#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr2 h GLN 776 N 0.00 0.37 -0.05 2.12 5.75 -2.04 -2.99 115.11 118.27 1sr2 h GLN 776 Ca 0.00 -0.54 -0.11 0.00 -0.15 0.00 0.00 58.65 57.85 1sr2 h GLN 776 Cb 0.00 0.19 0.01 0.00 1.07 0.00 0.00 27.48 28.74 1sr2 h GLN 776 CO 0.00 1.23 -0.41 1.05 -2.65 0.00 0.00 178.83 178.05 1sr2 h GLU 777 N -0.23 0.36 -3.86 1.69 -0.00 -2.08 -3.39 114.58 107.07 1sr2 h GLU 777 Ca -0.13 -0.32 -0.67 0.00 -0.00 0.00 0.00 59.36 58.23 1sr2 h GLU 777 Cb 1.60 0.08 -0.38 0.00 -0.00 0.00 0.00 28.75 30.05 1sr2 h GLU 777 CO 0.16 0.98 -0.53 0.00 -0.00 0.00 0.00 179.01 179.61 1sr2 s ALA 778 N -3.46 3.31 -1.17 1.06 0.00 -1.26 -5.02 121.76 115.23 1sr2 s ALA 778 Ca -0.14 -3.02 -0.20 0.00 0.00 0.00 0.00 51.96 48.60 1sr2 s ALA 778 Cb 0.03 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 1sr2 s ALA 778 CO 0.79 -1.96 1.91 0.28 0.00 0.00 0.00 175.76 176.78 1sr2 n VAL 779 N 3.69 2.66 -0.27 0.00 0.31 -1.13 -3.55 118.33 120.05 1sr2 n VAL 779 Ca 0.05 -2.64 -0.06 0.00 -0.01 0.00 0.00 64.34 61.67 1sr2 n VAL 779 Cb 0.37 -2.30 0.05 0.00 -0.91 0.00 0.00 33.84 31.05 1sr2 n VAL 779 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1sr2 h LEU 780 N 14.58 1.01 -6.45 7.52 3.38 -1.96 -3.24 115.31 130.15 1sr2 h LEU 780 Ca 0.37 -0.17 -0.70 0.00 0.09 0.00 0.00 57.88 57.46 1sr2 h LEU 780 Cb 0.83 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.27 1sr2 h LEU 780 CO 1.52 0.90 2.89 0.00 0.09 0.00 0.00 178.44 183.84 1sr2 n GLN 781 N -4.34 2.95 0.23 1.13 1.13 -1.26 -4.65 117.38 112.56 1sr2 n GLN 781 Ca 0.06 -2.79 0.06 0.00 -1.94 0.00 0.00 57.00 52.39 1sr2 n GLN 781 Cb 0.18 -3.33 0.53 0.00 0.11 0.00 0.00 30.24 27.73 1sr2 n GLN 781 CO 0.00 0.00 0.00 1.37 -1.44 0.00 0.00 177.06 176.99 1sr2 h LEU 782 N 10.54 0.00 -4.31 1.08 -0.00 -1.98 -2.18 115.31 118.46 1sr2 h LEU 782 Ca 0.54 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 57.90 1sr2 h LEU 782 Cb 0.69 0.00 -0.19 0.00 -0.00 0.00 0.00 40.66 41.16 1sr2 h LEU 782 CO 1.78 0.17 0.55 -0.38 -0.00 0.00 0.00 178.44 180.56 1sr2 n ILE 783 N -4.27 3.27 1.14 0.15 2.08 -1.26 -4.19 119.36 116.28 1sr2 n ILE 783 Ca -0.02 -2.88 0.09 0.00 0.56 0.00 0.00 62.75 60.50 1sr2 n ILE 783 Cb 0.24 -1.44 0.32 0.00 -0.75 0.00 0.00 39.64 38.01 1sr2 n ILE 783 CO 0.00 0.00 0.00 -1.84 0.56 0.00 0.00 176.55 175.27 1sr2 n GLU 784 N 0.36 1.75 0.00 0.38 -0.00 -0.82 -4.48 120.64 117.83 1sr2 n GLU 784 Ca 0.47 -1.14 0.00 0.00 -0.00 0.00 0.00 57.16 56.49 1sr2 n GLU 784 Cb 0.52 -1.36 0.00 0.00 -0.00 0.00 0.00 31.44 30.60 1sr2 n GLU 784 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1sr2 n VAL 785 N 0.37 0.00 0.00 3.84 0.24 -1.26 -5.10 118.33 116.42 1sr2 n VAL 785 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.45 1sr2 n VAL 785 Cb 0.32 -0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1sr2 n VAL 785 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1sr2 n GLN 786 N -1.72 0.00 -2.07 7.34 7.27 -1.26 -3.76 117.38 123.18 1sr2 n GLN 786 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 57.00 56.69 1sr2 n GLN 786 Cb 0.00 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 32.65 1sr2 n GLN 786 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1sr2 n LEU 787 N 0.00 7.42 0.00 1.69 7.99 -1.26 -4.88 117.00 127.96 1sr2 n LEU 787 Ca 0.00 -4.86 0.00 0.00 -0.01 0.00 0.00 56.01 51.14 1sr2 n LEU 787 Cb 0.00 -1.22 0.00 0.00 -0.11 0.00 0.00 43.42 42.09 1sr2 n LEU 787 CO 0.00 1.93 0.00 0.00 -1.51 0.00 0.00 177.39 177.81 1sr2 n ALA 788 N 0.59 0.00 -0.93 -1.18 0.00 -1.25 -4.89 120.51 112.85 1sr2 n ALA 788 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1sr2 n ALA 788 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1sr2 n ALA 788 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1sr2 n GLN 789 N 0.00 -0.37 0.00 0.00 1.13 -1.26 -4.64 117.38 112.23 1sr2 n GLN 789 Ca 0.00 0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 1sr2 n GLN 789 Cb 0.00 -3.43 0.00 0.00 0.11 0.00 0.00 30.24 26.92 1sr2 n GLN 789 CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 1sr2 n GLU 