#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sr2 s GLN 776 N 0.00 0.52 -0.70 2.12 2.00 -1.26 -4.77 119.66 117.58 1sr2 s GLN 776 Ca 0.00 0.94 0.00 0.00 -2.00 0.00 0.00 55.36 54.30 1sr2 s GLN 776 Cb 0.00 0.16 0.00 0.00 0.80 0.00 0.00 33.01 33.97 1sr2 s GLN 776 CO 0.00 -0.12 0.00 -1.91 -0.50 0.00 0.00 175.29 172.76 1sr2 n GLU 777 N 4.12 -0.52 0.05 1.67 4.07 -1.26 -4.49 120.64 124.28 1sr2 n GLU 777 Ca -0.18 0.70 0.00 0.00 -0.06 0.00 0.00 57.16 57.62 1sr2 n GLU 777 Cb 0.57 -4.48 0.00 0.00 -0.06 0.00 0.00 31.44 27.47 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 1.12 0.00 -0.62 4.31 0.00 -1.26 -5.09 120.51 118.97 1sr2 n ALA 778 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1sr2 n ALA 778 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1sr2 n ALA 778 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sr2 n VAL 779 N -2.61 0.00 -4.04 0.00 0.31 -1.26 -4.43 118.33 106.29 1sr2 n VAL 779 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 1sr2 n VAL 779 Cb 0.00 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 32.78 1sr2 n VAL 779 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1sr2 s LEU 780 N 0.00 3.67 0.00 7.52 1.43 -1.26 -4.83 118.68 125.21 1sr2 s LEU 780 Ca 0.00 -1.56 0.00 0.00 -1.03 0.00 0.00 54.13 51.54 1sr2 s LEU 780 Cb 0.00 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.69 1sr2 s LEU 780 CO 0.00 -0.24 0.00 0.00 0.23 0.00 0.00 176.35 176.34 1sr2 n GLN 781 N 4.41 0.00 0.00 1.70 6.02 -1.26 -4.62 117.38 123.63 1sr2 n GLN 781 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1sr2 n GLN 781 Cb 0.42 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.68 1sr2 n GLN 781 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 1sr2 n LEU 782 N 0.00 0.00 0.00 1.08 -0.00 -1.26 -4.92 117.00 111.89 1sr2 n LEU 782 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1sr2 n LEU 782 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.44 1sr2 n LEU 782 CO 0.00 0.00 0.84 0.00 -0.00 0.00 0.00 177.39 178.23 1sr2 n ILE 783 N 0.00 0.00 0.00 1.47 3.06 -1.26 -5.11 119.36 117.52 1sr2 n ILE 783 Ca 0.00 -0.47 0.00 0.00 -2.50 0.00 0.00 62.75 59.78 1sr2 n ILE 783 Cb 0.00 0.71 0.00 0.00 0.54 0.00 0.00 39.64 40.89 1sr2 n ILE 783 CO 0.00 0.00 0.00 -1.84 -2.50 0.00 0.00 176.55 172.21 1sr2 n GLU 784 N -0.74 0.00 -3.40 9.51 0.00 -1.26 -4.88 120.64 119.86 1sr2 n GLU 784 Ca -0.01 0.39 -0.20 0.00 0.00 0.00 0.00 57.16 57.34 1sr2 n GLU 784 Cb 0.56 -0.88 -0.10 0.00 0.00 0.00 0.00 31.44 31.03 1sr2 n GLU 784 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1sr2 s VAL 785 N -0.83 -0.27 0.25 3.84 1.01 -1.26 -5.13 120.40 118.01 1sr2 s VAL 785 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 1sr2 s VAL 785 Cb 0.00 -0.88 -0.09 0.00 0.00 0.00 0.00 36.38 35.41 1sr2 s VAL 785 CO 0.00 -0.61 1.03 0.00 0.00 0.00 0.00 175.10 175.52 1sr2 s GLN 786 N 1.77 4.73 0.00 2.72 0.00 -1.26 -3.79 119.66 123.83 1sr2 s GLN 786 