#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qy0 s ILE 448 N 0.00 4.28 -1.89 1.39 1.01 -0.61 -4.08 121.20 121.31 2qy0 s ILE 448 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.40 2qy0 s ILE 448 Cb 0.00 -2.82 0.00 0.00 0.01 0.00 0.00 42.46 39.65 2qy0 s ILE 448 CO 0.00 0.58 0.00 0.61 0.00 0.00 0.00 174.94 176.13 2qy0 n GLY 449 N 2.41 0.28 0.00 6.18 0.00 -1.26 -2.85 105.19 109.95 2qy0 n GLY 449 Ca -0.18 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2qy0 n GLY 449 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qy0 n GLY 450 N -0.84 3.97 3.38 -0.02 0.00 -1.26 -4.71 105.19 105.70 2qy0 n GLY 450 Ca -0.23 -2.08 -0.19 0.00 0.00 0.00 0.00 46.02 43.52 2qy0 n GLY 450 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2qy0 s GLN 451 N 0.77 1.43 0.15 1.61 -0.21 -0.48 -4.90 119.66 118.02 2qy0 s GLN 451 Ca 0.00 -1.69 -0.31 0.00 0.02 0.00 0.00 55.36 53.37 2qy0 s GLN 451 Cb 0.00 -1.05 -0.10 0.00 1.00 0.00 0.00 33.01 32.87 2qy0 s GLN 451 CO 0.00 0.07 1.56 0.15 -2.12 0.00 0.00 175.29 174.95 2qy0 s LYS 452 N -3.72 4.22 0.49 2.91 1.02 -1.26 -1.09 119.74 122.31 2qy0 s LYS 452 Ca 0.27 2.33 -0.21 0.00 0.02 0.00 0.00 55.97 58.37 2qy0 s LYS 452 Cb 0.03 -3.23 -0.07 0.00 -0.52 0.00 0.00 37.83 34.04 2qy0 s LYS 452 CO 0.09 -0.61 1.11 0.00 -0.92 0.00 0.00 175.35 175.02 2qy0 s ALA 453 N 1.35 2.87 0.08 5.17 0.00 0.26 -4.84 121.76 126.64 2qy0 s ALA 453 Ca 0.70 0.79 -0.07 0.00 0.00 0.00 0.00 51.96 53.38 2qy0 s ALA 453 Cb -0.43 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 2qy0 s ALA 453 CO 0.31 -0.56 0.35 0.15 0.00 0.00 0.00 175.76 176.01 2qy0 s LYS 454 N -2.99 3.66 -0.08 0.00 1.02 -1.26 -4.86 119.74 115.23 2qy0 s LYS 454 Ca 0.67 0.02 -0.38 0.00 0.02 0.00 0.00 55.97 56.30 2qy0 s LYS 454 Cb -0.23 -2.98 -0.16 0.00 -0.52 0.00 0.00 37.83 33.94 2qy0 s LYS 454 CO 0.28 0.56 1.53 -1.33 -0.92 0.00 0.00 175.35 175.47 2qy0 n MET 455 N 0.72 1.16 0.00 1.68 2.81 -1.26 -1.03 117.12 121.20 2qy0 n MET 455 Ca -0.07 0.42 0.00 0.00 -1.81 0.00 0.00 57.70 56.24 2qy0 n MET 455 Cb 0.52 -2.09 0.00 0.00 -0.71 0.00 0.00 33.22 30.95 2qy0 n MET 455 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qy0 n GLY 456 N 3.30 1.74 0.20 3.03 0.00 -1.26 -4.95 105.19 107.26 2qy0 n GLY 456 Ca 0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 2qy0 n GLY 456 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2qy0 h ASN 457 N 0.00 0.59 -2.06 1.61 -0.26 -1.43 -3.35 115.58 110.67 2qy0 h ASN 457 Ca 0.00 -0.17 -0.56 0.00 -0.56 0.00 0.00 56.30 55.01 2qy0 h ASN 457 Cb 0.00 -0.15 -0.40 0.00 -1.06 0.00 0.00 38.32 36.71 2qy0 h ASN 457 CO 0.00 0.60 -0.96 0.49 -1.06 0.00 0.00 177.43 176.50 2qy0 n PHE 458 N -4.62 0.97 0.26 1.19 3.01 -1.26 -4.97 117.46 112.04 2qy0 n PHE 458 Ca 0.00 -3.77 0.15 0.00 1.01 0.00 0.00 57.45 54.85 2qy0 n PHE 458 Cb 0.15 -0.42 0.78 0.00 -0.01 0.00 0.00 39.48 39.98 2qy0 n PHE 458 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2qy0 h PRO 459 N 3.86 0.00 -0.00 -1.08 0.13 -1.81 -1.81 132.00 131.29 2qy0 h PRO 459 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2qy0 h PRO 459 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2qy0 h PRO 459 CO 0.58 0.00 -0.06 -2.67 -0.23 0.00 0.00 178.00 175.62 2qy0 n TRP 460 N -2.59 0.00 -2.42 1.56 2.14 -0.53 -2.32 117.44 113.28 2qy0 n TRP 460 Ca -0.01 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.15 2qy0 n TRP 460 Cb 0.10 -0.13 -0.04 0.00 -0.81 0.00 0.00 31.31 30.44 2qy0 n TRP 460 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2qy0 s GLN 461 N -2.31 4.54 0.05 -2.67 2.00 -0.68 -0.15 119.66 120.44 2qy0 s GLN 461 Ca 0.34 1.83 0.08 0.00 -2.00 0.00 0.00 55.36 55.61 2qy0 s GLN 461 Cb 0.21 -3.24 -0.03 0.00 0.80 0.00 0.00 33.01 30.75 2qy0 s GLN 461 CO 0.43 0.01 -0.22 0.08 -0.50 0.00 0.00 175.29 175.09 2qy0 s VAL 462 N -0.35 1.77 -0.22 1.34 1.01 -0.44 -4.40 120.40 119.12 2qy0 s VAL 462 Ca 0.50 -1.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 2qy0 s VAL 462 Cb -0.32 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.51 2qy0 s VAL 462 CO 0.37 0.20 -0.06 0.12 0.00 0.00 0.00 175.10 175.73 2qy0 s PHE 463 N -0.85 2.94 0.18 5.22 5.36 -0.52 -2.36 117.98 127.95 2qy0 s PHE 463 Ca 0.08 -1.07 0.08 0.00 -0.96 0.00 0.00 56.93 55.06 2qy0 s PHE 463 Cb -0.09 -2.08 -0.04 0.00 -0.34 0.00 0.00 43.02 40.47 2qy0 s PHE 463 CO 0.02 -0.60 -0.06 0.95 -1.46 0.00 0.00 175.22 174.08 2qy0 s THR 464 N 1.44 3.39 -0.40 0.12 -4.23 0.46 -0.69 115.64 115.74 2qy0 s THR 464 Ca 0.05 -1.58 0.03 0.00 -1.18 0.00 0.00 61.69 59.01 2qy0 s THR 464 Cb -0.14 -2.69 0.16 0.00 1.34 0.00 0.00 72.50 71.16 2qy0 s THR 464 CO -0.05 -0.12 0.33 0.21 -0.54 0.00 0.00 174.62 174.46 2qy0 s ASN 465 N -2.90 1.64 0.00 3.99 2.47 -0.42 -1.06 114.94 118.66 2qy0 s ASN 465 Ca 0.26 -2.54 0.00 0.00 0.42 0.00 0.00 52.86 51.00 2qy0 s ASN 465 Cb -0.09 -0.14 0.00 0.00 -1.45 0.00 0.00 41.25 39.57 2qy0 s ASN 465 CO 0.17 -0.21 0.00 -0.38 -3.72 0.00 0.00 177.10 172.95 2qy0 n ILE 466 N 3.38 0.00 -1.60 -5.21 5.41 -1.26 -3.89 119.36 116.18 2qy0 n ILE 466 Ca 0.22 0.17 -0.32 0.00 1.00 0.00 0.00 62.75 63.82 2qy0 n ILE 466 Cb 0.45 -1.09 0.06 0.00 -0.71 0.00 0.00 39.64 38.34 2qy0 n ILE 466 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 2qy0 n HIS 467 N -1.92 3.08 0.00 1.39 8.25 -1.26 -4.46 115.22 120.30 2qy0 n HIS 467 Ca 0.00 -2.76 0.00 0.00 -0.26 0.00 0.00 57.72 54.70 2qy0 n HIS 467 Cb 0.00 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.03 2qy0 n HIS 467 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qy0 n GLY 468 N -0.83 0.75 3.74 -1.41 0.00 -1.26 -5.07 105.19 101.11 2qy0 n GLY 468 Ca 0.56 -2.29 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 2qy0 n GLY 468 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qy0 s ARG 469 N -0.80 4.76 0.36 1.61 3.52 -1.26 -4.04 118.95 123.10 2qy0 s ARG 469 Ca 0.00 1.52 -0.07 0.00 -0.13 0.00 0.00 55.73 57.04 2qy0 s ARG 469 Cb 0.00 -3.31 0.03 0.00 -1.56 0.00 0.00 34.95 30.11 2qy0 s ARG 469 CO 0.00 0.34 0.61 0.41 -0.81 0.00 0.00 175.30 175.85 2qy0 n GLY 470 N 1.83 1.62 3.60 8.12 0.00 -0.23 -3.90 105.19 116.23 2qy0 n GLY 470 Ca 0.00 -1.45 -0.28 0.00 0.00 0.00 0.00 46.02 44.29 2qy0 n GLY 470 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qy0 s GLY 471 N -3.09 2.77 0.20 -0.02 0.00 -0.25 -0.41 107.32 106.52 2qy0 s GLY 471 Ca 0.23 -0.93 -0.22 0.00 0.00 0.00 0.00 44.72 43.80 2qy0 s GLY 471 CO 0.17 -1.95 1.00 -0.32 0.00 0.00 0.00 173.10 172.00 2qy0 s GLY 472 N -3.70 0.05 -0.01 0.20 0.00 -0.99 -3.28 107.32 99.59 2qy0 s GLY 472 Ca 0.17 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.65 2qy0 s GLY 472 CO 0.11 1.60 -0.04 0.00 0.00 0.00 0.00 173.10 174.76 2qy0 s ALA 473 N -2.44 0.37 0.20 3.20 0.00 -0.71 -1.32 121.76 121.06 2qy0 s ALA 473 Ca 0.19 -0.16 -0.30 0.00 0.00 0.00 0.00 51.96 51.69 2qy0 s ALA 473 Cb -0.02 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.89 2qy0 s ALA 473 CO 0.05 0.08 1.22 -1.17 0.00 0.00 0.00 175.76 175.94 2qy0 s LEU 474 N -0.00 4.45 -0.04 0.00 2.96 0.79 -0.99 118.68 125.84 2qy0 s LEU 474 Ca 0.01 2.29 0.06 0.00 -0.22 0.00 0.00 54.13 56.26 2qy0 s LEU 474 Cb -0.03 -3.61 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 2qy0 s LEU 474 CO -0.00 -0.40 -0.21 -0.76 -1.32 0.00 0.00 176.35 173.66 2qy0 s LEU 475 N -0.34 2.31 0.00 -0.68 1.43 -0.04 -2.20 118.68 119.16 2qy0 s LEU 475 Ca 0.53 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 2qy0 s LEU 475 Cb -0.34 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2qy0 s LEU 475 CO 0.38 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.87 2qy0 n GLY 476 N 2.58 2.85 0.03 -3.19 0.00 -1.26 -2.03 105.19 104.17 2qy0 n GLY 476 Ca -0.17 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.51 2qy0 n GLY 476 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qy0 n ASP 477 N 0.71 1.66 -0.49 1.61 5.75 -1.26 -4.39 116.55 120.13 2qy0 n ASP 477 Ca 0.00 -2.