#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ql7 s ILE 513 N 0.00 1.92 0.31 -0.18 1.09 -1.26 -5.11 121.20 117.97 2ql7 s ILE 513 Ca 0.00 -1.08 -0.30 0.00 -1.10 0.00 0.00 60.65 58.18 2ql7 s ILE 513 Cb 0.00 -1.60 -0.12 0.00 -1.06 0.00 0.00 42.46 39.68 2ql7 s ILE 513 CO 0.00 0.51 1.50 -2.65 -0.10 0.00 0.00 174.94 174.20 2ql7 n PRO 514 N 2.39 2.52 0.24 2.79 -0.02 -1.26 -4.89 135.00 136.77 2ql7 n PRO 514 Ca -0.16 0.89 0.08 0.00 -2.02 0.00 0.00 63.50 62.29 2ql7 n PRO 514 Cb 0.52 -2.62 0.59 0.00 -0.02 0.00 0.00 33.50 31.97 2ql7 n PRO 514 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2ql7 h VAL 515 N 3.11 0.91 -0.06 -1.45 -1.51 -2.05 -2.35 116.25 112.84 2ql7 h VAL 515 Ca -0.47 -0.62 0.00 0.00 -1.23 0.00 0.00 66.70 64.38 2ql7 h VAL 515 Cb 1.24 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.76 2ql7 h VAL 515 CO 0.73 0.16 0.00 -0.62 -1.23 0.00 0.00 177.57 176.62 2ql7 n GLU 516 N -4.03 1.72 -2.15 5.19 -0.58 -1.26 -4.96 120.64 114.58 2ql7 n GLU 516 Ca -0.02 -1.06 -0.33 0.00 -0.42 0.00 0.00 57.16 55.33 2ql7 n GLU 516 Cb 0.25 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2ql7 n GLU 516 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ql7 s ALA 517 N -1.93 2.77 -0.74 0.62 0.00 -0.89 -4.18 121.76 117.41 2ql7 s ALA 517 Ca 0.36 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.75 2ql7 s ALA 517 Cb 0.20 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 20.08 2ql7 s ALA 517 CO 0.31 -0.71 0.12 -0.25 0.00 0.00 0.00 175.76 175.24 2ql7 n ASP 518 N -1.82 -3.36 -4.68 0.00 8.00 0.05 -5.01 116.55 109.74 2ql7 n ASP 518 Ca 0.09 -0.06 -0.27 0.00 0.71 0.00 0.00 54.79 55.25 2ql7 n ASP 518 Cb 0.53 -2.47 -0.08 0.00 -0.02 0.00 0.00 41.12 39.08 2ql7 n ASP 518 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2ql7 s PHE 519 N -2.62 2.90 -0.10 1.24 0.40 -1.25 -4.82 117.98 113.72 2ql7 s PHE 519 Ca 0.06 -0.10 -0.05 0.00 -0.60 0.00 0.00 56.93 56.24 2ql7 s PHE 519 Cb -0.03 -1.43 0.05 0.00 0.51 0.00 0.00 43.02 42.13 2ql7 s PHE 519 CO 0.08 0.50 0.23 -1.17 0.70 0.00 0.00 175.22 175.56 2ql7 s LEU 520 N -2.79 0.21 -0.22 -0.37 0.20 -1.26 -0.64 118.68 113.81 2ql7 s LEU 520 Ca 0.27 0.49 -0.01 0.00 0.69 0.00 0.00 54.13 55.57 2ql7 s LEU 520 Cb -0.10 0.62 0.02 0.00 -0.43 0.00 0.00 46.19 46.30 2ql7 s LEU 520 CO 0.19 -0.19 -0.11 -0.36 -0.29 0.00 0.00 176.35 175.59 2ql7 s PHE 521 N 1.68 2.95 -0.56 5.38 0.40 0.18 -4.99 117.98 123.02 2ql7 s PHE 521 Ca -0.05 -1.48 -0.13 0.00 -0.60 0.00 0.00 56.93 54.66 2ql7 s PHE 521 Cb -0.11 -2.01 0.14 0.00 0.51 0.00 0.00 43.02 41.54 2ql7 s PHE 521 CO -0.08 -0.72 0.48 0.00 0.70 0.00 0.00 175.22 175.60 2ql7 s ALA 522 N 1.34 3.62 -0.02 5.36 0.00 -1.26 -0.61 121.76 130.19 2ql7 s ALA 522 Ca 0.03 -2.65 -0.19 0.00 0.00 0.00 0.00 51.96 49.15 2ql7 s ALA 522 Cb -0.15 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 2ql7 s ALA 522 CO -0.07 -2.02 0.52 0.71 0.00 0.00 0.00 175.76 174.90 2ql7 s TYR 523 N 1.31 3.67 0.44 0.00 1.51 0.12 -4.97 117.35 119.43 2ql7 s TYR 523 Ca 0.06 1.09 0.34 0.00 -1.01 0.00 0.00 57.07 57.55 2ql7 s TYR 523 Cb -0.26 -2.51 1.74 0.00 -0.11 0.00 0.00 41.96 40.81 