Ca 0.14 1.67 0.00 0.00 -0.00 0.00 0.00 55.36 57.16 1sr2 s GLN 786 Cb -0.16 -3.23 0.00 0.00 0.00 0.00 0.00 33.01 29.62 1sr2 s GLN 786 CO -0.16 0.33 0.00 1.28 0.00 0.00 0.00 175.29 176.73 1sr2 n LEU 787 N 1.41 0.00 0.00 2.60 4.32 -1.26 -4.53 117.00 119.54 1sr2 n LEU 787 Ca -0.01 0.00 0.14 0.00 -0.02 0.00 0.00 56.01 56.12 1sr2 n LEU 787 Cb 0.46 0.00 0.76 0.00 -1.62 0.00 0.00 43.42 43.02 1sr2 n LEU 787 CO 0.52 0.00 0.99 0.00 -1.22 0.00 0.00 177.39 177.68 1sr2 n ALA 788 N 0.00 2.45 -0.72 -1.18 0.00 -1.26 -3.93 120.51 115.87 1sr2 n ALA 788 Ca 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 53.44 53.21 1sr2 n ALA 788 Cb 0.00 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 17.99 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 -1.16 1.42 -3.79 0.00 6.02 -1.25 -4.75 117.38 113.88 1sr2 n GLN 789 Ca 0.17 -0.73 -0.13 0.00 -0.01 0.00 0.00 57.00 56.31 1sr2 n GLN 789 Cb 0.16 -1.34 -0.12 0.00 1.02 0.00 0.00 30.24 29.96 1sr2 n GLN 789 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1sr2 s GLU 790 N -0.63 0.23 0.13 -1.09 0.41 -1.25 -5.15 118.70 111.36 1sr2 s GLU 790 Ca 0.19 0.32 -0.24 0.00 -0.41 0.00 0.00 54.97 54.83 1sr2 s GLU 790 Cb 0.13 0.08 0.07 0.00 -1.78 0.00 0.00 34.13 32.62 1sr2 s GLU 790 CO -0.01 -0.05 0.74 -1.21 -0.49 0.00 0.00 175.26 174.23 1sr2 s GLU 791 N 0.30 1.23 0.04 1.61 2.02 -1.26 -5.15 118.70 117.48 1sr2 s GLU 791 Ca -0.02 -0.53 -0.06 0.00 0.02 0.00 0.00 54.97 54.39 1sr2 s GLU 791 Cb -0.03 0.52 -0.01 0.00 0.10 0.00 0.00 34.13 34.71 1sr2 s GLU 791 CO -0.01 -0.55 0.10 0.14 0.02 0.00 0.00 175.26 174.96 1sr2 s VAL 792 N -3.56 0.14 -0.05 2.63 -7.23 -1.26 -5.16 120.40 105.91 1sr2 s VAL 792 Ca 0.05 -1.13 -0.00 0.00 -1.81 0.00 0.00 61.98 59.09 1sr2 s VAL 792 Cb -0.02 -0.97 0.03 0.00 0.56 0.00 0.00 36.38 35.98 1sr2 s VAL 792 CO -0.07 -0.62 -0.01 0.28 -0.31 0.00 0.00 175.10 174.37 1sr2 s THR 793 N -2.78 0.35 -0.28 5.32 -1.32 -1.26 -5.13 115.64 110.55 1sr2 s THR 793 Ca -0.03 0.05 -0.25 0.00 -1.21 0.00 0.00 61.69 60.25 1sr2 s THR 793 Cb -0.00 -0.45 0.10 0.00 -1.51 0.00 0.00 72.50 70.64 1sr2 s THR 793 CO -0.05 0.21 0.90 -1.83 -2.21 0.00 0.00 174.62 171.64 1sr2 s GLU 794 N 1.38 0.65 -0.42 7.08 4.04 -1.26 -5.09 118.70 125.07 1sr2 s GLU 794 Ca -0.04 0.78 0.08 0.00 0.04 0.00 0.00 54.97 55.83 1sr2 s GLU 794 Cb -0.13 0.31 0.29 0.00 0.02 0.00 0.00 34.13 34.62 1sr2 s GLU 794 CO -0.02 -0.08 0.78 -1.13 -1.84 0.00 0.00 175.26 172.96 1sr2 n SER 795 N 2.45 -0.85 -0.21 0.83 3.41 -1.26 -5.13 113.62 112.86 1sr2 n SER 795 Ca -0.13 -3.12 0.00 0.00 -0.26 0.00 0.00 58.87 55.36 1sr2 n SER 795 Cb 0.56 0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 1sr2 n SER 795 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1sr2 n PRO 796 N 0.96 3.79 -2.15 4.33 -0.04 -1.26 -4.87 135.00 135.76 1sr2 n PRO 796 Ca 0.16 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.25 1sr2 n PRO 796 Cb 0.62 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.05 