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 2qy0 n ASP 477 Cb 0.00 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 2qy0 n ASP 477 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2qy0 n ARG 478 N -0.55 0.00 -4.32 0.11 1.85 -1.23 -0.59 116.66 111.94 2qy0 n ARG 478 Ca 0.02 -0.40 -0.23 0.00 -1.00 0.00 0.00 57.85 56.24 2qy0 n ARG 478 Cb 0.37 -0.20 -0.12 0.00 -1.05 0.00 0.00 32.46 31.46 2qy0 n ARG 478 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 2qy0 s TRP 479 N 0.00 1.85 -0.05 2.89 0.52 -0.86 -0.75 118.94 122.54 2qy0 s TRP 479 Ca 0.00 -0.43 0.00 0.00 0.02 0.00 0.00 56.10 55.69 2qy0 s TRP 479 Cb 0.00 -0.97 0.02 0.00 -1.15 0.00 0.00 33.47 31.37 2qy0 s TRP 479 CO 0.00 0.27 -0.03 0.42 0.02 0.00 0.00 176.95 177.63 2qy0 s ILE 480 N -1.52 0.50 -0.07 2.03 1.01 0.35 -0.86 121.20 122.64 2qy0 s ILE 480 Ca 0.11 -0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.56 2qy0 s ILE 480 Cb -0.08 -0.56 -0.05 0.00 0.01 0.00 0.00 42.46 41.78 2qy0 s ILE 480 CO 0.05 0.23 0.32 -0.22 0.00 0.00 0.00 174.94 175.33 2qy0 s LEU 481 N 1.17 4.39 0.00 2.97 2.96 -0.16 -0.32 118.68 129.70 2qy0 s LEU 481 Ca -0.07 0.74 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 2qy0 s LEU 481 Cb -0.14 -2.42 0.00 0.00 0.50 0.00 0.00 46.19 44.13 2qy0 s LEU 481 CO -0.01 0.28 0.00 1.07 -1.32 0.00 0.00 176.35 176.37 2qy0 n THR 482 N 2.33 0.00 -3.41 3.68 5.66 -0.47 -1.73 114.28 120.34 2qy0 n THR 482 Ca -0.15 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.48 2qy0 n THR 482 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 2qy0 n THR 482 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qy0 s ALA 483 N -1.16 3.53 0.30 1.79 0.00 -1.26 -0.77 121.76 124.19 2qy0 s ALA 483 Ca 0.00 -0.29 0.04 0.00 0.00 0.00 0.00 51.96 51.71 2qy0 s ALA 483 Cb 0.00 -2.53 0.77 0.00 0.00 0.00 0.00 23.12 21.36 2qy0 s ALA 483 CO 0.00 0.07 1.63 0.00 0.00 0.00 0.00 175.76 177.45 2qy0 h ALA 484 N 6.58 1.33 0.00 0.00 0.00 -1.71 -2.09 119.26 123.37 2qy0 h ALA 484 Ca -0.42 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2qy0 h ALA 484 Cb 1.18 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2qy0 h ALA 484 CO 0.75 -0.53 0.00 1.12 0.00 0.00 0.00 179.25 180.59 2qy0 h HIS 485 N 0.16 0.00 -0.12 0.00 2.07 -1.90 0.33 115.15 115.68 2qy0 h HIS 485 Ca 0.59 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 58.08 2qy0 h HIS 485 Cb 1.23 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.20 2qy0 h HIS 485 CO -0.28 0.00 -0.06 0.00 -3.07 0.00 0.00 177.93 174.52 2qy0 h THR 486 N 0.00 1.12 0.03 6.12 1.03 -1.76 -1.93 112.91 117.52 2qy0 h THR 486 Ca 0.00 -0.50 -0.37 0.00 -0.01 0.00 0.00 66.41 65.54 2qy0 h THR 486 Cb 0.35 1.09 -0.05 0.00 -1.07 0.00 0.00 68.15 68.47 2qy0 h THR 486 CO 0.00 0.16 -2.23 0.18 -0.01 0.00 0.00 175.52 173.62 2qy0 n LEU 487 N -4.37 1.99 -3.65 0.00 4.77 0.89 -4.29 117.00 112.34 2qy0 n LEU 487 Ca -0.01 0.06 -0.28 0.00 -0.03 0.00 0.00 56.01 55.75 2qy0 n LEU 487 Cb 0.19 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.64 2qy0 n LEU 487 CO 0.36 0.75 -0.19 -0.31 -1.33 0.00 0.00 177.39 176.68 2qy0 s TYR 488 N -2.54 2.28 0.87 -1.77 1.51 0.32 -4.96 117.35 113.06 2qy0 s TYR 488 Ca -0.22 -2.78 -0.11 0.00 -1.01 0.00 0.00 57.07 52.95 2qy0 s TYR 488 Cb 0.08 -1.81 0.11 0.00 -0.11 0.00 0.00 41.96 40.23 2qy0 s TYR 488 CO 0.72 -0.70 1.10 -2.14 -1.11 0.00 0.00 175.55 173.43 2qy0 s PRO 489 N -0.56 1.48 0.10 -1.71 0.02 -0.73 -4.30 135.00 129.29 2qy0 s PRO 489 Ca 0.27 1.17 -0.12 0.00 0.02 0.00 0.00 61.00 62.35 2qy0 s PRO 489 Cb -0.03 -1.81 -0.18 0.00 0.02 0.00 0.00 34.50 32.50 2qy0 s PRO 489 CO -0.16 -2.19 1.26 0.87 -0.33 0.00 0.00 177.00 176.45 2qy0 h LYS 490 N -1.53 0.71 -1.79 5.54 1.79 -1.82 -3.39 116.57 116.08 2qy0 h LYS 490 Ca -0.46 -0.67 -0.32 0.00 -2.18 0.00 0.00 60.65 57.01 2qy0 h LYS 490 Cb 1.26 0.17 -0.29 0.00 -1.58 0.00 0.00 32.23 31.79 2qy0 h LYS 490 CO 0.49 1.27 -0.66 -1.21 -1.08 0.00 0.00 179.45 178.26 2qy0 s GLU 491 N -3.51 0.69 0.21 3.15 8.01 -1.26 -4.71 118.70 121.28 2qy0 s GLU 491 Ca -0.09 -0.83 -0.30 0.00 0.01 0.00 0.00 54.97 53.76 2qy0 s GLU 491 Cb 0.08 -0.61 -0.16 0.00 -4.31 0.00 0.00 34.13 29.13 2qy0 s GLU 491 CO 0.91 -1.21 0.80 0.72 0.01 0.00 0.00 175.26 176.49 2qy0 n HIS 492 N 4.17 0.38 -2.76 1.61 8.25 -1.26 -5.26 115.22 120.35 2qy0 n HIS 492 Ca 0.12 0.86 -0.02 0.00 -0.26 0.00 0.00 57.72 58.41 2qy0 n HIS 492 Cb 0.47 -2.10 0.07 0.00 1.12 0.00 0.00 29.99 29.55 2qy0 n HIS 492 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2qy0 n GLU 493 N 1.05 1.52 0.00 -0.41 -0.58 -1.26 -4.84 120.64 116.12 2qy0 n GLU 493 Ca 0.15 -2.79 0.00 0.00 -0.42 0.00 0.00 57.16 54.11 2qy0 n GLU 493 Cb 0.26 -0.94 0.00 0.00 -0.57 0.00 0.00 31.44 30.19 2qy0 n GLU 493 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2qy0 n ALA 498 N -0.76 0.00 -1.93 0.62 0.00 -1.26 -5.21 120.51 111.96 2qy0 n ALA 498 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2qy0 n ALA 498 Cb 0.83 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.33 2qy0 n ALA 498 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qy0 s SER 499 N 0.00 5.24 -1.04 0.00 0.01 -1.26 -5.02 113.70 111.63 2qy0 s SER 499 Ca 0.00 0.94 -0.11 0.00 1.31 0.00 0.00 55.95 58.09 2qy0 s SER 499 Cb 0.00 -1.70 0.24 0.00 0.21 0.00 0.00 66.02 64.77 2qy0 s SER 499 CO 0.00 -1.42 1.06 -0.76 0.41 0.00 0.00 173.24 172.53 2qy0 s LEU 500 N -5.33 6.26 -0.36 2.44 1.43 -1.26 -4.35 118.68 117.51 2qy0 s LEU 500 Ca 0.58 -3.23 -0.21 0.00 -1.03 0.00 0.00 54.13 50.24 2qy0 s LEU 500 Cb -0.11 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.88 2qy0 s LEU 500 CO 0.50 -0.45 0.68 -1.81 0.23 0.00 0.00 176.35 175.50 2qy0 s ASP 501 N 1.81 6.47 -0.08 2.29 1.01 -1.25 -4.60 116.67 122.32 2qy0 s ASP 501 Ca 0.29 0.23 0.02 0.00 0.71 0.00 0.00 52.55 53.80 2qy0 s ASP 501 Cb -0.09 -2.35 0.01 0.00 1.01 0.00 0.00 42.92 41.50 2qy0 s ASP 501 CO -0.07 -0.63 -0.14 -0.69 0.21 0.00 0.00 175.17 173.84 2qy0 s VAL 502 N 2.83 1.32 0.07 -1.27 1.01 -1.26 -1.30 120.40 121.79 2qy0 s VAL 502 Ca 0.27 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2qy0 s VAL 502 Cb -0.14 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 2qy0 s VAL 502 CO 0.15 0.40 -0.20 -0.36 0.00 0.00 0.00 175.10 175.09 2qy0 s PHE 503 N 0.67 1.70 0.05 5.22 0.40 0.13 -1.12 117.98 125.03 2qy0 s PHE 503 Ca -0.14 -0.40 -0.07 0.00 -0.60 0.00 0.00 56.93 55.72 2qy0 s PHE 503 Cb -0.16 -0.97 -0.00 0.00 0.51 0.00 0.00 43.02 42.39 2qy0 s PHE 503 CO 0.04 0.13 0.15 -0.51 0.70 0.00 0.00 175.22 175.73 2qy0 s LEU 504 N -1.53 1.59 0.00 -0.37 1.43 -1.26 -1.44 118.68 117.10 2qy0 s LEU 504 Ca 0.06 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 2qy0 s LEU 504 Cb -0.09 0.80 0.00 0.00 0.03 0.00 0.00 46.19 46.93 2qy0 s LEU 504 CO 0.03 -0.57 0.00 0.61 0.23 0.00 0.00 176.35 176.65 2qy0 n GLY 505 N 0.57 0.91 3.47 -3.19 0.00 -1.26 -4.91 105.19 100.76 2qy0 n GLY 505 Ca -0.18 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 45.65 2qy0 n GLY 505 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qy0 s HIS 506 N -2.00 -0.49 -0.13 1.61 2.46 -1.26 -4.82 115.29 110.66 2qy0 s HIS 506 Ca 0.00 0.25 0.18 0.00 0.47 0.00 0.00 55.06 55.96 2qy0 s HIS 506 Cb 0.00 0.57 -0.22 0.00 -0.13 0.00 0.00 32.58 32.80 2qy0 s HIS 506 CO 0.00 -0.89 0.51 0.25 -2.47 0.00 0.00 174.74 172.14 2qy0 n THR 507 N -0.38 1.00 -3.12 0.89 -2.24 -1.26 -4.82 114.28 104.34 2qy0 n THR 507 Ca -0.15 -0.70 -0.40 0.00 -2.27 0.00 0.00 64.05 60.52 2qy0 n THR 507 Cb 0.64 -0.49 -0.06 0.00 -2.10 0.00 0.00 70.33 68.32 2qy0 n THR 507 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2qy0 s ASN 508 N -5.41 6.72 0.25 3.42 3.84 -1.26 -0.32 114.94 122.18 2qy0 s ASN 508 Ca -0.06 0.87 -0.04 0.00 0.21 0.00 0.00 52.86 53.84 2qy0 s ASN 508 Cb 0.09 -2.35 0.36 0.00 -0.55 0.00 0.00 41.25 38.80 2qy0 s ASN 508 CO 0.84 -0.24 1.88 0.58 -2.79 0.00 0.00 177.10 177.37 2qy0 h VAL 509 N 5.10 1.09 -0.25 -5.21 2.07 -1.67 0.37 116.25 117.76 2qy0 h VAL 509 Ca -0.33 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 2qy0 h VAL 509 Cb 1.15 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2qy0 