2ql7 s TYR 523 CO 0.00 0.40 2.15 0.66 -1.11 0.00 0.00 175.55 177.66 2ql7 h SER 524 N 5.56 0.00 -5.26 2.29 4.64 -1.94 0.25 113.55 119.10 2ql7 h SER 524 Ca -0.46 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.77 2ql7 h SER 524 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.18 2ql7 h SER 524 CO 0.69 0.05 -0.25 0.28 -0.87 0.00 0.00 176.83 176.73 2ql7 s THR 525 N -4.12 0.04 0.60 2.95 -1.32 -1.26 -3.68 115.64 108.86 2ql7 s THR 525 Ca -0.03 -1.36 -0.09 0.00 -1.21 0.00 0.00 61.69 59.00 2ql7 s THR 525 Cb 0.12 -1.94 -0.02 0.00 -1.51 0.00 0.00 72.50 69.15 2ql7 s THR 525 CO 0.53 -0.18 0.96 0.68 -2.21 0.00 0.00 174.62 174.40 2ql7 s VAL 526 N -3.98 4.33 0.18 5.08 -7.23 -1.19 -4.19 120.40 113.40 2ql7 s VAL 526 Ca 0.19 0.49 -0.33 0.00 -1.81 0.00 0.00 61.98 60.52 2ql7 s VAL 526 Cb 0.02 -3.72 -0.15 0.00 0.56 0.00 0.00 36.38 33.09 2ql7 s VAL 526 CO 0.03 -0.86 1.20 -2.65 -0.31 0.00 0.00 175.10 172.51 2ql7 n PRO 527 N -2.66 1.27 -1.00 4.82 -0.02 -1.26 -2.40 135.00 133.76 2ql7 n PRO 527 Ca 0.05 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2ql7 n PRO 527 Cb 0.55 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 2ql7 n PRO 527 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ql7 n GLY 528 N 2.07 0.98 3.77 -1.23 0.00 -1.26 -5.03 105.19 104.48 2ql7 n GLY 528 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2ql7 n GLY 528 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ql7 s TYR 529 N -3.91 2.67 0.92 1.61 1.51 -1.01 -5.13 117.35 114.02 2ql7 s TYR 529 Ca 0.00 -0.49 -0.14 0.00 -1.01 0.00 0.00 57.07 55.43 2ql7 s TYR 529 Cb 0.00 -1.90 0.15 0.00 -0.11 0.00 0.00 41.96 40.10 2ql7 s TYR 529 CO 0.00 0.16 1.19 0.71 -1.11 0.00 0.00 175.55 176.50 2ql7 s TYR 530 N -2.51 2.24 -0.02 2.71 2.02 -1.26 -4.88 117.35 115.65 2ql7 s TYR 530 Ca 0.42 0.68 0.00 0.00 -0.37 0.00 0.00 57.07 57.80 2ql7 s TYR 530 Cb -0.00 -3.58 0.02 0.00 -0.40 0.00 0.00 41.96 38.00 2ql7 s TYR 530 CO 0.24 -2.42 -0.00 0.45 -1.57 0.00 0.00 175.55 172.25 2ql7 s SER 531 N -4.34 0.34 -0.08 2.29 0.15 -1.26 -4.82 113.70 105.98 2ql7 s SER 531 Ca 0.66 -0.02 -0.11 0.00 0.70 0.00 0.00 55.95 57.18 2ql7 s SER 531 Cb -0.11 -0.16 -0.05 0.00 -1.71 0.00 0.00 66.02 63.99 2ql7 s SER 531 CO 0.52 -0.07 0.26 0.26 1.20 0.00 0.00 173.24 175.41 2ql7 s TRP 532 N 0.75 3.62 -0.03 3.44 0.52 -1.26 -5.07 118.94 120.92 2ql7 s TRP 532 Ca -0.07 0.71 0.02 0.00 0.02 0.00 0.00 56.10 56.77 2ql7 s TRP 532 Cb -0.10 -2.13 0.01 0.00 -1.15 0.00 0.00 33.47 30.09 2ql7 s TRP 532 CO -0.01 0.62 -0.06 0.50 0.02 0.00 0.00 176.95 178.02 2ql7 s ARG 533 N -0.79 0.75 -0.27 4.98 3.52 -1.26 -1.81 118.95 124.06 2ql7 s ARG 533 Ca 0.18 -0.18 -0.11 0.00 -0.13 0.00 0.00 55.73 55.49 2ql7 s ARG 533 Cb -0.14 -0.74 -0.05 0.00 -1.56 0.00 0.00 34.95 32.47 2ql7 s ARG 533 CO 0.07 0.03 0.18 0.45 -0.81 0.00 0.00 175.30 175.22 2ql7 s SER 534 N 0.44 5.96 0.58 -2.12 0.15 -0.25 -4.87 113.70 113.59 2ql7 s SER 534 Ca -0.06 -0.02 0.28 0.00 0.70 0.00 0.00 55.95 56.85 2ql7 s SER 534 Cb -0.10 -2.10 1.55 0.00 -1.71 0.00 0.00 66.02 63.66 2ql7 s SER 534 CO 0.00 -0.04 2.02 -0.65 1.20 0.00 0.00 173.24 175.77 2ql7 