#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ql9 s ILE 513 N 0.00 2.54 0.43 -0.18 1.09 -1.26 -5.10 121.20 118.71 2ql9 s ILE 513 Ca 0.00 -0.91 -0.26 0.00 -1.10 0.00 0.00 60.65 58.37 2ql9 s ILE 513 Cb 0.00 -1.95 -0.09 0.00 -1.06 0.00 0.00 42.46 39.36 2ql9 s ILE 513 CO 0.00 0.58 1.45 -2.84 -0.10 0.00 0.00 174.94 174.03 2ql9 s PRO 514 N -0.54 3.82 0.41 2.79 0.02 -1.26 -4.89 135.00 135.36 2ql9 s PRO 514 Ca 0.07 2.48 0.17 0.00 0.02 0.00 0.00 61.00 63.74 2ql9 s PRO 514 Cb -0.11 -2.76 0.91 0.00 0.02 0.00 0.00 34.50 32.56 2ql9 s PRO 514 CO 0.01 -0.73 1.88 -0.39 -0.33 0.00 0.00 177.00 177.44 2ql9 h VAL 515 N 2.52 1.03 -0.11 3.83 -1.51 -2.05 -2.53 116.25 117.43 2ql9 h VAL 515 Ca -0.51 -1.09 0.00 0.00 -1.23 0.00 0.00 66.70 63.87 2ql9 h VAL 515 Cb 1.26 1.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.04 2ql9 h VAL 515 CO 0.62 0.29 0.00 -0.62 -1.23 0.00 0.00 177.57 176.63 2ql9 n GLU 516 N -3.91 1.58 -2.43 5.19 -0.58 -1.26 -4.93 120.64 114.31 2ql9 n GLU 516 Ca -0.02 -0.87 -0.33 0.00 -0.42 0.00 0.00 57.16 55.52 2ql9 n GLU 516 Cb 0.37 -1.40 -0.03 0.00 -0.57 0.00 0.00 31.44 29.81 2ql9 n GLU 516 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ql9 s ALA 517 N -1.87 2.95 -0.58 0.62 0.00 -0.96 -4.22 121.76 117.71 2ql9 s ALA 517 Ca 0.33 0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.65 2ql9 s ALA 517 Cb 0.18 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 20.12 2ql9 s ALA 517 CO 0.27 -0.31 0.00 -0.25 0.00 0.00 0.00 175.76 175.48 2ql9 n ASP 518 N -1.38 -2.88 -4.79 0.00 8.00 -0.28 -5.02 116.55 110.20 2ql9 n ASP 518 Ca 0.08 0.05 -0.28 0.00 0.71 0.00 0.00 54.79 55.35 2ql9 n ASP 518 Cb 0.53 -1.82 -0.06 0.00 -0.02 0.00 0.00 41.12 39.76 2ql9 n ASP 518 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ql9 s PHE 519 N -2.29 3.16 -0.08 1.24 0.40 -1.25 -4.82 117.98 114.33 2ql9 s PHE 519 Ca 0.00 0.01 -0.04 0.00 -0.60 0.00 0.00 56.93 56.30 2ql9 s PHE 519 Cb 0.00 -1.54 0.05 0.00 0.51 0.00 0.00 43.02 42.03 2ql9 s PHE 519 CO 0.00 0.52 0.18 -1.17 0.70 0.00 0.00 175.22 175.45 2ql9 s LEU 520 N -2.88 0.33 -0.22 -0.37 0.20 -1.26 -0.83 118.68 113.65 2ql9 s LEU 520 Ca 0.30 0.38 -0.02 0.00 0.69 0.00 0.00 54.13 55.49 2ql9 s LEU 520 Cb -0.11 0.44 0.01 0.00 -0.43 0.00 0.00 46.19 46.11 2ql9 s LEU 520 CO 0.23 -0.19 -0.09 -0.36 -0.29 0.00 0.00 176.35 175.65 2ql9 s PHE 521 N 1.63 2.95 -0.61 5.38 0.40 0.53 -4.99 117.98 123.27 2ql9 s PHE 521 Ca -0.05 -1.36 -0.11 0.00 -0.60 0.00 0.00 56.93 54.82 2ql9 s PHE 521 Cb -0.12 -2.04 0.16 0.00 0.51 0.00 0.00 43.02 41.54 2ql9 s PHE 521 CO -0.07 -0.69 0.51 0.00 0.70 0.00 0.00 175.22 175.68 2ql9 s ALA 522 N 1.37 3.68 0.18 5.36 0.00 -1.26 -0.54 121.76 130.54 2ql9 s ALA 522 Ca 0.04 -2.89 -0.22 0.00 0.00 0.00 0.00 51.96 48.88 2ql9 s ALA 522 Cb -0.15 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.81 2ql9 s ALA 522 CO -0.06 -2.07 0.73 0.71 0.00 0.00 0.00 175.76 175.06 2ql9 s TYR 523 N 0.82 3.79 0.36 0.00 1.51 0.40 -4.96 117.35 119.26 2ql9 s TYR 523 Ca 0.11 1.49 0.26 0.00 -1.01 0.00 0.00 57.07 57.91 2ql9 s TYR 523 Cb -0.21 -2.67 1.31 0.00 -0.11 0.00 0.00 41.96 40.28 2ql9 s TYR 523 