h VAL 509 CO 0.77 0.21 0.05 -0.08 0.02 0.00 0.00 177.57 178.54 2qy0 h GLU 510 N 1.12 0.41 -0.00 1.57 4.81 -1.94 -2.35 114.58 118.20 2qy0 h GLU 510 Ca 0.40 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.44 2qy0 h GLU 510 Cb 0.13 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 2qy0 h GLU 510 CO -0.16 0.52 -0.44 0.93 -0.73 0.00 0.00 179.01 179.13 2qy0 h GLU 511 N 0.23 0.01 -0.77 1.92 4.39 -1.73 -1.77 114.58 116.84 2qy0 h GLU 511 Ca 0.08 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.81 2qy0 h GLU 511 Cb 0.31 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.91 2qy0 h GLU 511 CO 0.00 0.45 0.49 -0.07 -1.16 0.00 0.00 179.01 178.72 2qy0 h LEU 512 N 0.01 0.79 -0.33 1.33 3.38 -0.16 -1.89 115.31 118.43 2qy0 h LEU 512 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 2qy0 h LEU 512 Cb 0.78 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2qy0 h LEU 512 CO 0.06 0.54 -0.82 0.24 0.09 0.00 0.00 178.44 178.55 2qy0 h MET 513 N 0.94 0.32 -0.24 1.13 2.86 -0.90 -3.15 114.93 115.88 2qy0 h MET 513 Ca 0.32 -0.30 -0.12 0.00 -2.06 0.00 0.00 59.70 57.54 2qy0 h MET 513 Cb 0.05 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2qy0 h MET 513 CO -0.12 0.98 -0.34 0.87 1.06 0.00 0.00 176.91 179.35 2qy0 h LYS 514 N 0.20 0.52 -0.47 1.72 1.57 -1.26 -2.06 116.57 116.79 2qy0 h LYS 514 Ca -0.04 -0.23 0.10 0.00 -1.87 0.00 0.00 60.65 58.60 2qy0 h LYS 514 Cb 1.42 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.69 2qy0 h LYS 514 CO 0.13 0.79 0.32 -0.07 -0.57 0.00 0.00 179.45 180.06 2qy0 h LEU 515 N 0.44 0.18 0.00 2.94 3.38 -1.31 -3.48 115.31 117.47 2qy0 h LEU 515 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qy0 h LEU 515 Cb 0.80 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.52 2qy0 h LEU 515 CO 0.07 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.32 2qy0 n GLY 516 N -1.56 2.65 3.75 0.83 0.00 -0.78 -5.04 105.19 105.05 2qy0 n GLY 516 Ca 0.07 -1.73 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 2qy0 n GLY 516 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qy0 s ASN 517 N 0.00 5.06 -0.34 1.61 4.22 -1.26 -4.63 114.94 119.60 2qy0 s ASN 517 Ca 0.00 2.32 -0.01 0.00 -2.14 0.00 0.00 52.86 53.02 2qy0 s ASN 517 Cb 0.00 -2.59 0.07 0.00 1.28 0.00 0.00 41.25 40.01 2qy0 s ASN 517 CO 0.00 -1.68 0.07 -1.00 -2.04 0.00 0.00 177.10 172.45 2qy0 s HIS 518 N -1.77 3.42 0.38 1.54 3.76 -0.28 -5.00 115.29 117.34 2qy0 s HIS 518 Ca 0.75 -2.17 -0.27 0.00 -0.15 0.00 0.00 55.06 53.21 2qy0 s HIS 518 Cb -0.28 -2.55 -0.11 0.00 1.11 0.00 0.00 32.58 30.74 2qy0 s HIS 518 CO 0.36 -0.87 1.37 -2.30 -0.85 0.00 0.00 174.74 172.44 2qy0 n PRO 519 N 4.57 2.29 -3.67 8.40 -0.02 -1.26 -4.37 135.00 140.94 2qy0 n PRO 519 Ca -0.08 0.81 -0.37 0.00 -2.02 0.00 0.00 63.50 61.84 2qy0 n PRO 519 Cb 0.43 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.32 2qy0 n PRO 519 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qy0 s ILE 520 N -1.13 5.28 -0.14 4.25 -1.09 -1.26 -0.94 121.20 126.16 2qy0 s ILE 520 Ca 0.56 0.15 -0.16 0.00 -2.23 0.00 0.00 60.65 58.98 2qy0 s ILE 520 Cb -0.51 -3.47 -0.24 0.00 -1.58 0.00 0.00 42.46 36.66 2qy0 s ILE 520 CO 0.62 0.33 0.40 -0.09 -1.23 0.00 0.00 174.94 174.97 2qy0 h ARG 521 N 7.65 0.16 -3.81 2.79 2.43 -0.92 -3.45 114.38 119.23 2qy0 h ARG 521 Ca -0.37 -0.27 -0.19 0.00 -0.81 0.00 0.00 59.98 58.33 2qy0 h ARG 521 Cb 1.17 0.10 -0.24 0.00 -0.42 0.00 0.00 29.97 30.59 2qy0 h ARG 521 CO 0.64 1.13 -0.68 0.50 -1.51 0.00 0.00 179.97 180.05 2qy0 s ARG 522 N -2.45 0.20 -0.04 0.20 3.52 -1.19 -5.01 118.95 114.18 2qy0 s ARG 522 Ca -0.24 -0.32 0.06 0.00 -0.13 0.00 0.00 55.73 55.11 2qy0 s ARG 522 Cb 0.05 0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.50 2qy0 s ARG 522 CO 0.70 -0.04 -0.22 0.08 -0.81 0.00 0.00 175.30 175.02 2qy0 s VAL 523 N -0.82 2.35 -0.22 7.11 1.01 -1.26 -0.97 120.40 127.60 2qy0 s VAL 523 Ca -0.09 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 60.90 2qy0 s VAL 523 Cb -0.06 -1.86 0.06 0.00 0.00 0.00 0.00 36.38 34.52 2qy0 s VAL 523 CO -0.00 0.58 -0.03 -0.44 0.00 0.00 0.00 175.10 175.21 2qy0 s SER 524 N -0.47 3.46 0.08 3.32 0.01 0.30 -4.99 113.70 115.42 2qy0 s SER 524 Ca 0.06 -1.02 -0.06 0.00 1.31 0.00 0.00 55.95 56.24 2qy0 s SER 524 Cb -0.11 -0.98 -0.05 0.00 0.21 0.00 0.00 66.02 65.08 2qy0 s SER 524 CO 0.01 -0.25 0.34 -0.69 0.41 0.00 0.00 173.24 173.06 2qy0 s VAL 525 N 1.56 5.21 0.31 3.43 1.01 -1.26 0.32 120.40 130.97 2qy0 s VAL 525 Ca -0.04 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.80 2qy0 s VAL 525 Cb -0.18 -3.61 -0.10 0.00 0.00 0.00 0.00 36.38 32.49 2qy0 s VAL 525 CO -0.07 0.20 1.16 -2.28 0.00 0.00 0.00 175.10 174.11 2qy0 s HIS 526 N -1.48 3.39 0.65 5.22 2.46 -0.93 -4.91 115.29 119.70 2qy0 s HIS 526 Ca 0.35 1.61 0.37 0.00 0.47 0.00 0.00 55.06 57.86 2qy0 s HIS 526 Cb -0.13 -3.39 2.04 0.00 -0.13 0.00 0.00 32.58 30.98 2qy0 s HIS 526 CO 0.21 -0.95 2.18 -1.35 -2.47 0.00 0.00 174.74 172.36 2qy0 h PRO 527 N 3.55 0.00 0.00 2.88 0.11 -1.92 -2.83 132.00 133.79 2qy0 h PRO 527 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2qy0 h PRO 527 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2qy0 h PRO 527 CO 0.66 0.00 -0.60 -0.44 -0.21 0.00 0.00 178.00 177.41 2qy0 h ASP 528 N 0.00 0.00 -3.10 -2.05 3.32 -1.89 -3.46 116.42 109.25 2qy0 h ASP 528 Ca 0.01 -0.20 -0.53 0.00 0.02 0.00 0.00 57.03 56.34 2qy0 h ASP 528 Cb 0.29 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.90 2qy0 h ASP 528 CO -0.00 0.10 0.85 -0.47 -1.72 0.00 0.00 179.24 178.00 2qy0 s TYR 529 N -3.17 2.97 -0.38 4.55 5.04 -1.07 -4.61 117.35 120.69 2qy0 s TYR 529 Ca 0.06 0.76 0.03 0.00 -2.44 0.00 0.00 57.07 55.48 2qy0 s TYR 529 Cb 0.13 -3.94 0.11 0.00 0.35 0.00 0.00 41.96 38.60 2qy0 s TYR 529 CO 0.72 -3.30 0.10 1.03 -1.34 0.00 0.00 175.55 172.76 2qy0 s ARG 530 N 0.30 1.63 0.35 4.97 1.81 -1.26 -5.00 118.95 121.74 2qy0 s ARG 530 Ca 0.66 -1.97 0.10 0.00 -1.72 0.00 0.00 55.73 52.79 2qy0 s ARG 530 Cb -0.45 -3.29 0.85 0.00 -0.45 0.00 0.00 34.95 31.62 2qy0 s ARG 530 CO 0.39 -0.98 1.82 0.37 -0.68 0.00 0.00 175.30 176.21 2qy0 h GLN 531 N 7.53 0.64 -0.01 3.54 4.15 -1.92 -3.22 115.11 125.83 2qy0 h GLN 531 Ca -0.06 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.32 2qy0 h GLN 531 Cb 1.01 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.55 2qy0 h GLN 531 CO 0.57 0.42 -0.52 -0.25 -1.93 0.00 0.00 178.83 177.12 2qy0 n ASP 532 N -4.64 1.45 -4.89 -0.69 8.00 -1.26 -4.41 116.55 110.11 2qy0 n ASP 532 Ca 0.21 -1.15 -0.31 0.00 0.71 0.00 0.00 54.79 54.25 2qy0 n ASP 532 Cb 0.59 0.47 -0.05 0.00 -0.02 0.00 0.00 41.12 42.11 2qy0 n ASP 532 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 2qy0 s GLU 533 N -2.63 3.33 0.00 -1.24 -1.05 -1.22 -5.01 118.70 110.89 2qy0 s GLU 533 Ca 0.17 -0.48 0.00 0.00 -0.15 0.00 0.00 54.97 54.51 2qy0 s GLU 533 Cb 0.18 -2.98 0.00 0.00 -0.44 0.00 0.00 34.13 30.89 2qy0 s GLU 533 CO 0.63 0.60 0.00 0.45 0.95 0.00 0.00 175.26 177.89 2qy0 n SER 534 N 0.36 0.83 -2.11 0.83 2.88 -1.26 -4.07 113.62 111.08 2qy0 n SER 534 Ca -0.06 -0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 2qy0 n SER 534 Cb 0.51 0.89 0.05 0.00 -0.75 0.00 0.00 64.21 64.90 2qy0 n SER 534 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2qy0 n TYR 535 N -0.97 0.78 -3.49 0.66 4.01 -1.26 -4.99 117.16 111.91 2qy0 n TYR 535 Ca 0.00 -1.45 -0.26 0.00 -0.16 0.00 0.00 57.90 56.03 2qy0 n TYR 535 Cb 0.00 -0.21 -0.13 0.00 -0.31 0.00 0.00 39.34 38.69 2qy0 n TYR 535 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2qy0 s ASN 536 N -3.04 2.93 -0.19 7.72 2.47 -1.26 -1.17 114.94 122.39 2qy0 s ASN 536 Ca 0.32 -1.31 0.16 0.00 0.42 0.00 0.00 52.86 52.44 2qy0 s ASN 536 Cb 0.36 -0.12 0.78 0.00 -1.45 0.00 0.00 41.25 40.82 2qy0 s ASN 536 CO -0.09 -0.40 1.70 0.49 -3.72 0.00 0.00 177.10 175.08 2qy0 n PHE 537 N 5.04 1.85 -1.60 0.43 3.01 -1.26 -4.61 117.46 120.33 2qy0 n PHE 537 Ca -0.02 -0.70 -0.47 0.00 1.01 0.00 0.00 57.45 57.27 2qy0 n PHE 537 Cb 0.42 -0.42 -0.03 0.00 -0.01 