h PRO 535 N 8.30 0.00 0.03 5.44 0.11 -2.01 0.81 132.00 144.69 2ql7 h PRO 535 Ca -0.35 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.40 2ql7 h PRO 535 Cb 1.19 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 2ql7 h PRO 535 CO 0.56 0.00 -2.18 0.41 -0.21 0.00 0.00 178.00 176.58 2ql7 n GLY 536 N -1.47 -0.70 0.01 -0.55 0.00 -1.26 -4.62 105.19 96.59 2ql7 n GLY 536 Ca 0.05 -0.21 0.04 0.00 0.00 0.00 0.00 46.02 45.90 2ql7 n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ql7 n ARG 537 N -3.15 3.87 0.00 1.61 1.74 -1.03 -5.12 116.66 114.58 2ql7 n ARG 537 Ca -0.33 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.73 2ql7 n ARG 537 Cb 1.06 -0.94 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 2ql7 n ARG 537 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ql7 n GLY 538 N 1.21 0.54 3.77 -0.13 0.00 0.28 -4.87 105.19 105.99 2ql7 n GLY 538 Ca 0.02 -2.05 -0.34 0.00 0.00 0.00 0.00 46.02 43.65 2ql7 n GLY 538 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ql7 s SER 539 N -0.20 5.39 0.10 1.61 1.04 -1.26 -1.09 113.70 119.29 2ql7 s SER 539 Ca 0.00 2.11 -0.25 0.00 0.48 0.00 0.00 55.95 58.30 2ql7 s SER 539 Cb 0.00 -2.57 -0.13 0.00 0.10 0.00 0.00 66.02 63.43 2ql7 s SER 539 CO 0.00 -1.44 1.70 -0.50 0.98 0.00 0.00 173.24 173.98 2ql7 h TRP 540 N 0.64 -0.26 -0.43 5.02 6.55 -1.74 -1.82 115.95 123.91 2ql7 h TRP 540 Ca -0.49 0.00 0.06 0.00 0.95 0.00 0.00 58.89 59.42 2ql7 h TRP 540 Cb 1.26 0.10 -0.05 0.00 -0.86 0.00 0.00 29.16 29.61 2ql7 h TRP 540 CO 0.52 -0.16 0.12 0.35 -1.05 0.00 0.00 178.44 178.23 2ql7 h PHE 541 N -0.23 0.21 -0.40 0.49 3.57 -1.90 -1.58 116.94 117.10 2ql7 h PHE 541 Ca 0.01 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 2ql7 h PHE 541 Cb 0.22 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2ql7 h PHE 541 CO -0.12 0.06 -0.12 0.28 -2.23 0.00 0.00 178.31 176.18 2ql7 h VAL 542 N 0.27 1.28 0.00 1.41 2.07 -1.93 0.33 116.25 119.68 2ql7 h VAL 542 Ca 0.20 -1.22 0.03 0.00 0.82 0.00 0.00 66.70 66.53 2ql7 h VAL 542 Cb 0.22 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2ql7 h VAL 542 CO -0.24 0.41 -0.29 1.56 0.02 0.00 0.00 177.57 179.03 2ql7 h GLN 543 N 0.61 -0.43 0.22 1.57 4.20 -1.08 -0.96 115.11 119.25 2ql7 h GLN 543 Ca 0.10 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2ql7 h GLN 543 Cb 0.65 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.51 2ql7 h GLN 543 CO 0.04 -0.29 -0.21 0.00 -0.67 0.00 0.00 178.83 177.71 2ql7 h ALA 544 N 0.32 -0.43 -0.36 3.87 0.00 -1.20 -1.72 119.26 119.73 2ql7 h ALA 544 Ca 0.06 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2ql7 h ALA 544 Cb 0.53 0.29 -0.09 0.00 0.00 0.00 0.00 17.79 18.53 2ql7 h ALA 544 CO -0.25 -0.77 -0.36 1.25 0.00 0.00 0.00 179.25 179.12 2ql7 h LEU 545 N -0.46 -1.18 -0.82 0.00 5.85 -0.60 -0.62 115.31 117.48 2ql7 h LEU 545 Ca -0.00 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2ql7 h LEU 545 Cb 0.42 0.53 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 2ql7 h LEU 545 CO -0.04 -0.35 0.44 0.00 -0.34 0.00 0.00 178.44 178.15 2ql7 h SER 547 N 1.15 0.07 -0.38 0.00 0.87 -0.36 0.27 113.55 115.18 2ql7 