790 N -1.84 0.00 -2.17 -1.09 0.28 -1.26 -5.08 120.64 109.48 1sr2 n GLU 790 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.57 1sr2 n GLU 790 Cb 0.09 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 32.94 1sr2 n GLU 790 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 1sr2 s GLU 791 N -0.60 4.01 0.00 3.44 0.41 -1.26 -4.48 118.70 120.21 1sr2 s GLU 791 Ca 0.00 1.79 0.00 0.00 -0.41 0.00 0.00 54.97 56.35 1sr2 s GLU 791 Cb 0.00 -3.95 0.00 0.00 -1.78 0.00 0.00 34.13 28.40 1sr2 s GLU 791 CO 0.00 -1.03 0.00 1.55 -0.49 0.00 0.00 175.26 175.29 1sr2 n VAL 792 N 5.90 0.00 -3.55 2.63 3.14 -1.26 -4.87 118.33 120.32 1sr2 n VAL 792 Ca 0.17 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.47 1sr2 n VAL 792 Cb 0.44 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 33.14 1sr2 n VAL 792 CO 0.00 0.00 0.00 -0.89 -6.46 0.00 0.00 176.83 169.48 1sr2 s THR 793 N 0.00 -0.67 0.34 1.55 2.01 -1.26 -5.16 115.64 112.45 1sr2 s THR 793 Ca 0.00 0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.11 1sr2 s THR 793 Cb 0.00 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.75 1sr2 s THR 793 CO 0.00 0.01 0.52 -0.70 -0.69 0.00 0.00 174.62 173.76 1sr2 s GLU 794 N 2.62 3.36 -0.45 4.92 2.56 -1.26 -5.08 118.70 125.37 1sr2 s GLU 794 Ca 0.03 -0.55 0.05 0.00 0.00 0.00 0.00 54.97 54.51 1sr2 s GLU 794 Cb -0.13 -2.72 0.18 0.00 2.00 0.00 0.00 34.13 33.46 1sr2 s GLU 794 CO -0.14 0.13 0.52 -1.54 -0.56 0.00 0.00 175.26 173.67 1sr2 s SER 795 N -4.07 0.03 0.00 -1.70 1.04 -1.26 -5.01 113.70 102.73 1sr2 s SER 795 Ca 0.41 -2.15 0.15 0.00 0.48 0.00 0.00 55.95 54.83 1sr2 s SER 795 Cb -0.09 0.82 0.88 0.00 0.10 0.00 0.00 66.02 67.73 1sr2 s SER 795 CO 0.34 -0.14 1.54 -2.65 0.98 0.00 0.00 173.24 173.31 1sr2 n PRO 796 N 3.20 0.96 0.00 4.02 -0.02 -1.26 -4.93 135.00 136.96 1sr2 n PRO 796 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 1sr2 n PRO 796 Cb 0.51 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.75 1sr2 n PRO 796 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1sr2 n LEU 797 N -0.74 0.00 -2.82 2.45 4.77 -1.26 -4.78 117.00 114.62 1sr2 n LEU 797 Ca 0.11 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.97 1sr2 n LEU 797 Cb 0.05 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 1sr2 n LEU 797 CO 0.08 0.00 0.07 0.61 -1.33 0.00 0.00 177.39 176.82 1sr2 n GLY 798 N 0.00 -0.28 0.57 -0.72 0.00 -1.26 -2.95 105.19 100.54 1sr2 n GLY 798 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1sr2 n GLY 798 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sr2 n GLY 799 N -1.15 2.42 2.10 -0.02 0.00 -1.26 -4.88 105.19 102.40 1sr2 n GLY 799 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 1sr2 n GLY 799 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sr2 n ASP 800 N 0.00 4.16 0.03 1.61 8.00 -1.15 -4.44 116.55 124.76 1sr2 n ASP 800 Ca 0.00 -3.45 0.00 0.00 0.71 0.00 0.00 54.79 52.06 1sr2 n ASP 800 Cb 0.00 -0.83 0.32 0.00 -0.02 0.00 0.00 41.12 40.59 1sr2 n ASP 800 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1sr2 h GLU 801 N 1.01 0.46 -0.24 -1.24 3.07 -1.90 -1.58 114.58 114.17 1sr2 h GLU 801 Ca 0.56 -0.10 -0.06 0.00 -0.50 0.00 0.00 59.36 59.26 1sr2 h GLU 801 Cb 2.42 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 30.24 1sr2 h GLU 801 CO 1.04 0.51 -0.12 -2.95 -1.40 0.00 0.00 179.01 176.09 1sr2 h ASN 802 N 0.44 0.38 -0.09 1.42 -1.07 -1.90 -0.06 115.58 114.70 1sr2 h ASN 802 Ca 0.10 -0.09 -0.01 0.00 0.07 0.00 0.00 56.30 56.37 1sr2 h ASN 802 Cb 0.33 -0.10 -0.00 0.00 -2.07 0.00 0.00 38.32 36.48 1sr2 h ASN 802 CO 0.01 0.53 0.03 0.00 0.07 0.00 0.00 177.43 178.07 1sr2 h ALA 803 N 1.51 0.12 -0.53 4.14 0.00 -1.63 -1.32 119.26 121.55 1sr2 h ALA 803 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1sr2 h ALA 803 Cb 0.44 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1sr2 h ALA 803 CO 0.02 -0.26 0.33 0.37 0.00 0.00 0.00 179.25 179.71 1sr2 h GLN 804 N -0.05 0.71 -0.05 0.00 5.75 -1.16 -0.71 115.11 119.61 1sr2 h GLN 804 Ca 0.03 -0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1sr2 h GLN 804 