CO -0.03 0.45 2.01 0.66 -1.11 0.00 0.00 175.55 177.54 2ql9 h SER 524 N 3.97 0.00 -5.44 2.29 4.64 -1.94 -0.50 113.55 116.58 2ql9 h SER 524 Ca -0.48 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 2ql9 h SER 524 Cb 1.20 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.19 2ql9 h SER 524 CO 0.65 0.15 -0.26 0.28 -0.87 0.00 0.00 176.83 176.79 2ql9 s THR 525 N -4.10 0.00 0.46 2.95 -1.32 -1.26 -3.55 115.64 108.81 2ql9 s THR 525 Ca -0.02 -1.62 -0.09 0.00 -1.21 0.00 0.00 61.69 58.75 2ql9 s THR 525 Cb 0.13 -2.44 -0.05 0.00 -1.51 0.00 0.00 72.50 68.63 2ql9 s THR 525 CO 0.60 0.00 0.81 0.68 -2.21 0.00 0.00 174.62 174.50 2ql9 s VAL 526 N -3.67 4.82 0.20 5.08 -7.23 -1.20 -4.07 120.40 114.33 2ql9 s VAL 526 Ca 0.29 0.49 -0.32 0.00 -1.81 0.00 0.00 61.98 60.64 2ql9 s VAL 526 Cb 0.01 -3.80 -0.15 0.00 0.56 0.00 0.00 36.38 33.00 2ql9 s VAL 526 CO 0.14 -0.73 1.16 -2.65 -0.31 0.00 0.00 175.10 172.71 2ql9 n PRO 527 N -1.85 1.26 -0.26 4.82 -0.02 -1.26 -2.04 135.00 135.65 2ql9 n PRO 527 Ca 0.02 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2ql9 n PRO 527 Cb 0.54 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2ql9 n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ql9 n GLY 528 N 1.91 2.01 3.76 -1.23 0.00 -1.26 -5.03 105.19 105.35 2ql9 n GLY 528 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 2ql9 n GLY 528 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ql9 s TYR 529 N -3.09 2.86 0.88 1.61 1.51 -0.86 -5.12 117.35 115.13 2ql9 s TYR 529 Ca 0.00 -0.24 -0.12 0.00 -1.01 0.00 0.00 57.07 55.69 2ql9 s TYR 529 Cb 0.00 -1.48 0.12 0.00 -0.11 0.00 0.00 41.96 40.49 2ql9 s TYR 529 CO 0.00 0.44 1.13 0.71 -1.11 0.00 0.00 175.55 176.72 2ql9 s TYR 530 N -2.29 2.60 -0.03 2.71 2.02 -1.26 -4.82 117.35 116.28 2ql9 s TYR 530 Ca 0.35 0.89 0.02 0.00 -0.37 0.00 0.00 57.07 57.96 2ql9 s TYR 530 Cb -0.06 -3.36 0.01 0.00 -0.40 0.00 0.00 41.96 38.15 2ql9 s TYR 530 CO 0.23 -2.22 -0.06 0.45 -1.57 0.00 0.00 175.55 172.38 2ql9 s SER 531 N -4.06 0.95 0.08 2.29 0.15 -1.26 -4.83 113.70 107.02 2ql9 s SER 531 Ca 0.63 -0.14 -0.10 0.00 0.70 0.00 0.00 55.95 57.04 2ql9 s SER 531 Cb -0.14 -0.30 -0.06 0.00 -1.71 0.00 0.00 66.02 63.81 2ql9 s SER 531 CO 0.53 0.02 0.40 0.26 1.20 0.00 0.00 173.24 175.65 2ql9 s TRP 532 N 0.37 3.59 -0.02 3.44 0.52 -1.26 -5.07 118.94 120.51 2ql9 s TRP 532 Ca -0.05 0.79 -0.01 0.00 0.02 0.00 0.00 56.10 56.86 2ql9 s TRP 532 Cb -0.09 -2.16 0.02 0.00 -1.15 0.00 0.00 33.47 30.08 2ql9 s TRP 532 CO 0.00 0.52 0.03 0.50 0.02 0.00 0.00 176.95 178.03 2ql9 s ARG 533 N -1.89 -0.00 -0.29 4.98 3.52 -1.26 -2.19 118.95 121.81 2ql9 s ARG 533 Ca 0.33 0.12 -0.11 0.00 -0.13 0.00 0.00 55.73 55.95 2ql9 s ARG 533 Cb -0.14 -0.12 -0.03 0.00 -1.56 0.00 0.00 34.95 33.10 2ql9 s ARG 533 CO 0.18 -0.09 0.17 -1.12 -0.81 0.00 0.00 175.30 173.64 2ql9 s SER 534 N 0.56 5.79 0.54 -2.12 0.01 -0.24 -4.90 113.70 113.34 2ql9 s SER 534 Ca -0.05 -0.23 0.30 0.00 1.31 0.00 0.00 55.95 57.28 2ql9 s SER 534 Cb -0.07 -2.07 1.46 0.00 0.21 0.00 0.00 66.02 65.56 2ql9 s SER 534 CO -0.02 -0.12 1.92 -0.65 0.41 0.00 0.00 173.24 174.78 2ql9 h PRO 535 N 8.37 0.00 0.06 