0.00 0.00 39.48 39.44 2qy0 n PHE 537 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 2qy0 n GLU 538 N 0.74 1.36 -2.70 -1.08 4.07 -1.26 -1.97 120.64 119.81 2qy0 n GLU 538 Ca 0.27 0.48 -0.13 0.00 -0.06 0.00 0.00 57.16 57.72 2qy0 n GLU 538 Cb 1.09 -1.99 0.02 0.00 -0.06 0.00 0.00 31.44 30.51 2qy0 n GLU 538 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qy0 n GLY 539 N 1.89 -0.04 3.23 8.31 0.00 -1.26 -3.54 105.19 113.78 2qy0 n GLY 539 Ca 0.13 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2qy0 n GLY 539 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2qy0 n ASP 540 N -0.77 4.95 -3.69 1.61 2.03 -0.83 -3.75 116.55 116.10 2qy0 n ASP 540 Ca -0.07 -2.99 -0.14 0.00 0.52 0.00 0.00 54.79 52.12 2qy0 n ASP 540 Cb 0.57 -1.59 -0.09 0.00 -0.72 0.00 0.00 41.12 39.29 2qy0 n ASP 540 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2qy0 s ILE 541 N 1.99 0.00 0.22 5.18 2.07 -1.26 -4.06 121.20 125.33 2qy0 s ILE 541 Ca 0.45 -0.02 -0.14 0.00 -1.41 0.00 0.00 60.65 59.52 2qy0 s ILE 541 Cb 0.04 -0.74 0.01 0.00 0.13 0.00 0.00 42.46 41.90 2qy0 s ILE 541 CO 0.01 -0.01 0.48 0.00 -1.91 0.00 0.00 174.94 173.50 2qy0 s ALA 542 N 0.15 -0.53 -0.04 1.50 0.00 0.05 -2.20 121.76 120.70 2qy0 s ALA 542 Ca -0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 2qy0 s ALA 542 Cb -0.04 0.93 0.03 0.00 0.00 0.00 0.00 23.12 24.05 2qy0 s ALA 542 CO 0.01 -0.81 0.04 -1.17 0.00 0.00 0.00 175.76 173.83 2qy0 s LEU 543 N -2.95 0.41 -0.18 0.00 2.96 0.15 -1.36 118.68 117.71 2qy0 s LEU 543 Ca 0.16 0.04 -0.11 0.00 -0.22 0.00 0.00 54.13 54.00 2qy0 s LEU 543 Cb -0.00 -0.19 -0.05 0.00 0.50 0.00 0.00 46.19 46.45 2qy0 s LEU 543 CO 0.03 -0.21 0.18 -0.76 -1.32 0.00 0.00 176.35 174.26 2qy0 s LEU 544 N 1.91 4.24 -0.19 -0.68 1.43 0.57 -0.54 118.68 125.42 2qy0 s LEU 544 Ca 0.02 0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 53.39 2qy0 s LEU 544 Cb -0.12 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 2qy0 s LEU 544 CO -0.03 0.19 0.06 -0.70 0.23 0.00 0.00 176.35 176.10 2qy0 s GLU 545 N 0.20 3.93 0.32 1.70 2.12 -0.15 -0.50 118.70 126.33 2qy0 s GLU 545 Ca 0.11 -0.36 -0.27 0.00 0.36 0.00 0.00 54.97 54.81 2qy0 s GLU 545 Cb -0.12 -3.23 -0.09 0.00 0.26 0.00 0.00 34.13 30.95 2qy0 s GLU 545 CO 0.00 0.21 1.01 -0.51 -0.54 0.00 0.00 175.26 175.44 2qy0 s LEU 546 N 0.53 4.38 0.38 2.70 1.43 0.07 -0.32 118.68 127.86 2qy0 s LEU 546 Ca 0.03 2.03 0.05 0.00 -1.03 0.00 0.00 54.13 55.21 2qy0 s LEU 546 Cb -0.13 -3.90 0.75 0.00 0.03 0.00 0.00 46.19 42.94 2qy0 s LEU 546 CO 0.01 -0.18 2.02 -0.08 0.23 0.00 0.00 176.35 178.35 2qy0 h GLU 547 N 3.29 0.64 -4.79 1.70 4.57 -1.35 -3.42 114.58 115.22 2qy0 h GLU 547 Ca -0.47 -0.05 -0.45 0.00 -1.18 0.00 0.00 59.36 57.21 2qy0 h GLU 547 Cb 1.20 -0.14 -0.31 0.00 -0.16 0.00 0.00 28.75 29.35 2qy0 h GLU 547 CO 0.65 0.45 -0.80 -0.80 -1.18 0.00 0.00 179.01 177.33 2qy0 s ASN 548 N -6.62 1.41 0.47 1.04 0.01 -1.26 -5.00 114.94 104.99 2qy0 s ASN 548 Ca -0.09 -0.22 -0.23 0.00 -0.71 0.00 0.00 52.86 51.61 2qy0 s ASN 548 Cb 0.17 -0.35 -0.07 0.00 0.41 0.00 0.00 41.25 41.42 2qy0 s ASN 548 CO 0.75 0.09 1.19 -0.94 -1.51 0.00 0.00 177.10 176.68 2qy0 s SER 549 N 0.09 6.05 0.41 -1.22 1.04 -1.26 -4.88 113.70 113.93 2qy0 s SER 549 Ca -0.02 2.35 -0.10 0.00 0.48 0.00 0.00 55.95 58.66 2qy0 s SER 549 Cb -0.08 -2.61 -0.06 0.00 0.10 0.00 0.00 66.02 63.37 2qy0 s SER 549 CO 0.01 -1.00 0.77 0.68 0.98 0.00 0.00 173.24 174.68 2qy0 s VAL 550 N -1.53 4.79 -0.13 5.02 -7.23 0.24 -5.00 120.40 116.57 2qy0 s VAL 550 Ca 0.65 0.59 -0.21 0.00 -1.81 0.00 0.00 61.98 61.19 2qy0 s VAL 550 Cb -0.30 -3.74 -0.03 0.00 0.56 0.00 0.00 36.38 32.87 2qy0 s VAL 550 CO 0.36 -0.55 0.63 -0.89 -0.31 0.00 0.00 175.10 174.34 2qy0 s THR 551 N -2.41 5.06 0.44 5.32 2.01 -1.26 -4.90 115.64 119.91 2qy0 s THR 551 Ca 0.51 1.26 -0.20 0.00 0.31 0.00 0.00 61.69 63.57 2qy0 s THR 551 Cb -0.10 -3.96 -0.10 0.00 0.01 0.00 0.00 72.50 68.34 2qy0 s THR 551 CO 0.33 0.21 0.95 -0.76 -0.69 0.00 0.00 174.62 174.65 2qy0 s LEU 552 N 1.22 3.87 0.00 4.42 1.43 -1.26 -4.94 118.68 123.42 2qy0 s LEU 552 Ca 0.32 1.64 -0.08 0.00 -1.03 0.00 0.00 54.13 54.97 2qy0 s LEU 552 Cb -0.16 -4.51 0.03 0.00 0.03 0.00 0.00 46.19 41.58 2qy0 s LEU 552 CO 0.13 -0.41 0.45 0.61 0.23 0.00 0.00 176.35 177.37 2qy0 n GLY 553 N -0.86 1.48 0.27 -3.19 0.00 -0.47 -4.99 105.19 97.44 2qy0 n GLY 553 Ca 0.07 -1.19 0.09 0.00 0.00 0.00 0.00 46.02 44.99 2qy0 n GLY 553 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qy0 h PRO 554 N 0.00 0.00 -0.46 1.61 0.13 -2.01 -1.40 132.00 129.87 2qy0 h PRO 554 Ca -0.20 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2qy0 h PRO 554 Cb 0.73 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2qy0 h PRO 554 CO 0.25 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.11 2qy0 n ASN 555 N -4.52 3.39 -3.31 1.44 3.02 -1.26 -4.53 115.26 109.47 2qy0 n ASN 555 Ca -0.02 -1.97 -0.09 0.00 -0.03 0.00 0.00 54.58 52.46 2qy0 n ASN 555 Cb 0.14 -0.30 -0.06 0.00 -0.61 0.00 0.00 39.78 38.95 2qy0 n ASN 555 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2qy0 s LEU 556 N -1.36 -0.74 -0.02 3.41 2.96 -0.53 -4.48 118.68 117.93 2qy0 s LEU 556 Ca 0.40 -0.36 -0.10 0.00 -0.22 0.00 0.00 54.13 53.86 2qy0 s LEU 556 Cb 0.23 1.07 0.01 0.00 0.50 0.00 0.00 46.19 47.99 2qy0 s LEU 556 CO 0.31 -0.35 0.20 -0.76 -1.32 0.00 0.00 176.35 174.43 2qy0 s LEU 557 N 2.53 1.27 0.66 -0.68 1.43 -0.98 -1.37 118.68 121.55 2qy0 s LEU 557 Ca 0.10 -0.00 -0.09 0.00 -1.03 0.00 0.00 54.13 53.11 2qy0 s LEU 557 Cb -0.13 0.87 0.02 0.00 0.03 0.00 0.00 46.19 46.98 2qy0 s LEU 557 CO -0.29 -0.34 1.01 -2.16 0.23 0.00 0.00 176.35 174.80 2qy0 s PRO 558 N -1.10 2.80 0.16 1.29 0.04 -1.26 -1.46 135.00 135.47 2qy0 s PRO 558 Ca -0.12 0.20 0.04 0.00 0.04 0.00 0.00 61.00 61.16 2qy0 s PRO 558 Cb -0.06 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 2qy0 s PRO 558 CO 0.02 -0.93 0.19 -1.50 0.04 0.00 0.00 177.00 174.82 2qy0 s ILE 559 N -3.21 4.79 0.62 0.56 2.07 -0.93 -4.85 121.20 120.25 2qy0 s ILE 559 Ca 0.57 -0.94 -0.06 0.00 -1.41 0.00 0.00 60.65 58.80 2qy0 s ILE 559 Cb -0.11 -3.46 0.02 0.00 0.13 0.00 0.00 42.46 39.04 2qy0 s ILE 559 CO 0.48 -0.11 0.93 0.00 -1.91 0.00 0.00 174.94 174.34 2qy0 s LEU 561 N -5.06 4.28 0.41 0.00 1.43 -1.26 -1.23 118.68 117.25 2qy0 s LEU 561 Ca 0.55 0.23 -0.21 0.00 -1.03 0.00 0.00 54.13 53.67 2qy0 s LEU 561 Cb -0.11 -2.89 -0.11 0.00 0.03 0.00 0.00 46.19 43.11 2qy0 s LEU 561 CO 0.45 0.17 0.94 -2.16 0.23 0.00 0.00 176.35 175.98 2qy0 s PRO 562 N -2.50 4.27 0.00 1.29 0.04 -1.26 -4.88 135.00 131.96 2qy0 s PRO 562 Ca 0.34 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2qy0 s PRO 562 Cb -0.13 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.12 2qy0 s PRO 562 CO 0.27 0.03 0.66 -0.40 0.04 0.00 0.00 177.00 177.60 2qy0 n ASP 563 N -0.44 1.23 -3.76 6.66 3.85 -1.26 -4.81 116.55 118.02 2qy0 n ASP 563 Ca 0.06 -1.40 -0.06 0.00 -0.71 0.00 0.00 54.79 52.68 2qy0 n ASP 563 Cb 0.53 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.29 2qy0 n ASP 563 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2qy0 s ASN 564 N -0.40 -0.27 0.09 -1.12 2.20 -1.26 -5.06 114.94 109.12 2qy0 s ASN 564 Ca 0.00 -0.44 0.28 0.00 -0.94 0.00 0.00 52.86 51.76 2qy0 s ASN 564 Cb 0.00 0.61 1.04 0.00 -2.00 0.00 0.00 41.25 40.90 2qy0 s ASN 564 CO 0.00 -1.11 1.85 -0.67 -2.94 0.00 0.00 177.10 174.23 2qy0 n ASP 565 N -0.44 0.36 0.25 3.54 2.03 -1.26 -3.41 116.55 117.62 2qy0 n ASP 565 Ca -0.06 0.52 0.16 0.00 0.52 0.00 0.00 54.79 55.93 2qy0 n ASP 565 Cb 0.60 -0.61 0.70 0.00 -0.72 0.00 0.00 41.12 41.09 2qy0 n ASP 565 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2qy0 h THR 566 N 0.00 0.00 0.00 5.18 1.35 -2.01 -1.40 112.91 116.03 2qy0 h THR 566 Ca 0.00 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 2qy0 h THR 566 Cb 0.61 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 2qy0 h THR 566 CO 0.00 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 175.76 2qy0 n PHE 567 N -2.85 0.00 -1.40 4.73 3.01 -1.22 -2.55 117.46 117.18 2qy0 n PHE 567 Ca 0.00 0.00 0.08 0.00 1.01 0.00 0.00 57.45 58.54 2qy0 n PHE 567 Cb 0.25 -0.27 0.17 0.00 -0.01 0.00 0.00 39.48 39.62 2qy0 n PHE 567 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2qy0 n TYR 568 N -1.27 0.00 -2.27 1.38 4.02 -0.53 -5.00 117.16 113.50 2qy0 n TYR 568 Ca 0.01 -1.23 -0.40 0.00 -0.01 0.00 0.00 57.90 56.27 2qy0 n TYR 568 Cb 0.02 -0.20 -0.03 0.00 -0.02 0.00 0.00 39.34 39.11 2qy0 n TYR 568 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2qy0 s ASP 569 N -3.01 6.85 0.04 7.72 -0.00 -1.06 -4.92 116.67 122.30 2qy0 s ASP 569 Ca 0.35 2.47 -0.38 0.00 -0.00 0.00 0.00 52.55 54.99 2qy0 s ASP 569 Cb 0.32 -2.63 -0.17 0.00 -0.00 0.00 0.00 42.92 40.44 2qy0 s ASP 569 CO -0.03 -0.46 1.33 -0.11 -0.00 0.00 0.00 175.17 175.91 2qy0 n LEU 570 N 0.72 1.46 0.00 1.23 7.94 -1.26 -2.17 117.00 124.92 2qy0 n LEU 570 Ca 0.01 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2qy0 n LEU 570 Cb 0.44 -1.15 0.00 0.00 0.53 0.00 0.00 43.42 43.24 2qy0 n LEU 570 CO 0.55 -1.12 0.00 0.61 -1.11 0.00 0.00 177.39 176.32 2qy0 n GLY 571 N 2.51 1.47 3.72 -3.96 0.00 -0.58 -4.98 105.19 103.39 2qy0 n GLY 571 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2qy0 n GLY 571 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qy0 s LEU 572 N 0.00 4.37 -0.07 0.99 2.96 -0.92 -4.54 118.68 121.46 2qy0 s LEU 572 Ca 0.00 2.86 -0.18 0.00 -0.22 0.00 0.00 54.13 56.59 2qy0 s LEU 572 Cb 0.00 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 43.04 2qy0 s LEU 572 CO 0.00 -0.96 0.49 -0.04 -1.32 0.00 0.00 176.35 174.52 2qy0 s MET 573 N 1.03 4.26 0.35 1.98 -1.94 -1.26 -0.34 119.30 123.39 2qy0 s MET 573 Ca 0.73 0.50 0.03 0.00 -1.71 0.00 0.00 55.69 55.25 2qy0 s MET 573 Cb -0.49 -3.38 -0.04 0.00 2.01 0.00 0.00 34.83 32.93 2qy0 s MET 573 CO 0.33 0.29 0.10 0.20 -0.01 0.00 0.00 175.02 175.93 2qy0 s GLY 574 N 0.16 2.27 0.03 -0.03 0.00 0.13 -4.63 107.32 105.25 2qy0 s GLY 574 Ca 0.27 -1.65 0.07 0.00 0.00 0.00 0.00 44.72 43.40 2qy0 s GLY 574 CO 0.12 -1.79 -0.18 -0.19 0.00 0.00 0.00 173.10 171.06 2qy0 s TYR 575 N -3.33 2.55 -0.13 1.90 1.51 0.15 -0.03 117.35 119.98 2qy0 s TYR 575 Ca 0.31 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.12 2qy0 s TYR 575 Cb 0.06 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.45 2qy0 s TYR 575 CO 0.15 0.23 -0.17 0.08 -1.11 0.00 0.00 175.55 174.73 2qy0 s VAL 576 N -0.89 1.67 0.16 0.71 1.01 -0.65 -0.07 120.40 122.34 2qy0 s VAL 576 Ca 0.14 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.45 2qy0 s VAL 576 Cb -0.10 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2qy0 s VAL 576 CO 0.04 0.48 0.04 -0.94 0.00 0.00 0.00 175.10 174.72 2qy0 s SER 577 N 1.09 5.01 -0.09 3.32 1.04 -1.26 -1.80 113.70 121.01 2qy0 s SER 577 Ca -0.03 -0.29 -0.32 0.00 0.48 0.00 0.00 55.95 55.78 2qy0 s SER 577 Cb -0.14 -1.16 0.12 0.00 0.10 0.00 0.00 66.02 64.94 2qy0 s SER 577 CO -0.05 0.09 1.14 -0.83 0.98 0.00 0.00 173.24 174.58 2qy0 s GLY 578 N -2.90 -0.35 -0.01 7.32 0.00 0.12 -4.75 107.32 106.75 2qy0 s GLY 578 Ca 0.28 1.16 0.22 0.00 0.00 0.00 0.00 44.72 46.38 2qy0 s GLY 578 CO 0.20 0.36 1.54 0.69 0.00 0.00 0.00 173.10 175.88 2qy0 n PHE 579 N -0.24 1.00 -0.43 1.90 3.01 -1.26 -1.38 117.46 120.05 2qy0 n PHE 579 Ca -0.04 -0.51 -0.29 0.00 1.01 0.00 0.00 57.45 57.62 2qy0 n PHE 579 Cb 0.60 -0.02 0.28 0.00 -0.01 0.00 0.00 39.48 40.33 2qy0 n PHE 579 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2qy0 s GLY 580 N -0.99 1.47 0.45 1.37 0.00 -1.24 -4.53 107.32 103.85 2qy0 s GLY 580 Ca 0.48 -0.46 -0.24 0.00 0.00 0.00 0.00 44.72 44.50 2qy0 s GLY 580 CO 0.32 0.41 1.27 0.14 0.00 0.00 0.00 173.10 175.24 2qy0 s VAL 581 N -2.34 2.64 0.66 1.40 1.01 0.03 -2.97 120.40 120.84 2qy0 s VAL 581 Ca 0.69 0.53 0.06 0.00 0.00 0.00 0.00 61.98 63.25 2qy0 s VAL 581 Cb -0.20 -3.29 0.12 0.00 0.00 0.00 0.00 36.38 33.01 2qy0 s VAL 581 CO 0.62 0.04 0.91 -0.04 0.00 0.00 0.00 175.10 176.63 2qy0 s MET 582 N -2.53 1.92 0.40 2.72 -1.94 -0.03 -1.26 119.30 118.58 2qy0 s MET 582 Ca 0.62 -1.51 0.08 0.00 -1.71 0.00 0.00 55.69 53.17 2qy0 s MET 582 Cb -0.36 -2.50 0.85 0.00 2.01 0.00 0.00 34.83 34.83 2qy0 s MET 582 CO 0.44 -1.22 2.00 1.49 -0.01 0.00 0.00 175.02 177.72 2qy0 h GLU 583 N -0.20 0.59 0.00 2.03 4.81 -1.95 -3.32 114.58 116.54 2qy0 h GLU 583 Ca -0.31 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2qy0 h GLU 583 Cb 1.28 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2qy0 h GLU 583 CO 0.39 0.39 -0.02 0.39 -0.73 0.00 0.00 179.01 179.43 2qy0 n GLU 584 N -4.47 0.13 -3.69 1.92 1.02 -1.26 -5.11 120.64 109.17 2qy0 n GLU 584 Ca 0.08 -0.57 -0.09 0.00 -0.02 0.00 0.00 57.16 56.55 2qy0 n GLU 584 Cb 0.20 -0.52 -0.03 0.00 -0.02 0.00 0.00 31.44 31.07 2qy0 n GLU 584 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2qy0 s LYS 585 N -0.05 1.49 0.45 3.49 -2.85 -1.25 -5.15 119.74 115.87 2qy0 s LYS 585 Ca 0.00 -0.80 -0.21 0.00 -1.00 0.00 0.00 55.97 53.96 2qy0 s LYS 585 Cb 0.00 0.57 -0.10 0.00 -2.06 0.00 0.00 37.83 36.24 2qy0 s LYS 585 CO 0.00 -0.66 0.98 0.42 0.10 0.00 0.00 175.35 176.19 2qy0 s ILE 586 N -3.86 4.19 -0.16 3.79 1.01 -1.26 -0.85 121.20 124.07 2qy0 s ILE 586 Ca 0.08 1.37 -0.08 0.00 0.00 0.00 0.00 60.65 62.03 2qy0 s ILE 586 Cb -0.03 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 2qy0 s ILE 586 CO -0.02 -0.29 0.10 0.00 0.00 0.00 0.00 174.94 174.73 2qy0 s ALA 587 N -2.10 3.64 -1.28 9.38 0.00 -1.26 -4.83 121.76 125.30 2qy0 s ALA 587 Ca 0.64 -0.70 0.12 0.00 0.00 0.00 0.00 51.96 52.02 2qy0 s ALA 587 Cb -0.12 -1.97 0.22 0.00 0.00 0.00 0.00 23.12 21.26 2qy0 s ALA 587 CO 0.15 0.36 1.10 0.72 0.00 0.00 0.00 175.76 178.09 2qy0 n HIS 588 N 2.88 0.27 -3.80 0.00 -0.00 -1.26 -4.92 115.22 108.38 2qy0 n HIS 588 Ca -0.18 -0.26 -0.12 0.00 -0.00 0.00 0.00 57.72 57.16 2qy0 n HIS 588 Cb 0.53 -0.01 -0.10 0.00 -0.00 0.00 0.00 29.99 30.41 2qy0 n HIS 588 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2qy0 s ASP 589 N -1.02 -0.17 0.14 0.41 1.01 -1.26 -1.70 116.67 114.08 2qy0 s ASP 589 Ca 0.20 0.22 -0.34 0.00 0.71 0.00 0.00 52.55 53.34 2qy0 s ASP 589 Cb 0.12 0.39 -0.16 0.00 1.01 0.00 0.00 42.92 44.27 2qy0 s ASP 589 CO 0.17 -0.25 1.22 -0.11 0.21 0.00 0.00 175.17 176.40 2qy0 n LEU 590 N 2.13 1.51 -4.45 1.23 7.94 0.57 -4.81 117.00 121.12 2qy0 n LEU 590 Ca -0.18 1.13 -0.22 0.00 -1.11 0.00 0.00 56.01 55.64 2qy0 n LEU 590 Cb 0.57 -1.20 -0.10 0.00 0.53 0.00 0.00 43.42 43.22 2qy0 n LEU 590 CO 0.20 -1.23 -0.38 -0.13 -1.11 0.00 0.00 177.39 174.74 2qy0 s ARG 591 N -0.05 1.60 0.02 1.96 0.52 -0.48 -0.58 118.95 121.94 2qy0 s ARG 591 Ca 0.78 -1.81 -0.11 0.00 -0.52 0.00 0.00 55.73 54.08 2qy0 s ARG 591 Cb -0.90 -1.29 0.01 0.00 0.52 0.00 0.00 34.95 33.29 2qy0 s ARG 591 CO 0.50 0.08 0.22 -0.59 0.02 0.00 0.00 175.30 175.53 2qy0 s PHE 592 N -2.91 -0.01 0.22 -0.53 -0.12 -0.25 0.11 117.98 114.50 2qy0 s PHE 592 Ca 0.30 -0.13 0.06 0.00 -0.05 0.00 0.00 56.93 57.11 2qy0 s PHE 592 Cb 0.03 0.00 -0.05 0.00 -0.63 0.00 0.00 43.02 42.37 2qy0 s PHE 592 CO 0.13 -0.41 -0.07 0.14 -0.05 0.00 0.00 175.22 174.96 2qy0 s VAL 593 N -2.15 1.41 -0.22 -2.49 -7.23 -0.74 -1.38 120.40 107.60 2qy0 s VAL 593 Ca -0.08 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 57.96 2qy0 s VAL 593 Cb -0.03 -2.21 0.01 0.00 0.56 0.00 0.00 36.38 34.71 2qy0 s VAL 593 CO -0.01 -0.46 -0.09 -0.60 -0.31 0.00 0.00 175.10 173.62 2qy0 s ARG 594 N -3.75 3.05 0.03 4.82 3.52 -1.26 -1.63 118.95 123.72 2qy0 s ARG 594 Ca 0.25 -0.83 0.07 0.00 -0.13 0.00 0.00 55.73 55.09 2qy0 s ARG 594 Cb 0.03 -2.89 -0.02 0.00 -1.56 0.00 0.00 34.95 30.50 2qy0 s ARG 594 CO 0.08 -0.29 -0.19 -0.51 -0.81 0.00 0.00 175.30 173.57 2qy0 s LEU 595 N 1.37 2.14 0.10 -0.88 1.43 0.96 -4.93 118.68 118.87 2qy0 s LEU 595 Ca 0.03 -0.47 -0.22 0.00 -1.03 0.00 0.00 54.13 52.44 2qy0 s LEU 595 Cb -0.15 -0.93 -0.07 0.00 0.03 0.00 0.00 46.19 45.07 2qy0 s LEU 595 CO -0.06 0.16 0.67 -2.16 0.23 0.00 0.00 176.35 175.19 2qy0 s PRO 596 N -0.99 4.38 0.33 1.29 0.04 -1.26 -0.69 135.00 138.09 2qy0 s PRO 596 Ca 0.07 0.93 -0.29 0.00 0.04 0.00 0.00 61.00 61.74 2qy0 s PRO 596 Cb -0.08 -3.27 -0.11 0.00 0.04 0.00 0.00 34.50 31.08 2qy0 s PRO 596 CO 0.01 0.56 1.47 0.08 0.04 0.00 0.00 177.00 179.16 2qy0 s VAL 597 N -0.96 2.28 0.31 -0.36 1.01 0.54 -1.24 120.40 121.99 2qy0 s VAL 597 Ca 0.32 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.65 2qy0 s VAL 597 Cb -0.21 -3.