#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr2 n GLN 776 N 0.00 -3.16 0.00 2.12 3.00 -1.26 -4.53 117.38 113.55 1sr2 n GLN 776 Ca 0.00 2.49 0.00 0.00 -0.01 0.00 0.00 57.00 59.48 1sr2 n GLN 776 Cb 0.00 -3.13 0.00 0.00 0.00 0.00 0.00 30.24 27.11 1sr2 n GLN 776 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1sr2 n GLU 777 N 1.12 0.00 -3.01 -1.09 4.07 -1.26 -4.51 120.64 115.96 1sr2 n GLU 777 Ca -0.02 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.71 1sr2 n GLU 777 Cb 0.04 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.40 1sr2 n GLU 777 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1sr2 n ALA 778 N 0.00 5.07 -0.07 4.31 0.00 -1.26 -4.74 120.51 123.81 1sr2 n ALA 778 Ca 0.00 -4.74 -0.04 0.00 0.00 0.00 0.00 53.44 48.65 1sr2 n ALA 778 Cb 0.00 -1.76 -0.02 0.00 0.00 0.00 0.00 19.45 17.68 1sr2 n ALA 778 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sr2 h VAL 779 N 3.03 0.00 -2.39 0.00 2.07 -1.85 -3.40 116.25 113.70 1sr2 h VAL 779 Ca 0.27 -1.00 -0.47 0.00 0.82 0.00 0.00 66.70 66.32 1sr2 h VAL 779 Cb 0.54 0.01 -0.36 0.00 -1.52 0.00 0.00 31.29 29.96 1sr2 h VAL 779 CO 1.12 0.00 -0.75 -0.76 0.02 0.00 0.00 177.57 177.20 1sr2 s LEU 780 N -8.24 0.37 0.32 2.57 1.43 -1.26 -4.94 118.68 108.94 1sr2 s LEU 780 Ca -0.14 -1.53 0.02 0.00 -1.03 0.00 0.00 54.13 51.44 1sr2 s LEU 780 Cb 0.02 0.03 -0.03 0.00 0.03 0.00 0.00 46.19 46.24 1sr2 s LEU 780 CO 0.21 -0.35 0.51 -1.10 0.23 0.00 0.00 176.35 175.85 1sr2 s GLN 781 N 1.67 3.47 -0.14 1.70 -0.21 -1.26 -5.03 119.66 119.87 1sr2 s GLN 781 Ca 0.14 -0.43 -0.22 0.00 0.02 0.00 0.00 55.36 54.86 1sr2 s GLN 781 Cb -0.18 -2.71 -0.25 0.00 1.00 0.00 0.00 33.01 30.87 1sr2 s GLN 781 CO -0.16 0.21 0.56 1.37 -2.12 0.00 0.00 175.29 175.15 1sr2 h LEU 782 N 0.84 0.15 0.00 2.90 -0.00 -2.01 -3.50 115.31 113.70 1sr2 h LEU 782 Ca -0.50 -0.81 0.00 0.00 -0.00 0.00 0.00 57.88 56.57 1sr2 h LEU 782 Cb 1.22 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.83 1sr2 h LEU 782 CO 0.61 1.36 0.00 -0.38 -0.00 0.00 0.00 178.44 180.03 1sr2 n ILE 783 N -4.32 0.00 0.03 0.15 5.41 -1.26 -5.10 119.36 114.27 1sr2 n ILE 783 Ca -0.21 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.54 1sr2 n ILE 783 Cb 0.69 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.62 1sr2 n ILE 783 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1sr2 n GLU 784 N 0.00 0.00 -0.23 0.38 4.71 -1.26 -4.84 120.64 119.40 1sr2 n GLU 784 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 57.16 57.24 1sr2 n GLU 784 Cb 0.00 -0.22 0.25 0.00 -1.01 0.00 0.00 31.44 30.46 1sr2 n GLU 784 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 1sr2 n VAL 785 N -3.01 0.61 -2.83 2.62 0.24 -1.26 -4.90 118.33 109.80 1sr2 n VAL 785 Ca 0.00 -0.67 -0.22 0.00 -2.04 0.00 0.00 64.34 61.41 1sr2 n VAL 785 Cb 0.00 0.44 0.02 0.00 -1.47 0.00 0.00 33.84 32.83 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 1.02 -3.91 -0.29 7.34 7.27 -1.26 -1.78 117.38 125.76 1sr2 n GLN 786 Ca 0.18 0.94 0.00 0.00 0.07 0.00 0.00 57.00 58.19 1sr2 n GLN 786 Cb 0.45 -5.75 0.00 0.00 2.41 0.00 0.00 30.24 27.36 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 -3.72 0.23 -2.47 1.69 4.77 -1.26 -4.84 117.00 111.40 1sr2 n LEU 787 Ca -0.15 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.60 1sr2 n LEU 787 Cb 0.64 -0.52 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1sr2 n LEU 787 CO 0.42 -0.12 1.91 0.00 -1.33 0.00 0.00 177.39 178.27 1sr2 n ALA 788 N 0.75 6.60 -3.62 -1.18 0.00 -0.74 -4.72 120.51 117.60 1sr2 n ALA 788 Ca 0.00 -2.66 -0.28 0.00 0.00 0.00 0.00 53.44 50.50 1sr2 n ALA 788 Cb 0.00 -2.44 -0.16 0.00 0.00 0.00 0.00 19.45 16.85 1sr2 n ALA 788 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1sr2 s GLN 789 N 0.07 0.28 -0.33 0.00 2.00 -1.26 -5.04 119.66 115.37 1sr2 s GLN 789 Ca 0.64 -0.42 -0.22 0.00 -2.00 0.00 0.00 55.36 53.36 1sr2 s GLN 789 Cb 0.31 -1.65 0.00 0.00 0.80 0.00 0.00 33.01 32.47 1sr2 s GLN 789 CO -0.09 -0.83 0.71 -1.83 -0.50 0.00 0.00 175.29 172.75 1sr2 