Cb 0.23 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1sr2 h GLN 804 CO -0.00 0.50 -0.01 1.25 -2.65 0.00 0.00 178.83 177.92 1sr2 h LEU 805 N 0.71 -0.04 0.00 -2.39 5.85 -0.84 0.05 115.31 118.65 1sr2 h LEU 805 Ca 0.19 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.92 1sr2 h LEU 805 Cb -0.04 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1sr2 h LEU 805 CO -0.04 -0.01 -0.03 1.12 -0.34 0.00 0.00 178.44 179.14 1sr2 h HIS 806 N 0.00 0.00 0.00 1.25 2.07 -1.18 -1.93 115.15 115.36 1sr2 h HIS 806 Ca 0.02 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.54 1sr2 h HIS 806 Cb 0.03 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.01 1sr2 h HIS 806 CO -0.11 0.00 -0.60 0.00 -3.07 0.00 0.00 177.93 174.15 1sr2 h ALA 807 N 2.41 0.70 -0.01 6.11 0.00 -0.66 -3.22 119.26 124.58 1sr2 h ALA 807 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1sr2 h ALA 807 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1sr2 h ALA 807 CO 0.00 0.02 -0.05 -1.13 0.00 0.00 0.00 179.25 178.09 1sr2 n SER 808 N -2.86 1.22 -0.05 0.00 3.41 -0.04 -4.91 113.62 110.39 1sr2 n SER 808 Ca 0.01 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.33 1sr2 n SER 808 Cb 0.55 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1sr2 n SER 808 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1sr2 n GLY 809 N 1.19 0.50 0.75 5.00 0.00 -1.22 -4.95 105.19 106.47 1sr2 n GLY 809 Ca 0.18 -0.83 0.08 0.00 0.00 0.00 0.00 46.02 45.45 1sr2 n GLY 809 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sr2 n TYR 810 N -3.70 0.36 -0.01 1.61 4.01 -0.74 -4.49 117.16 114.19 1sr2 n TYR 810 Ca 0.00 -0.28 -0.04 0.00 -0.16 0.00 0.00 57.90 57.42 1sr2 n TYR 810 Cb 0.48 -0.01 0.19 0.00 -0.31 0.00 0.00 39.34 39.68 1sr2 n TYR 810 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1sr2 h TYR 811 N 2.84 0.62 -0.17 -0.72 3.20 -1.81 0.23 116.97 121.16 1sr2 h TYR 811 Ca 0.00 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 1sr2 h TYR 811 Cb 0.73 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 1sr2 h TYR 811 CO 0.18 0.73 0.07 0.00 -1.64 0.00 0.00 178.16 177.49 1sr2 h ALA 812 N 1.28 1.79 0.12 1.82 0.00 -1.93 -2.02 119.26 120.33 1sr2 h ALA 812 Ca 0.08 -0.05 -0.31 0.00 0.00 0.00 0.00 54.91 54.62 1sr2 h ALA 812 Cb 0.63 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1sr2 h ALA 812 CO 0.04 0.17 -1.57 -0.07 0.00 0.00 0.00 179.25 177.83 1sr2 h LEU 813 N 0.24 0.41 -0.42 0.00 3.38 -1.71 -3.30 115.31 113.91 1sr2 h LEU 813 Ca 0.06 -0.58 0.07 0.00 0.09 0.00 0.00 57.88 57.53 1sr2 h LEU 813 Cb 0.06 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.61 1sr2 h LEU 813 CO -0.01 1.48 0.02 0.15 0.09 0.00 0.00 178.44 180.18 1sr2 h PHE 814 N 0.07 0.01 -0.76 1.13 3.57 -0.28 0.17 116.94 120.86 1sr2 h PHE 814 Ca -0.26 0.03 -0.24 0.00 3.53 0.00 0.00 57.97 61.03 1sr2 h PHE 814 Cb 2.03 0.06 -0.14 0.00 2.79 0.00 0.00 35.95 40.68 1sr2 h PHE 814 CO 0.07 -0.06 0.31 1.33 -2.23 0.00 0.00 178.31 177.72 1sr2 n VAL 815 N -5.18 2.92 0.04 1.41 0.24 -0.85 -3.75 118.33 113.16 1sr2 n VAL 815 Ca 0.03 -1.61 0.00 0.00 -2.04 0.00 0.00 64.34 60.73 1sr2 n VAL 815 Cb 0.21 -0.38 0.00 0.00 -1.47 0.00 0.00 33.84 32.20 1sr2 n VAL 815 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1sr2 n ASP 816 N -0.20 0.20 0.07 -1.34 2.03 -0.77 -4.91 116.55 111.62 1sr2 n ASP 816 Ca 0.42 0.14 -0.14 0.00 0.52 0.00 0.00 54.79 55.73 1sr2 n ASP 816 Cb 1.40 0.02 -0.14 0.00 -0.72 0.00 0.00 41.12 41.69 1sr2 n ASP 816 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1sr2 h THR 817 N 0.00 1.30 0.53 5.18 2.02 -1.22 -3.37 112.91 117.36 1sr2 h THR 817 Ca 0.00 -2.95 -0.03 0.00 0.77 0.00 0.00 66.41 64.20 1sr2 h THR 817 Cb 0.00 2.79 0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1sr2 h THR 817 CO 0.00 0.83 -0.26 0.58 0.37 0.00 0.00 175.52 177.05 1sr2 h VAL 818 N 0.05 0.35 -0.95 3.16 2.07 -1.61 -1.67 116.25 117.65 1sr2 h VAL 818 Ca -0.18 -0.37 0.11 0.00 0.82 0.00 0.00 66.70 67.08 1sr2 h VAL 818 Cb 1.97 0.47 -0.07 0.00 -1.52 0.00 0.00 31.29 32.13 1sr2 h VAL 818 CO 0.16 0.05 0.60 -0.65 