12.44 0.11 -2.01 0.92 132.00 151.89 2ql9 h PRO 535 Ca -0.34 -0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.46 2ql9 h PRO 535 Cb 1.17 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2ql9 h PRO 535 CO 0.59 0.00 -1.66 0.78 -0.21 0.00 0.00 178.00 177.50 2ql9 h GLY 536 N 0.00 0.14 0.00 -0.55 0.00 -2.05 -3.41 103.07 97.20 2ql9 h GLY 536 Ca 0.38 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2ql9 h GLY 536 CO -0.01 0.31 -0.69 0.54 0.00 0.00 0.00 176.54 176.69 2ql9 n ARG 537 N -3.27 3.06 0.00 4.80 1.74 -0.80 -5.13 116.66 117.07 2ql9 n ARG 537 Ca -0.18 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 2ql9 n ARG 537 Cb 1.04 -0.95 0.00 0.00 -1.02 0.00 0.00 32.46 31.53 2ql9 n ARG 537 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ql9 n GLY 538 N 1.51 -3.53 3.77 -0.13 0.00 0.31 -4.86 105.19 102.25 2ql9 n GLY 538 Ca 0.00 -2.15 -0.37 0.00 0.00 0.00 0.00 46.02 43.50 2ql9 n GLY 538 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ql9 s SER 539 N -0.06 5.96 0.15 1.61 1.04 -1.26 -1.07 113.70 120.06 2ql9 s SER 539 Ca 0.00 2.41 -0.16 0.00 0.48 0.00 0.00 55.95 58.67 2ql9 s SER 539 Cb 0.00 -2.61 0.06 0.00 0.10 0.00 0.00 66.02 63.57 2ql9 s SER 539 CO 0.00 -1.07 1.74 -0.50 0.98 0.00 0.00 173.24 174.39 2ql9 h TRP 540 N 1.90 0.19 -0.40 5.02 6.55 -1.82 -1.65 115.95 125.74 2ql9 h TRP 540 Ca -0.50 0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.40 2ql9 h TRP 540 Cb 1.26 -0.03 -0.04 0.00 -0.86 0.00 0.00 29.16 29.49 2ql9 h TRP 540 CO 0.52 0.07 0.16 0.35 -1.05 0.00 0.00 178.44 178.49 2ql9 h PHE 541 N 0.25 0.29 -0.57 0.49 3.57 -1.90 -1.24 116.94 117.83 2ql9 h PHE 541 Ca 0.16 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 2ql9 h PHE 541 Cb 0.15 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2ql9 h PHE 541 CO -0.15 0.13 -0.02 0.28 -2.23 0.00 0.00 178.31 176.32 2ql9 h VAL 542 N 0.34 1.27 0.15 1.41 2.07 -1.88 0.37 116.25 119.97 2ql9 h VAL 542 Ca 0.18 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2ql9 h VAL 542 Cb 0.14 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2ql9 h VAL 542 CO -0.16 0.41 -0.14 1.56 0.02 0.00 0.00 177.57 179.26 2ql9 h GLN 543 N 0.90 -0.30 -0.28 1.57 4.20 -1.01 -1.38 115.11 118.82 2ql9 h GLN 543 Ca 0.16 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.90 2ql9 h GLN 543 Cb 0.57 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 2ql9 h GLN 543 CO 0.03 -0.20 0.16 0.00 -0.67 0.00 0.00 178.83 178.16 2ql9 h ALA 544 N 0.51 0.34 -0.25 3.87 0.00 -1.07 -1.56 119.26 121.10 2ql9 h ALA 544 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2ql9 h ALA 544 Cb 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ql9 h ALA 544 CO -0.03 -0.21 0.12 1.25 0.00 0.00 0.00 179.25 180.37 2ql9 h LEU 545 N 0.34 0.16 -0.79 0.00 5.85 -0.77 -0.85 115.31 119.25 2ql9 h LEU 545 Ca 0.11 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 2ql9 h LEU 545 Cb -0.01 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2ql9 h LEU 545 CO -0.05 0.13 0.13 0.00 -0.34 0.00 0.00 178.44 178.31 2ql9 h SER 547 N 0.99 0.19 -0.41 0.00 0.87 -0.89 0.37 113.55 114.67 2ql9 h SER 547 Ca 0.20 -0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.58 2ql9 h SER 547 Cb 0.39 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 2ql9 h SER 547 CO 0.01 0.19 -0.23 0.40 -0.53 0.00 0.00 176.83 176.67 2ql9 h ILE 548 N 0.17 1.28 -0.61 2.23 1.08 -1.03 -3.06 117.51 117.57 2ql9 h ILE 548 Ca 0.06 -1.38 -0.06 0.00 -0.39 0.00 0.00 64.86 63.09 2ql9 h ILE 548 Cb 0.04 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 35.04 2ql9 h ILE 548 CO -0.01 0.46 0.14 -0.07 -0.69 0.00 0.00 178.15 177.98 2ql9 h LEU 549 N 0.69 0.91 -1.59 1.44 3.38 -0.85 0.17 115.31 119.46 2ql9 h LEU 549 Ca 0.09 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2ql9 h LEU 549 Cb 0.80 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2ql9 h LEU 549 CO 0.07 0.89 -0.21 -0.33 0.09 0.00 0.00 178.44 178.94 2ql9 h GLU 550 N 0.92 0.00 0.00 1.13 5.08 -0.89 0.37 114.58 121.19 2ql9 h GLU 550 Ca 0.19 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2ql9 h GLU 550 Cb 0.35 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2ql9 h GLU 550 CO 0.00 0.21 -2.07 -1.91 -1.00 0.00 0.00 179.01 174.24 2ql9 n GLU 551 N -4.24 0.67 0.00 2.33 4.07 -1.02 -4.72 120.64 117.72 2ql9 n GLU 551 Ca -0.02 -0.13 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 2ql9 n GLU 551 Cb 0.27 -1.53 0.00 0.00 -0.06 0.00 0.00 31.44 30.12 2ql9 n GLU 551 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 2ql9 n HIS 552 N -2.42 0.00 -0.04 4.31 8.25 0.56 -4.88 115.22 121.00 2ql9 n HIS 552 Ca -0.12 -0.01 0.24 0.00 -0.26 0.00 0.00 57.72 57.57 2ql9 n HIS 552 Cb 0.74 -0.00 0.71 0.00 1.12 0.00 0.00 29.99 32.56 2ql9 n HIS 552 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2ql9 h GLY 553 N 0.00 0.00 -1.73 -1.41 0.00 -0.31 -1.44 103.07 98.18 2ql9 h GLY 553 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ql9 h GLY 553 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 2ql9 n LYS 554 N -3.90 2.60 0.00 4.80 5.02 -1.26 -4.34 118.16 121.08 2ql9 n LYS 554 Ca 0.13 -2.16 0.00 0.00 -2.02 0.00 0.00 58.31 54.26 2ql9 n LYS 554 Cb 0.83 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.48 2ql9 n LYS 554 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ql9 n ASP 555 N 0.93 0.06 -4.57 4.39 5.68 -0.59 -4.58 116.55 117.87 2ql9 n ASP 555 Ca 0.15 -0.33 -0.26 0.00 -0.50 0.00 0.00 54.79 53.85 2ql9 n ASP 555 Cb 0.48 0.23 -0.09 0.00 -1.14 0.00 0.00 41.12 40.60 2ql9 n ASP 555 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2ql9 s LEU 556 N -0.46 2.96 0.47 -2.12 1.43 -0.89 -5.12 118.68 114.96 2ql9 s LEU 556 Ca 0.00 -0.61 -0.21 0.00 -1.03 0.00 0.00 54.13 52.28 2ql9 s LEU 556 Cb 0.00 -1.63 -0.08 0.00 0.03 0.00 0.00 46.19 44.51 2ql9 s LEU 556 CO 0.00 0.09 1.05 -0.70 0.23 0.00 0.00 176.35 177.02 2ql9 s GLU 557 N -2.94 3.85 0.29 1.70 -6.30 -1.26 -4.66 118.70 109.37 2ql9 s GLU 557 Ca 0.26 1.43 0.04 0.00 -2.50 0.00 0.00 54.97 54.19 2ql9 s GLU 557 Cb -0.08 -2.20 0.72 0.00 0.00 0.00 0.00 34.13 32.57 2ql9 s GLU 557 CO 0.15 -0.40 1.70 0.97 0.02 0.00 0.00 175.26 177.70 2ql9 h ILE 558 N 1.68 0.49 -0.06 -3.70 6.09 -1.44 0.31 117.51 120.89 2ql9 h ILE 558 Ca -0.49 -0.14 -0.09 0.00 -1.37 0.00 