h SER 547 Ca 0.29 0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.76 2ql7 h SER 547 Cb 0.05 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2ql7 h SER 547 CO -0.04 0.07 -0.20 0.40 -0.53 0.00 0.00 176.83 176.52 2ql7 h ILE 548 N 0.17 1.28 -0.59 2.23 1.08 -0.96 -3.02 117.51 117.70 2ql7 h ILE 548 Ca 0.10 -1.34 -0.04 0.00 -0.39 0.00 0.00 64.86 63.19 2ql7 h ILE 548 Cb 0.07 1.34 -0.03 0.00 -3.07 0.00 0.00 36.82 35.13 2ql7 h ILE 548 CO -0.11 0.44 0.21 -0.07 -0.69 0.00 0.00 178.15 177.94 2ql7 h LEU 549 N 0.59 0.80 -1.11 1.44 3.38 -0.90 0.24 115.31 119.75 2ql7 h LEU 549 Ca 0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2ql7 h LEU 549 Cb 0.76 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2ql7 h LEU 549 CO 0.06 0.73 0.30 -0.33 0.09 0.00 0.00 178.44 179.29 2ql7 h GLU 550 N 0.85 0.93 0.09 1.13 5.08 -0.88 0.16 114.58 121.94 2ql7 h GLU 550 Ca 0.20 -0.13 -0.33 0.00 -1.00 0.00 0.00 59.36 58.10 2ql7 h GLU 550 Cb 0.20 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2ql7 h GLU 550 CO -0.01 0.73 -1.78 1.49 -1.00 0.00 0.00 179.01 178.43 2ql7 h GLU 551 N 0.92 0.20 0.00 2.33 4.57 -1.31 -3.43 114.58 117.86 2ql7 h GLU 551 Ca 0.22 -0.34 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2ql7 h GLU 551 Cb 0.12 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 2ql7 h GLU 551 CO -0.03 1.00 0.00 0.72 -1.18 0.00 0.00 179.01 179.53 2ql7 n HIS 552 N -3.36 0.00 0.24 0.92 8.25 0.80 -4.81 115.22 117.26 2ql7 n HIS 552 Ca -0.23 -0.05 0.16 0.00 -0.26 0.00 0.00 57.72 57.34 2ql7 n HIS 552 Cb 1.05 -0.00 0.73 0.00 1.12 0.00 0.00 29.99 32.88 2ql7 n HIS 552 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2ql7 h GLY 553 N 0.00 0.00 -1.66 -1.41 0.00 -0.73 -0.51 103.07 98.76 2ql7 h GLY 553 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ql7 h GLY 553 CO 0.00 0.00 -0.06 1.17 0.00 0.00 0.00 176.54 177.65 2ql7 n LYS 554 N -3.14 1.97 0.00 4.80 3.00 -1.26 -4.37 118.16 119.15 2ql7 n LYS 554 Ca 0.02 -1.69 0.00 0.00 -0.00 0.00 0.00 58.31 56.64 2ql7 n LYS 554 Cb 0.54 -1.42 0.00 0.00 0.00 0.00 0.00 35.03 34.15 2ql7 n LYS 554 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2ql7 n ASP 555 N 1.06 0.07 -4.45 3.14 5.68 -0.26 -4.69 116.55 117.11 2ql7 n ASP 555 Ca 0.12 -1.01 -0.25 0.00 -0.50 0.00 0.00 54.79 53.15 2ql7 n ASP 555 Cb 0.54 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.41 2ql7 n ASP 555 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2ql7 s LEU 556 N -0.01 2.52 0.49 -2.12 1.43 -0.84 -5.12 118.68 115.02 2ql7 s LEU 556 Ca 0.00 -0.95 -0.21 0.00 -1.03 0.00 0.00 54.13 51.94 2ql7 s LEU 556 Cb 0.00 -1.13 -0.08 0.00 0.03 0.00 0.00 46.19 45.01 2ql7 s LEU 556 CO 0.00 0.08 1.07 -0.70 0.23 0.00 0.00 176.35 177.03 2ql7 s GLU 557 N -3.11 3.73 0.32 1.70 -6.30 -1.26 -4.65 118.70 109.12 2ql7 s GLU 557 Ca 0.25 1.46 0.08 0.00 -2.50 0.00 0.00 54.97 54.27 2ql7 s GLU 557 Cb -0.06 -2.14 0.80 0.00 0.00 0.00 0.00 34.13 32.73 2ql7 s GLU 557 CO 0.12 -0.51 1.79 0.97 0.02 0.00 0.00 175.26 177.65 2ql7 h ILE 558 N 1.55 0.69 -0.11 -3.70 6.09 -1.61 0.30 117.51 120.72 2ql7 h ILE 558 Ca -0.49 -0.24 -0.14 0.00 -1.37 