#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9y s PHE 524 N 0.00 1.28 -0.08 -0.32 0.08 -1.26 -5.14 117.98 112.54 2k9y s PHE 524 Ca 0.00 -0.38 -0.06 0.00 0.12 0.00 0.00 56.93 56.61 2k9y s PHE 524 Cb 0.00 -0.91 0.03 0.00 -0.57 0.00 0.00 43.02 41.57 2k9y s PHE 524 CO 0.00 -0.16 0.21 -0.65 -0.10 0.00 0.00 175.22 174.52 2k9y s GLN 525 N 0.29 0.22 -0.43 0.44 1.11 -1.26 -5.10 119.66 114.93 2k9y s GLN 525 Ca -0.06 0.36 0.06 0.00 0.01 0.00 0.00 55.36 55.73 2k9y s GLN 525 Cb -0.11 0.03 0.21 0.00 -1.01 0.00 0.00 33.01 32.12 2k9y s GLN 525 CO 0.02 -0.08 0.56 0.25 0.01 0.00 0.00 175.29 176.05 2k9y n THR 526 N 3.43 -0.63 -4.38 -0.19 -2.24 -1.26 -5.12 114.28 103.88 2k9y n THR 526 Ca -0.17 -2.90 -0.22 0.00 -2.27 0.00 0.00 64.05 58.49 2k9y n THR 526 Cb 0.56 -0.78 -0.13 0.00 -2.10 0.00 0.00 70.33 67.89 2k9y n THR 526 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2k9y s LEU 527 N -0.37 2.23 0.18 3.22 2.34 -1.26 -5.15 118.68 119.86 2k9y s LEU 527 Ca 0.33 -0.57 0.10 0.00 0.06 0.00 0.00 54.13 54.05 2k9y s LEU 527 Cb 0.11 -0.77 -0.04 0.00 -0.56 0.00 0.00 46.19 44.93 2k9y s LEU 527 CO -0.15 0.06 -0.20 -0.44 -1.06 0.00 0.00 176.35 174.55 2k9y s SER 528 N -1.48 2.96 0.21 1.48 0.01 -1.26 -5.12 113.70 110.50 2k9y s SER 528 Ca 0.04 -0.87 -0.30 0.00 1.31 0.00 0.00 55.95 56.13 2k9y s SER 528 Cb -0.09 -0.19 -0.09 0.00 0.21 0.00 0.00 66.02 65.86 2k9y s SER 528 CO 0.02 0.02 1.29 -2.16 0.41 0.00 0.00 173.24 172.82 2k9y s PRO 529 N -2.79 4.40 0.00 12.44 0.04 -1.26 -5.02 135.00 142.82 2k9y s PRO 529 Ca 0.18 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.26 2k9y s PRO 529 Cb -0.06 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2k9y s PRO 529 CO 0.08 -0.22 0.00 0.39 0.04 0.00 0.00 177.00 177.29 2k9y n GLU 530 N 2.43 0.00 0.00 4.56 1.02 -1.26 -5.16 120.64 122.22 2k9y n GLU 530 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2k9y n GLU 530 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.85 2k9y n GLU 530 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k9y n GLY 531 N 0.00 3.30 1.45 0.62 0.00 -1.26 -4.99 105.19 104.32 2k9y n GLY 531 Ca 0.00 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2k9y n GLY 531 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k9y n SER 532 N 0.00 0.08 0.00 1.61 3.41 -1.26 -4.98 113.62 112.48 2k9y n SER 532 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2k9y n SER 532 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2k9y n SER 532 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2k9y n GLY 533 N 1.63 3.35 0.10 5.00 0.00 -1.26 -4.99 105.19 109.02 2k9y n GLY 533 Ca 0.00 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.71 2k9y n GLY 533 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2k9y h ASN 534 N 0.00 0.00 1.09 1.61 4.21 -2.03 -3.31 115.58 117.14 2k9y h ASN 534 Ca 0.00 -0.08 -0.00 0.00 1.21 0.00 0.00 56.30 57.43 2k9y h ASN 534 Cb 0.00 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.20 2k9y h ASN 534 CO 0.00 0.04 -0.00 -0.07 -1.29 0.00 0.00 177.43 176.10 2k9y h LEU 535 N 0.00 0.00 -1.05 1.61 -0.00 -2.01 -2.90 115.31 110.96 2k9y h LEU 535 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.80 2k9y h LEU 535 Cb 0.92 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.56 2k9y h LEU 535 CO 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 178.44 178.30 2k9y h ALA 536 N 2.00 1.21 -0.15 1.53 0.00 -1.94 -2.43 119.26 119.47 2k9y h ALA 536 Ca -0.00 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2k9y h ALA 536 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2k9y h ALA 536 CO 0.00 0.51 0.28 0.28 0.00 