0.00 64.86 62.76 2ql9 h ILE 558 Cb 1.22 0.04 -0.01 0.00 0.47 0.00 0.00 36.82 38.54 2ql9 h ILE 558 CO 0.60 0.08 -0.39 0.24 -3.07 0.00 0.00 178.15 175.60 2ql9 h MET 559 N 0.41 0.13 -0.43 2.19 2.86 -1.92 -0.96 114.93 117.21 2ql9 h MET 559 Ca 0.55 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 58.01 2ql9 h MET 559 Cb 1.04 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 2ql9 h MET 559 CO -0.52 0.50 -0.24 1.96 1.06 0.00 0.00 176.91 179.67 2ql9 h GLN 560 N 0.11 0.89 0.15 1.72 4.20 -1.33 -0.69 115.11 120.15 2ql9 h GLN 560 Ca 0.01 -0.38 -0.01 0.00 0.06 0.00 0.00 58.65 58.33 2ql9 h GLN 560 Cb 0.74 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.49 2ql9 h GLN 560 CO 0.06 1.03 -0.07 0.82 -0.67 0.00 0.00 178.83 180.00 2ql9 h ILE 561 N 0.76 0.95 -0.08 2.54 2.04 -0.96 -2.19 117.51 120.56 2ql9 h ILE 561 Ca 0.10 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 2ql9 h ILE 561 Cb 0.79 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 2ql9 h ILE 561 CO 0.07 0.09 -0.28 -0.07 0.00 0.00 0.00 178.15 177.96 2ql9 h LEU 562 N -0.39 0.15 -0.63 1.44 3.38 -1.13 -0.80 115.31 117.33 2ql9 h LEU 562 Ca -0.02 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 2ql9 h LEU 562 Cb 0.31 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2ql9 h LEU 562 CO 0.03 0.43 -0.23 0.74 0.09 0.00 0.00 178.44 179.51 2ql9 h THR 563 N 0.14 1.27 -0.23 0.22 2.02 -1.08 0.11 112.91 115.36 2ql9 h THR 563 Ca 0.02 -1.36 -0.11 0.00 0.77 0.00 0.00 66.41 65.73 2ql9 h THR 563 Cb 0.57 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2ql9 h THR 563 CO 0.04 0.46 -0.31 0.03 0.37 0.00 0.00 175.52 176.11 2ql9 h ARG 564 N 0.72 0.46 -0.54 6.66 3.08 -0.79 -1.61 114.38 122.37 2ql9 h ARG 564 Ca 0.10 -0.19 -0.09 0.00 0.07 0.00 0.00 59.98 59.86 2ql9 h ARG 564 Cb 0.76 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.77 2ql9 h ARG 564 CO 0.06 0.72 -0.02 0.28 -1.07 0.00 0.00 179.97 179.95 2ql9 h VAL 565 N 0.40 1.27 -0.19 2.04 2.07 -0.69 -0.43 116.25 120.70 2ql9 h VAL 565 Ca 0.05 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.47 2ql9 h VAL 565 Cb 0.74 0.93 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2ql9 h VAL 565 CO 0.06 0.40 -0.05 0.78 0.02 0.00 0.00 177.57 178.78 2ql9 h ASN 566 N 0.84 -0.18 -0.59 0.57 2.35 -0.32 -0.81 115.58 117.43 2ql9 h ASN 566 Ca 0.15 0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 2ql9 h ASN 566 Cb 0.56 0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.02 2ql9 h ASN 566 CO 0.03 -0.06 0.24 -0.78 -1.65 0.00 0.00 177.43 175.21 2ql9 h ASP 567 N 0.00 0.82 -0.58 5.81 3.58 -1.09 -1.23 116.42 123.73 2ql9 h ASP 567 Ca 0.09 -0.17 -0.04 0.00 0.42 0.00 0.00 57.03 57.34 2ql9 h ASP 567 Cb 0.14 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 40.95 2ql9 h ASP 567 CO -0.20 0.76 0.22 -0.09 -2.88 0.00 0.00 179.24 177.06 2ql9 h ARG 568 N 0.82 0.88 -0.46 0.28 2.43 -0.76 -0.88 114.38 116.70 2ql9 h ARG 568 Ca 0.20 -0.17 -0.13 0.00 -0.81 0.00 0.00 59.98 59.08 2ql9 h ARG 568 Cb 0.20 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2ql9 h ARG 568 CO -0.02 0.76 -0.21 0.28 -1.51 0.00 0.00 179.97 179.27 