s GLU 790 N 2.02 3.84 -0.46 1.67 -1.05 -1.26 -4.97 118.70 118.49 1sr2 s GLU 790 Ca 0.05 0.33 0.05 0.00 -0.15 0.00 0.00 54.97 55.25 1sr2 s GLU 790 Cb -0.16 -3.76 0.19 0.00 -0.44 0.00 0.00 34.13 29.96 1sr2 s GLU 790 CO -0.21 -0.70 0.42 0.39 0.95 0.00 0.00 175.26 176.11 1sr2 n GLU 791 N 6.12 0.65 -2.26 -4.83 1.02 -1.26 -5.05 120.64 115.03 1sr2 n GLU 791 Ca 0.01 -3.44 -0.37 0.00 -0.02 0.00 0.00 57.16 53.34 1sr2 n GLU 791 Cb 0.48 -1.69 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 1sr2 n GLU 791 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1sr2 s VAL 792 N -0.55 3.55 -0.28 2.62 0.11 -1.26 -4.94 120.40 119.64 1sr2 s VAL 792 Ca 0.33 0.01 -0.01 0.00 -2.93 0.00 0.00 61.98 59.38 1sr2 s VAL 792 Cb 0.06 -4.38 0.05 0.00 -1.53 0.00 0.00 36.38 30.58 1sr2 s VAL 792 CO -0.17 -1.33 -0.03 0.42 -3.33 0.00 0.00 175.10 170.66 1sr2 s THR 793 N 7.77 2.82 0.84 5.04 -4.23 -1.26 -5.10 115.64 121.51 1sr2 s THR 793 Ca 0.56 -1.38 -0.08 0.00 -1.18 0.00 0.00 61.69 59.61 1sr2 s THR 793 Cb -0.08 -2.60 0.18 0.00 1.34 0.00 0.00 72.50 71.34 1sr2 s THR 793 CO 0.10 -0.05 1.15 -0.62 -0.54 0.00 0.00 174.62 174.67 1sr2 n GLU 794 N 4.59 -0.67 -3.73 3.99 4.71 -1.26 -5.06 120.64 123.22 1sr2 n GLU 794 Ca -0.14 -2.39 -0.38 0.00 -0.01 0.00 0.00 57.16 54.24 1sr2 n GLU 794 Cb 0.44 -0.99 -0.11 0.00 -1.01 0.00 0.00 31.44 29.76 1sr2 n GLU 794 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1sr2 s SER 795 N -5.42 5.36 0.41 1.62 0.01 -1.26 -5.08 113.70 109.33 1sr2 s SER 795 Ca 0.70 -1.54 -0.25 0.00 1.31 0.00 0.00 55.95 56.17 1sr2 s SER 795 Cb -0.03 -1.88 -0.11 0.00 0.21 0.00 0.00 66.02 64.21 1sr2 s SER 795 CO 0.48 -0.46 1.04 -2.65 0.41 0.00 0.00 173.24 172.06 1sr2 n PRO 796 N 4.76 1.42 -1.87 12.44 -0.02 -1.26 -4.85 135.00 145.63 1sr2 n PRO 796 Ca -0.09 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.48 1sr2 n PRO 796 Cb 0.43 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1sr2 n PRO 796 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1sr2 s LEU 797 N -0.55 3.45 0.00 2.45 1.02 -1.26 -2.24 118.68 121.55 1sr2 s LEU 797 Ca 0.62 1.30 0.00 0.00 0.02 0.00 0.00 54.13 56.07 1sr2 s LEU 797 Cb -0.57 -3.29 0.00 0.00 0.02 0.00 0.00 46.19 42.35 1sr2 s LEU 797 CO 0.57 -1.97 0.00 0.61 0.02 0.00 0.00 176.35 175.59 1sr2 n GLY 798 N 5.59 1.48 1.92 -3.19 0.00 -1.26 -5.03 105.19 104.70 1sr2 n GLY 798 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.33 -0.23 2.26 -0.02 0.00 -0.95 -5.02 105.19 100.90 1sr2 n GLY 799 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1sr2 n GLY 799 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sr2 n ASP 800 N -2.86 1.04 0.11 1.61 -0.08 -1.26 -4.92 116.55 110.20 1sr2 n ASP 800 Ca 0.00 -2.91 -0.03 0.00 -1.51 0.00 0.00 54.79 50.34 1sr2 n ASP 800 Cb 0.00 -0.64 0.16 0.00 2.34 0.00 0.00 41.12 42.99 1sr2 n ASP 800 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1sr2 h GLU 801 N 3.77 0.15 0.10 -0.67 3.07 -1.94 -2.98 114.58 116.08 1sr2 h GLU 801 Ca 0.10 -0.10 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1sr2 h GLU 801 Cb 0.85 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 1sr2 h GLU 801 CO 0.54 0.68 -0.05 -0.97 -1.40 0.00 0.00 179.01 177.81 1sr2 h ASN 802 N 0.11 -0.11 -0.43 1.42 -0.73 -1.91 0.23 115.58 114.16 1sr2 h ASN 802 Ca -0.00 -0.14 -0.06 0.00 1.87 0.00 0.00 56.30 57.97 1sr2 h ASN 802 Cb 1.04 0.03 -0.02 0.00 0.27 0.00 0.00 38.32 39.63 1sr2 h ASN 802 CO 0.08 0.07 0.07 0.00 -0.37 0.00 0.00 177.43 177.28 1sr2 h ALA 803 N 0.59 1.18 -0.25 1.57 0.00 -1.97 0.25 119.26 120.64 1sr2 h ALA 803 Ca -0.01 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1sr2 h ALA 803 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1sr2 h ALA 803 CO 0.02 0.54 0.04 0.37 0.00 0.00 0.00 179.25 180.22 1sr2 h GLN 804 N 0.75 0.41 -0.01 0.00 4.15 -1.34 0.83 115.11 119.90 1sr2 h GLN 804 Ca 0.16 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.40 1sr2 h GLN 804 Cb 0.36 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1sr2 h GLN 804 CO 