 0.02 0.00 -0.60 0.00 0.00 56.93 55.04 2qr1 s PHE 529 Cb -0.07 -0.66 0.00 0.00 0.51 0.00 0.00 43.02 42.81 2qr1 s PHE 529 CO -0.00 -0.57 -0.06 1.41 0.70 0.00 0.00 175.22 176.70 2qr1 s MET 530 N -4.10 0.62 -0.57 0.44 -2.45 0.06 -2.18 119.30 111.13 2qr1 s MET 530 Ca 0.39 -0.21 -0.13 0.00 -1.25 0.00 0.00 55.69 54.48 2qr1 s MET 530 Cb 0.07 -0.61 0.14 0.00 1.25 0.00 0.00 34.83 35.69 2qr1 s MET 530 CO 0.13 0.10 0.49 -1.17 1.05 0.00 0.00 175.02 175.62 2qr1 s LEU 531 N 0.08 6.09 -0.19 4.11 2.96 0.05 -1.55 118.68 130.24 2qr1 s LEU 531 Ca -0.01 -2.00 -0.29 0.00 -0.22 0.00 0.00 54.13 51.61 2qr1 s LEU 531 Cb -0.05 -2.14 -0.01 0.00 0.50 0.00 0.00 46.19 44.49 2qr1 s LEU 531 CO -0.00 -0.75 1.30 -0.62 -1.32 0.00 0.00 176.35 174.96 2qr1 s ASP 532 N 3.00 6.86 -0.14 3.68 2.15 0.47 -2.71 116.67 129.98 2qr1 s ASP 532 Ca 0.07 1.63 -0.03 0.00 0.43 0.00 0.00 52.55 54.64 2qr1 s ASP 532 Cb -0.26 -2.54 -0.03 0.00 -0.30 0.00 0.00 42.92 39.80 2qr1 s ASP 532 CO -0.00 -0.84 -0.04 -0.69 -0.17 0.00 0.00 175.17 173.43 2qr1 s VAL 533 N 3.74 3.90 -0.06 1.11 1.01 -1.26 -1.15 120.40 127.69 2qr1 s VAL 533 Ca 0.56 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 2qr1 s VAL 533 Cb -0.21 -2.69 0.04 0.00 0.00 0.00 0.00 36.38 33.51 2qr1 s VAL 533 CO 0.17 0.51 0.12 -0.75 0.00 0.00 0.00 175.10 175.16 2qr1 s LYS 534 N 0.15 0.06 0.16 2.72 2.20 -0.85 -4.95 119.74 119.24 2qr1 s LYS 534 Ca -0.01 0.35 -0.30 0.00 -0.36 0.00 0.00 55.97 55.65 2qr1 s LYS 534 Cb -0.14 -0.21 -0.07 0.00 -1.51 0.00 0.00 37.83 35.90 2qr1 s LYS 534 CO 0.03 -0.18 1.01 0.45 -0.36 0.00 0.00 175.35 176.30 2qr1 s SER 535 N 1.28 7.43 0.00 1.43 0.15 -1.26 -1.56 113.70 121.17 2qr1 s SER 535 Ca -0.08 1.95 0.14 0.00 0.70 0.00 0.00 55.95 58.66 2qr1 s SER 535 Cb -0.12 -2.60 0.35 0.00 -1.71 0.00 0.00 66.02 61.94 2qr1 s SER 535 CO -0.05 -0.09 1.27 0.59 1.20 0.00 0.00 173.24 176.16 2qr1 n ASN 536 N 2.34 3.04 0.00 5.45 5.03 0.30 -4.91 115.26 126.51 2qr1 n ASN 536 Ca 0.02 -1.93 0.00 0.00 0.87 0.00 0.00 54.58 53.53 2qr1 n ASN 536 Cb 0.47 -0.25 0.00 0.00 -1.02 0.00 0.00 39.78 38.98 2qr1 n ASN 536 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qr1 n GLY 537 N 0.83 -1.80 3.37 7.41 0.00 -1.19 -4.78 105.19 109.03 2qr1 n GLY 537 Ca 0.14 -1.81 -0.20 0.00 0.00 0.00 0.00 46.02 44.15 2qr1 n GLY 537 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qr1 s TYR 538 N 0.00 1.88 -0.19 1.61 2.02 -1.26 -0.39 117.35 121.02 2qr1 s TYR 538 Ca 0.00 -0.49 -0.16 0.00 -0.37 0.00 0.00 57.07 56.04 2qr1 s TYR 538 Cb 0.00 -0.86 0.05 0.00 -0.40 0.00 0.00 41.96 40.75 2qr1 s TYR 538 CO 0.00 0.44 0.50 0.21 -1.57 0.00 0.00 175.55 175.13 2qr1 s LYS 539 N -3.46 0.57 -0.70 -0.62 2.20 -1.10 -5.00 119.74 111.62 2qr1 s LYS 539 Ca 0.23 0.74 -0.18 0.00 -0.36 0.00 0.00 55.97 56.39 2qr1 s