#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aik h MET 629 N 0.00 0.22 -0.55 -0.99 -0.00 -2.05 -2.02 114.93 109.54 1aik h MET 629 Ca 0.00 -0.24 -0.10 0.00 -0.00 0.00 0.00 59.70 59.36 1aik h MET 629 Cb 0.00 0.07 -0.02 0.00 -0.00 0.00 0.00 31.60 31.65 1aik h MET 629 CO 0.00 0.97 -0.05 1.49 -0.00 0.00 0.00 176.91 179.32 1aik h GLU 630 N 0.12 0.99 -0.70 -0.10 4.57 -2.05 -1.72 114.58 115.70 1aik h GLU 630 Ca -0.05 -0.33 -0.02 0.00 -1.18 0.00 0.00 59.36 57.78 1aik h GLU 630 Cb 1.52 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.99 1aik h GLU 630 CO 0.14 1.00 0.34 2.35 -1.18 0.00 0.00 179.01 181.66 1aik h TRP 631 N 0.90 1.00 -0.52 0.92 7.01 -1.96 0.94 115.95 124.22 1aik h TRP 631 Ca 0.15 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.11 1aik h TRP 631 Cb 0.59 -0.31 -0.03 0.00 -2.10 0.00 0.00 29.16 27.32 1aik h TRP 631 CO 0.04 0.73 0.33 -0.44 -2.79 0.00 0.00 178.44 176.31 1aik h ASP 632 N 0.97 0.61 -0.24 2.65 3.32 -0.88 0.13 116.42 122.98 1aik h ASP 632 Ca 0.24 -0.04 -0.15 0.00 0.02 0.00 0.00 57.03 57.10 1aik h ASP 632 Cb 0.11 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1aik h ASP 632 CO -0.03 0.47 -0.45 0.03 -1.72 0.00 0.00 179.24 177.54 1aik h ARG 633 N 0.70 0.72 -0.18 3.56 3.08 -0.97 -1.70 114.38 119.60 1aik h ARG 633 Ca 0.19 -0.46 -0.06 0.00 0.07 0.00 0.00 59.98 59.72 1aik h ARG 633 Cb -0.05 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1aik h ARG 633 CO -0.04 1.08 -0.16 0.93 -1.07 0.00 0.00 179.97 180.71 1aik h GLU 634 N 0.45 0.31 -0.21 0.04 5.08 -0.49 0.11 114.58 119.87 1aik h GLU 634 Ca 0.01 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 1aik h GLU 634 Cb 1.05 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1aik h GLU 634 CO 0.10 0.47 -0.39 0.82 -1.00 0.00 0.00 179.01 179.01 1aik h ILE 635 N 0.29 1.30 0.10 3.13 1.08 -0.56 -2.21 117.51 120.63 1aik h ILE 635 Ca 0.05 -1.54 -0.29 0.00 -0.39 0.00 0.00 64.86 62.70 1aik h ILE 635 Cb 0.46 1.57 -0.01 0.00 -3.07 0.00 0.00 36.82 35.77 1aik h ILE 635 CO 0.03 0.48 -1.44 0.78 -0.69 0.00 0.00 178.15 177.31 1aik h ASN 636 N 0.40 0.33 -0.20 1.72 2.35 -0.36 -2.30 115.58 117.51 1aik h ASN 636 Ca 0.04 -0.44 0.03 0.00 -0.55 0.00 0.00 56.30 55.38 1aik h ASN 636 Cb 0.86 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 39.10 1aik h ASN 636 CO 0.07 1.36 0.02 0.78 -1.65 0.00 0.00 177.43 178.01 1aik h ASN 637 N 0.06 -0.03 0.26 5.81 2.35 -0.76 0.66 115.58 123.93 1aik h ASN 637 Ca -0.20 0.04 -0.18 0.00 -0.55 0.00 0.00 56.30 55.40 1aik h ASN 637 Cb 1.98 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 40.41 1aik h ASN 637 CO 0.16 0.01 -0.73 1.88 -1.65 0.00 0.00 177.43 177.11 1aik h TYR 638 N 0.10 0.54 -0.66 1.19 0.05 -1.48 -2.59 116.97 114.12 1aik h TYR 638 Ca 0.09 -0.24 -0.02 0.00 0.05 0.00 0.00 58.73 58.61 1aik h TYR 638 Cb 0.10 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 37.73 1aik h TYR 638 CO -0.16 0.99 0.31 1.15 -1.05 0.00 0.00 178.16 179.40 1aik h THR 639 N 0.27 1.21 -0.39 -2.88 2.02 -0.91 -0.66 112.91 111.57 1aik h THR 639 Ca -0.03 -0.61 -0.14 0.00 0.77 0.00 0.00 66.41 66.40 1aik h THR 639 Cb 1.30 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.08 