0.01 0.54 -0.29 1.25 -1.93 0.00 0.00 178.83 178.41 1sr2 h LEU 805 N 0.22 0.03 -0.12 -2.39 5.85 -0.22 -1.13 115.31 117.54 1sr2 h LEU 805 Ca 0.07 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 1sr2 h LEU 805 Cb 0.33 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1sr2 h LEU 805 CO 0.01 0.32 -0.42 -0.74 -0.34 0.00 0.00 178.44 177.27 1sr2 h HIS 806 N 0.02 0.65 -0.01 1.25 2.76 -0.68 -2.23 115.15 116.92 1sr2 h HIS 806 Ca 0.00 -0.27 -0.09 0.00 -2.20 0.00 0.00 60.37 57.81 1sr2 h HIS 806 Cb 0.53 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.37 1sr2 h HIS 806 CO 0.00 1.02 -0.44 0.00 -1.30 0.00 0.00 177.93 177.22 1sr2 h ALA 807 N 0.50 1.26 0.00 5.26 0.00 -0.46 -2.31 119.26 123.51 1sr2 h ALA 807 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1sr2 h ALA 807 Cb 1.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1sr2 h ALA 807 CO 0.09 0.55 0.00 -1.13 0.00 0.00 0.00 179.25 178.76 1sr2 n SER 808 N -4.02 0.52 0.00 0.00 3.41 -0.46 -4.89 113.62 108.18 1sr2 n SER 808 Ca -0.02 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1sr2 n SER 808 Cb 0.46 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 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 0.96 1.01 0.28 5.00 0.00 -0.87 -4.87 105.19 106.70 1sr2 n GLY 809 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.00 0.11 0.05 1.61 4.01 -1.10 -3.62 117.16 116.23 1sr2 n TYR 810 Ca 0.00 -0.06 0.11 0.00 -0.16 0.00 0.00 57.90 57.79 1sr2 n TYR 810 Cb 0.00 0.00 0.57 0.00 -0.31 0.00 0.00 39.34 39.60 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 1.09 0.23 -0.66 -0.72 3.20 -1.68 -1.75 116.97 116.68 1sr2 h TYR 811 Ca 0.00 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1sr2 h TYR 811 Cb 0.24 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 1sr2 h TYR 811 CO 0.06 0.13 0.41 0.00 -1.64 0.00 0.00 178.16 177.12 1sr2 h ALA 812 N 1.81 0.85 -0.34 1.82 0.00 -1.89 -2.28 119.26 119.24 1sr2 h ALA 812 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1sr2 h ALA 812 Cb 0.35 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1sr2 h ALA 812 CO -0.03 0.19 -0.02 -0.07 0.00 0.00 0.00 179.25 179.31 1sr2 h LEU 813 N 0.82 0.50 -0.71 0.00 3.38 -1.60 -2.20 115.31 115.50 1sr2 h LEU 813 Ca 0.26 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1sr2 h LEU 813 Cb -0.00 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1sr2 h LEU 813 CO -0.09 0.59 0.44 0.15 0.09 0.00 0.00 178.44 179.61 1sr2 h PHE 814 N 0.51 0.92 -0.58 1.13 3.57 -1.29 -2.24 116.94 118.97 1sr2 h PHE 814 Ca 0.11 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1sr2 h PHE 814 Cb 0.36 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.80 1sr2 h PHE 814 CO 0.01 0.61 0.00 1.33 -2.23 0.00 0.00 178.31 178.03 1sr2 n VAL 815 N -4.55 1.61 0.00 1.41 0.24 -1.13 -4.03 118.33 111.88 1sr2 n VAL 815 Ca 0.06 -1.20 0.00 0.00 -2.04 0.00 0.00 64.34 61.16 1sr2 n VAL 815 Cb 0.04 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 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 0.96 0.00 0.11 -1.34 2.03 -0.84 -4.83 116.55 112.63 1sr2 n ASP 816 Ca 0.23 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.59 1sr2 n ASP 816 Cb 0.77 -0.12 0.01 0.00 -0.72 0.00 0.00 41.12 41.06 1sr2 n ASP 816 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1sr2 h THR 817 N 0.00 0.42 0.56 5.18 1.03 -1.66 -3.31 112.91 115.13 1sr2 h THR 817 Ca 0.00 -1.69 -0.03 0.00 -0.01 0.00 0.00 66.41 64.68 1sr2 h THR 817 Cb 0.00 2.03 0.01 0.00 -1.07 0.00 0.00 68.15 69.11 1sr2 h THR 817 CO 0.00 0.24 -0.27 0.58 -0.01 0.00 0.00 175.52 176.06 1sr2 h VAL 818 N 0.00 0.26 -0.57 0.00 2.07 -1.67 0.19 116.25 116.52 1sr2 h VAL 818 Ca -0.05 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 1sr2 h VAL 818 Cb 1.31 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 1sr2 h VAL 818 CO 0.03 0.04 0.17 -0.65 0.02 0.00 0.00 177.57 177.18 1sr2 h PRO 819 N -1.06 0.86 -0.06 1.57 0.11 -1.75 -1.90 132.00 129.77 1sr2 h PRO 819 Ca -0.08 -0.16 -0.16 0.00 0.11 0.00 0.00 66.00 