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2qy0 s VAL 597 CO 0.22 0.06 0.15 0.00 0.00 0.00 0.00 175.10 175.53 2qy0 s ALA 598 N -0.68 3.52 -0.33 5.51 0.00 0.23 -1.52 121.76 128.49 2qy0 s ALA 598 Ca 0.56 -1.70 -0.29 0.00 0.00 0.00 0.00 51.96 50.53 2qy0 s ALA 598 Cb -0.45 -0.91 0.01 0.00 0.00 0.00 0.00 23.12 21.77 2qy0 s ALA 598 CO 0.54 0.10 1.12 1.21 0.00 0.00 0.00 175.76 178.74 2qy0 s ASN 599 N -3.84 6.86 0.55 0.00 3.84 -1.26 -4.67 114.94 116.42 2qy0 s ASN 599 Ca 0.36 1.04 0.23 0.00 0.21 0.00 0.00 52.86 54.70 2qy0 s ASN 599 Cb -0.05 -2.54 1.50 0.00 -0.55 0.00 0.00 41.25 39.61 2qy0 s ASN 599 CO 0.23 -0.94 2.17 1.55 -2.79 0.00 0.00 177.10 177.32 2qy0 h PRO 600 N 8.39 0.00 -0.54 0.43 0.13 -1.97 -0.47 132.00 137.96 2qy0 h PRO 600 Ca -0.22 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.86 2qy0 h PRO 600 Cb 1.07 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2qy0 h PRO 600 CO 1.04 0.00 0.11 0.37 -0.23 0.00 0.00 178.00 179.29 2qy0 h GLN 601 N 0.00 0.84 -0.00 0.86 4.15 -1.99 -1.34 115.11 117.62 2qy0 h GLN 601 Ca 0.03 -0.18 -0.22 0.00 0.77 0.00 0.00 58.65 59.05 2qy0 h GLN 601 Cb 0.14 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.71 2qy0 h GLN 601 CO -0.00 0.77 -0.92 0.00 -1.93 0.00 0.00 178.83 176.75 2qy0 h ALA 602 N 1.32 0.40 -0.46 3.38 0.00 -1.53 -1.39 119.26 120.97 2qy0 h ALA 602 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2qy0 h ALA 602 Cb 0.32 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2qy0 h ALA 602 CO 0.00 0.83 0.30 0.00 0.00 0.00 0.00 179.25 180.38 2qy0 h GLU 604 N 0.62 1.16 -0.33 0.00 4.39 -1.15 -2.30 114.58 116.98 2qy0 h GLU 604 Ca 0.17 -0.07 -0.04 0.00 0.34 0.00 0.00 59.36 59.75 2qy0 h GLU 604 Cb -0.05 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.32 2qy0 h GLU 604 CO -0.03 0.77 0.01 -0.97 -1.16 0.00 0.00 179.01 177.62 2qy0 h ASN 605 N 1.19 0.47 -0.07 1.42 -1.24 -0.71 0.67 115.58 117.31 2qy0 h ASN 605 Ca 0.35 -0.08 -0.09 0.00 0.71 0.00 0.00 56.30 57.19 2qy0 h ASN 605 Cb -0.07 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 38.86 2qy0 h ASN 605 CO -0.09 0.53 -0.30 -0.25 -1.29 0.00 0.00 177.43 176.02 2qy0 h TRP 606 N 0.48 0.44 -0.38 0.67 7.01 -0.86 -0.86 115.95 122.46 2qy0 h TRP 606 Ca 0.11 -0.19 -0.01 0.00 2.11 0.00 0.00 58.89 60.91 2qy0 h TRP 606 Cb 0.30 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 2qy0 h TRP 606 CO 0.01 0.92 0.20 -0.07 -2.79 0.00 0.00 178.44 176.71 2qy0 h LEU 607 N -0.16 0.47 -1.47 0.65 3.38 -1.30 -2.43 115.31 114.45 2qy0 h LEU 607 Ca -0.02 -0.09 0.12 0.00 0.09 0.00 0.00 57.88 57.98 2qy0 h LEU 607 Cb 0.95 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 2qy0 h LEU 607 CO 0.06 0.43 0.50 -0.09 0.09 0.00 0.00 178.44 179.44 2qy0 h ARG 608 N 0.48 0.54 0.00 1.13 2.43 -0.77 -0.63 114.38 117.57 2qy0 h ARG 608 Ca 0.13 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.20 2qy0 h ARG 608 Cb 0.06 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2qy0 h ARG 608 CO -0.02 0.36 -0.34 0.78 -1.51 0.00 0.00 179.97 179.24 2qy0 h GLY 609 N 0.56 0.00 -2.30 2.80 0.00 -0.67 -2.92 103.07 100.54 2qy0 h GLY 609 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 2qy0 h GLY 609 CO -0.13 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.69 2qy0 n LYS 610 N -3.84 2.51 -3.69 4.80 5.02 -0.31 -4.97 118.16 117.68 2qy0 n LYS 610 Ca -0.01 -2.28 -0.25 0.00 -2.02 0.00 0.00 58.31 53.74 2qy0 n LYS 610 Cb 0.41 -1.52 0.06 0.00 -0.02 0.00 0.00 35.03 33.97 2qy0 n LYS 610 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2qy0 n ASN 611 N 1.48 -5.33 -4.78 4.39 3.02 -0.81 -4.97 115.26 108.26 2qy0 n ASN 611 Ca 0.20 -0.63 -0.36 0.00 -0.03 0.00 0.00 54.58 53.75 2qy0 n ASN 611 Cb 0.60 -4.65 -0.07 0.00 -0.61 0.00 0.00 39.78 35.06 2qy0 n ASN 611 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2qy0 s ARG 612 N -6.32 4.00 -0.31 3.52 1.81 -1.02 -5.00 118.95 115.63 2qy0 s ARG 612 Ca 0.54 -0.02 0.11 0.00 -1.72 0.00 0.00 55.73 54.64 2qy0 s ARG 612 Cb -0.25 -3.35 0.73 0.00 -0.45 0.00 0.00 34.95 31.64 2qy0 s ARG 612 CO 0.76 0.44 1.77 -1.33 -0.68 0.00 0.00 175.30 176.26 2qy0 n MET 613 N 2.99 3.68 -1.86 3.54 2.81 -1.26 -4.66 117.12 122.36 2qy0 n MET 613 Ca -0.15 -3.09 -0.38 0.00 -1.81 0.00 0.00 57.70 52.27 2qy0 n MET 613 Cb 0.53 -2.18 0.03 0.00 -0.71 0.00 0.00 33.22 30.89 2qy0 n MET 613 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2qy0 s ASP 614 N -1.16 5.37 -0.04 7.83 1.11 -1.26 -4.94 116.67 123.58 2qy0 s ASP 614 Ca 0.54 2.67 -0.30 0.00 0.18 0.00 0.00 52.55 55.64 2qy0 s ASP 614 Cb 0.43 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.75 2qy0 s ASP 614 CO 0.13 -1.49 1.36 -0.69 1.18 0.00 0.00 175.17 175.65 2qy0 s VAL 615 N -1.36 3.91 -0.39 -1.27 1.01 -0.32 -4.96 120.40 117.01 2qy0 s VAL 615 Ca 0.71 1.24 0.01 0.00 0.00 0.00 0.00 61.98 63.94 2qy0 s VAL 615 Cb -0.38 -3.80 0.12 0.00 0.00 0.00 0.00 36.38 32.33 2qy0 s VAL 615 CO 0.45 -0.03 0.18 0.12 0.00 0.00 0.00 175.10 175.82 2qy0 s PHE 616 N 2.68 2.01 0.73 5.22 5.99 -1.26 -4.61 117.98 128.75 2qy0 s PHE 616 Ca 0.61 -2.25 0.01 0.00 0.00 0.00 0.00 56.93 55.31 2qy0 s PHE 616 Cb -0.29 -1.90 0.14 0.00 0.00 0.00 0.00 43.02 40.97 2qy0 s PHE 616 CO 0.24 -0.82 1.00 -1.54 -0.00 0.00 0.00 175.22 174.10 2qy0 s SER 617 N 0.78 4.28 0.00 6.13 1.04 -1.26 -4.96 113.70 119.70 2qy0 s SER 617 Ca 0.15 -0.57 0.15 0.00 0.48 0.00 0.00 55.95 56.16 2qy0 s SER 617 Cb -0.22 0.29 0.74 0.00 0.10 0.00 0.00 66.02 66.92 2qy0 s SER 617 CO -0.08 -1.93 1.46 0.00 0.98 0.00 0.00 173.24 173.67 2qy0 n GLN 618 N -2.82 0.14 -0.69 4.02 10.64 -1.26 -2.73 117.38 124.67 2qy0 n GLN 618 Ca 0.17 0.18 0.08 0.00 -1.83 0.00 0.00 57.00 55.60 2qy0 n GLN 618 Cb 0.61 -1.50 0.35 0.00 -0.86 0.00 0.00 30.24 28.85 2qy0 n GLN 618 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2qy0 n ASN 619 N -1.36 4.97 -4.22 2.61 3.02 -1.26 -4.92 115.26 114.10 2qy0 n ASN 619 Ca 0.06 -2.73 -0.14 0.00 -0.03 0.00 0.00 54.58 51.74 2qy0 n ASN 619 Cb 0.14 -0.60 -0.10 0.00 -0.61 0.00 0.00 39.78 38.61 2qy0 n ASN 619 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2qy0 s MET 620 N -2.37 0.96 0.24 3.52 -1.94 -1.11 -0.57 119.30 118.03 2qy0 s MET 620 Ca 0.50 -1.33 0.01 0.00 -1.71 0.00 0.00 55.69 53.16 2qy0 s MET 620 Cb 0.36 -0.56 -0.04 0.00 2.01 0.00 0.00 34.83 36.60 2qy0 s MET 620 CO 0.18 0.07 0.13 -0.59 -0.01 0.00 0.00 175.02 174.80 2qy0 s PHE 621 N -2.99 1.37 0.12 -0.03 -0.12 -0.46 -4.74 117.98 111.13 2qy0 s PHE 621 Ca 0.12 -1.33 0.09 0.00 -0.05 0.00 0.00 56.93 55.76 2qy0 s PHE 621 Cb 0.01 -0.72 -0.04 0.00 -0.63 0.00 0.00 43.02 41.64 2qy0 s PHE 621 CO -0.00 -0.53 -0.22 0.00 -0.05 0.00 0.00 175.22 174.42 2qy0 s ALA 623 N -1.27 0.86 0.00 0.00 0.00 -0.53 -0.60 121.76 120.23 2qy0 s ALA 623 Ca 0.09 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.63 2qy0 s ALA 623 Cb -0.09 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.66 2qy0 s ALA 623 CO 0.05 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 175.80 2qy0 n GLY 624 N -0.07 -2.42 3.41 0.00 0.00 -0.37 -1.24 105.19 104.50 2qy0 n GLY 624 Ca -0.08 -1.61 -0.14 0.00 0.00 0.00 0.00 46.02 44.18 2qy0 n GLY 624 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qy0 s HIS 625 N -0.58 -0.52 0.66 1.61 2.46 -1.22 -4.67 115.29 113.03 2qy0 s HIS 625 Ca 0.00 1.17 0.25 0.00 0.47 0.00 0.00 55.06 56.95 2qy0 s HIS 625 Cb 0.00 0.22 1.35 0.00 -0.13 0.00 0.00 32.58 34.01 2qy0 s HIS 625 CO 0.00 -0.35 1.76 -1.35 -2.47 0.00 0.00 174.74 172.33 2qy0 h PRO 626 N 4.69 0.00 -0.01 2.88 0.11 -1.79 0.32 132.00 138.19 2qy0 h PRO 626 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2qy0 h PRO 626 