2ql9 h VAL 569 N 0.81 1.27 -0.33 0.20 2.07 -1.03 -0.50 116.25 118.74 2ql9 h VAL 569 Ca 0.19 -1.36 -0.12 0.00 0.82 0.00 0.00 66.70 66.22 2ql9 h VAL 569 Cb 0.22 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2ql9 h VAL 569 CO -0.01 0.47 -0.30 0.00 0.02 0.00 0.00 177.57 177.74 2ql9 h ALA 570 N 0.94 0.85 0.04 1.67 0.00 -1.01 -3.26 119.26 118.48 2ql9 h ALA 570 Ca 0.11 -0.40 -0.37 0.00 0.00 0.00 0.00 54.91 54.25 2ql9 h ALA 570 Cb 0.77 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 2ql9 h ALA 570 CO 0.06 0.64 -2.26 0.54 0.00 0.00 0.00 179.25 178.23 2ql9 n ARG 571 N -4.08 0.69 0.07 0.00 1.74 -0.35 -4.58 116.66 110.14 2ql9 n ARG 571 Ca -0.01 0.17 0.13 0.00 -0.77 0.00 0.00 57.85 57.37 2ql9 n ARG 571 Cb 0.47 -1.60 0.35 0.00 -1.02 0.00 0.00 32.46 30.66 2ql9 n ARG 571 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 2ql9 n HIS 572 N -3.22 0.67 -4.67 -1.55 -0.00 -0.20 -4.91 115.22 101.34 2ql9 n HIS 572 Ca -0.37 0.20 -0.30 0.00 0.46 0.00 0.00 57.72 57.71 2ql9 n HIS 572 Cb 1.04 -0.77 -0.14 0.00 -0.12 0.00 0.00 29.99 30.00 2ql9 n HIS 572 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 2ql9 s PHE 573 N -3.11 2.37 -0.17 1.57 0.40 -1.23 -5.07 117.98 112.75 2ql9 s PHE 573 Ca 0.10 -0.37 -0.10 0.00 -0.60 0.00 0.00 56.93 55.96 2ql9 s PHE 573 Cb 0.14 -1.36 0.05 0.00 0.51 0.00 0.00 43.02 42.36 2ql9 s PHE 573 CO 0.63 0.23 0.41 -2.00 0.70 0.00 0.00 175.22 175.19 2ql9 s GLU 574 N -1.58 0.41 0.57 0.44 2.12 -1.26 -4.71 118.70 114.69 2ql9 s GLU 574 Ca 0.13 0.74 -0.18 0.00 0.36 0.00 0.00 54.97 56.03 2ql9 s GLU 574 Cb -0.10 0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.27 2ql9 s GLU 574 CO 0.04 -0.14 1.08 -1.54 -0.54 0.00 0.00 175.26 174.16 2ql9 s SER 575 N 1.15 5.80 -0.05 -1.70 1.04 -0.09 -4.83 113.70 115.02 2ql9 s SER 575 Ca -0.08 1.95 -0.02 0.00 0.48 0.00 0.00 55.95 58.28 2ql9 s SER 575 Cb -0.07 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.53 2ql9 s SER 575 CO -0.10 -1.16 0.07 0.00 0.98 0.00 0.00 173.24 173.04 2ql9 s GLN 576 N -3.70 -0.06 0.00 4.02 -2.07 -1.26 0.87 119.66 117.46 2ql9 s GLN 576 Ca 0.67 0.39 -0.03 0.00 -1.82 0.00 0.00 55.36 54.58 2ql9 s GLN 576 Cb -0.18 -0.45 -0.01 0.00 -1.09 0.00 0.00 33.01 31.28 2ql9 s GLN 576 CO 0.31 -0.31 0.04 0.45 -1.32 0.00 0.00 175.29 174.46 2ql9 s SER 577 N 2.10 0.11 0.63 12.60 0.15 -1.26 -4.98 113.70 123.05 2ql9 s SER 577 Ca 0.04 -0.27 0.40 0.00 0.70 0.00 0.00 55.95 56.82 2ql9 s SER 577 Cb -0.12 0.14 2.12 0.00 -1.71 0.00 0.00 66.02 66.45 2ql9 s SER 577 CO -0.03 -0.26 2.27 0.44 1.20 0.00 0.00 173.24 176.86 2ql9 h ASP 578 N 4.86 0.00 -3.35 5.45 5.19 -2.01 -3.39 116.42 123.17 2ql9 h ASP 578 Ca -0.30 0.00 -0.60 0.00 -0.62 0.00 0.00 57.03 55.51 2ql9 h ASP 578 Cb 1.20 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 40.62 2ql9 h ASP 578 CO 0.42 0.01 0.40 -0.62 -3.12 0.00 0.00 179.24 176.33 2ql9 s ASP 579 N -5.41 6.75 0.30 6.45 -1.08 -1.26 -4.93 116.67 117.49 2ql9 s ASP 579 Ca -0.04 0.89 0.22 0.00 -0.52 0.00 0.00 52.55 53.10 2ql9 s ASP 579 Cb 0.12 -2.41 1.12 0.00 -1.46 0.00 0.00 42.92 40.29 2ql9 s ASP 579 CO 0.46 -0.51 1.66 -0.81 0.52 0.00 0.00 175.17 