0.02 0.00 0.00 177.57 177.75 1sr2 h PRO 819 N -0.98 0.89 0.08 1.57 0.11 -1.76 -0.75 132.00 131.17 1sr2 h PRO 819 Ca -0.07 -0.05 -0.27 0.00 0.11 0.00 0.00 66.00 65.72 1sr2 h PRO 819 Cb 0.63 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 31.55 1sr2 h PRO 819 CO 0.12 0.59 -1.14 0.22 -0.21 0.00 0.00 178.00 177.58 1sr2 h ASP 820 N 0.92 0.61 0.21 -2.05 3.58 -1.70 -1.50 116.42 116.49 1sr2 h ASP 820 Ca 0.45 -0.57 -0.08 0.00 0.42 0.00 0.00 57.03 57.26 1sr2 h ASP 820 Cb 0.47 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 1sr2 h ASP 820 CO -0.22 1.40 -0.31 0.44 -2.88 0.00 0.00 179.24 177.67 1sr2 h ASP 821 N 0.19 0.16 -0.47 2.28 3.32 -0.80 0.18 116.42 121.28 1sr2 h ASP 821 Ca -0.14 -0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.78 1sr2 h ASP 821 Cb 1.82 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 41.31 1sr2 h ASP 821 CO 0.20 0.47 -0.03 0.58 -1.72 0.00 0.00 179.24 178.74 1sr2 h VAL 822 N 0.14 1.27 -0.68 -1.35 2.07 -1.06 -1.62 116.25 115.01 1sr2 h VAL 822 Ca 0.02 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 1sr2 h VAL 822 Cb 0.62 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1sr2 h VAL 822 CO 0.05 0.39 0.32 0.11 0.02 0.00 0.00 177.57 178.45 1sr2 h LYS 823 N 0.71 0.98 -0.69 1.57 1.57 -0.42 -1.60 116.57 118.68 1sr2 h LYS 823 Ca 0.13 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1sr2 h LYS 823 Cb 0.55 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1sr2 h LYS 823 CO 0.03 0.76 0.44 0.00 -0.57 0.00 0.00 179.45 180.11 1sr2 h ARG 824 N 0.97 0.92 -0.67 3.15 3.08 -0.45 -0.65 114.38 120.73 1sr2 h ARG 824 Ca 0.24 -0.07 0.09 0.00 0.07 0.00 0.00 59.98 60.31 1sr2 h ARG 824 Cb 0.12 -0.20 -0.07 0.00 0.08 0.00 0.00 29.97 29.89 1sr2 h ARG 824 CO -0.03 0.63 0.31 -0.07 -1.07 0.00 0.00 179.97 179.74 1sr2 h LEU 825 N 0.94 0.39 -0.75 3.04 3.38 -0.48 0.77 115.31 122.60 1sr2 h LEU 825 Ca 0.25 0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.33 1sr2 h LEU 825 Cb -0.07 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1sr2 h LEU 825 CO -0.05 0.22 0.46 1.88 0.09 0.00 0.00 178.44 181.04 1sr2 h TYR 826 N 0.54 0.85 -0.32 1.13 0.05 -0.53 -0.44 116.97 118.25 1sr2 h TYR 826 Ca 0.33 0.03 -0.03 0.00 0.05 0.00 0.00 58.73 59.11 1sr2 h TYR 826 Cb 0.37 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 1sr2 h TYR 826 CO -0.13 0.45 0.09 1.15 -1.05 0.00 0.00 178.16 178.67 1sr2 h THR 827 N 0.86 1.21 -0.50 -2.88 2.02 0.39 -0.48 112.91 113.54 1sr2 h THR 827 Ca 0.32 -0.70 -0.11 0.00 0.77 0.00 0.00 66.41 66.69 1sr2 h THR 827 Cb 0.11 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 1sr2 h THR 827 CO -0.15 0.23 -0.12 -0.33 0.37 0.00 0.00 175.52 175.52 1sr2 h GLU 828 N 0.35 0.93 -0.59 6.66 4.39 -0.66 -1.43 114.58 124.23 1sr2 h GLU 828 Ca 0.10 -0.34 -0.08 0.00 0.34 0.00 0.00 59.36 59.38 1sr2 h GLU 828 Cb 0.27 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1sr2 h GLU 828 CO -0.00 1.00 0.06 0.00 -1.16 0.00 0.00 179.01 178.91 1sr2 h ALA 829 N 1.02 0.79 -0.56 3.43 0.00 -0.94 0.19 119.26 123.18 1sr2 h ALA 829 Ca 0.13 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1sr2 h ALA 829 Cb 0.66 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1sr2 h ALA 829 CO 0.05 0.57 0.15 0.00 0.00 0.00 0.00 179.25 180.02 1sr2 h ALA 830 N 1.00 0.74 -0.08 0.00 0.00 -0.81 -2.35 119.26 117.76 1sr2 h ALA 830 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1sr2 h ALA 830 Cb 0.47 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1sr2 h ALA 830 CO 0.02 0.43 0.00 2.41 0.00 0.00 0.00 179.25 182.11 1sr2 n THR 831 N -4.40 0.10 -1.96 0.00 -1.04 -0.56 -4.88 114.28 101.53 1sr2 n THR 831 Ca 0.03 -0.17 -0.19 0.00 -2.04 0.00 0.00 64.05 61.67 1sr2 n THR 831 Cb 0.22 0.04 -0.05 0.00 -1.82 0.00 0.00 70.33 68.73 1sr2 n THR 831 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1sr2 n SER 832 N -0.24 -5.43 -3.86 8.00 7.64 -0.58 -4.88 113.62 114.27 1sr2 n SER 832 Ca 0.15 0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.84 1sr2 n SER 832 Cb 0.20 -4.55 0.00 0.00 -1.01 0.00 0.00 64.21 58.85 1sr2 n SER 832 