1sr2 n PRO 796 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1sr2 s LEU 797 N 0.00 3.26 -0.31 1.53 2.01 -1.26 -4.75 118.68 119.15 1sr2 s LEU 797 Ca 0.00 -0.05 0.09 0.00 0.01 0.00 0.00 54.13 54.18 1sr2 s LEU 797 Cb 0.00 -2.54 0.46 0.00 0.01 0.00 0.00 46.19 44.12 1sr2 s LEU 797 CO 0.00 -2.31 1.17 0.61 1.01 0.00 0.00 176.35 176.82 1sr2 n GLY 798 N 5.90 5.79 0.00 -3.19 0.00 -1.26 -4.87 105.19 107.56 1sr2 n GLY 798 Ca 0.21 -2.50 0.00 0.00 0.00 0.00 0.00 46.02 43.74 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 -0.65 2.65 2.88 -0.02 0.00 -1.26 -5.02 105.19 103.75 1sr2 n GLY 799 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 1sr2 n GLY 799 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sr2 s ASP 800 N -1.49 4.36 0.17 1.61 -1.08 -1.26 -4.95 116.67 114.03 1sr2 s ASP 800 Ca 0.00 -2.02 0.01 0.00 -0.52 0.00 0.00 52.55 50.02 1sr2 s ASP 800 Cb 0.00 -1.27 0.04 0.00 -1.46 0.00 0.00 42.92 40.22 1sr2 s ASP 800 CO 0.00 -0.38 1.41 -0.33 0.52 0.00 0.00 175.17 176.39 1sr2 h GLU 801 N 7.69 0.27 -0.61 4.34 3.07 -1.95 -3.20 114.58 124.19 1sr2 h GLU 801 Ca -0.08 -0.26 -0.01 0.00 -0.50 0.00 0.00 59.36 58.51 1sr2 h GLU 801 Cb 1.00 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.95 1sr2 h GLU 801 CO 0.51 0.94 0.33 -0.97 -1.40 0.00 0.00 179.01 178.42 1sr2 h ASN 802 N 0.17 0.77 -0.33 1.42 -0.73 -1.92 0.28 115.58 115.23 1sr2 h ASN 802 Ca -0.04 -0.10 0.01 0.00 1.87 0.00 0.00 56.30 58.04 1sr2 h ASN 802 Cb 1.41 -0.20 -0.02 0.00 0.27 0.00 0.00 38.32 39.79 1sr2 h ASN 802 CO 0.13 0.64 0.21 0.00 -0.37 0.00 0.00 177.43 178.05 1sr2 h ALA 803 N 1.16 0.42 -0.39 1.57 0.00 -1.94 0.11 119.26 120.18 1sr2 h ALA 803 Ca 0.22 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 1sr2 h ALA 803 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1sr2 h ALA 803 CO -0.03 -0.13 -0.25 0.37 0.00 0.00 0.00 179.25 179.21 1sr2 h GLN 804 N 0.44 0.86 -0.16 0.00 -0.00 -1.50 -1.39 115.11 113.36 1sr2 h GLN 804 Ca 0.12 -0.41 -0.03 0.00 -0.00 0.00 0.00 58.65 58.34 1sr2 h GLN 804 Cb -0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.42 1sr2 h GLN 804 CO -0.03 1.05 -0.05 1.25 0.00 0.00 0.00 178.83 181.05 1sr2 h LEU 805 N 0.67 0.21 -0.31 -2.39 5.85 -0.68 -0.55 115.31 118.12 1sr2 h LEU 805 Ca 0.08 -0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 1sr2 h LEU 805 Cb 0.82 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 1sr2 h LEU 805 CO 0.07 0.30 -0.18 -0.74 -0.34 0.00 0.00 178.44 177.55 1sr2 h HIS 806 N 0.23 0.78 0.00 1.25 2.76 -0.46 -2.13 115.15 117.58 1sr2 h HIS 806 Ca 0.05 -0.20 -0.06 0.00 -2.20 0.00 0.00 60.37 57.96 1sr2 h HIS 806 Cb 0.24 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1sr2 h HIS 806 CO 0.00 0.91 -0.30 0.00 -1.30 0.00 0.00 177.93 177.24 1sr2 h ALA 807 N 0.75 1.16 0.00 5.26 0.00 -0.40 -2.38 119.26 123.66 1sr2 h ALA 807 Ca 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1sr2 h ALA 807 