0.00 0.00 64.86 62.61 2ql7 h ILE 558 Cb 1.23 -0.07 -0.01 0.00 0.47 0.00 0.00 36.82 38.44 2ql7 h ILE 558 CO 0.59 0.13 -0.54 0.24 -3.07 0.00 0.00 178.15 175.50 2ql7 h MET 559 N 0.70 0.32 -0.58 2.19 2.86 -1.92 -1.34 114.93 117.17 2ql7 h MET 559 Ca 0.57 -0.20 -0.08 0.00 -2.06 0.00 0.00 59.70 57.93 2ql7 h MET 559 Cb 0.97 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 2ql7 h MET 559 CO -0.35 0.78 0.07 1.96 1.06 0.00 0.00 176.91 180.43 2ql7 h GLN 560 N 0.25 0.98 0.16 1.72 4.20 -1.36 -0.93 115.11 120.14 2ql7 h GLN 560 Ca 0.00 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 2ql7 h GLN 560 Cb 1.03 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.71 2ql7 h GLN 560 CO 0.09 0.95 -0.08 0.82 -0.67 0.00 0.00 178.83 179.94 2ql7 h ILE 561 N 0.88 0.90 0.00 2.54 2.04 -1.06 -1.90 117.51 120.91 2ql7 h ILE 561 Ca 0.17 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 2ql7 h ILE 561 Cb 0.46 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 2ql7 h ILE 561 CO 0.02 0.06 -0.26 -0.07 0.00 0.00 0.00 178.15 177.90 2ql7 h LEU 562 N -0.35 0.00 -0.22 1.44 3.38 -1.18 -0.40 115.31 117.98 2ql7 h LEU 562 Ca -0.02 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 2ql7 h LEU 562 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 2ql7 h LEU 562 CO 0.04 0.26 -0.71 0.74 0.09 0.00 0.00 178.44 178.86 2ql7 h THR 563 N 0.00 1.28 -0.18 0.22 2.02 -1.06 0.53 112.91 115.73 2ql7 h THR 563 Ca -0.00 -1.91 -0.09 0.00 0.77 0.00 0.00 66.41 65.17 2ql7 h THR 563 Cb 0.62 1.88 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 2ql7 h THR 563 CO 0.03 0.61 -0.30 0.03 0.37 0.00 0.00 175.52 176.26 2ql7 h ARG 564 N 0.56 0.35 -0.57 6.66 3.08 -0.85 -1.09 114.38 122.53 2ql7 h ARG 564 Ca -0.03 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 59.81 2ql7 h ARG 564 Cb 1.33 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 2ql7 h ARG 564 CO 0.15 0.62 0.07 0.28 -1.07 0.00 0.00 179.97 180.02 2ql7 h VAL 565 N 0.31 1.26 -0.20 2.04 2.07 -0.82 -0.49 116.25 120.42 2ql7 h VAL 565 Ca 0.04 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2ql7 h VAL 565 Cb 0.69 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2ql7 h VAL 565 CO 0.05 0.37 0.13 0.78 0.02 0.00 0.00 177.57 178.92 2ql7 h ASN 566 N 0.85 0.23 -0.90 0.57 2.35 -0.33 -1.66 115.58 116.68 2ql7 h ASN 566 Ca 0.17 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2ql7 h ASN 566 Cb 0.45 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 2ql7 h ASN 566 CO 0.02 0.18 0.51 -0.78 -1.65 0.00 0.00 177.43 175.71 2ql7 h ASP 567 N 0.26 1.11 -0.23 5.81 3.58 -0.98 -2.00 116.42 123.97 2ql7 h ASP 567 Ca 0.07 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.38 2ql7 h ASP 567 Cb -0.02 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.75 2ql7 h ASP 567 CO -0.02 0.87 -0.07 -0.09 -2.88 0.00 0.00 179.24 177.06 2ql7 h ARG 568 N 1.25 0.45 -0.50 0.28 2.43 -0.81 -1.00 114.38 116.49 2ql7 h ARG 568 Ca 0.32 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 2ql7 h ARG 568 Cb -0.00 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2ql7 h ARG 568 CO -0.05 0.70 0.22 0.28 -1.51 0.00 0.00 