#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2rmz h GLU 686 N 0.00 0.66 -2.08 0.54 5.08 -2.07 -3.38 114.58 113.33 2rmz h GLU 686 Ca 0.00 -0.25 -0.57 0.00 -1.00 0.00 0.00 59.36 57.54 2rmz h GLU 686 Cb 0.00 -0.04 -0.39 0.00 0.50 0.00 0.00 28.75 28.82 2rmz h GLU 686 CO 0.00 0.82 -1.03 0.43 -1.00 0.00 0.00 179.01 178.23 2rmz n SER 687 N -4.43 0.56 -0.31 1.42 7.64 -1.26 -4.97 113.62 112.27 2rmz n SER 687 Ca -0.02 -2.75 0.13 0.00 1.01 0.00 0.00 58.87 57.24 2rmz n SER 687 Cb 0.33 -0.64 0.37 0.00 -1.01 0.00 0.00 64.21 63.26 2rmz n SER 687 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2rmz h PRO 688 N 4.21 0.68 -0.80 1.43 0.11 -2.05 -0.61 132.00 134.98 2rmz h PRO 688 Ca 0.11 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 2rmz h PRO 688 Cb 0.86 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.78 2rmz h PRO 688 CO 0.50 0.45 0.32 0.87 -0.21 0.00 0.00 178.00 179.92 2rmz h LYS 689 N 0.70 1.19 0.00 1.05 1.57 -1.96 -3.49 116.57 115.64 2rmz h LYS 689 Ca 0.52 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2rmz h LYS 689 Cb 0.88 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2rmz h LYS 689 CO -0.28 0.97 0.00 0.41 -0.57 0.00 0.00 179.45 179.98 2rmz n GLY 690 N -0.87 3.27 3.78 3.86 0.00 -0.23 -5.03 105.19 109.96 2rmz n GLY 690 Ca 0.07 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.14 2rmz n GLY 690 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2rmz s PRO 691 N -2.15 3.57 -1.42 1.61 0.04 -1.26 -3.37 135.00 132.01 2rmz s PRO 691 Ca 0.00 1.60 -0.02 0.00 0.04 0.00 0.00 61.00 62.62 2rmz s PRO 691 Cb 0.00 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.41 2rmz s PRO 691 CO 0.00 -0.67 0.17 -0.25 0.04 0.00 0.00 177.00 176.30 2rmz n ASP 692 N -0.99 -4.98 -0.23 6.66 8.00 -1.26 -4.85 116.55 118.90 2rmz n ASP 692 Ca 0.10 -0.04 -0.08 0.00 0.71 0.00 0.00 54.79 55.48 2rmz n ASP 692 Cb 0.50 -4.14 0.03 0.00 -0.02 0.00 0.00 41.12 37.50 2rmz n ASP 692 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 2rmz h ILE 693 N -0.38 1.27 -0.76 0.53 6.09 -1.96 -2.64 117.51 119.65 2rmz h ILE 693 Ca -0.42 -1.09 -0.01 0.00 -1.37 0.00 0.00 64.86 61.96 2rmz h ILE 693 Cb 1.30 0.70 -0.04 0.00 0.47 0.00 0.00 36.82 39.26 2rmz h ILE 693 CO 0.49 0.40 0.42 -0.07 -3.07 0.00 0.00 178.15 176.32 2rmz h LEU 694 N 1.01 0.95 -0.55 2.19 3.38 -1.88 0.35 115.31 120.76 2rmz h LEU 694 Ca 0.19 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 2rmz h LEU 694 Cb 0.49 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2rmz h LEU 694 CO 0.02 0.77 0.31 0.58 0.09 0.00 0.00 178.44 180.22 2rmz h VAL 695 N 1.05 1.18 -0.33 1.22 2.07 -1.89 -1.24 116.25 118.30 2rmz h VAL 695 Ca 0.27 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 67.25 2rmz h VAL 695 Cb 0.03 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2rmz h VAL 695 CO -0.04 0.19 -0.23 0.58 0.02 0.00 0.00 177.57 178.09 2rmz h VAL 696 N 0.74 1.29 -0.52 2.57 2.07 -1.17 -1.47 116.25 119.76 