0.00 0.00 179.25 180.32 2k9y h VAL 537 N 0.47 0.23 0.98 0.00 2.07 -1.74 -2.39 116.25 115.86 2k9y h VAL 537 Ca 0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.56 2k9y h VAL 537 Cb 0.53 0.76 0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2k9y h VAL 537 CO 0.03 0.00 -0.47 0.40 0.02 0.00 0.00 177.57 177.55 2k9y h ILE 538 N 0.00 0.00 -0.75 4.57 2.04 -1.62 -2.38 117.51 119.37 2k9y h ILE 538 Ca 0.07 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.92 2k9y h ILE 538 Cb 0.62 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 2k9y h ILE 538 CO -0.00 0.00 0.49 1.23 0.00 0.00 0.00 178.15 179.86 2k9y h GLY 539 N -1.34 1.07 0.19 5.37 0.00 -1.61 0.21 103.07 106.95 2k9y h GLY 539 Ca -0.13 -0.38 0.08 0.00 0.00 0.00 0.00 47.33 46.90 2k9y h GLY 539 CO 0.22 0.35 -0.12 -1.33 0.00 0.00 0.00 176.54 175.66 2k9y h GLY 540 N 0.97 0.23 0.17 4.60 0.00 -1.47 0.33 103.07 107.90 2k9y h GLY 540 Ca 0.29 0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.77 2k9y h GLY 540 CO -0.08 -0.16 -0.03 -2.08 0.00 0.00 0.00 176.54 174.18 2k9y h VAL 541 N -0.03 0.99 -0.01 4.60 2.07 -1.20 -2.45 116.25 120.22 2k9y h VAL 541 Ca 0.19 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.22 2k9y h VAL 541 Cb 0.32 1.79 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 2k9y h VAL 541 CO -0.41 0.30 -0.47 0.00 0.02 0.00 0.00 177.57 177.01 2k9y h ALA 542 N -0.33 -0.89 -0.26 1.67 0.00 -0.52 -0.02 119.26 118.91 2k9y h ALA 542 Ca -0.01 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.87 2k9y h ALA 542 Cb 0.57 0.90 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 2k9y h ALA 542 CO 0.02 -1.04 -0.01 0.28 0.00 0.00 0.00 179.25 178.50 2k9y h VAL 543 N -0.59 0.80 -0.92 0.00 2.07 -0.51 -1.60 116.25 115.51 2k9y h VAL 543 Ca 0.01 -0.02 0.20 0.00 0.82 0.00 0.00 66.70 67.70 2k9y h VAL 543 Cb 0.63 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 2k9y h VAL 543 CO -0.32 0.01 0.60 1.23 0.02 0.00 0.00 177.57 179.11 2k9y h GLY 544 N 0.07 1.01 1.11 2.17 0.00 -0.97 -0.16 103.07 106.30 2k9y h GLY 544 Ca 0.13 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 2k9y h GLY 544 CO -0.22 -0.00 -0.29 -2.08 0.00 0.00 0.00 176.54 173.94 2k9y h VAL 545 N 0.47 1.27 -0.14 4.60 2.07 -0.03 -2.73 116.25 121.76 2k9y h VAL 545 Ca 0.48 -1.46 0.03 0.00 0.82 0.00 0.00 66.70 66.57 2k9y h VAL 545 Cb 1.10 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 2k9y h VAL 545 CO -0.20 0.50 -0.04 0.58 0.02 0.00 0.00 177.57 178.43 2k9y h VAL 546 N 0.79 0.86 -0.29 2.57 2.07 -0.61 -1.00 116.25 120.65 2k9y h VAL 546 Ca 0.09 -0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.62 2k9y h VAL 546 Cb 0.88 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 2k9y h VAL 546 CO 0.08 0.00 0.15 -0.07 0.02 0.00 0.00 177.57 177.75 2k9y h LEU 547 N 0.00 0.24 -1.19 2.57 3.38 -1.47 -2.15 115.31 116.69 2k9y h LEU 547 Ca 0.07 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.12 2k9y h LEU 547 Cb 0.10 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.75 2k9y h LEU 547 CO -0.15 0.18 0.57 0.25 0.09 0.00 0.00 178.44 179.38 2k9y h LEU 548 N 0.32 0.85 -0.89 1.67 7.12 -1.16 -1.34 115.31 121.87 2k9y h LEU 548 Ca 0.12 0.01 -0.04 0.00 0.13 0.00 0.00 57.88 58.10 2k9y h LEU 548 Cb 0.02 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 39.95 2k9y h LEU 548 CO -0.07 0.53 0.31 0.25 -0.13 0.00 0.00 178.44 179.33 2k9y h LEU 549 N 0.95 1.03 0.67 2.25 6.46 -0.56 -2.59 115.31 123.52 2k9y h LEU 549 Ca 0.39 -0.15 -0.03 0.00 -0.12 0.00 0.00 57.88 57.97 2k9y h LEU 549 Cb 0.27 -0.27 0.01 0.00 -0.73 0.00 0.00 40.66 39.94 2k9y h LEU 549 CO -0.15 0.90 -0.32 