#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aik h GLY 547 N 0.00 0.43 0.66 5.00 0.00 -2.04 0.21 103.07 107.33 1aik h GLY 547 Ca 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1aik h GLY 547 CO 0.00 0.25 -0.02 -2.22 0.00 0.00 0.00 176.54 174.54 1aik h ILE 548 N 0.38 1.32 -0.87 2.60 2.04 -2.05 0.25 117.51 121.18 1aik h ILE 548 Ca 0.08 -1.00 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 1aik h ILE 548 Cb 0.37 1.87 -0.04 0.00 -0.74 0.00 0.00 36.82 38.28 1aik h ILE 548 CO 0.02 0.28 0.45 0.58 0.00 0.00 0.00 178.15 179.47 1aik h VAL 549 N -0.25 1.26 0.05 1.67 2.07 -1.89 -0.06 116.25 119.09 1aik h VAL 549 Ca 0.01 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1aik h VAL 549 Cb 0.45 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1aik h VAL 549 CO 0.01 0.30 -0.02 -0.61 0.02 0.00 0.00 177.57 177.27 1aik h GLN 550 N 1.23 -0.06 -0.96 1.57 -0.00 -0.54 -2.41 115.11 113.95 1aik h GLN 550 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.96 1aik h GLN 550 Cb 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 27.48 27.52 1aik h GLN 550 CO -0.04 0.02 0.61 0.37 0.00 0.00 0.00 178.83 179.79 1aik h GLN 551 N -0.13 1.28 -0.78 1.69 5.75 -0.28 -1.60 115.11 121.03 1aik h GLN 551 Ca -0.01 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1aik h GLN 551 Cb 0.11 -0.28 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 1aik h GLN 551 CO 0.01 0.87 0.52 1.96 -2.65 0.00 0.00 178.83 179.53 1aik h GLN 552 N 1.31 1.02 -0.49 1.69 4.20 -0.91 0.18 115.11 122.10 1aik h GLN 552 Ca 0.35 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.89 1aik h GLN 552 Cb -0.11 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.42 1aik h GLN 552 CO -0.07 0.68 -0.09 -0.97 -0.67 0.00 0.00 178.83 177.70 1aik h ASN 553 N 1.05 0.94 -0.34 1.46 -0.73 -0.89 -0.07 115.58 117.00 1aik h ASN 553 Ca 0.29 -0.35 -0.10 0.00 1.87 0.00 0.00 56.30 58.01 1aik h ASN 553 Cb -0.11 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.21 1aik h ASN 553 CO -0.06 1.07 -0.13 0.78 -0.37 0.00 0.00 177.43 178.71 1aik h ASN 554 N 0.79 0.78 -0.03 1.15 2.35 -0.29 -1.08 115.58 119.25 1aik h ASN 554 Ca 0.13 -0.24 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1aik h ASN 554 Cb 0.64 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.80 1aik h ASN 554 CO 0.04 0.93 -0.02 -0.07 -1.65 0.00 0.00 177.43 176.66 1aik h LEU 555 N 0.71 0.07 -0.73 1.61 3.38 -0.52 -1.90 115.31 117.93 1aik h LEU 555 Ca 0.12 -0.43 0.07 0.00 0.09 0.00 0.00 57.88 57.73 1aik h LEU 555 Cb 0.62 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 1aik h LEU 555 CO 0.04 0.49 0.41 0.25 0.09 0.00 0.00 178.44 179.72 1aik h LEU 556 N -0.34 0.60 -1.01 1.67 5.85 -0.90 0.50 115.31 121.69 1aik h LEU 556 Ca 0.01 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 1aik h LEU 556 Cb 0.46 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1aik h LEU 556 CO 0.01 0.37 -0.18 0.03 -0.34 0.00 0.00 178.44 178.33 1aik h ARG 557 N 0.73 0.51 -0.63 1.25 3.08 -1.13 -1.21 114.38 116.97 1aik h ARG 557 Ca 0.34 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 60.14 1aik h ARG 557 Cb 0.