2rmz h VAL 696 Ca 0.19 -1.37 0.01 0.00 0.82 0.00 0.00 66.70 66.36 2rmz h VAL 696 Cb 0.02 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2rmz h VAL 696 CO -0.03 0.45 0.33 0.25 0.02 0.00 0.00 177.57 178.58 2rmz h LEU 697 N 0.51 0.55 -0.58 2.57 5.85 -0.72 0.24 115.31 123.73 2rmz h LEU 697 Ca 0.07 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2rmz h LEU 697 Cb 0.78 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2rmz h LEU 697 CO 0.06 0.39 0.22 -0.07 -0.34 0.00 0.00 178.44 178.71 2rmz h LEU 698 N 0.66 0.80 -0.54 2.25 3.38 -1.16 -0.31 115.31 120.40 2rmz h LEU 698 Ca 0.20 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2rmz h LEU 698 Cb -0.03 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 2rmz h LEU 698 CO -0.07 0.76 0.35 0.28 0.09 0.00 0.00 178.44 179.85 2rmz h SER 699 N 0.79 0.59 -0.43 -0.43 0.02 -0.70 0.13 113.55 113.52 2rmz h SER 699 Ca 0.19 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 2rmz h SER 699 Cb 0.21 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2rmz h SER 699 CO -0.01 0.42 0.15 0.58 -1.14 0.00 0.00 176.83 176.83 2rmz h VAL 700 N 0.70 1.21 -0.70 2.27 2.07 -0.70 -2.23 116.25 118.87 2rmz h VAL 700 Ca 0.20 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 2rmz h VAL 700 Cb -0.05 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2rmz h VAL 700 CO -0.06 0.25 0.34 0.24 0.02 0.00 0.00 177.57 178.36 2rmz h MET 701 N 0.56 1.00 -0.59 1.57 2.07 -0.59 -2.50 114.93 116.44 2rmz h MET 701 Ca 0.14 -0.13 -0.01 0.00 -2.07 0.00 0.00 59.70 57.63 2rmz h MET 701 Cb 0.23 -0.19 -0.03 0.00 -1.87 0.00 0.00 31.60 29.74 2rmz h MET 701 CO -0.01 0.76 0.31 0.78 1.07 0.00 0.00 176.91 179.83 2rmz h GLY 702 N 1.05 0.89 0.94 8.32 0.00 -0.41 -2.55 103.07 111.31 2rmz h GLY 702 Ca 0.24 -0.42 0.04 0.00 0.00 0.00 0.00 47.33 47.20 2rmz h GLY 702 CO -0.03 0.40 0.60 0.00 0.00 0.00 0.00 176.54 177.51 2rmz h ALA 703 N 1.14 1.43 -0.50 3.60 0.00 -0.97 -2.07 119.26 121.88 2rmz h ALA 703 Ca 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2rmz h ALA 703 Cb 0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2rmz h ALA 703 CO -0.03 0.47 0.20 0.82 0.00 0.00 0.00 179.25 180.71 2rmz h ILE 704 N 1.14 1.21 -0.41 0.00 2.04 -1.20 -2.44 117.51 117.85 2rmz h ILE 704 Ca 0.37 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.56 2rmz h ILE 704 Cb 0.06 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 2rmz h ILE 704 CO -0.12 0.24 0.13 -0.07 0.00 0.00 0.00 178.15 178.33 2rmz h LEU 705 N 0.67 0.59 -0.62 1.44 3.38 -1.12 -1.41 115.31 118.23 2rmz h LEU 705 Ca 0.17 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2rmz h LEU 705 Cb 0.19 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2rmz h LEU 705 CO -0.01 0.64 0.15 -0.07 0.09 0.00 0.00 178.44 179.24 2rmz h LEU 706 N 0.52 0.94 -0.30 1.67 -0.00 -1.32 -1.33 115.31 115.49 2rmz h LEU 706 Ca 0.13 -0.23 -0.18 0.00 -0.00 0.00 0.00 57.88 57.60 2rmz h LEU 706 Cb 0.26 