176.49 2ql9 n PRO 580 N 6.00 0.15 0.07 4.34 -0.04 -1.26 -2.14 135.00 142.12 2ql9 n PRO 580 Ca 0.04 0.59 -0.10 0.00 -0.04 0.00 0.00 63.50 63.99 2ql9 n PRO 580 Cb 0.48 -1.94 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 2ql9 n PRO 580 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2ql9 h HIS 581 N 0.00 0.46 -0.48 0.54 2.76 -1.91 -3.23 115.15 113.28 2ql9 h HIS 581 Ca 0.00 -0.23 -0.23 0.00 -2.20 0.00 0.00 60.37 57.71 2ql9 h HIS 581 Cb 0.08 -0.06 -0.14 0.00 1.55 0.00 0.00 27.41 28.84 2ql9 h HIS 581 CO 0.00 1.02 0.08 1.19 -1.30 0.00 0.00 177.93 178.92 2ql9 n PHE 582 N -3.75 1.52 -3.79 5.26 3.01 -0.91 -5.00 117.46 113.79 2ql9 n PHE 582 Ca -0.05 -1.57 -0.37 0.00 1.01 0.00 0.00 57.45 56.48 2ql9 n PHE 582 Cb 0.77 -0.57 -0.06 0.00 -0.01 0.00 0.00 39.48 39.60 2ql9 n PHE 582 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2ql9 s HIS 583 N -3.21 3.57 -1.48 1.38 2.46 -1.15 -4.05 115.29 112.82 2ql9 s HIS 583 Ca 0.47 0.55 -0.07 0.00 0.47 0.00 0.00 55.06 56.48 2ql9 s HIS 583 Cb 0.42 -2.05 0.01 0.00 -0.13 0.00 0.00 32.58 30.83 2ql9 s HIS 583 CO 0.03 0.61 0.87 0.39 -2.47 0.00 0.00 174.74 174.18 2ql9 n GLU 584 N 2.36 -6.30 -3.15 2.88 1.02 0.25 -4.94 120.64 112.75 2ql9 n GLU 584 Ca -0.18 0.87 -0.29 0.00 -0.02 0.00 0.00 57.16 57.54 2ql9 n GLU 584 Cb 0.54 -5.83 -0.03 0.00 -0.02 0.00 0.00 31.44 26.10 2ql9 n GLU 584 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2ql9 s LYS 585 N -5.99 3.69 0.45 3.49 -0.14 -1.25 -4.67 119.74 115.33 2ql9 s LYS 585 Ca 0.44 0.18 0.06 0.00 -1.36 0.00 0.00 55.97 55.29 2ql9 s LYS 585 Cb -0.19 -2.55 -0.03 0.00 -1.68 0.00 0.00 37.83 33.38 2ql9 s LYS 585 CO 0.54 0.12 0.24 0.15 -0.76 0.00 0.00 175.35 175.64 2ql9 s LYS 586 N -3.67 2.27 -0.09 1.68 -0.14 -1.26 -0.91 119.74 117.62 2ql9 s LYS 586 Ca 0.47 -1.88 -0.16 0.00 -1.36 0.00 0.00 55.97 53.03 2ql9 s LYS 586 Cb -0.11 -2.03 0.04 0.00 -1.68 0.00 0.00 37.83 34.06 2ql9 s LYS 586 CO 0.31 -0.25 0.40 -1.14 -0.76 0.00 0.00 175.35 173.90 2ql9 s GLN 587 N -4.01 0.62 -0.05 1.68 0.74 -1.26 -5.02 119.66 112.36 2ql9 s GLN 587 Ca 0.38 0.24 -0.00 0.00 0.05 0.00 0.00 55.36 56.03 2ql9 s GLN 587 Cb 0.01 0.29 0.03 0.00 1.10 0.00 0.00 33.01 34.44 2ql9 s GLN 587 CO 0.21 -0.14 -0.01 -1.50 -0.55 0.00 0.00 175.29 173.31 2ql9 s ILE 588 N -0.54 0.32 1.24 -2.34 1.10 -1.26 -3.45 121.20 116.27 2ql9 s ILE 588 Ca -0.07 0.07 -0.20 0.00 -0.51 0.00 0.00 60.65 59.94 2ql9 s ILE 588 Cb -0.04 -0.43 0.30 0.00 0.15 0.00 0.00 42.46 42.45 2ql9 s ILE 588 CO 0.03 0.21 1.09 -2.84 -2.11 0.00 0.00 174.94 171.32 2ql9 s PRO 589 N 1.39 -1.55 -0.14 3.50 0.02 -1.23 -3.23 135.00 133.75 2ql9 s PRO 589 Ca -0.04 -0.09 -0.04 0.00 0.02 0.00 0.00 61.00 60.84 2ql9 s PRO 589 Cb -0.13 -1.56 0.06 0.00 0.02 0.00 0.00 34.50 32.89 2ql9 s PRO 589 CO -0.02 -3.92 0.15 0.00 -0.33 0.00 0.00 177.00 172.87 2ql9 s VAL 591 N 2.24 5.20 -0.22 0.00 1.01 -1.26 -0.46 120.40 126.91 2ql9 s VAL 591 Ca 0.04 0.12 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 2ql9 s VAL 591 Cb -0.14 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.83 2ql9 s VAL 591 CO -0.08 0.36 -0.08 -0.69 0.00 0.00 0.00 175.10 174.61 