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2qy0 h PRO 626 CO 0.25 0.00 -0.41 -1.13 -0.21 0.00 0.00 178.00 176.49 2qy0 n SER 627 N -2.83 1.42 -4.81 -2.05 3.41 -1.26 -4.13 113.62 103.36 2qy0 n SER 627 Ca -0.01 -1.13 -0.38 0.00 -0.26 0.00 0.00 58.87 57.08 2qy0 n SER 627 Cb 0.50 0.34 -0.06 0.00 -0.26 0.00 0.00 64.21 64.73 2qy0 n SER 627 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qy0 s LEU 628 N -2.55 4.49 0.20 1.04 1.43 0.11 -4.96 118.68 118.44 2qy0 s LEU 628 Ca 0.20 1.13 0.10 0.00 -1.03 0.00 0.00 54.13 54.53 2qy0 s LEU 628 Cb 0.18 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.64 2qy0 s LEU 628 CO 0.57 0.28 1.40 0.50 0.23 0.00 0.00 176.35 179.33 2qy0 h LYS 629 N 4.74 0.00 -6.44 1.70 3.64 -1.91 -2.72 116.57 115.58 2qy0 h LYS 629 Ca -0.50 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.35 2qy0 h LYS 629 Cb 1.21 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.05 2qy0 h LYS 629 CO 0.63 0.78 1.01 -0.65 -2.27 0.00 0.00 179.45 178.95 2qy0 s GLN 630 N -2.97 4.19 0.20 1.90 1.11 -1.26 -4.41 119.66 118.42 2qy0 s GLN 630 Ca 0.01 2.34 -0.23 0.00 0.01 0.00 0.00 55.36 57.49 2qy0 s GLN 630 Cb 0.10 -3.63 0.05 0.00 -1.01 0.00 0.00 33.01 28.51 2qy0 s GLN 630 CO 0.78 -0.75 0.73 0.34 0.01 0.00 0.00 175.29 176.41 2qy0 s ASP 631 N 2.52 -0.35 0.59 5.90 3.68 -1.13 -4.77 116.67 123.11 2qy0 s ASP 631 Ca 0.74 -0.34 -0.15 0.00 2.13 0.00 0.00 52.55 54.93 2qy0 s ASP 631 Cb -0.40 0.62 -0.04 0.00 -1.45 0.00 0.00 42.92 41.66 2qy0 s ASP 631 CO 0.32 -1.10 1.04 0.00 0.13 0.00 0.00 175.17 175.57 2qy0 s ALA 632 N -3.70 2.80 0.07 3.66 0.00 -1.26 -1.58 121.76 121.75 2qy0 s ALA 632 Ca 0.08 0.32 -0.00 0.00 0.00 0.00 0.00 51.96 52.35 2qy0 s ALA 632 Cb -0.03 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2qy0 s ALA 632 CO -0.01 -0.74 0.10 0.00 0.00 0.00 0.00 175.76 175.10 2qy0 n GLN 634 N -0.11 2.29 0.00 0.00 7.27 -1.26 0.39 117.38 125.96 2qy0 n GLN 634 Ca 0.00 0.83 0.00 0.00 0.07 0.00 0.00 57.00 57.90 2qy0 n GLN 634 Cb 0.11 -2.74 0.00 0.00 2.41 0.00 0.00 30.24 30.03 2qy0 n GLN 634 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2qy0 n GLY 635 N 4.54 0.70 0.09 1.69 0.00 -1.25 -0.79 105.19 110.16 2qy0 n GLY 635 Ca 0.23 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.29 2qy0 n GLY 635 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qy0 n ASP 636 N 0.00 0.66 -4.48 1.61 10.43 0.16 -3.61 116.55 121.31 2qy0 n ASP 636 Ca 0.00 0.27 -0.44 0.00 2.57 0.00 0.00 54.79 57.19 2qy0 n ASP 636 Cb 0.00 0.60 -0.01 0.00 1.84 0.00 0.00 41.12 43.55 2qy0 n ASP 636 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 2qy0 n SER 637 N -2.71 -0.24 0.00 -2.24 7.64 -1.26 -2.15 113.62 112.66 2qy0 n SER 637 Ca -0.08 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.87 2qy0 n SER 637 Cb 0.73 -1.13 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 2qy0 n SER 637 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qy0 n GLY 638 N 1.65 2.39 3.81 0.23 0.00 -0.76 -1.09 105.19 111.42 2qy0 n GLY 638 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 2qy0 n GLY 638 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qy0 s GLY 639 N -1.93 1.63 0.33 -0.02 0.00 -0.91 -2.76 107.32 103.66 2qy0 s GLY 639 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 44.72 44.51 2qy0 s GLY 639 CO 0.00 0.24 0.61 -1.34 0.00 0.00 0.00 173.10 172.62 2qy0 s VAL 640 N -3.14 4.98 -0.20 1.40 -7.23 -1.26 -0.37 120.40 114.58 2qy0 s VAL 640 Ca 0.60 0.11 -0.21 0.00 -1.81 0.00 0.00 61.98 60.67 2qy0 s VAL 640 Cb -0.14 -3.76 -0.02 0.00 0.56 0.00 0.00 36.38 33.02 2qy0 s VAL 640 CO 0.54 -0.43 0.66 0.12 -0.31 0.00 0.00 175.10 175.68 2qy0 s PHE 641 N -2.22 3.37 -0.13 2.82 5.36 0.45 -4.34 117.98 123.28 2qy0 s PHE 641 Ca 0.45 0.96 0.01 0.00 -0.96 0.00 0.00 56.93 57.39 2qy0 s PHE 641 Cb -0.10 -2.83 -0.00 0.00 -0.34 0.00 0.00 43.02 39.74 2qy0 s PHE 641 CO 0.32 -0.20 -0.17 0.00 -1.46 0.00 0.00 175.22 173.71 2qy0 s ALA 642 N 2.02 2.43 -0.10 11.12 0.00 0.90 -1.89 121.76 136.24 2qy0 s ALA 642 Ca 0.30 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2qy0 s ALA 642 Cb -0.16 -1.10 -0.01 0.00 0.00 0.00 0.00 23.12 21.85 2qy0 s ALA 642 CO 0.10 0.13 -0.21 0.08 0.00 0.00 0.00 175.76 175.86 2qy0 s VAL 643 N 0.57 2.33 -0.47 0.00 1.01 -0.28 0.33 120.40 123.88 2qy0 s VAL 643 Ca -0.10 -0.93 -0.27 0.00 0.00 0.00 0.00 61.98 60.68 2qy0 s VAL 643 Cb -0.16 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.34 2qy0 s VAL 643 CO 0.04 0.55 1.02 -0.60 0.00 0.00 0.00 175.10 176.11 2qy0 s ARG 644 N 0.24 3.60 -0.05 2.72 3.52 -1.26 -1.29 118.95 126.43 2qy0 s ARG 644 Ca -0.14 0.31 -0.35 0.00 -0.13 0.00 0.00 55.73 55.43 2qy0 s ARG 644 Cb -0.17 -3.92 -0.12 0.00 -1.56 0.00 0.00 34.95 29.17 2qy0 s ARG 644 CO 0.07 -1.31 1.81 -3.47 -0.81 0.00 0.00 175.30 171.59 2qy0 n ASP 645 N 7.48 3.28 0.19 -2.12 -0.08 -0.31 -4.87 116.55 120.12 2qy0 n ASP 645 Ca 0.08 1.00 0.06 0.00 -1.51 0.00 0.00 54.79 54.42 2qy0 n ASP 645 Cb 0.49 -1.36 0.32 0.00 2.34 0.00 0.00 41.12 42.91 2qy0 n ASP 645 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2qy0 h PRO 646 N 8.41 0.00 0.00 -0.67 0.13 -1.94 -0.51 132.00 137.42 2qy0 h PRO 646 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2qy0 h PRO 646 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2qy0 h PRO 646 CO 0.94 0.37 0.00 -0.91 -0.23 0.00 0.00 178.00 178.16 2qy0 h ASN 647 N 0.00 0.00 0.00 1.44 2.35 -1.98 -3.39 115.58 114.00 2qy0 h ASN 647 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2qy0 h ASN 647 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 2qy0 h ASN 647 CO 0.05 0.00 -0.59 0.41 -1.65 0.00 0.00 177.43 175.64 2qy0 n THR 648 N -2.70 0.00 -1.00 2.81 -1.04 -1.15 -5.03 114.28 106.18 2qy0 n THR 648 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2qy0 n THR 648 Cb 0.42 -0.42 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2qy0 n THR 648 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2qy0 n ASP 649 N -1.29 -3.87 -4.92 8.00 2.03 -0.21 -5.02 116.55 111.27 2qy0 n ASP 649 Ca 0.00 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.01 2qy0 n ASP 649 Cb 0.24 -1.42 -0.04 0.00 -0.72 0.00 0.00 41.12 39.18 2qy0 n ASP 649 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2qy0 s ARG 650 N -0.61 3.51 -0.12 -0.67 0.52 -1.26 -4.88 118.95 115.44 2qy0 s ARG 650 Ca 0.00 -0.33 -0.04 0.00 -0.52 0.00 0.00 55.73 54.84 2qy0 s ARG 650 Cb 0.00 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.51 2qy0 s ARG 650 CO 0.00 0.51 0.04 -1.58 0.02 0.00 0.00 175.30 174.29 2qy0 s TRP 651 N -1.67 3.26 -0.01 -0.53 0.52 -1.26 -1.17 118.94 118.08 2qy0 s TRP 651 Ca 0.38 0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.72 2qy0 s TRP 651 Cb -0.12 -1.90 -0.01 0.00 -1.15 0.00 0.00 33.47 30.29 2qy0 s TRP 651 CO 0.27 0.41 -0.10 0.08 0.02 0.00 0.00 176.95 177.62 2qy0 s VAL 652 N -0.51 0.83 -0.98 4.03 1.01 -0.41 -1.55 120.40 122.82 2qy0 s VAL 652 Ca 0.10 -0.44 -0.17 0.00 0.00 0.00 0.00 61.98 61.47 2qy0 s VAL 652 Cb -0.12 -0.70 0.16 0.00 0.00 0.00 0.00 36.38 35.72 2qy0 s VAL 652 CO 0.02 0.24 1.14 0.00 0.00 0.00 0.00 175.10 176.50 2qy0 s ALA 653 N -0.19 3.65 -0.14 5.51 0.00 -0.37 -1.13 121.76 129.09 2qy0 s ALA 653 Ca 0.03 -3.01 0.23 0.00 0.00 0.00 0.00 51.96 49.21 2qy0 s ALA 653 Cb -0.05 -3.98 0.59 0.00 0.00 0.00 0.00 23.12 19.68 2qy0 s ALA 653 CO -0.00 -2.81 1.69 1.79 0.00 0.00 0.00 175.76 176.42 2qy0 h THR 654 N 5.37 0.35 -3.49 0.00 1.35 -1.70 -3.40 112.91 111.38 2qy0 h THR 654 Ca 0.18 -1.25 -0.07 0.00 -0.55 0.00 0.00 66.41 64.73 2qy0 h THR 654 Cb 0.99 1.97 -0.06 0.00 -1.73 0.00 0.00 68.15 69.31 2qy0 h THR 654 CO 1.08 0.18 0.01 -0.83 -0.25 0.00 0.00 175.52 175.71 2qy0 s GLY 655 N -4.29 0.57 -0.07 5.82 0.00 -1.12 -0.67 107.32 107.56 2qy0 s GLY 655 Ca 0.04 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.90 2qy0 s GLY 655 CO 0.66 -0.54 -0.09 -0.42 0.00 0.00 0.00 173.10 172.72 2qy0 s ILE 656 N -3.48 0.93 0.04 0.90 1.01 -0.95 -0.41 121.20 119.23 2qy0 s ILE 656 Ca 0.21 -0.31 -0.34 0.00 0.00 0.00 