LYS 539 Cb -0.03 0.24 0.12 0.00 -1.51 0.00 0.00 37.83 36.66 2qr1 s LYS 539 CO 0.09 -0.09 0.81 0.16 -0.36 0.00 0.00 175.35 175.97 2qr1 s ASP 540 N 0.48 6.36 0.00 1.43 -4.77 -1.26 -1.97 116.67 116.93 2qr1 s ASP 540 Ca -0.02 -1.72 0.00 0.00 -3.30 0.00 0.00 52.55 47.52 2qr1 s ASP 540 Cb -0.04 -2.31 0.00 0.00 -1.09 0.00 0.00 42.92 39.47 2qr1 s ASP 540 CO -0.02 -1.05 0.00 -0.38 0.70 0.00 0.00 175.17 174.42 2qr1 n ILE 541 N 5.32 0.00 0.00 2.11 5.41 -0.71 -5.01 119.36 126.48 2qr1 n ILE 541 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.76 2qr1 n ILE 541 Cb 0.45 -0.57 0.00 0.00 -0.71 0.00 0.00 39.64 38.81 2qr1 n ILE 541 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2qr1 n LYS 557 N 1.30 0.00 -2.48 0.38 4.76 -1.26 -5.08 118.16 115.79 2qr1 n LYS 557 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 2qr1 n LYS 557 Cb 0.00 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.16 2qr1 n LYS 557 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2qr1 s SER 558 N -4.00 6.30 0.26 4.39 0.15 -1.26 -4.95 113.70 114.60 2qr1 s SER 558 Ca 0.00 2.02 0.25 0.00 0.70 0.00 0.00 55.95 58.92 2qr1 s SER 558 Cb 0.00 -2.57 0.87 0.00 -1.71 0.00 0.00 66.02 62.61 2qr1 s SER 558 CO 0.00 -0.81 1.75 0.28 1.20 0.00 0.00 173.24 175.67 2qr1 h SER 559 N 1.71 0.00 -3.19 5.45 0.02 -2.06 -3.44 113.55 112.04 2qr1 h SER 559 Ca -0.49 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 59.82 2qr1 h SER 559 Cb 1.23 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.66 2qr1 h SER 559 CO 0.59 0.00 -0.64 -0.36 -1.14 0.00 0.00 176.83 175.28 2qr1 s PHE 560 N -3.22 3.03 -1.94 3.45 2.99 -1.26 -1.06 117.98 119.96 2qr1 s PHE 560 Ca 0.08 -0.02 0.03 0.00 0.00 0.00 0.00 56.93 57.02 2qr1 s PHE 560 Cb 0.11 -1.53 0.08 0.00 0.00 0.00 0.00 43.02 41.68 2qr1 s PHE 560 CO 0.53 0.50 1.05 -0.35 -0.00 0.00 0.00 175.22 176.94 2qr1 n PRO 561 N 0.36 1.23 -0.22 0.24 -0.04 -1.26 -4.91 135.00 130.40 2qr1 n PRO 561 Ca -0.10 -0.33 0.01 0.00 -0.04 0.00 0.00 63.50 63.04 2qr1 n PRO 561 Cb 0.53 -1.10 0.13 0.00 -0.04 0.00 0.00 33.50 33.01 2qr1 n PRO 561 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2qr1 h PHE 562 N 0.54 0.45 -0.68 0.54 3.57 -1.84 0.12 116.94 119.63 2qr1 h PHE 562 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2qr1 h PHE 562 Cb 0.15 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 2qr1 h PHE 562 CO 0.07 0.11 0.30 -0.07 -2.23 0.00 0.00 178.31 176.48 2qr1 h LEU 563 N 0.44 0.90 -1.01 0.59 3.38 -1.45 -0.39 115.31 117.76 2qr1 h LEU 563 Ca 0.33 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.10 2qr1 h LEU 563 Cb 0.43 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2qr1 h LEU 563 CO -0.32 0.78 -0.35 0.44 0.09 0.00 0.00 178.44 179.08 2qr1 h ASP 564 N 0.98 0.27 0.12 -0.43 3.32 -1.53 -1.38 