65.71 1sr2 h PRO 819 Cb 0.64 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 1sr2 h PRO 819 CO 0.13 0.75 -0.66 -0.44 -0.21 0.00 0.00 178.00 177.56 1sr2 h ASP 820 N 0.84 0.29 -0.53 -2.05 3.32 -1.64 -1.46 116.42 115.19 1sr2 h ASP 820 Ca 0.19 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 1sr2 h ASP 820 Cb 0.26 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1sr2 h ASP 820 CO -0.01 0.87 -0.05 0.44 -1.72 0.00 0.00 179.24 178.78 1sr2 h ASP 821 N 0.18 0.98 -0.58 6.45 5.19 -0.30 0.15 116.42 128.48 1sr2 h ASP 821 Ca -0.01 -0.29 0.00 0.00 -0.62 0.00 0.00 57.03 56.11 1sr2 h ASP 821 Cb 1.20 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 40.41 1sr2 h ASP 821 CO 0.10 1.06 0.37 0.58 -3.12 0.00 0.00 179.24 178.24 1sr2 h VAL 822 N 0.90 1.16 -0.43 -1.35 2.07 -1.10 0.35 116.25 117.84 1sr2 h VAL 822 Ca 0.15 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.39 1sr2 h VAL 822 Cb 0.59 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1sr2 h VAL 822 CO 0.04 0.15 0.25 0.11 0.02 0.00 0.00 177.57 178.14 1sr2 h LYS 823 N 0.79 0.50 -0.24 1.57 1.57 -0.87 -0.42 116.57 119.47 1sr2 h LYS 823 Ca 0.21 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.98 1sr2 h LYS 823 Cb -0.07 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1sr2 h LYS 823 CO -0.04 0.33 0.11 -0.09 -0.57 0.00 0.00 179.45 179.18 1sr2 h ARG 824 N 0.51 0.23 -0.61 3.15 2.43 -0.20 -0.54 114.38 119.34 1sr2 h ARG 824 Ca 0.17 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.41 1sr2 h ARG 824 Cb 0.02 -0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.45 1sr2 h ARG 824 CO -0.08 0.15 0.27 -0.07 -1.51 0.00 0.00 179.97 178.72 1sr2 h LEU 825 N 0.23 0.32 -1.44 3.80 3.38 0.09 0.16 115.31 121.85 1sr2 h LEU 825 Ca 0.10 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1sr2 h LEU 825 Cb 0.04 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1sr2 h LEU 825 CO -0.08 0.19 0.09 1.88 0.09 0.00 0.00 178.44 180.61 1sr2 h TYR 826 N 0.48 0.45 -0.27 1.13 0.05 -0.66 -0.19 116.97 117.97 1sr2 h TYR 826 Ca 0.30 -0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.93 1sr2 h TYR 826 Cb 0.32 -0.14 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 1sr2 h TYR 826 CO -0.14 0.40 -0.34 1.15 -1.05 0.00 0.00 178.16 178.17 1sr2 h THR 827 N 0.45 1.30 -0.47 -2.88 2.02 0.73 -1.45 112.91 112.62 1sr2 h THR 827 Ca 0.11 -1.53 -0.06 0.00 0.77 0.00 0.00 66.41 65.70 1sr2 h THR 827 Cb 0.16 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 1sr2 h THR 827 CO -0.01 0.49 0.05 -0.33 0.37 0.00 0.00 175.52 176.09 1sr2 h GLU 828 N 0.44 0.74 -0.75 6.66 4.39 -0.38 -2.64 114.58 123.03 1sr2 h GLU 828 Ca 0.03 -0.17 -0.05 0.00 0.34 0.00 0.00 59.36 59.51 1sr2 h GLU 828 Cb 0.93 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.44 1sr2 h GLU 828 CO 0.08 0.72 0.28 0.00 -1.16 0.00 0.00 179.01 178.93 1sr2 h ALA 829 N 1.34 0.98 0.00 3.43 0.00 -0.86 0.26 119.26 124.41 1sr2 h ALA 829 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1sr2 h ALA 829 Cb 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1sr2 h ALA 829 CO 0.01 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.89 1sr2 h ALA 830 N 1.14 1.00 -0.26 0.00 0.00 -0.92 -0.72 119.26 119.50 1sr2 h ALA 830 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1sr2 h ALA 830 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1sr2 h ALA 830 CO -0.02 0.00 0.00 2.41 0.00 0.00 0.00 179.25 181.64 1sr2 n THR 831 N -2.61 0.61 -2.67 0.00 -1.04 -0.64 -4.97 114.28 102.95 1sr2 n THR 831 Ca 0.00 -0.80 -0.19 0.00 -2.04 0.00 0.00 64.05 61.02 1sr2 n THR 831 Cb 0.18 0.81 0.00 0.00 -1.82 0.00 0.00 70.33 69.50 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 0.75 -5.07 -4.03 8.00 7.64 -0.21 -4.87 113.62 115.83 1sr2 n SER 832 Ca 0.12 -0.06 -0.43 0.00 1.01 0.00 0.00 58.87 59.51 1sr2 n SER 832 Cb 0.42 -4.21 0.00 0.00 -1.01 0.00 0.00 64.21 59.41 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 -2.10 4.93 0.27 6.43 -0.08 0.73 -4.74 116.55 122.00 1sr2 n ASP 833 Ca -0.16 -3.03 0.14 0.00 -1.51 0.00 0.00 54.79 50.23 1sr2 n ASP 833 Cb 0.63 -1.54 0.78 0.00 2.34 0.00 0.00 41.12 43.33 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 6.21 0.00 -0.60 -0.67 0.04 -1.89 0.17 116.94 120.19 1sr2 h PHE 834 Ca 0.41 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.13 1sr2 h PHE 834 Cb 0.70 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.82 1sr2 h PHE 834 CO 1.26 0.08 0.21 0.00 -0.60 0.00 0.00 178.31 179.26 1sr2 h ALA 835 N 1.92 0.79 -0.01 2.45 0.00 -1.97 -0.12 119.26 122.31 1sr2 h ALA 835 Ca -0.00 -0.19 -0.20 0.00 0.00 0.00 0.00 54.91 54.52 1sr2 h ALA 835 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1sr2 h ALA 835 CO 0.01 0.43 -0.86 0.00 0.00 0.00 0.00 179.25 178.83 1sr2 h ALA 836 N 1.07 0.51 0.06 0.00 0.00 -1.60 -2.09 119.26 117.21 1sr2 h ALA 836 Ca 0.20 -0.70 0.02 0.00 0.00 0.00 0.00 54.91 54.43 1sr2 h ALA 836 Cb 0.26 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1sr2 h ALA 836 CO -0.01 0.87 -0.20 -0.07 0.00 0.00 0.00 179.25 179.83 1sr2 h LEU 837 N 0.16 -0.57 -0.65 0.00 4.07 -0.47 0.14 115.31 117.98 1sr2 h LEU 837 Ca -0.05 0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 1sr2 h LEU 837 Cb 1.48 0.23 -0.03 0.00 1.08 0.00 0.00 40.66 43.42 1sr2 h LEU 837 CO 0.14 -0.28 0.36 0.00 -1.08 0.00 0.00 178.44 177.58 1sr2 h ALA 838 N 0.49 0.83 -0.27 1.53 0.00 -0.99 0.67 119.26 121.52 1sr2 h ALA 838 Ca 0.04 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1sr2 h ALA 838 Cb 0.40 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1sr2 h ALA 838 CO -0.14 0.35 0.16 1.96 0.00 0.00 0.00 179.25 181.58 1sr2 h GLN 839 N 0.89 0.36 -0.45 0.00 1.08 -1.06 0.15 115.11 116.08 1sr2 h GLN 839 Ca 0.23 -0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 57.27 1sr2 h GLN 839 Cb 0.04 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 1sr2 h GLN 839 CO -0.04 0.28 -0.23 1.15 -0.95 0.00 0.00 178.83 179.04 1sr2 h THR 840 N 0.34 1.27 -0.09 -0.54 2.02 -0.53 -0.51 112.91 114.87 1sr2 h THR 840 Ca 0.10 -1.38 -0.06 0.00 0.77 0.00 0.00 66.41 65.83 1sr2 h THR 840 Cb 0.01 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1sr2 h THR 840 CO -0.02 0.47 -0.23 0.00 0.37 0.00 0.00 175.52 176.12 1sr2 h ALA 841 N 0.93 1.46 -0.08 6.16 0.00 -0.62 0.28 119.26 127.38 1sr2 h ALA 841 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1sr2 h ALA 841 Cb 0.79 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1sr2 h ALA 841 CO 0.07 0.39 -0.04 1.25 0.00 0.00 0.00 179.25 180.92 1sr2 h HIS 842 N 0.14 0.19 -0.31 0.00 6.17 -0.32 -1.40 115.15 119.61 1sr2 h HIS 842 Ca 0.02 -0.05 0.02 0.00 0.71 0.00 0.00 60.37 61.08 1sr2 h HIS 842 Cb 0.48 -0.04 -0.02 0.00 2.52 0.00 0.00 27.41 30.35 1sr2 h HIS 842 CO 0.00 0.53 0.16 -0.09 0.71 0.00 0.00 177.93 179.24 1sr2 h ARG 843 N -0.20 0.32 -0.75 5.26 1.12 -0.60 -2.01 114.38 117.52 1sr2 h ARG 843 Ca 0.02 -0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 58.85 1sr2 h ARG 843 Cb 0.48 -0.07 -0.04 0.00 -0.01 0.00 0.00 29.97 30.33 1sr2 h ARG 843 CO 0.01 0.21 0.41 -0.07 -3.11 0.00 0.00 179.97 177.43 1sr2 h LEU 844 N 0.33 0.93 -0.48 3.80 3.38 -0.46 -0.53 115.31 122.28 1sr2 h LEU 844 Ca 0.13 -0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.10 1sr2 h LEU 844 Cb 0.04 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 1sr2 h LEU 844 CO -0.09 0.75 0.11 0.50 0.09 0.00 0.00 178.44 179.80 1sr2 h LYS 845 N 1.05 0.24 -0.67 1.13 1.63 -0.81 -1.89 116.57 117.25 1sr2 h LYS 845 Ca 0.27 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 60.03 1sr2 h LYS 845 Cb 0.02 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 1sr2 h LYS 845 CO -0.04 0.16 0.32 0.78 -3.45 0.00 0.00 179.45 177.22 1sr2 h GLY 846 N 0.25 1.05 0.87 5.01 0.00 -0.41 -1.23 103.07 108.60 1sr2 h GLY 846 Ca 0.24 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 1sr2 h GLY 846 CO -0.30 0.50 -0.02 -2.08 0.00 0.00 0.00 176.54 174.63 1sr2 h VAL 847 N 0.94 1.04 -0.60 4.60 2.07 -0.95 -1.66 116.25 121.69 1sr2 h VAL 847 Ca 0.23 