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 40.67 2rmz h LEU 706 CO -0.00 0.93 -0.52 -0.29 -0.00 0.00 0.00 178.44 178.55 2rmz h ILE 707 N 0.91 1.27 -0.58 1.22 2.10 -1.42 -2.16 117.51 118.86 2rmz h ILE 707 Ca 0.20 -1.70 0.01 0.00 1.08 0.00 0.00 64.86 64.44 2rmz h ILE 707 Cb 0.35 1.61 -0.03 0.00 -1.09 0.00 0.00 36.82 37.67 2rmz h ILE 707 CO 0.00 0.56 0.38 1.23 -1.08 0.00 0.00 178.15 179.24 2rmz h GLY 708 N 0.67 0.82 0.99 8.18 0.00 -1.12 0.66 103.07 113.25 2rmz h GLY 708 Ca 0.02 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2rmz h GLY 708 CO 0.12 0.30 0.30 -2.00 0.00 0.00 0.00 176.54 175.26 2rmz h LEU 709 N 0.79 0.72 -0.81 3.11 5.85 -1.21 -1.31 115.31 122.45 2rmz h LEU 709 Ca 0.21 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2rmz h LEU 709 Cb -0.09 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 2rmz h LEU 709 CO -0.05 0.62 0.52 0.00 -0.34 0.00 0.00 178.44 179.19 2rmz h ALA 710 N 1.13 1.06 -0.78 1.25 0.00 -0.72 -1.50 119.26 119.70 2rmz h ALA 710 Ca 0.20 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2rmz h ALA 710 Cb 0.07 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2rmz h ALA 710 CO -0.03 0.35 0.30 0.00 0.00 0.00 0.00 179.25 179.87 2rmz h ALA 711 N 1.33 1.02 -0.68 0.00 0.00 -0.29 -1.15 119.26 119.49 2rmz h ALA 711 Ca 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2rmz h ALA 711 Cb -0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 2rmz h ALA 711 CO -0.11 0.65 0.34 1.25 0.00 0.00 0.00 179.25 181.39 2rmz h LEU 712 N 1.14 0.88 -0.50 0.00 5.85 -0.54 -0.95 115.31 121.19 2rmz h LEU 712 Ca 0.26 -0.13 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2rmz h LEU 712 Cb 0.23 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2rmz h LEU 712 CO -0.02 0.76 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.57 2rmz h LEU 713 N 0.94 1.03 -0.48 2.25 3.38 -0.99 -2.04 115.31 119.41 2rmz h LEU 713 Ca 0.24 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 2rmz h LEU 713 Cb 0.10 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2rmz h LEU 713 CO -0.03 1.19 0.21 0.40 0.09 0.00 0.00 178.44 180.30 2rmz h ILE 714 N 0.87 1.20 -0.21 1.22 2.04 -0.94 -0.34 117.51 121.35 2rmz h ILE 714 Ca 0.11 -0.59 0.01 0.00 1.00 0.00 0.00 64.86 65.40 2rmz h ILE 714 Cb 0.78 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2rmz h ILE 714 CO 0.07 0.23 0.11 -0.25 0.00 0.00 0.00 178.15 178.30 2rmz h TRP 715 N 0.63 0.20 -0.65 1.37 7.01 -1.08 -1.96 115.95 121.47 2rmz h TRP 715 Ca 0.16 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.21 2rmz h TRP 715 Cb 0.15 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 2rmz h TRP 715 CO -0.00 0.12 0.40 -0.22 -2.79 0.00 0.00 178.44 175.94 2rmz h LYS 716 N 0.23 0.75 -0.63 2.65 1.63 -1.05 -1.65 116.57 118.50 2rmz h LYS 716 Ca 0.09 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2rmz h LYS 716 Cb 0.02 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.45 2rmz h LYS 716 CO -0.06 0.50 