2ql9 s VAL 592 N 1.03 2.94 -0.07 2.92 1.01 0.30 -4.99 120.40 123.53 2ql9 s VAL 592 Ca 0.07 -0.77 0.05 0.00 0.00 0.00 0.00 61.98 61.32 2ql9 s VAL 592 Cb -0.14 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 2ql9 s VAL 592 CO 0.04 0.36 -0.22 -0.55 0.00 0.00 0.00 175.10 174.73 2ql9 s SER 593 N 1.39 2.80 -0.12 3.32 0.15 -1.26 -0.35 113.70 119.63 2ql9 s SER 593 Ca 0.04 -0.48 0.15 0.00 0.70 0.00 0.00 55.95 56.36 2ql9 s SER 593 Cb -0.15 -1.00 0.27 0.00 -1.71 0.00 0.00 66.02 63.42 2ql9 s SER 593 CO -0.06 0.18 1.14 0.23 1.20 0.00 0.00 173.24 175.93 2ql9 n MET 594 N 3.27 1.09 -2.41 5.44 2.81 -0.01 -5.02 117.12 122.29 2ql9 n MET 594 Ca -0.19 -2.42 -0.35 0.00 -1.81 0.00 0.00 57.70 52.94 2ql9 n MET 594 Cb 0.52 -1.33 -0.02 0.00 -0.71 0.00 0.00 33.22 31.69 2ql9 n MET 594 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2ql9 s LEU 595 N -2.42 3.84 0.00 4.03 1.43 -1.21 -1.12 118.68 123.23 2ql9 s LEU 595 Ca 0.28 2.06 0.08 0.00 -1.03 0.00 0.00 54.13 55.53 2ql9 s LEU 595 Cb 0.25 -4.52 0.10 0.00 0.03 0.00 0.00 46.19 42.05 2ql9 s LEU 595 CO 0.01 -0.95 0.86 0.35 0.23 0.00 0.00 176.35 176.85 2ql9 n THR 596 N -1.01 0.24 -3.97 5.49 -2.24 -1.26 -4.89 114.28 106.64 2ql9 n THR 596 Ca 0.10 -0.62 -0.10 0.00 -2.27 0.00 0.00 64.05 61.16 2ql9 n THR 596 Cb 0.51 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.69 2ql9 n THR 596 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ql9 s LYS 597 N -0.76 1.36 0.34 -0.78 -0.14 -1.26 -5.15 119.74 113.35 2ql9 s LYS 597 Ca 0.11 -1.21 -0.22 0.00 -1.36 0.00 0.00 55.97 53.30 2ql9 s LYS 597 Cb 0.07 0.43 -0.10 0.00 -1.68 0.00 0.00 37.83 36.55 2ql9 s LYS 597 CO 0.11 -0.53 0.88 -1.21 -0.76 0.00 0.00 175.35 173.83 2ql9 s GLU 598 N -3.99 4.34 -0.16 1.68 2.02 -1.26 -5.05 118.70 116.27 2ql9 s GLU 598 Ca 0.20 1.10 0.02 0.00 0.02 0.00 0.00 54.97 56.31 2ql9 s GLU 598 Cb 0.01 -2.56 0.02 0.00 0.10 0.00 0.00 34.13 31.69 2ql9 s GLU 598 CO 0.05 0.18 -0.21 -1.17 0.02 0.00 0.00 175.26 174.13 2ql9 s LEU 599 N -2.52 2.11 -0.03 1.80 2.96 -1.26 -5.04 118.68 116.69 2ql9 s LEU 599 Ca 0.53 -0.62 0.06 0.00 -0.22 0.00 0.00 54.13 53.88 2ql9 s LEU 599 Cb -0.14 -1.45 -0.01 0.00 0.50 0.00 0.00 46.19 45.08 2ql9 s LEU 599 CO 0.19 0.04 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.72 2ql9 s TYR 600 N 1.08 2.05 -1.78 5.38 2.02 -1.26 -0.93 117.35 123.91 2ql9 s TYR 600 Ca -0.01 -0.47 0.29 0.00 -0.37 0.00 0.00 57.07 56.51 2ql9 s TYR 600 Cb -0.14 -1.33 1.25 0.00 -0.40 0.00 0.00 41.96 41.34 2ql9 s TYR 600 CO -0.08 -0.09 1.87 1.19 -1.57 0.00 0.00 175.55 176.87 2ql9 n PHE 601 N 2.71 0.00 -3.64 2.71 3.72 -1.26 -4.90 117.46 116.80 2ql9 n PHE 601 Ca -0.16 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.03 2ql9 n PHE 601 Cb 0.52 -0.14 -0.03 0.00 -0.94 0.00 0.00 39.48 38.89 2ql9 n PHE 601 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2ql9 s SER 602 N -2.38 5.03 0.00 4.37 1.04 -1.26 -5.02 113.70 115.49 2ql9 s SER 602 Ca 0.31 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2ql9 s SER 602 Cb 0.20 -0.62 0.00 0.00 0.10 0.00 0.00 66.02 65.71 2ql9 s SER 602 CO 0.45 -0.60 0.00 0.00 0.98 0.00 0.00 173.24 174.07