0.00 60.65 60.21 2qy0 s ILE 656 Cb -0.02 -0.91 -0.12 0.00 0.01 0.00 0.00 42.46 41.42 2qy0 s ILE 656 CO 0.11 0.32 1.76 0.52 0.00 0.00 0.00 174.94 177.66 2qy0 n VAL 657 N 4.25 0.34 0.05 2.92 0.31 0.51 -1.50 118.33 125.21 2qy0 n VAL 657 Ca -0.20 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2qy0 n VAL 657 Cb 0.51 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 2qy0 n VAL 657 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2qy0 n SER 658 N 5.33 0.44 -3.92 4.52 2.88 -0.91 -1.82 113.62 120.15 2qy0 n SER 658 Ca 0.20 0.16 -0.09 0.00 -1.33 0.00 0.00 58.87 57.81 2qy0 n SER 658 Cb 0.31 -0.06 -0.04 0.00 -0.75 0.00 0.00 64.21 63.66 2qy0 n SER 658 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2qy0 s TRP 659 N -1.62 0.15 0.00 0.66 1.48 -1.00 -4.97 118.94 113.63 2qy0 s TRP 659 Ca 0.00 -0.53 0.00 0.00 -1.06 0.00 0.00 56.10 54.51 2qy0 s TRP 659 Cb 0.00 0.33 0.00 0.00 -1.16 0.00 0.00 33.47 32.64 2qy0 s TRP 659 CO 0.00 -1.02 0.00 0.41 -4.06 0.00 0.00 176.95 172.28 2qy0 n GLY 660 N -0.38 1.51 3.07 3.67 0.00 -1.26 -1.24 105.19 110.56 2qy0 n GLY 660 Ca -0.04 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 2qy0 n GLY 660 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qy0 s ILE 661 N -2.62 3.24 0.00 -0.61 1.01 -1.26 -5.00 121.20 115.96 2qy0 s ILE 661 Ca 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 60.65 58.02 2qy0 s ILE 661 Cb 0.00 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.28 2qy0 s ILE 661 CO 0.00 -0.77 0.00 0.61 0.00 0.00 0.00 174.94 174.78 2qy0 n GLY 662 N 3.90 0.41 1.29 6.18 0.00 -1.26 -4.81 105.19 110.91 2qy0 n GLY 662 Ca 0.03 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2qy0 n GLY 662 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qy0 s SER 664 N -5.44 6.04 -1.14 0.00 0.15 -1.26 -4.58 113.70 107.46 2qy0 s SER 664 Ca 0.00 0.72 -0.06 0.00 0.70 0.00 0.00 55.95 57.32 2qy0 s SER 664 Cb 0.00 -1.98 -0.03 0.00 -1.71 0.00 0.00 66.02 62.30 2qy0 s SER 664 CO 0.00 -0.68 0.89 0.54 1.20 0.00 0.00 173.24 175.18 2qy0 n ARG 665 N -2.26 -3.63 -0.37 5.44 5.12 -1.02 -4.95 116.66 114.98 2qy0 n ARG 665 Ca 0.01 0.77 0.00 0.00 -1.93 0.00 0.00 57.85 56.70 2qy0 n ARG 665 Cb 0.56 -5.50 0.00 0.00 -1.16 0.00 0.00 32.46 26.36 2qy0 n ARG 665 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qy0 n GLY 666 N -1.32 2.51 3.74 -0.13 0.00 -1.26 -4.67 105.19 104.06 2qy0 n GLY 666 Ca -0.17 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.67 2qy0 n GLY 666 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qy0 s TYR 667 N -4.85 3.29 0.08 1.61 2.02 -1.26 -2.79 117.35 115.45 2qy0 s TYR 667 Ca 0.00 0.28 -0.00 0.00 -0.37 0.00 0.00 57.07 56.98 2qy0 s TYR 667 Cb 0.00 -1.85 -0.04 0.00 -0.40 0.00 0.00 41.96 39.67 2qy0 s TYR 667 CO 0.00 0.53 0.24 0.20 -1.57 0.00 0.00 175.55 174.95 2qy0 s GLY 668 N -0.87 2.14 -0.02 0.71 0.00 -0.37 -4.57 107.32 104.34 2qy0 s GLY 668 Ca 0.13 -0.83 0.07 0.00 0.00 0.00 0.00 44.72 44.09 2qy0 s GLY 668 CO 0.03 -0.80 -0.24 -1.36 0.00 0.00 0.00 173.10 170.73 2qy0 s PHE 669 N -1.55 2.41 -0.02 1.90 0.40 -0.37 -1.45 117.98 119.30 2qy0 s PHE 669 Ca 0.36 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.33 2qy0 s PHE 669 Cb -0.13 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.88 2qy0 s PHE 669 CO 0.28 0.02 -0.08 0.71 0.70 0.00 0.00 175.22 176.85 2qy0 s TYR 670 N -0.65 0.78 0.10 0.36 1.51 0.09 -2.14 117.35 117.40 2qy0 s TYR 670 Ca 0.10 -0.17 -0.31 0.00 -1.01 0.00 0.00 57.07 55.68 2qy0 s TYR 670 Cb -0.10 -0.55 -0.09 0.00 -0.11 0.00 0.00 41.96 41.11 2qy0 s TYR 670 CO -0.00 -0.07 1.74 0.99 -1.11 0.00 0.00 175.55 177.10 2qy0 s THR 671 N 0.10 2.79 -0.81 -0.71 2.01 -0.56 -1.35 115.64 117.11 2qy0 s THR 671 Ca -0.01 0.27 -0.25 0.00 0.31 0.00 0.00 61.69 62.01 2qy0 s THR 671 Cb -0.06 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2qy0 s THR 671 CO 0.00 -0.00 1.93 -0.75 -0.69 0.00 0.00 174.62 175.11 2qy0 s LYS 672 N 2.70 2.55 0.38 4.92 2.20 0.26 -2.24 119.74 130.51 2qy0 s LYS 672 Ca 0.77 0.02 0.07 0.00 -0.36 0.00 0.00 55.97 56.47 2qy0 s LYS 672 Cb -0.43 -4.85 0.79 0.00 -1.51 0.00 0.00 37.83 31.83 2qy0 s LYS 672 CO 0.34 -3.20 1.98 0.28 -0.36 0.00 0.00 175.35 174.39 2qy0 h VAL 673 N 7.16 1.03 -0.99 4.02 2.07 -1.16 -1.97 116.25 126.41 2qy0 h VAL 673 Ca -0.02 -0.24 0.20 0.00 0.82 0.00 0.00 66.70 67.47 2qy0 h VAL 673 Cb 1.06 0.28 -0.10 0.00 -1.52 0.00 0.00 31.29 31.00 2qy0 h VAL 673 CO 1.21 0.13 0.62 0.25 0.02 0.00 0.00 177.57 179.79 2qy0 h LEU 674 N 0.69 0.70 0.00 2.57 5.85 -1.84 -0.53 115.31 122.74 2qy0 h LEU 674 Ca 0.28 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.09 2qy0 h LEU 674 Cb 0.23 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2qy0 h LEU 674 CO -0.09 0.24 0.00 0.59 -0.34 0.00 0.00 178.44 178.84 2qy0 n ASN 675 N -4.72 0.00 -0.13 1.25 4.13 -0.74 -2.99 115.26 112.06 2qy0 n ASN 675 Ca 0.23 -0.27 0.02 0.00 1.68 0.00 0.00 54.58 56.24 2qy0 n ASN 675 Cb 0.63 -0.21 0.04 0.00 -1.54 0.00 0.00 39.78 38.70 2qy0 n ASN 675 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2qy0 n TYR 676 N -1.21 0.10 -0.19 3.10 4.02 -0.21 -4.76 117.16 118.01 2qy0 n TYR 676 Ca 0.14 -0.54 -0.09 0.00 -0.01 0.00 0.00 57.90 57.40 2qy0 n TYR 676 Cb 0.17 -0.06 0.01 0.00 -0.02 0.00 0.00 39.34 39.44 2qy0 n TYR 676 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2qy0 h VAL 677 N 0.39 1.25 -0.95 -0.72 2.07 -1.47 0.54 116.25 117.36 2qy0 h VAL 677 Ca 0.00 -0.96 0.02 0.00 0.82 0.00 0.00 66.70 66.58 2qy0 h VAL 677 Cb 0.59 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2qy0 h VAL 677 CO 0.00 0.35 0.63 0.44 0.02 0.00 0.00 177.57 179.01 2qy0 h ASP 678 N 0.78 1.07 -0.47 0.57 3.32 -1.85 -1.00 116.42 118.84 2qy0 h ASP 678 Ca 0.16 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 2qy0 h ASP 678 Cb 0.41 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 2qy0 h ASP 678 CO 0.01 0.76 -0.14 -0.25 -1.72 0.00 0.00 179.24 177.90 2qy0 h TRP 679 N 1.25 1.07 0.17 4.55 7.01 -1.73 -2.20 115.95 126.07 2qy0 h TRP 679 Ca 0.36 -0.22 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 2qy0 h TRP 679 Cb -0.08 -0.26 0.00 0.00 -2.10 0.00 0.00 29.16 26.72 2qy0 h TRP 679 CO -0.01 1.01 -0.08 0.82 -2.79 0.00 0.00 178.44 177.40 2qy0 h ILE 680 N 0.84 0.86 -0.32 2.65 2.04 -0.52 -1.86 117.51 121.21 2qy0 h ILE 680 Ca 0.13 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 2qy0 h ILE 680 Cb 0.68 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2qy0 h ILE 680 CO 0.05 0.03 0.08 0.11 0.00 0.00 0.00 178.15 178.42 2qy0 h LYS 681 N -0.29 0.46 -0.10 2.37 1.57 -1.09 0.17 116.57 119.66 2qy0 h LYS 681 Ca -0.02 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 2qy0 h LYS 681 Cb 0.23 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 2qy0 h LYS 681 CO 0.04 0.43 -0.09 -0.22 -0.57 0.00 0.00 179.45 179.04 2qy0 h LYS 682 N 0.46 0.24 -0.00 3.15 3.64 -1.28 -2.71 116.57 120.06 2qy0 h LYS 682 Ca 0.11 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2qy0 h LYS 682 Cb 0.18 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2qy0 h LYS 682 CO -0.00 0.64 -0.09 0.93 -2.27 0.00 0.00 179.45 178.66 2qy0 h GLU 683 N -0.16 0.01 0.00 1.90 4.39 -0.95 -2.77 114.58 116.99 2qy0 h GLU 683 Ca 0.02 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2qy0 h GLU 683 Cb 0.59 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 2qy0 h GLU 683 CO 0.02 0.09 0.00 -1.33 -1.16 0.00 0.00 179.01 176.64 2qy0 n MET 684 N -4.43 0.97 0.00 2.33 2.81 0.01 -4.03 117.12 114.78 2qy0 n MET 684 Ca -0.03 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 2qy0 n MET 684 Cb 0.17 -1.25 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 2qy0 n MET 684 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2qy0 n GLU 685 N -0.75 1.03 0.00 0.03 4.71 -1.04 -5.04 120.64 119.57 2qy0 n GLU 685 Ca 0.12 -0.92 0.00 0.00 -0.01 0.00 0.00 57.16 56.35 2qy0 n GLU 685 Cb 0.05 -0.91 0.00 0.00 -1.01 0.00 0.00 31.44 29.58 2qy0 n GLU 685 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37