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1sr2 n ASP 833 N -1.40 5.00 0.29 6.43 -0.08 0.56 -4.76 116.55 122.59 1sr2 n ASP 833 Ca -0.21 -3.09 0.16 0.00 -1.51 0.00 0.00 54.79 50.14 1sr2 n ASP 833 Cb 0.65 -1.49 0.90 0.00 2.34 0.00 0.00 41.12 43.52 1sr2 n ASP 833 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1sr2 h PHE 834 N 5.76 0.00 -0.35 -0.67 0.04 -1.90 0.16 116.94 119.98 1sr2 h PHE 834 Ca 0.41 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.17 1sr2 h PHE 834 Cb 0.63 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 1sr2 h PHE 834 CO 1.27 0.05 0.19 0.00 -0.60 0.00 0.00 178.31 179.21 1sr2 h ALA 835 N 1.95 0.45 0.07 2.45 0.00 -1.95 0.93 119.26 123.16 1sr2 h ALA 835 Ca -0.00 -0.08 -0.25 0.00 0.00 0.00 0.00 54.91 54.58 1sr2 h ALA 835 Cb 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1sr2 h ALA 835 CO 0.01 -0.02 -1.13 0.00 0.00 0.00 0.00 179.25 178.11 1sr2 h ALA 836 N 1.05 0.21 -0.35 0.00 0.00 -1.54 -2.20 119.26 116.44 1sr2 h ALA 836 Ca 0.12 -0.89 0.02 0.00 0.00 0.00 0.00 54.91 54.16 1sr2 h ALA 836 Cb 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1sr2 h ALA 836 CO -0.02 1.08 0.19 1.25 0.00 0.00 0.00 179.25 181.75 1sr2 h LEU 837 N 0.05 0.30 -0.58 0.00 5.85 -0.64 0.20 115.31 120.49 1sr2 h LEU 837 Ca -0.08 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 1sr2 h LEU 837 Cb 1.87 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.83 1sr2 h LEU 837 CO 0.17 0.22 0.19 0.00 -0.34 0.00 0.00 178.44 178.68 1sr2 h ALA 838 N 1.16 0.76 -0.77 1.25 0.00 -0.79 -0.94 119.26 119.94 1sr2 h ALA 838 Ca 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1sr2 h ALA 838 Cb 0.03 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1sr2 h ALA 838 CO -0.08 0.41 0.43 1.96 0.00 0.00 0.00 179.25 181.97 1sr2 h GLN 839 N 0.81 1.07 -0.36 0.00 1.08 -0.93 0.92 115.11 117.71 1sr2 h GLN 839 Ca 0.19 -0.12 -0.13 0.00 -1.45 0.00 0.00 58.65 57.14 1sr2 h GLN 839 Cb 0.27 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1sr2 h GLN 839 CO -0.01 0.79 -0.29 1.15 -0.95 0.00 0.00 178.83 179.52 1sr2 h THR 840 N 1.06 1.28 -0.40 -0.54 2.02 -0.39 -1.73 112.91 114.21 1sr2 h THR 840 Ca 0.27 -1.43 -0.07 0.00 0.77 0.00 0.00 66.41 65.95 1sr2 h THR 840 Cb 0.02 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1sr2 h THR 840 CO -0.04 0.47 -0.05 0.00 0.37 0.00 0.00 175.52 176.27 1sr2 h ALA 841 N 1.03 1.17 -0.39 6.16 0.00 -0.76 -0.15 119.26 126.32 1sr2 h ALA 841 Ca 0.08 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.74 1sr2 h ALA 841 Cb 0.81 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1sr2 h ALA 841 CO 0.07 0.53 0.23 0.45 0.00 0.00 0.00 179.25 180.53 1sr2 h HIS 842 N 0.62 0.43 -0.48 0.00 -0.00 -0.47 -0.48 115.15 114.77 1sr2 h HIS 842 Ca 0.12 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.50 1sr2 h HIS 842 Cb 0.46 -0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 27.71 1sr2 h HIS 842 CO 0.02 0.25 0.28 -0.09 -0.00 0.00 0.00 177.93 178.39 1sr2 h ARG 843 N 0.46 0.67 -0.42 2.45 2.43 -0.80 -1.62 114.38 117.54 1sr2 h ARG 843 Ca 0.15 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1sr2 h ARG 843 Cb 0.01 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 1sr2 h ARG 843 CO -0.07 0.51 0.12 -0.07 -1.51 0.00 0.00 179.97 178.95 1sr2 h LEU 844 N 0.64 0.62 -1.16 3.80 3.38 -0.69 0.12 115.31 122.03 1sr2 h LEU 844 Ca 0.17 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1sr2 h LEU 844 Cb 0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1sr2 h LEU 844 CO -0.03 0.67 0.12 0.07 0.09 0.00 0.00 178.44 179.37 1sr2 h LYS 845 N 0.54 0.72 0.05 1.13 2.10 -1.02 -1.34 116.57 118.74 1sr2 h LYS 845 Ca 0.13 -0.13 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1sr2 h LYS 845 Cb 0.28 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1sr2 h LYS 845 CO -0.00 0.64 -0.03 0.78 -2.00 0.00 0.00 179.45 178.85 1sr2 h GLY 846 N 0.89 -0.08 1.05 0.07 0.00 -0.64 -1.56 103.07 102.80 1sr2 h GLY 846 Ca 0.16 0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.46 1sr2 h GLY 846 CO -0.00 -0.03 0.24 -0.39 0.00 0.00 0.00 176.54 176.36 1sr2 h VAL 847 N -0.44 1.26 -0.50 4.60 -1.51 -0.66 -1.08 116.25 117.92 1sr2 h VAL 847 Ca -0.01 -0.88 -0.08 0.00 -1.23 0.00 0.00 66.70 64.51 1sr2 h VAL 847 Cb 0.39 0.46 -0.02 0.00 -2.13 0.00 0.00 31.29 29.99 1sr2 h VAL 847 CO 0.01 0.35 -0.01 -0.26 -1.23 0.00 0.00 177.57 176.43 1sr2 h PHE 848 N 1.07 0.91 -0.42 5.19 -1.00 -1.28 -1.62 116.94 119.77 1sr2 h PHE 848 Ca 0.24 -0.14 -0.03 0.00 2.81 0.00 0.00 57.97 60.85 1sr2 h PHE 848 Cb 0.29 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.58 1sr2 h PHE 848 CO 0.02 0.83 0.15 0.00 -1.61 0.00 0.00 178.31 177.71 1sr2 h ALA 849 N 1.20 1.47 0.20 2.45 0.00 -0.72 0.50 119.26 124.36 1sr2 h ALA 849 Ca 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1sr2 h ALA 849 Cb 0.49 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1sr2 h ALA 849 CO 0.02 0.40 -0.10 0.52 0.00 0.00 0.00 179.25 180.10 1sr2 h MET 850 N 0.60 -0.26 0.00 0.00 2.86 -0.29 -2.49 114.93 115.35 1sr2 h MET 850 Ca 0.15 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1sr2 h MET 850 Cb 0.16 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1sr2 h MET 850 CO -0.01 -0.13 0.00 1.28 1.06 0.00 0.00 176.91 179.11 1sr2 n LEU 851 N -5.18 0.00 -1.33 1.22 4.77 -0.83 -4.87 117.00 110.78 1sr2 n LEU 851 Ca -0.09 0.27 -0.10 0.00 -0.03 0.00 0.00 56.01 56.06 1sr2 n LEU 851 Cb 0.15 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 40.98 1sr2 n LEU 851 CO 0.34 -0.03 -0.04 0.59 -1.33 0.00 0.00 177.39 176.92 1sr2 n ASN 852 N -1.27 -3.44 -4.12 -1.43 3.02 0.47 -4.42 115.26 104.07 1sr2 n ASN 852 Ca 0.13 -0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.18 1sr2 n ASN 852 Cb 0.21 -2.48 -0.01 0.00 -0.61 0.00 0.00 39.78 36.89 1sr2 n ASN 852 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1sr2 n LEU 853 N -1.72 5.76 0.08 3.41 4.77 0.15 -4.85 117.00 124.61 1sr2 n LEU 853 Ca -0.07 -3.95 -0.15 0.00 -0.03 0.00 0.00 56.01 51.81 1sr2 n LEU 853 Cb 0.56 -1.67 -0.09 0.00 -2.33 0.00 0.00 43.42 39.89 1sr2 n LEU 853 CO 0.18 0.51 0.51 0.58 -1.33 0.00 0.00 177.39 177.85 1sr2 h VAL 854 N 4.77 0.00 -0.99 4.08 2.07 -1.91 0.28 116.25 124.54 1sr2 h VAL 854 Ca 0.50 0.00 0.05 0.00 0.82 0.00 0.00 66.70 68.07 1sr2 h VAL 854 Cb 0.75 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 1sr2 h VAL 854 CO 1.69 0.00 0.65 -0.65 0.02 0.00 0.00 177.57 179.27 1sr2 h PRO 855 N -0.68 1.17 -0.19 1.57 0.11 -1.99 0.29 132.00 132.28 1sr2 h PRO 855 Ca 0.00 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 1sr2 h PRO 855 Cb 0.71 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 1sr2 h PRO 855 CO -0.30 0.78 -0.05 0.78 -0.21 0.00 0.00 178.00 179.00 1sr2 h GLY 856 N 1.21 0.39 1.28 -0.55 0.00 -1.85 -1.41 103.07 102.14 1sr2 h GLY 856 Ca 0.41 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1sr2 h GLY 856 CO -0.15 0.29 0.30 1.70 0.00 0.00 0.00 176.54 178.68 1sr2 h LYS 857 N 0.08 0.94 -0.84 4.80 3.64 -0.09 -1.30 116.57 123.78 1sr2 h LYS 857 Ca 0.05 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1sr2 h LYS 857 Cb 0.49 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 1sr2 h LYS 857 CO 0.02 0.74 0.48 1.96 -2.27 0.00 0.00 179.45 180.38 1sr2 h GLN 858 N 0.93 1.16 -0.66 1.90 1.08 -0.80 -0.08 115.11 118.64 1sr2 h GLN 858 Ca 0.23 -0.12 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 1sr2 h GLN 858 Cb 0.12 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.29 1sr2 h GLN 858 CO -0.03 0.84 0.35 -0.07 -0.95 0.00 0.00 178.83 178.97 1sr2 h LEU 859 N 1.17 0.83 -1.42 1.46 3.38 -0.35 -1.67 115.31 118.71 1sr2 h LEU 859 Ca 0.30 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 1sr2 h LEU 859 Cb -0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1sr2 h LEU 859 CO -0.05 0.70 -0.29 0.00 0.09 0.00 0.00 178.44 178.89 1sr2 h GLU 861 N 0.00 0.15 -0.24 0.00 4.39 -0.24 0.12 114.58 118.76 1sr2 h GLU 861 Ca -0.00 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.57 1sr2 h GLU 861 Cb 0.57 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 1sr2 h GLU 861 CO 0.04 0.47 -0.14 1.15 -1.16 0.00 0.00 