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1aik h ARG 557 CO -0.21 0.67 0.07 0.00 -1.07 0.00 0.00 179.97 179.43 1aik h ALA 558 N 1.35 0.84 -0.54 0.04 0.00 -0.14 -0.14 119.26 120.68 1aik h ALA 558 Ca 0.08 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1aik h ALA 558 Cb 0.58 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1aik h ALA 558 CO 0.04 0.63 -0.02 0.82 0.00 0.00 0.00 179.25 180.72 1aik h ILE 559 N 0.97 1.27 -0.43 0.00 2.04 -0.73 -0.36 117.51 120.27 1aik h ILE 559 Ca 0.19 -1.13 -0.12 0.00 1.00 0.00 0.00 64.86 64.80 1aik h ILE 559 Cb 0.48 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1aik h ILE 559 CO 0.02 0.40 -0.21 -0.33 0.00 0.00 0.00 178.15 178.03 1aik h GLU 560 N 0.83 0.86 -0.69 2.37 5.08 -0.83 0.13 114.58 122.34 1aik h GLU 560 Ca 0.15 -0.35 -0.08 0.00 -1.00 0.00 0.00 59.36 58.09 1aik h GLU 560 Cb 0.55 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 1aik h GLU 560 CO 0.03 0.99 0.13 0.00 -1.00 0.00 0.00 179.01 179.16 1aik h ALA 561 N 1.01 0.93 -0.01 3.43 0.00 -0.77 -2.10 119.26 121.75 1aik h ALA 561 Ca 0.10 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1aik h ALA 561 Cb 0.74 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1aik h ALA 561 CO 0.06 0.67 -0.51 1.96 0.00 0.00 0.00 179.25 181.43 1aik h GLN 562 N 1.05 0.04 -0.61 0.00 4.20 -0.52 -1.90 115.11 117.38 1aik h GLN 562 Ca 0.21 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.87 1aik h GLN 562 Cb 0.42 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1aik h GLN 562 CO 0.01 0.54 0.25 0.37 -0.67 0.00 0.00 178.83 179.32 1aik h GLN 563 N 0.03 0.90 -0.68 1.46 5.75 -0.18 0.23 115.11 122.63 1aik h GLN 563 Ca -0.00 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.34 1aik h GLN 563 Cb 0.91 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.28 1aik h GLN 563 CO 0.07 0.77 0.45 0.45 -2.65 0.00 0.00 178.83 177.91 1aik h HIS 564 N 0.84 0.85 -0.69 3.99 3.86 -0.72 -1.22 115.15 122.07 1aik h HIS 564 Ca 0.20 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.47 1aik h HIS 564 Cb 0.20 -0.29 -0.05 0.00 1.06 0.00 0.00 27.41 28.33 1aik h HIS 564 CO 0.01 0.53 0.42 -0.07 0.86 0.00 0.00 177.93 179.68 1aik h LEU 565 N 0.92 0.68 -0.74 2.43 3.38 -1.04 -1.29 115.31 119.65 1aik h LEU 565 Ca 0.25 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.26 1aik h LEU 565 Cb -0.10 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1aik h LEU 565 CO -0.06 0.46 0.46 -0.07 0.09 0.00 0.00 178.44 179.33 1aik h LEU 566 N 0.81 0.76 -1.20 1.67 3.38 0.17 -0.90 115.31 120.00 1aik h LEU 566 Ca 0.28 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1aik h LEU 566 Cb 0.06 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1aik h LEU 566 CO -0.12 0.53 -0.06 1.56 0.09 0.00 0.00 178.44 180.43 1aik h GLN 567 N 0.90 0.48 -0.09 1.13 1.08 -0.78 -1.89 115.11 115.93 1aik h GLN 567 Ca 0.30 -0.12 -0.19 0.00 -1.45 0.00 0.00 58.65 57.19 1aik h GLN 567 Cb 0.02 -0.06 0.01 0.00 -0.05 0.00 0.00 27.48 27.40 1aik h GLN 567 CO -0.11 0.55 -0.69 -0.07 -0.95 0.00 0.00 178.83 177.56 1aik h LEU 568 N 0.45 0.78 -1.10 1.46 3.38 -0.39 -0.20 115.31 119.68 1aik h LEU 568 Ca 0.09 -0.66 -0.05 0.00 0.09 0.00 0.00 57.88 57.35 1aik h LEU 568 Cb 0.40 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1aik h LEU 568 CO 0.02 1.32 0.13 0.71 0.09 0.00 0.00 178.44 180.71 1aik h THR 569 N 0.29 1.21 -0.46 0.22 1.35 -1.03 -0.62 112.91 113.88 1aik h THR 569 Ca -0.06 -0.76 -0.08 0.00 -0.55 