179.97 179.61 2ql7 h VAL 569 N 0.18 1.20 -0.45 0.20 2.07 -1.24 -1.27 116.25 116.95 2ql7 h VAL 569 Ca 0.06 -0.59 -0.08 0.00 0.82 0.00 0.00 66.70 66.90 2ql7 h VAL 569 Cb 0.54 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2ql7 h VAL 569 CO 0.03 0.23 -0.06 0.00 0.02 0.00 0.00 177.57 177.79 2ql7 h ALA 570 N 1.07 1.06 0.00 1.67 0.00 -1.32 -3.24 119.26 118.49 2ql7 h ALA 570 Ca 0.17 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2ql7 h ALA 570 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2ql7 h ALA 570 CO -0.02 0.58 -0.79 0.54 0.00 0.00 0.00 179.25 179.57 2ql7 n ARG 571 N -4.19 0.49 -0.01 0.00 1.74 -0.39 -4.48 116.66 109.82 2ql7 n ARG 571 Ca 0.02 0.53 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 2ql7 n ARG 571 Cb 0.33 -1.70 0.01 0.00 -1.02 0.00 0.00 32.46 30.08 2ql7 n ARG 571 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2ql7 n HIS 572 N -4.55 0.03 -4.12 -1.55 8.25 -0.49 -4.80 115.22 107.98 2ql7 n HIS 572 Ca -0.16 -0.01 -0.20 0.00 -0.26 0.00 0.00 57.72 57.09 2ql7 n HIS 572 Cb 0.41 -0.06 -0.16 0.00 1.12 0.00 0.00 29.99 31.30 2ql7 n HIS 572 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2ql7 s PHE 573 N -1.47 0.73 -0.15 4.41 0.40 -1.22 -5.03 117.98 115.65 2ql7 s PHE 573 Ca 0.01 -0.20 -0.07 0.00 -0.60 0.00 0.00 56.93 56.06 2ql7 s PHE 573 Cb 0.01 -0.67 0.06 0.00 0.51 0.00 0.00 43.02 42.93 2ql7 s PHE 573 CO 0.00 -0.20 0.35 -2.00 0.70 0.00 0.00 175.22 174.07 2ql7 s GLU 574 N 1.01 0.30 0.99 0.44 2.12 -1.26 -4.67 118.70 117.64 2ql7 s GLU 574 Ca -0.10 0.76 -0.13 0.00 0.36 0.00 0.00 54.97 55.87 2ql7 s GLU 574 Cb -0.14 0.01 0.18 0.00 0.26 0.00 0.00 34.13 34.45 2ql7 s GLU 574 CO -0.00 -0.19 1.12 -1.54 -0.54 0.00 0.00 175.26 174.10 2ql7 s SER 575 N 1.73 2.75 -0.25 -1.70 1.04 -0.57 -4.84 113.70 111.86 2ql7 s SER 575 Ca -0.07 1.00 -0.12 0.00 0.48 0.00 0.00 55.95 57.24 2ql7 s SER 575 Cb -0.10 -1.56 0.09 0.00 0.10 0.00 0.00 66.02 64.55 2ql7 s SER 575 CO -0.11 -3.03 0.58 -1.10 0.98 0.00 0.00 173.24 170.56 2ql7 s GLN 576 N -5.17 0.55 -0.02 4.02 -0.21 -1.26 -1.24 119.66 116.33 2ql7 s GLN 576 Ca 0.66 1.17 -0.21 0.00 0.02 0.00 0.00 55.36 56.99 2ql7 s GLN 576 Cb -0.16 0.33 0.04 0.00 1.00 0.00 0.00 33.01 34.23 2ql7 s GLN 576 CO 0.56 -0.18 0.47 0.45 -2.12 0.00 0.00 175.29 174.46 2ql7 s SER 577 N 2.08 -0.38 0.23 5.90 0.15 -1.24 -4.92 113.70 115.52 2ql7 s SER 577 Ca -0.07 0.31 -0.07 0.00 0.70 0.00 0.00 55.95 56.82 2ql7 s SER 577 Cb -0.09 0.41 0.29 0.00 -1.71 0.00 0.00 66.02 64.93 2ql7 s SER 577 CO -0.17 -0.54 1.84 0.44 1.20 0.00 0.00 173.24 176.01 2ql7 h ASP 578 N 3.40 0.77 -3.02 5.45 3.32 -2.02 -3.38 116.42 120.94 2ql7 h ASP 578 Ca -0.29 0.02 -0.57 0.00 0.02 0.00 0.00 57.03 56.21 2ql7 h ASP 578 Cb 1.17 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.53 2ql7 h ASP 578 CO 0.40 0.50 1.11 -0.62 -1.72 0.00 0.00 179.24 178.92 2ql7 s ASP 579 N -5.74 6.29 0.60 6.45 2.15 -1.26 -4.88 116.67 120.28 2ql7 s ASP 579 Ca -0.13 1.14 0.29 0.00 0.43 0.00 0.00 52.55 54.29 2ql7 s ASP 579 Cb 0.17 -2.54 1.58 0.00 -0.30 0.00 0.00 42.92 41.84 2ql7 s ASP 579 CO 0.78 -1.41 1.98 1.55 -0.17 0.00 0.00 175.17 