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 1sr2 h VAL 847 Cb 0.13 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1sr2 h VAL 847 CO -0.03 0.07 0.04 -0.26 0.02 0.00 0.00 177.57 177.42 1sr2 h PHE 848 N -0.20 1.08 -0.97 1.57 -1.00 -1.27 0.45 116.94 116.61 1sr2 h PHE 848 Ca -0.01 -0.16 0.01 0.00 2.81 0.00 0.00 57.97 60.62 1sr2 h PHE 848 Cb 0.17 -0.29 -0.05 0.00 3.61 0.00 0.00 35.95 39.39 1sr2 h PHE 848 CO -0.03 0.94 0.63 0.00 -1.61 0.00 0.00 178.31 178.24 1sr2 h ALA 849 N 1.10 1.28 0.00 2.45 0.00 -1.15 0.31 119.26 123.25 1sr2 h ALA 849 Ca 0.18 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sr2 h ALA 849 Cb 0.49 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1sr2 h ALA 849 CO 0.02 0.65 -0.18 0.00 0.00 0.00 0.00 179.25 179.75 1sr2 h MET 850 N 1.32 0.00 -0.02 0.00 -0.00 -0.63 -2.92 114.93 112.69 1sr2 h MET 850 Ca 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.05 1sr2 h MET 850 Cb -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.47 1sr2 h MET 850 CO -0.07 0.00 -0.04 1.28 -0.00 0.00 0.00 176.91 178.07 1sr2 n LEU 851 N -2.36 1.62 -0.29 -0.10 4.77 0.15 -4.91 117.00 115.89 1sr2 n LEU 851 Ca 0.05 -0.53 -0.04 0.00 -0.03 0.00 0.00 56.01 55.46 1sr2 n LEU 851 Cb 0.45 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 1sr2 n LEU 851 CO 0.33 0.27 -0.04 -3.20 -1.33 0.00 0.00 177.39 173.42 1sr2 n ASN 852 N 0.20 -3.89 -4.20 -1.43 4.05 0.48 -4.89 115.26 105.58 1sr2 n ASN 852 Ca 0.17 0.09 -0.43 0.00 0.45 0.00 0.00 54.58 54.86 1sr2 n ASN 852 Cb 0.38 -1.71 0.00 0.00 1.23 0.00 0.00 39.78 39.68 1sr2 n ASN 852 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1sr2 n LEU 853 N -0.42 5.87 0.15 1.20 4.77 0.78 -4.86 117.00 124.48 1sr2 n LEU 853 Ca -0.04 -4.53 -0.14 0.00 -0.03 0.00 0.00 56.01 51.27 1sr2 n LEU 853 Cb 0.20 -1.56 -0.07 0.00 -2.33 0.00 0.00 43.42 39.66 1sr2 n LEU 853 CO 0.06 1.01 0.65 0.58 -1.33 0.00 0.00 177.39 178.36 1sr2 h VAL 854 N 4.25 0.33 -0.65 4.08 2.07 -1.91 0.25 116.25 124.66 1sr2 h VAL 854 Ca 0.36 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.89 1sr2 h VAL 854 Cb 0.76 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1sr2 h VAL 854 CO 1.42 0.00 0.43 -0.65 0.02 0.00 0.00 177.57 178.80 1sr2 h PRO 855 N -0.59 0.83 -0.39 1.57 0.11 -1.97 0.19 132.00 131.75 1sr2 h PRO 855 Ca 0.01 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.00 1sr2 h PRO 855 Cb 0.59 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1sr2 h PRO 855 CO -0.14 0.55 -0.02 0.78 -0.21 0.00 0.00 178.00 178.96 1sr2 h GLY 856 N 0.85 0.76 1.11 -0.55 0.00 -1.83 -0.06 103.07 103.34 1sr2 h GLY 856 Ca 0.25 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 1sr2 h GLY 856 CO -0.06 0.53 0.30 1.70 0.00 0.00 0.00 176.54 179.01 1sr2 h LYS 857 N 0.52 1.13 -0.40 4.80 3.11 0.18 -1.43 116.57 124.48 1sr2 h LYS 857 Ca 0.11 -0.20 -0.05 0.00 -2.81 0.00 0.00 60.65 57.70 1sr2 h LYS 857 Cb 0.50 -0.18 -0.02 0.00 -1.00 0.00 0.00 32.23 31.53 1sr2 h LYS 857 CO 0.02 0.92 0.05 -0.56 -2.81 0.00 0.00 179.45 177.08 1sr2 h GLN 858 N 1.11 0.60 -0.65 1.90 3.07 -0.42 0.95 115.11 121.67 1sr2 h GLN 858 Ca 0.25 -0.12 -0.02 0.00 0.09 0.00 0.00 58.65 58.85 1sr2 h GLN 858 Cb 0.22 -0.09 -0.03 0.00 0.08 0.00 0.00 27.48 27.66 1sr2 h GLN 858 CO -0.02 0.59 0.31 -0.07 0.09 0.00 0.00 178.83 179.73 1sr2 h LEU 859 N 0.58 0.85 -1.43 0.06 3.38 -0.31 -1.12 115.31 117.33 1sr2 h LEU 859 Ca 0.13 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1sr2 h LEU 859 Cb 0.29 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1sr2 h LEU 859 CO 0.00 0.74 -0.28 0.00 0.09 0.00 0.00 178.44 179.00 1sr2 h GLU 861 N 0.00 -0.36 -0.65 0.00 4.39 -0.16 -1.91 114.58 115.89 1sr2 h GLU 861 Ca -0.00 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 1sr2 h GLU 861 Cb 0.57 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 1sr2 h GLU 861 CO 0.04 -0.04 0.29 1.15 -1.16 0.00 0.00 179.01 179.28 1sr2 h THR 862 N -0.71 1.22 0.02 1.13 2.02 -1.00 -2.12 112.91 113.47 1sr2 h THR 862 Ca -0.04 -0.65 0.01 0.00 0.77 