116.42 117.77 2qr1 h ASP 564 Ca 0.23 -0.10 -0.23 0.00 0.02 0.00 0.00 57.03 56.95 2qr1 h ASP 564 Cb 0.14 -0.08 0.02 0.00 0.22 0.00 0.00 39.33 39.64 2qr1 h ASP 564 CO -0.03 0.61 -0.98 -0.07 -1.72 0.00 0.00 179.24 177.05 2qr1 h LEU 565 N 0.23 0.66 -0.99 1.55 4.07 -0.51 -2.73 115.31 117.59 2qr1 h LEU 565 Ca 0.03 -0.87 0.22 0.00 0.08 0.00 0.00 57.88 57.34 2qr1 h LEU 565 Cb 0.73 -0.21 -0.12 0.00 1.08 0.00 0.00 40.66 42.14 2qr1 h LEU 565 CO 0.06 1.47 0.58 0.00 -1.08 0.00 0.00 178.44 179.46 2qr1 h ALA 567 N 1.70 1.21 0.42 0.00 0.00 -1.20 0.92 119.26 122.31 2qr1 h ALA 567 Ca 0.61 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 2qr1 h ALA 567 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2qr1 h ALA 567 CO -0.45 0.52 -0.20 0.52 0.00 0.00 0.00 179.25 179.64 2qr1 h MET 568 N 0.26 -0.54 -0.65 0.00 2.07 -0.76 -1.74 114.93 113.57 2qr1 h MET 568 Ca 0.04 0.04 0.10 0.00 -2.07 0.00 0.00 59.70 57.80 2qr1 h MET 568 Cb 0.66 0.12 -0.07 0.00 -1.87 0.00 0.00 31.60 30.44 2qr1 h MET 568 CO 0.05 -0.34 0.27 1.25 1.07 0.00 0.00 176.91 179.21 2qr1 h LEU 569 N -0.60 0.30 -0.56 1.22 6.46 -0.58 0.43 115.31 121.97 2qr1 h LEU 569 Ca -0.06 0.07 -0.08 0.00 -0.12 0.00 0.00 57.88 57.70 2qr1 h LEU 569 Cb 0.45 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.40 2qr1 h LEU 569 CO 0.09 0.17 0.06 0.58 -0.62 0.00 0.00 178.44 178.72 2qr1 h VAL 570 N 0.47 1.26 -0.13 1.05 2.07 -0.84 0.16 116.25 120.30 2qr1 h VAL 570 Ca 0.33 -1.03 -0.07 0.00 0.82 0.00 0.00 66.70 66.75 2qr1 h VAL 570 Cb 0.39 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2qr1 h VAL 570 CO -0.30 0.37 -0.22 0.00 0.02 0.00 0.00 177.57 177.44 2qr1 h LYS 572 N 0.20 0.45 -1.00 0.00 1.79 -0.48 -2.96 116.57 114.57 2qr1 h LYS 572 Ca 0.03 -0.56 0.12 0.00 -2.18 0.00 0.00 60.65 58.06 2qr1 h LYS 572 Cb 0.51 0.18 -0.08 0.00 -1.58 0.00 0.00 32.23 31.26 2qr1 h LYS 572 CO 0.04 1.21 0.63 -0.07 -1.08 0.00 0.00 179.45 180.18 2qr1 h LEU 573 N -0.05 0.92 -0.20 2.94 3.38 -0.50 -3.03 115.31 118.78 2qr1 h LEU 573 Ca -0.12 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2qr1 h LEU 573 Cb 1.54 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2qr1 h LEU 573 CO 0.16 0.50 0.00 -0.26 0.09 0.00 0.00 178.44 178.93 2qr1 h PHE 574 N 1.00 0.00 -0.97 1.13 0.05 -1.24 -3.28 116.94 113.63 2qr1 h PHE 574 Ca 0.49 0.00 -0.59 0.00 3.82 0.00 0.00 57.97 61.69 2qr1 h PHE 574 Cb 0.47 0.00 -0.40 0.00 2.00 0.00 0.00 35.95 38.02 2qr1 h PHE 574 CO -0.00 0.00 -0.46 -1.13 -0.18 0.00 0.00 178.31 176.54 2qr1 n SER 575 N -2.97 5.43 -0.07 2.17 3.41 -1.12 -5.09 113.62 115.38 2qr1 n SER 575 Ca 0.04 -3.75 0.16 0.00 -0.26 0.00 0.00 58.87 55.05 2qr1 n SER 575 Cb 0.48 -0.49 0.89 0.00 -0.26 0.00 0.00 64.21 64.83 2qr1 n SER 575 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88