0.38 1.25 -3.45 0.00 0.00 179.45 178.07 2rmz h LEU 717 N 0.77 0.76 -0.75 5.20 5.85 -0.66 -1.50 115.31 124.98 2rmz h LEU 717 Ca 0.27 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.85 2rmz h LEU 717 Cb 0.05 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 2rmz h LEU 717 CO -0.12 0.60 0.08 -0.07 -0.34 0.00 0.00 178.44 178.59 2rmz h LEU 718 N 0.85 0.99 -0.62 2.25 3.38 -1.01 -2.26 115.31 118.90 2rmz h LEU 718 Ca 0.23 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2rmz h LEU 718 Cb -0.02 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2rmz h LEU 718 CO -0.04 1.00 0.24 0.40 0.09 0.00 0.00 178.44 180.13 2rmz h ILE 719 N 0.97 1.23 -0.70 1.22 2.04 -0.91 -2.25 117.51 119.11 2rmz h ILE 719 Ca 0.19 -0.74 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 2rmz h ILE 719 Cb 0.45 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2rmz h ILE 719 CO 0.01 0.29 0.35 0.74 0.00 0.00 0.00 178.15 179.55 2rmz h THR 720 N 0.86 1.23 -0.64 -0.27 2.02 -1.10 -3.01 112.91 112.00 2rmz h THR 720 Ca 0.20 -0.62 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 2rmz h THR 720 Cb 0.22 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 2rmz h THR 720 CO -0.02 0.26 0.26 0.40 0.37 0.00 0.00 175.52 176.79 2rmz h ILE 721 N 0.98 1.24 -0.52 3.11 2.04 -1.11 -2.90 117.51 120.34 2rmz h ILE 721 Ca 0.24 -0.74 0.08 0.00 1.00 0.00 0.00 64.86 65.45 2rmz h ILE 721 Cb 0.10 0.52 -0.07 0.00 -0.74 0.00 0.00 36.82 36.63 2rmz h ILE 721 CO -0.03 0.29 0.15 0.45 0.00 0.00 0.00 178.15 179.01 2rmz h HIS 722 N 0.90 0.25 -3.47 1.37 3.86 -1.28 -3.34 115.15 113.45 2rmz h HIS 722 Ca 0.21 0.03 -0.72 0.00 -1.16 0.00 0.00 60.37 58.73 2rmz h HIS 722 Cb 0.21 -0.03 -0.26 0.00 1.06 0.00 0.00 27.41 28.39 2rmz h HIS 722 CO 0.01 0.05 -0.46 0.16 0.86 0.00 0.00 177.93 178.55 2rmz s ASP 723 N -5.35 5.77 0.20 2.45 -4.77 -1.09 -4.95 116.67 108.93 2rmz s ASP 723 Ca -0.13 -1.30 -0.08 0.00 -3.30 0.00 0.00 52.55 47.74 2rmz s ASP 723 Cb 0.16 -2.04 0.12 0.00 -1.09 0.00 0.00 42.92 40.07 2rmz s ASP 723 CO 0.73 -0.51 1.67 0.03 0.70 0.00 0.00 175.17 177.79 2rmz h ARG 724 N 8.49 1.03 -0.53 2.11 3.08 -1.69 -2.99 114.38 123.88 2rmz h ARG 724 Ca -0.25 -0.31 -0.01 0.00 0.07 0.00 0.00 59.98 59.48 2rmz h ARG 724 Cb 1.09 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.02 2rmz h ARG 724 CO 0.75 1.00 0.29 -0.22 -1.07 0.00 0.00 179.97 180.73 2rmz h LYS 725 N 0.95 0.73 -5.62 0.04 3.64 -1.92 -3.48 116.57 110.91 2rmz h LYS 725 Ca 0.17 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.37 2rmz h LYS 725 Cb 0.53 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2rmz h LYS 725 CO 0.03 0.56 -0.42 -1.91 -2.27 0.00 0.00 179.45 175.44 2rmz n GLU 726 N -4.64 -1.78 0.00 1.90 2.13 -1.13 -5.22 120.64 111.90 2rmz n GLU 726 Ca 0.03 1.63 0.00 0.00 0.66 0.00 0.00 57.16 59.47 2rmz n GLU 726 Cb 0.08 -4.97 0.00 0.00 0.27 0.00 0.00 31.44 26.82 2rmz n GLU 726 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06