0.00 0.00 66.41 64.95 1aik h THR 569 Cb 1.34 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 68.44 1aik h THR 569 CO 0.14 0.28 -0.03 0.58 -0.25 0.00 0.00 175.52 176.25 1aik h VAL 570 N 0.75 1.27 -0.97 6.82 2.07 -0.97 0.46 116.25 125.68 1aik h VAL 570 Ca 0.17 -1.11 0.04 0.00 0.82 0.00 0.00 66.70 66.62 1aik h VAL 570 Cb 0.27 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 1aik h VAL 570 CO -0.00 0.38 0.63 -0.25 0.02 0.00 0.00 177.57 178.35 1aik h TRP 571 N 0.68 1.19 -0.41 1.57 7.01 -0.55 -0.01 115.95 125.43 1aik h TRP 571 Ca 0.13 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.10 1aik h TRP 571 Cb 0.55 -0.40 -0.02 0.00 -2.10 0.00 0.00 29.16 27.19 1aik h TRP 571 CO 0.04 0.68 0.05 0.78 -2.79 0.00 0.00 178.44 177.20 1aik h GLY 572 N 1.22 0.74 0.86 2.65 0.00 -0.03 -1.79 103.07 106.72 1aik h GLY 572 Ca 0.39 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 1aik h GLY 572 CO -0.13 0.47 0.04 -2.22 0.00 0.00 0.00 176.54 174.70 1aik h ILE 573 N 0.53 1.15 -0.60 2.60 2.04 -0.57 -1.36 117.51 121.31 1aik h ILE 573 Ca 0.12 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 1aik h ILE 573 Cb 0.41 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 1aik h ILE 573 CO 0.01 0.13 0.12 0.11 0.00 0.00 0.00 178.15 178.53 1aik h LYS 574 N -0.01 0.95 -0.24 2.37 1.57 -0.92 0.98 116.57 121.26 1aik h LYS 574 Ca 0.03 -0.22 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1aik h LYS 574 Cb 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1aik h LYS 574 CO -0.00 0.86 0.15 1.96 -0.57 0.00 0.00 179.45 181.84 1aik h GLN 575 N 0.90 0.29 -0.17 3.15 1.08 -1.13 -0.46 115.11 118.77 1aik h GLN 575 Ca 0.19 -0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.23 1aik h GLN 575 Cb 0.36 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1aik h GLN 575 CO 0.00 0.19 -0.51 -0.07 -0.95 0.00 0.00 178.83 177.50 1aik h LEU 576 N 0.30 0.52 -1.09 1.46 3.38 -0.89 -2.99 115.31 116.00 1aik h LEU 576 Ca 0.09 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 1aik h LEU 576 Cb -0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1aik h LEU 576 CO -0.04 0.94 -0.20 -0.61 0.09 0.00 0.00 178.44 178.62 1aik h GLN 577 N 0.37 0.41 0.00 1.13 -0.00 -0.54 -2.73 115.11 113.75 1aik h GLN 577 Ca 0.01 -0.13 -0.04 0.00 -0.00 0.00 0.00 58.65 58.49 1aik h GLN 577 Cb 1.02 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 28.46 1aik h GLN 577 CO 0.09 0.59 -0.19 0.00 0.00 0.00 0.00 178.83 179.32 1aik h ALA 578 N 1.42 1.59 -0.02 3.38 0.00 -0.93 -1.57 119.26 123.13 1aik h ALA 578 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1aik h ALA 578 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1aik h ALA 578 CO 0.04 0.24 -0.23 0.54 0.00 0.00 0.00 179.25 179.84 1aik n ARG 579 N -4.17 1.63 -2.46 0.00 1.74 -1.05 -4.12 116.66 108.23 1aik n ARG 579 Ca -0.02 -1.29 -0.01 0.00 -0.77 0.00 0.00 57.85 55.76 1aik n ARG 579 Cb 0.26 -1.47 0.05 0.00 -1.02 0.00 0.00 32.46 30.27 1aik n ARG 579 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1aik n ILE 580 N 0.44 1.14 0.00 0.55 5.41 -0.99 -5.12 119.36 120.79 1aik n ILE 580 Ca 0.12 -2.65 0.00 0.00 1.00 0.00 0.00 62.75 61.22 1aik n ILE 580 Cb 0.49 1.02 0.00 0.00 -0.71 0.00 0.00 39.64 40.45 1aik n ILE 580 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44