177.90 2ql7 h PRO 580 N 10.99 0.00 0.00 4.34 0.13 -1.96 0.15 132.00 145.65 2ql7 h PRO 580 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2ql7 h PRO 580 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ql7 h PRO 580 CO 1.05 0.00 0.00 1.58 -0.23 0.00 0.00 178.00 180.40 2ql7 n HIS 581 N -3.61 0.14 -1.23 1.56 -0.00 -1.26 -2.19 115.22 108.64 2ql7 n HIS 581 Ca 0.04 0.05 0.07 0.00 0.46 0.00 0.00 57.72 58.35 2ql7 n HIS 581 Cb 0.50 -0.59 0.10 0.00 -0.12 0.00 0.00 29.99 29.88 2ql7 n HIS 581 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 2ql7 n PHE 582 N -1.63 0.00 -4.13 1.57 0.99 0.52 -5.04 117.46 109.75 2ql7 n PHE 582 Ca 0.04 -0.76 -0.35 0.00 -0.00 0.00 0.00 57.45 56.37 2ql7 n PHE 582 Cb 0.20 -0.12 -0.09 0.00 -1.00 0.00 0.00 39.48 38.46 2ql7 n PHE 582 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.76 175.18 2ql7 s HIS 583 N -2.18 3.30 -1.32 1.38 2.46 -0.93 -3.70 115.29 114.30 2ql7 s HIS 583 Ca 0.24 0.23 -0.05 0.00 0.47 0.00 0.00 55.06 55.94 2ql7 s HIS 583 Cb 0.21 -1.93 0.02 0.00 -0.13 0.00 0.00 32.58 30.75 2ql7 s HIS 583 CO 0.02 0.42 1.03 0.39 -2.47 0.00 0.00 174.74 174.14 2ql7 n GLU 584 N 2.59 -6.80 -3.89 2.88 1.02 -0.38 -4.93 120.64 111.14 2ql7 n GLU 584 Ca -0.18 0.78 -0.31 0.00 -0.02 0.00 0.00 57.16 57.43 2ql7 n GLU 584 Cb 0.53 -5.74 -0.04 0.00 -0.02 0.00 0.00 31.44 26.18 2ql7 n GLU 584 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2ql7 s LYS 585 N -5.99 3.46 0.47 3.49 -0.14 -1.26 -4.77 119.74 115.01 2ql7 s LYS 585 Ca 0.32 -0.40 0.06 0.00 -1.36 0.00 0.00 55.97 54.59 2ql7 s LYS 585 Cb -0.15 -3.01 -0.01 0.00 -1.68 0.00 0.00 37.83 32.99 2ql7 s LYS 585 CO 0.75 0.58 0.31 0.15 -0.76 0.00 0.00 175.35 176.38 2ql7 s LYS 586 N -2.58 2.30 -0.18 1.68 -0.14 -1.26 -1.51 119.74 118.05 2ql7 s LYS 586 Ca 0.36 -1.88 -0.20 0.00 -1.36 0.00 0.00 55.97 52.89 2ql7 s LYS 586 Cb -0.13 -2.09 0.05 0.00 -1.68 0.00 0.00 37.83 33.98 2ql7 s LYS 586 CO 0.28 -0.35 0.55 -1.14 -0.76 0.00 0.00 175.35 173.92 2ql7 s GLN 587 N -4.11 0.69 -0.06 1.68 0.74 -1.26 -5.02 119.66 112.32 2ql7 s GLN 587 Ca 0.38 0.65 -0.00 0.00 0.05 0.00 0.00 55.36 56.43 2ql7 s GLN 587 Cb -0.00 0.33 0.02 0.00 1.10 0.00 0.00 33.01 34.46 2ql7 s GLN 587 CO 0.22 -0.11 -0.02 -1.50 -0.55 0.00 0.00 175.29 173.33 2ql7 s ILE 588 N 0.03 0.44 1.13 -2.34 1.10 -1.26 -3.33 121.20 116.96 2ql7 s ILE 588 Ca -0.02 -0.00 -0.17 0.00 -0.51 0.00 0.00 60.65 59.94 2ql7 s ILE 588 Cb -0.04 -0.53 0.25 0.00 0.15 0.00 0.00 42.46 42.30 2ql7 s ILE 588 CO 0.02 0.23 1.14 -2.84 -2.11 0.00 0.00 174.94 171.38 2ql7 s PRO 589 N 1.38 -0.62 -0.08 3.50 0.02 -1.24 -3.15 135.00 134.80 2ql7 s PRO 589 Ca -0.04 -0.02 -0.02 0.00 0.02 0.00 0.00 61.00 60.94 2ql7 s PRO 589 Cb -0.13 -1.66 0.04 0.00 0.02 0.00 0.00 34.50 32.76 2ql7 s PRO 589 CO -0.02 -3.32 0.04 0.00 -0.33 0.00 0.00 177.00 173.37 2ql7 s VAL 591 N 2.06 4.35 -0.25 0.00 1.01 -1.26 0.16 120.40 126.48 2ql7 s VAL 591 Ca 0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.82 2ql7 s VAL 591 Cb -0.13 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.27 2ql7 s VAL 591 CO -0.05 0.39 -0.04 -0.69 0.00 0.00 0.00 175.10 174.71 