1aik h THR 639 CO 0.12 0.26 -0.31 0.28 0.37 0.00 0.00 175.52 176.24 1aik h SER 640 N 0.93 0.94 -0.64 4.18 0.02 -0.84 -0.19 113.55 117.96 1aik h SER 640 Ca 0.23 -0.45 -0.06 0.00 -0.84 0.00 0.00 61.79 60.68 1aik h SER 640 Cb 0.11 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.35 1aik h SER 640 CO -0.03 1.19 0.19 0.25 -1.14 0.00 0.00 176.83 177.29 1aik h LEU 641 N 0.70 0.96 -0.40 5.07 5.85 -1.17 -1.78 115.31 124.54 1aik h LEU 641 Ca 0.07 -0.18 -0.17 0.00 0.84 0.00 0.00 57.88 58.44 1aik h LEU 641 Cb 0.89 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1aik h LEU 641 CO 0.08 0.90 -0.50 0.40 -0.34 0.00 0.00 178.44 178.98 1aik h ILE 642 N 0.98 1.29 -0.66 4.05 2.04 -1.00 -0.22 117.51 123.99 1aik h ILE 642 Ca 0.21 -1.69 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 1aik h ILE 642 Cb 0.30 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 1aik h ILE 642 CO -0.01 0.55 0.40 0.45 0.00 0.00 0.00 178.15 179.54 1aik h HIS 643 N 0.62 0.87 -0.62 1.37 3.86 -0.83 0.05 115.15 120.48 1aik h HIS 643 Ca 0.03 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 1aik h HIS 643 Cb 1.08 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 29.24 1aik h HIS 643 CO 0.06 0.59 0.15 0.77 0.86 0.00 0.00 177.93 180.36 1aik h SER 644 N 0.90 0.94 0.16 2.45 0.02 -1.00 -1.29 113.55 115.73 1aik h SER 644 Ca 0.24 -0.24 -0.16 0.00 -0.84 0.00 0.00 61.79 60.80 1aik h SER 644 Cb -0.03 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 1aik h SER 644 CO -0.04 0.93 -0.58 -0.07 -1.14 0.00 0.00 176.83 175.93 1aik h LEU 645 N 0.91 0.49 -0.66 5.07 3.38 -0.76 0.91 115.31 124.65 1aik h LEU 645 Ca 0.19 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1aik h LEU 645 Cb 0.36 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1aik h LEU 645 CO 0.00 0.96 -0.15 0.40 0.09 0.00 0.00 178.44 179.74 1aik h ILE 646 N 0.33 1.27 -0.24 1.22 2.04 -0.90 -0.13 117.51 121.09 1aik h ILE 646 Ca 0.00 -1.27 -0.10 0.00 1.00 0.00 0.00 64.86 64.49 1aik h ILE 646 Cb 1.10 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1aik h ILE 646 CO 0.10 0.44 -0.25 -0.08 0.00 0.00 0.00 178.15 178.36 1aik h GLU 647 N 0.80 0.60 -0.61 2.37 4.81 -0.94 -0.96 114.58 120.64 1aik h GLU 647 Ca 0.12 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.03 1aik h GLU 647 Cb 0.68 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 1aik h GLU 647 CO 0.05 0.91 0.34 1.49 -0.73 0.00 0.00 179.01 181.08 1aik h GLU 648 N 0.30 0.85 -0.80 1.92 4.81 -0.63 -1.83 114.58 119.21 1aik h GLU 648 Ca 0.04 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 1aik h GLU 648 Cb 0.80 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.98 1aik h GLU 648 CO 0.06 0.63 0.32 0.77 -0.73 0.00 0.00 179.01 180.06 1aik h SER 649 N 0.83 1.10 -0.96 1.04 0.02 -0.95 -0.87 113.55 113.76 1aik h SER 649 Ca 0.22 -0.17 0.06 0.00 -0.84 0.00 0.00 61.79 61.06 1aik h SER 649 Cb 0.03 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.22 1aik h SER 649 CO -0.04 0.97 0.62 1.56 -1.14 0.00 0.00 176.83 178.81 1aik h GLN 650 N 1.16 1.08 -0.01 3.45 4.20 -0.81 0.28 115.11 124.47 1aik h GLN 650 Ca 0.27 