179.01 179.37 1sr2 h THR 862 N -0.17 1.22 -0.60 1.13 2.02 -1.04 -1.97 112.91 113.50 1sr2 h THR 862 Ca 0.02 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 1sr2 h THR 862 Cb 0.41 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1sr2 h THR 862 CO 0.01 0.32 0.30 0.25 0.37 0.00 0.00 175.52 176.76 1sr2 h LEU 863 N 0.38 0.77 -0.63 2.58 6.46 -0.80 0.12 115.31 124.19 1sr2 h LEU 863 Ca 0.07 -0.12 0.07 0.00 -0.12 0.00 0.00 57.88 57.78 1sr2 h LEU 863 Cb 0.48 -0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 40.16 1sr2 h LEU 863 CO 0.03 0.67 0.32 -0.08 -0.62 0.00 0.00 178.44 178.76 1sr2 h GLU 864 N 0.81 0.57 0.00 1.25 4.81 -0.31 0.97 114.58 122.68 1sr2 h GLU 864 Ca 0.21 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1sr2 h GLU 864 Cb 0.10 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1sr2 h GLU 864 CO -0.03 0.38 -0.40 1.25 -0.73 0.00 0.00 179.01 179.48 1sr2 h HIS 865 N 0.59 0.00 -0.22 0.92 2.76 -0.94 -1.21 115.15 117.05 1sr2 h HIS 865 Ca 0.29 0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.33 1sr2 h HIS 865 Cb 0.23 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 1sr2 h HIS 865 CO -0.10 0.40 -0.43 -0.07 -1.30 0.00 0.00 177.93 176.43 1sr2 h LEU 866 N 0.00 0.56 -0.36 0.26 3.38 0.80 -0.61 115.31 119.34 1sr2 h LEU 866 Ca -0.00 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.58 1sr2 h LEU 866 Cb 0.72 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1sr2 h LEU 866 CO 0.05 0.92 -0.29 0.40 0.09 0.00 0.00 178.44 179.61 1sr2 h ILE 867 N 0.43 1.28 -0.19 1.22 2.04 -0.44 0.13 117.51 121.99 1sr2 h ILE 867 Ca 0.03 -1.45 -0.06 0.00 1.00 0.00 0.00 64.86 64.38 1sr2 h ILE 867 Cb 0.93 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 1sr2 h ILE 867 CO 0.08 0.48 -0.14 0.08 0.00 0.00 0.00 178.15 178.65 1sr2 h ARG 868 N 0.63 0.30 0.00 2.37 -0.00 -1.10 -0.50 114.38 116.08 1sr2 h ARG 868 Ca 0.07 -0.08 0.00 0.00 -0.00 0.00 0.00 59.98 59.97 1sr2 h ARG 868 Cb 0.87 -0.04 0.00 0.00 -0.00 0.00 0.00 29.97 30.80 1sr2 h ARG 868 CO 0.08 0.45 -0.08 -1.91 -0.00 0.00 0.00 179.97 178.50 1sr2 n GLU 869 N -4.24 0.21 -3.43 0.08 4.07 -0.25 -4.93 120.64 112.15 1sr2 n GLU 869 Ca -0.00 0.16 -0.24 0.00 -0.06 0.00 0.00 57.16 57.01 1sr2 n GLU 869 Cb 0.29 -1.73 0.05 0.00 -0.06 0.00 0.00 31.44 30.00 1sr2 n GLU 869 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1sr2 n LYS 870 N -2.09 -6.47 -2.98 5.31 4.01 0.29 -4.93 118.16 111.31 1sr2 n LYS 870 Ca 0.06 0.82 -0.44 0.00 -0.51 0.00 0.00 58.31 58.23 1sr2 n LYS 870 Cb 0.41 -5.78 -0.02 0.00 -0.51 0.00 0.00 35.03 29.13 1sr2 n LYS 870 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1sr2 s ASP 871 N -3.08 6.68 0.12 4.39 -1.08 -0.20 -4.92 116.67 118.58 1sr2 s ASP 871 Ca 0.49 -2.20 -0.29 0.00 -0.52 0.00 0.00 52.55 50.03 1sr2 s ASP 871 Cb -0.22 -2.37 -0.08 0.00 -1.46 0.00 0.00 42.92 38.78 1sr2 s ASP 871 CO 0.61 -0.98 1.60 0.58 0.52 0.00 0.00 175.17 177.51 1sr2 h VAL 872 N 5.61 0.25 -0.79 1.11 2.07 -1.91 0.46 116.25 123.05 1sr2 h VAL 872 Ca 0.16 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.77 1sr2 h VAL 872 Cb 1.01 0.25 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 1sr2 h VAL 872 CO 1.07 0.00 0.51 1.55 0.02 0.00 0.00 177.57 180.73 1sr2 h PRO 873 N -0.56 0.74 -0.24 1.57 0.13 -1.99 -1.17 132.00 130.48 1sr2 h PRO 873 Ca 0.04 -0.04 -0.19 0.00 -0.87 0.00 0.00 66.00 64.93 1sr2 h PRO 873 Cb 0.61 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1sr2 h PRO 873 CO -0.24 0.49 -0.58 0.78 -0.23 0.00 0.00 178.00 178.22 1sr2 h GLY 874 N 0.77 0.91 0.89 1.56 0.00 -1.81 -1.98 103.07 103.40 1sr2 h GLY 874 Ca 0.35 -1.12 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 1sr2 h GLY 874 CO -0.13 1.00 -0.34 -2.22 0.00 0.00 0.00 176.54 174.85 1sr2 h ILE 875 N 0.59 0.31 -0.83 2.60 2.04 -0.02 -1.28 117.51 120.92 1sr2 h ILE 875 Ca -0.00 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.83 1sr2 h ILE 875 Cb 1.20 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 1sr2 h ILE 875 CO 0.13 0.00 0.40 1.05 0.00 0.00 0.00 178.15 179.73 1sr2 h GLU 876 N -0.87 