0.00 0.00 66.41 66.51 1sr2 h THR 862 Cb 0.49 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1sr2 h THR 862 CO 0.06 0.27 -0.10 0.25 0.37 0.00 0.00 175.52 176.37 1sr2 h LEU 863 N 0.92 -0.27 -0.88 2.58 6.46 -0.62 -0.27 115.31 123.23 1sr2 h LEU 863 Ca 0.22 0.04 0.06 0.00 -0.12 0.00 0.00 57.88 58.08 1sr2 h LEU 863 Cb 0.14 0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.12 1sr2 h LEU 863 CO -0.02 -0.14 0.55 -0.33 -0.62 0.00 0.00 178.44 177.88 1sr2 h GLU 864 N -0.18 0.99 -0.65 1.25 5.08 -0.96 0.14 114.58 120.26 1sr2 h GLU 864 Ca 0.03 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1sr2 h GLU 864 Cb 0.21 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1sr2 h GLU 864 CO -0.08 0.66 0.21 1.25 -1.00 0.00 0.00 179.01 180.05 1sr2 h HIS 865 N 1.02 1.00 0.00 4.33 2.76 -1.01 0.12 115.15 123.37 1sr2 h HIS 865 Ca 0.38 -0.08 -0.11 0.00 -2.20 0.00 0.00 60.37 58.36 1sr2 h HIS 865 Cb 0.14 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.79 1sr2 h HIS 865 CO -0.03 0.79 -0.51 -0.07 -1.30 0.00 0.00 177.93 176.82 1sr2 h LEU 866 N 0.95 0.00 -0.06 0.26 3.38 0.24 -0.52 115.31 119.56 1sr2 h LEU 866 Ca 0.21 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.96 1sr2 h LEU 866 Cb 0.25 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1sr2 h LEU 866 CO -0.01 0.51 -0.82 0.40 0.09 0.00 0.00 178.44 178.61 1sr2 h ILE 867 N 0.00 1.31 -0.57 1.22 2.04 -0.23 0.97 117.51 122.26 1sr2 h ILE 867 Ca -0.01 -2.07 -0.05 0.00 1.00 0.00 0.00 64.86 63.73 1sr2 h ILE 867 Cb 1.08 2.26 -0.03 0.00 -0.74 0.00 0.00 36.82 39.40 1sr2 h ILE 867 CO 0.07 0.64 0.13 0.08 0.00 0.00 0.00 178.15 179.07 1sr2 h ARG 868 N 0.33 0.88 -0.01 2.37 -0.00 -0.66 -0.09 114.38 117.20 1sr2 h ARG 868 Ca -0.08 -0.19 0.00 0.00 -0.00 0.00 0.00 59.98 59.71 1sr2 h ARG 868 Cb 1.47 -0.13 0.00 0.00 -0.00 0.00 0.00 29.97 31.31 1sr2 h ARG 868 CO 0.16 0.79 0.00 -1.91 -0.00 0.00 0.00 179.97 179.02 1sr2 n GLU 869 N -4.26 1.08 -3.75 0.08 4.07 -0.21 -4.92 120.64 112.72 1sr2 n GLU 869 Ca 0.04 -0.12 -0.23 0.00 -0.06 0.00 0.00 57.16 56.79 1sr2 n GLU 869 Cb 0.24 -1.45 0.02 0.00 -0.06 0.00 0.00 31.44 30.19 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 -0.81 -4.76 -3.52 5.31 4.76 -0.05 -4.93 118.16 114.17 1sr2 n LYS 870 Ca 0.21 0.59 -0.41 0.00 -2.87 0.00 0.00 58.31 55.83 1sr2 n LYS 870 Cb 0.13 -5.13 -0.05 0.00 -1.84 0.00 0.00 35.03 28.14 1sr2 n LYS 870 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1sr2 s ASP 871 N -4.26 6.18 0.14 4.39 2.15 0.24 -4.96 116.67 120.54 1sr2 s ASP 871 Ca 0.07 -3.04 -0.24 0.00 0.43 0.00 0.00 52.55 49.77 1sr2 s ASP 871 Cb -0.03 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.55 1sr2 s ASP 871 CO 0.82 -0.40 1.63 0.58 -0.17 0.00 0.00 175.17 177.63 1sr2 h VAL 872 N 4.68 0.38 -1.00 1.11 2.07 -1.92 0.76 116.25 122.34 1sr2 h VAL 872 Ca 0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.71 1sr2 h VAL 872 Cb 0.95 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1sr2 h VAL 872 CO 0.79 0.00 0.64 -0.65 0.02 0.00 0.00 177.57 178.36 1sr2 h PRO 873 N -0.30 1.02 -0.39 1.57 0.11 -1.98 0.78 132.00 132.82 1sr2 h PRO 873 Ca 0.12 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.11 1sr2 h PRO 873 Cb 0.47 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1sr2 h PRO 873 CO -0.35 0.68 0.04 0.78 -0.21 0.00 0.00 178.00 178.94 1sr2 h GLY 874 N 1.06 0.71 0.83 -0.55 0.00 -1.72 -1.75 103.07 101.66 1sr2 h GLY 874 Ca 0.47 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1sr2 h GLY 874 CO -0.23 0.46 -0.23 -2.22 0.00 0.00 0.00 176.54 174.32 1sr2 h ILE 875 N 0.50 0.51 -0.56 2.60 2.04 0.22 -1.54 117.51 121.29 1sr2 h ILE 875 Ca 0.12 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.03 1sr2 h ILE 875 Cb 0.40 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1sr2 h ILE 875 CO 0.01 0.00 0.28 -0.33 0.00 0.00 0.00 178.15 178.11 1sr2 h GLU 876 N -0.55 0.51 -0.86 2.37 5.08 -0.87 -0.37 114.58 119.90 1sr2 h GLU 876 Ca -0.03 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1sr2 h