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.82 1aik h GLN 650 Cb 0.22 -0.24 0.01 0.00 0.30 0.00 0.00 27.48 27.76 1aik h GLN 650 CO -0.02 0.72 -0.33 -0.91 -0.67 0.00 0.00 178.83 177.61 1aik h ASN 651 N 1.12 0.31 -0.03 1.46 2.35 -0.95 -2.81 115.58 117.02 1aik h ASN 651 Ca 0.41 -0.75 -0.04 0.00 -0.55 0.00 0.00 56.30 55.37 1aik h ASN 651 Cb 0.17 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1aik h ASN 651 CO -0.16 1.02 -0.08 -0.61 -1.65 0.00 0.00 177.43 175.96 1aik h GLN 652 N -0.37 0.26 -0.49 0.81 5.75 -0.97 -0.76 115.11 119.34 1aik h GLN 652 Ca -0.04 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 1aik h GLN 652 Cb 1.06 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.55 1aik h GLN 652 CO 0.07 0.35 0.26 0.37 -2.65 0.00 0.00 178.83 177.23 1aik h GLN 653 N 0.25 0.68 -0.36 1.69 5.75 -0.38 0.32 115.11 123.07 1aik h GLN 653 Ca 0.05 -0.08 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 1aik h GLN 653 Cb 0.30 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1aik h GLN 653 CO 0.01 0.54 0.08 0.93 -2.65 0.00 0.00 178.83 177.74 1aik h GLU 654 N 0.64 0.57 -0.76 1.69 5.08 -1.10 -0.90 114.58 119.82 1aik h GLU 654 Ca 0.17 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1aik h GLU 654 Cb 0.06 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1aik h GLU 654 CO -0.03 0.63 0.37 -0.22 -1.00 0.00 0.00 179.01 178.77 1aik h LYS 655 N 0.42 1.08 -0.29 2.33 3.64 -0.90 0.04 116.57 122.89 1aik h LYS 655 Ca 0.11 -0.15 -0.13 0.00 -1.27 0.00 0.00 60.65 59.21 1aik h LYS 655 Cb 0.32 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1aik h LYS 655 CO 0.00 0.83 -0.33 -0.91 -2.27 0.00 0.00 179.45 176.78 1aik h ASN 656 N 1.06 0.80 -0.83 4.20 2.35 -0.86 -0.20 115.58 122.09 1aik h ASN 656 Ca 0.26 -0.48 -0.02 0.00 -0.55 0.00 0.00 56.30 55.50 1aik h ASN 656 Cb 0.10 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.21 1aik h ASN 656 CO -0.03 1.12 0.43 -0.33 -1.65 0.00 0.00 177.43 176.96 1aik h GLU 657 N 0.49 1.18 -0.71 0.81 5.08 -0.84 -1.67 114.58 118.92 1aik h GLU 657 Ca 0.04 -0.16 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1aik h GLU 657 Cb 0.91 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 1aik h GLU 657 CO 0.08 0.89 0.47 1.96 -1.00 0.00 0.00 179.01 181.41 1aik h GLN 658 N 1.17 0.93 0.00 2.33 4.20 -0.69 -2.86 115.11 120.20 1aik h GLN 658 Ca 0.29 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.85 1aik h GLN 658 Cb 0.08 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1aik h GLN 658 CO -0.04 0.62 -0.41 1.49 -0.67 0.00 0.00 178.83 179.82 1aik h GLU 659 N 0.96 0.00 -0.37 1.46 4.81 -0.39 -2.52 114.58 118.53 1aik h GLU 659 Ca 0.26 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1aik h GLU 659 Cb -0.11 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 1aik h GLU 659 CO -0.06 0.41 -0.05 1.25 -0.73 0.00 0.00 179.01 179.84 1aik h LEU 660 N 0.00 0.58 0.00 1.64 5.85 -1.10 -3.51 115.31 118.77 1aik h LEU 660 Ca -0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.58 1aik h LEU 660 Cb 0.81 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1aik h LEU 660 CO 0.05 0.68 0.00 0.18 -0.34 0.00 0.00 178.44 179.01