2ql7 s VAL 592 N 1.13 3.08 -0.09 2.92 1.01 0.22 -4.99 120.40 123.68 2ql7 s VAL 592 Ca 0.04 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2ql7 s VAL 592 Cb -0.14 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2ql7 s VAL 592 CO 0.03 0.22 -0.19 -0.55 0.00 0.00 0.00 175.10 174.61 2ql7 s SER 593 N 1.37 3.57 -0.09 3.32 0.15 -1.26 -0.65 113.70 120.12 2ql7 s SER 593 Ca 0.01 -0.39 0.12 0.00 0.70 0.00 0.00 55.95 56.40 2ql7 s SER 593 Cb -0.16 -1.17 0.19 0.00 -1.71 0.00 0.00 66.02 63.17 2ql7 s SER 593 CO -0.04 0.23 1.08 0.23 1.20 0.00 0.00 173.24 175.95 2ql7 n MET 594 N 3.08 1.10 -2.37 5.44 2.81 0.18 -5.02 117.12 122.35 2ql7 n MET 594 Ca -0.18 -2.06 -0.38 0.00 -1.81 0.00 0.00 57.70 53.26 2ql7 n MET 594 Cb 0.52 -1.20 -0.03 0.00 -0.71 0.00 0.00 33.22 31.81 2ql7 n MET 594 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2ql7 s LEU 595 N -1.97 4.25 0.00 4.03 1.43 -1.21 -0.77 118.68 124.44 2ql7 s LEU 595 Ca 0.21 2.29 0.15 0.00 -1.03 0.00 0.00 54.13 55.75 2ql7 s LEU 595 Cb 0.18 -3.97 0.15 0.00 0.03 0.00 0.00 46.19 42.58 2ql7 s LEU 595 CO 0.02 -0.54 1.01 0.35 0.23 0.00 0.00 176.35 177.42 2ql7 n THR 596 N 0.27 0.09 -4.13 5.49 -2.24 -1.26 -4.90 114.28 107.60 2ql7 n THR 596 Ca 0.03 -0.55 -0.12 0.00 -2.27 0.00 0.00 64.05 61.15 2ql7 n THR 596 Cb 0.47 1.24 -0.08 0.00 -2.10 0.00 0.00 70.33 69.85 2ql7 n THR 596 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ql7 s LYS 597 N -1.23 1.38 0.27 -0.78 -0.14 -1.26 -5.15 119.74 112.84 2ql7 s LYS 597 Ca 0.19 -1.54 -0.22 0.00 -1.36 0.00 0.00 55.97 53.04 2ql7 s LYS 597 Cb 0.13 0.35 -0.09 0.00 -1.68 0.00 0.00 37.83 36.54 2ql7 s LYS 597 CO 0.19 -0.51 0.81 -1.21 -0.76 0.00 0.00 175.35 173.87 2ql7 s GLU 598 N -4.01 4.35 -0.16 1.68 2.02 -1.26 -5.06 118.70 116.27 2ql7 s GLU 598 Ca 0.33 1.02 0.01 0.00 0.02 0.00 0.00 54.97 56.36 2ql7 s GLU 598 Cb 0.04 -2.81 0.01 0.00 0.10 0.00 0.00 34.13 31.46 2ql7 s GLU 598 CO 0.12 0.33 -0.18 -1.17 0.02 0.00 0.00 175.26 174.39 2ql7 s LEU 599 N -2.07 2.28 -0.03 1.80 2.96 -1.26 -5.05 118.68 117.31 2ql7 s LEU 599 Ca 0.46 -0.56 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 2ql7 s LEU 599 Cb -0.17 -1.51 -0.01 0.00 0.50 0.00 0.00 46.19 45.00 2ql7 s LEU 599 CO 0.22 0.05 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.81 2ql7 s TYR 600 N 1.00 1.71 -0.71 5.38 2.02 -1.26 -1.32 117.35 124.16 2ql7 s TYR 600 Ca -0.02 -0.42 0.05 0.00 -0.37 0.00 0.00 57.07 56.31 2ql7 s TYR 600 Cb -0.15 -1.13 0.29 0.00 -0.40 0.00 0.00 41.96 40.58 2ql7 s TYR 600 CO -0.05 -0.10 0.96 1.19 -1.57 0.00 0.00 175.55 175.98 2ql7 n PHE 601 N 2.90 0.76 -4.34 2.71 3.72 -1.26 -4.93 117.46 117.01 2ql7 n PHE 601 Ca -0.17 -0.28 -0.19 0.00 -0.05 0.00 0.00 57.45 56.76 2ql7 n PHE 601 Cb 0.53 -0.26 -0.06 0.00 -0.94 0.00 0.00 39.48 38.76 2ql7 n PHE 601 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2ql7 n SER 602 N 0.21 0.53 0.00 4.37 3.41 -1.26 -4.96 113.62 115.91 2ql7 n SER 602 Ca 0.10 -2.78 0.00 0.00 -0.26 0.00 0.00 58.87 55.93 2ql7 n SER 602 Cb 0.60 1.04 0.00 0.00 -0.26 0.00 0.00 64.21 65.59 2ql7 n SER 602 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88