GLU 876 Cb 0.47 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1sr2 h GLU 876 CO 0.01 0.34 0.46 -0.22 -1.00 0.00 0.00 179.01 178.60 1sr2 h LYS 877 N 0.53 1.20 -0.03 2.33 3.64 -1.16 -2.04 116.57 121.04 1sr2 h LYS 877 Ca 0.25 -0.15 -0.16 0.00 -1.27 0.00 0.00 60.65 59.33 1sr2 h LYS 877 Cb 0.18 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1sr2 h LYS 877 CO -0.18 0.89 -0.70 1.88 -2.27 0.00 0.00 179.45 179.07 1sr2 h TYR 878 N 1.20 0.24 -0.29 1.91 -1.99 -0.66 -1.31 116.97 116.07 1sr2 h TYR 878 Ca 0.30 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.92 1sr2 h TYR 878 Cb 0.04 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 1sr2 h TYR 878 CO 0.01 0.82 0.15 0.82 -0.00 0.00 0.00 178.16 179.95 1sr2 h ILE 879 N 0.12 1.14 0.00 -2.88 2.04 -0.62 0.99 117.51 118.30 1sr2 h ILE 879 Ca -0.02 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.40 1sr2 h ILE 879 Cb 1.24 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1sr2 h ILE 879 CO 0.10 0.14 -0.30 0.77 0.00 0.00 0.00 178.15 178.86 1sr2 h SER 880 N 0.34 0.00 -0.14 1.72 4.64 -1.29 -0.34 113.55 118.48 1sr2 h SER 880 Ca 0.10 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.34 1sr2 h SER 880 Cb 0.09 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 1sr2 h SER 880 CO -0.01 0.30 -0.17 -0.78 -0.87 0.00 0.00 176.83 175.30 1sr2 h ASP 881 N 0.00 0.53 0.20 4.97 3.58 -0.57 0.18 116.42 125.32 1sr2 h ASP 881 Ca -0.00 -0.15 -0.11 0.00 0.42 0.00 0.00 57.03 57.18 1sr2 h ASP 881 Cb 0.56 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 1sr2 h ASP 881 CO 0.04 0.71 -0.41 0.40 -2.88 0.00 0.00 179.24 177.11 1sr2 h ILE 882 N 0.49 1.31 -0.18 2.25 2.04 0.21 -0.93 117.51 122.69 1sr2 h ILE 882 Ca 0.08 -1.52 -0.13 0.00 1.00 0.00 0.00 64.86 64.30 1sr2 h ILE 882 Cb 0.57 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1sr2 h ILE 882 CO 0.04 0.46 -0.38 -0.78 0.00 0.00 0.00 178.15 177.48 1sr2 h ASP 883 N 0.23 0.65 0.08 1.72 3.58 -0.22 -0.91 116.42 121.55 1sr2 h ASP 883 Ca 0.02 -0.56 -0.08 0.00 0.42 0.00 0.00 57.03 56.83 1sr2 h ASP 883 Cb 0.82 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 1sr2 h ASP 883 CO 0.06 1.09 -0.26 0.77 -2.88 0.00 0.00 179.24 178.03 1sr2 h SER 884 N 0.24 0.29 0.61 2.28 4.64 -0.66 0.29 113.55 121.24 1sr2 h SER 884 Ca 0.00 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1sr2 h SER 884 Cb 0.99 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1sr2 h SER 884 CO 0.08 0.56 -0.43 0.22 -0.87 0.00 0.00 176.83 176.39 1sr2 h TYR 885 N 0.27 -1.14 -0.44 4.77 3.20 -0.91 -1.95 116.97 120.76 1sr2 h TYR 885 Ca 0.04 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 1sr2 h TYR 885 Cb 0.60 0.42 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 1sr2 h TYR 885 CO 0.01 -0.62 0.05 0.28 -1.64 0.00 0.00 178.16 176.24 1sr2 h VAL 886 N -1.00 1.21 -0.11 1.81 2.07 -0.95 -1.90 116.25 117.39 1sr2 h VAL 886 Ca -0.07 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.66 1sr2 h VAL 886 Cb 0.82 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1sr2 h VAL 886 CO 0.04 0.29 -0.15 0.11 0.02 0.00 0.00 177.57 177.89 1sr2 h LYS 887 N 0.65 -0.18 -0.15 1.57 1.57 -0.27 -0.90 116.57 118.87 1sr2 h LYS 887 Ca 0.14 0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 1sr2 h LYS 887 Cb 0.33 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1sr2 h LYS 887 CO 0.01 -0.12 -0.37 0.66 -0.57 0.00 0.00 179.45 179.05 1sr2 h SER 888 N -0.19 0.32 0.62 0.86 4.64 -0.97 -3.01 113.55 115.82 1sr2 h SER 888 Ca 0.08 -0.13 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 1sr2 h SER 888 Cb 0.31 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.29 1sr2 h SER 888 CO -0.22 0.67 -0.61 -0.07 -0.87 0.00 0.00 176.83 175.74 1sr2 h LEU 889 N 0.27 0.00 0.00 5.97 4.07 -0.94 -3.52 115.31 121.15 1sr2 h LEU 889 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1sr2 h LEU 889 Cb 0.78 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.52 1sr2 h LEU 889 CO 0.06 0.61 0.00 0.18 -1.08 0.00 0.00 178.44 178.21