0.58 -0.62 0.00 0.00 178.44 178.83 2k9y h VAL 550 N 1.10 0.35 -0.98 1.05 2.07 -0.77 -1.62 116.25 117.43 2k9y h VAL 550 Ca 0.26 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.96 2k9y h VAL 550 Cb 0.19 0.35 -0.11 0.00 -1.52 0.00 0.00 31.29 30.20 2k9y h VAL 550 CO -0.02 0.00 0.58 -0.07 0.02 0.00 0.00 177.57 178.08 2k9y h LEU 551 N -0.90 0.75 0.00 2.57 -0.00 -1.41 0.26 115.31 116.58 2k9y h LEU 551 Ca -0.09 0.10 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 2k9y h LEU 551 Cb 0.69 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.31 2k9y h LEU 551 CO 0.15 0.27 0.00 0.00 -0.00 0.00 0.00 178.44 178.86 2k9y n ALA 552 N -2.35 -0.34 0.08 1.53 0.00 -0.98 0.03 120.51 118.48 2k9y n ALA 552 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.52 2k9y n ALA 552 Cb 0.55 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.93 2k9y n ALA 552 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2k9y h GLY 553 N 0.00 -0.84 2.00 0.00 0.00 -1.16 0.10 103.07 103.17 2k9y h GLY 553 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.85 2k9y h GLY 553 CO 0.00 -0.25 0.00 -0.62 0.00 0.00 0.00 176.54 175.67 2k9y n VAL 554 N -5.46 1.00 -0.03 4.60 0.31 0.89 0.34 118.33 119.98 2k9y n VAL 554 Ca -0.06 0.56 -0.14 0.00 -0.01 0.00 0.00 64.34 64.68 2k9y n VAL 554 Cb 0.38 -1.53 -0.10 0.00 -0.91 0.00 0.00 33.84 31.68 2k9y n VAL 554 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2k9y h GLY 555 N 0.78 0.27 0.31 2.92 0.00 0.22 -3.10 103.07 104.47 2k9y h GLY 555 Ca 0.00 -0.37 -0.22 0.00 0.00 0.00 0.00 47.33 46.74 2k9y h GLY 555 CO 0.00 0.33 -2.00 0.33 0.00 0.00 0.00 176.54 175.20 2k9y n PHE 556 N -4.53 0.31 0.75 5.60 7.35 -0.98 -4.08 117.46 121.88 2k9y n PHE 556 Ca -0.08 0.10 0.09 0.00 -0.76 0.00 0.00 57.45 56.80 2k9y n PHE 556 Cb 0.44 -0.91 0.43 0.00 0.35 0.00 0.00 39.48 39.80 2k9y n PHE 556 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2k9y n PHE 557 N -2.68 0.00 0.06 -5.13 7.35 0.15 -1.38 117.46 115.83 2k9y n PHE 557 Ca -0.19 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.52 2k9y n PHE 557 Cb 0.92 -0.41 -0.05 0.00 0.35 0.00 0.00 39.48 40.29 2k9y n PHE 557 CO 0.00 0.00 0.00 0.97 -0.76 0.00 0.00 176.76 176.97 2k9y h ILE 558 N 0.00 0.51 -0.39 -2.13 2.10 -1.68 -3.38 117.51 112.54 2k9y h ILE 558 Ca 0.00 -1.93 -0.28 0.00 1.08 0.00 0.00 64.86 63.73 2k9y h ILE 558 Cb 0.26 2.05 -0.37 0.00 -1.09 0.00 0.00 36.82 37.67 2k9y h ILE 558 CO 0.00 0.29 -0.98 0.00 -1.08 0.00 0.00 178.15 176.38 2k9y n HIS 559 N -2.93 1.26 0.18 2.19 1.44 -1.02 -4.75 115.22 111.60 2k9y n HIS 559 Ca -0.07 -1.80 0.11 0.00 -2.01 0.00 0.00 57.72 53.96 2k9y n HIS 559 Cb 0.79 -0.24 0.11 0.00 0.12 0.00 0.00 29.99 30.77 2k9y n HIS 559 CO 0.00 0.00 0.00 0.07 -2.81 0.00 0.00 176.34 173.60 2k9y h ARG 560 N 2.08 0.00 0.00 -1.40 -0.00 -1.40 -3.36 114.38 110.29 2k9y h ARG 560 Ca -0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.90 2k9y h ARG 560 Cb 1.43 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.39 2k9y h ARG 560 CO 0.28 0.03 -1.21 2.89 -0.00 0.00 0.00 179.97 181.96 2k9y n ARG 561 N -2.99 3.34 -2.36 0.08 -4.01 -1.26 -5.10 116.66 104.36 2k9y n ARG 561 Ca 0.03 -0.00 -0.04 0.00 -1.04 0.00 0.00 57.85 56.79 2k9y n ARG 561 Cb 0.55 -1.08 -0.03 0.00 -3.04 0.00 0.00 32.46 28.86 2k9y n ARG 561 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 2k9y n ARG 562 N -2.10 -4.06 -0.40 2.89 1.74 -1.26 -5.25 116.66 108.23 2k9y n ARG 562 Ca -0.05 3.10 0.00 0.00 -0.77 0.00 0.00 57.85 60.13 2k9y n ARG 562 Cb 0.58 -4.39 0.00 0.00 -1.02 0.00 0.00 32.46 27.63 2k9y n ARG 562 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74