1.20 -0.76 2.37 4.11 -1.32 -1.52 114.58 117.80 1sr2 h GLU 876 Ca -0.07 -0.17 0.02 0.00 0.07 0.00 0.00 59.36 59.21 1sr2 h GLU 876 Cb 0.70 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 1sr2 h GLU 876 CO 0.08 0.92 0.49 -0.22 0.07 0.00 0.00 179.01 180.35 1sr2 h LYS 877 N 1.18 0.94 -0.13 1.06 3.11 -1.25 -1.91 116.57 119.58 1sr2 h LYS 877 Ca 0.29 -0.06 -0.11 0.00 -2.81 0.00 0.00 60.65 57.96 1sr2 h LYS 877 Cb 0.12 -0.21 -0.01 0.00 -1.00 0.00 0.00 32.23 31.12 1sr2 h LYS 877 CO -0.04 0.62 -0.41 1.88 -2.81 0.00 0.00 179.45 178.70 1sr2 h TYR 878 N 0.97 0.34 -0.62 1.91 -1.99 -0.53 -1.13 116.97 115.92 1sr2 h TYR 878 Ca 0.30 -0.09 -0.04 0.00 2.00 0.00 0.00 58.73 60.89 1sr2 h TYR 878 Cb -0.03 -0.07 -0.03 0.00 2.00 0.00 0.00 36.73 38.60 1sr2 h TYR 878 CO -0.03 0.65 0.23 0.82 -0.00 0.00 0.00 178.16 179.83 1sr2 h ILE 879 N 0.24 1.24 -0.34 -2.88 2.04 -0.68 0.78 117.51 117.89 1sr2 h ILE 879 Ca 0.02 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 1sr2 h ILE 879 Cb 0.83 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1sr2 h ILE 879 CO 0.07 0.30 -0.03 0.77 0.00 0.00 0.00 178.15 179.25 1sr2 h SER 880 N 0.87 0.51 -0.06 1.72 4.64 -1.01 -0.71 113.55 119.52 1sr2 h SER 880 Ca 0.20 -0.11 -0.10 0.00 -0.47 0.00 0.00 61.79 61.32 1sr2 h SER 880 Cb 0.23 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1sr2 h SER 880 CO -0.01 0.60 -0.27 -0.78 -0.87 0.00 0.00 176.83 175.50 1sr2 h ASP 881 N 0.52 0.51 0.12 4.97 3.58 -0.52 0.17 116.42 125.76 1sr2 h ASP 881 Ca 0.11 -0.18 -0.11 0.00 0.42 0.00 0.00 57.03 57.27 1sr2 h ASP 881 Cb 0.38 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 1sr2 h ASP 881 CO 0.02 0.76 -0.37 0.40 -2.88 0.00 0.00 179.24 177.16 1sr2 h ILE 882 N 0.44 1.30 -0.19 2.25 2.04 -0.37 0.12 117.51 123.10 1sr2 h ILE 882 Ca 0.06 -1.46 -0.18 0.00 1.00 0.00 0.00 64.86 64.28 1sr2 h ILE 882 Cb 0.70 1.58 0.01 0.00 -0.74 0.00 0.00 36.82 38.36 1sr2 h ILE 882 CO 0.05 0.45 -0.59 -0.78 0.00 0.00 0.00 178.15 177.27 1sr2 h ASP 883 N 0.30 0.85 0.52 1.72 3.58 -0.34 -1.02 116.42 122.04 1sr2 h ASP 883 Ca 0.03 -0.59 -0.12 0.00 0.42 0.00 0.00 57.03 56.77 1sr2 h ASP 883 Cb 0.79 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.58 1sr2 h ASP 883 CO 0.06 1.29 -0.56 0.77 -2.88 0.00 0.00 179.24 177.93 1sr2 h SER 884 N 0.45 0.04 0.55 2.28 4.64 -0.64 0.10 113.55 120.97 1sr2 h SER 884 Ca -0.02 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.26 1sr2 h SER 884 Cb 1.22 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1sr2 h SER 884 CO 0.13 0.59 -0.37 0.22 -0.87 0.00 0.00 176.83 176.52 1sr2 h TYR 885 N 0.03 -1.00 -0.14 4.77 3.20 -0.50 -1.02 116.97 122.32 1sr2 h TYR 885 Ca -0.00 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 1sr2 h TYR 885 Cb 0.99 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.61 1sr2 h TYR 885 CO 0.00 -0.56 -0.10 0.28 -1.64 0.00 0.00 178.16 176.14 1sr2 h VAL 886 N -0.89 1.16 -0.51 1.81 2.07 -1.09 -0.26 116.25 118.54 1sr2 h VAL 886 Ca -0.06 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1sr2 h VAL 886 Cb 0.74 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1sr2 h VAL 886 CO 0.04 0.21 0.21 0.11 0.02 0.00 0.00 177.57 178.17 1sr2 h LYS 887 N 0.21 0.75 0.00 1.57 1.57 -0.66 -0.96 116.57 119.04 1sr2 h LYS 887 Ca 0.04 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1sr2 h LYS 887 Cb 0.32 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1sr2 h LYS 887 CO 0.02 0.66 -0.43 0.66 -0.57 0.00 0.00 179.45 179.79 1sr2 h SER 888 N 0.68 0.00 1.05 0.86 4.64 -0.59 -3.13 113.55 117.07 1sr2 h SER 888 Ca 0.17 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.34 1sr2 h SER 888 Cb 0.18 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.25 1sr2 h SER 888 CO -0.02 0.31 -0.71 -0.07 -0.87 0.00 0.00 176.83 175.48 1sr2 h LEU 889 N 0.00 0.00 0.00 5.97 4.07 -0.90 -3.52 115.31 120.94 1sr2 h LEU 889 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1sr2 h LEU 889 Cb 1.25 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1sr2 h LEU 889 CO 0.04 0.71 0.00 0.18 -1.08 0.00 0.00 178.44 178.29