Cb 0.72 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1sr2 h ALA 807 CO 0.05 0.37 -0.23 -1.13 0.00 0.00 0.00 179.25 178.31 1sr2 n SER 808 N -3.68 0.40 0.00 0.00 3.41 -0.30 -4.92 113.62 108.54 1sr2 n SER 808 Ca -0.01 0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1sr2 n SER 808 Cb 0.41 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 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 1.43 0.47 0.46 5.00 0.00 -0.90 -4.90 105.19 106.75 1sr2 n GLY 809 Ca 0.06 -0.42 0.14 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.98 0.00 0.27 1.61 4.01 -0.82 -3.62 117.16 115.64 1sr2 n TYR 810 Ca 0.00 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.88 1sr2 n TYR 810 Cb 0.00 -0.01 0.77 0.00 -0.31 0.00 0.00 39.34 39.80 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 2.24 0.00 -0.12 -0.72 3.20 -1.79 -1.58 116.97 118.20 1sr2 h TYR 811 Ca 0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1sr2 h TYR 811 Cb 0.49 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1sr2 h TYR 811 CO 0.00 0.09 0.07 0.00 -1.64 0.00 0.00 178.16 176.68 1sr2 h ALA 812 N 1.91 0.16 -0.80 1.82 0.00 -1.90 -1.50 119.26 118.95 1sr2 h ALA 812 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1sr2 h ALA 812 Cb 0.29 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1sr2 h ALA 812 CO 0.01 -0.31 0.35 1.25 0.00 0.00 0.00 179.25 180.55 1sr2 h LEU 813 N 0.10 1.07 -0.40 0.00 6.46 -1.60 -1.80 115.31 119.14 1sr2 h LEU 813 Ca 0.04 -0.15 0.07 0.00 -0.12 0.00 0.00 57.88 57.72 1sr2 h LEU 813 Cb 0.08 -0.28 -0.06 0.00 -0.73 0.00 0.00 40.66 39.67 1sr2 h LEU 813 CO -0.01 0.93 0.05 0.15 -0.62 0.00 0.00 178.44 178.94 1sr2 h PHE 814 N 1.15 0.07 -0.49 1.25 3.57 -0.99 -1.20 116.94 120.30 1sr2 h PHE 814 Ca 0.27 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1sr2 h PHE 814 Cb 0.17 0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1sr2 h PHE 814 CO 0.02 -0.03 0.00 1.33 -2.23 0.00 0.00 178.31 177.40 1sr2 n VAL 815 N -5.14 0.92 -0.05 1.41 0.24 -0.60 -3.61 118.33 111.51 1sr2 n VAL 815 Ca 0.03 -0.73 -0.07 0.00 -2.04 0.00 0.00 64.34 61.52 1sr2 n VAL 815 Cb 0.20 0.20 -0.02 0.00 -1.47 0.00 0.00 33.84 32.74 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 0.87 1.64 -0.03 -1.34 2.03 -0.62 -4.84 116.55 114.26 1sr2 n ASP 816 Ca 0.17 0.26 -0.21 0.00 0.52 0.00 0.00 54.79 55.54 1sr2 n ASP 816 Cb 0.52 -0.60 -0.13 0.00 -0.72 0.00 0.00 41.12 40.19 1sr2 n ASP 816 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1sr2 n THR 817 N -4.12 1.71 0.31 5.18 -1.04 -0.55 -4.44 114.28 111.33 1sr2 n THR 817 Ca -0.12 -0.62 -0.17 0.00 -2.04 0.00 0.00 64.05 61.10 1sr2 n THR 817 Cb 0.39 -1.67 -0.09 0.00 -1.82 0.00 0.00 70.33 67.14 1sr2 n THR 817 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1sr2 h VAL 818 N 0.02 0.44 -0.28 12.58 2.07 -1.69 -0.90 116.25 128.49 1sr2 h VAL 818 Ca -0.46 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.11 1sr2 h VAL 818 Cb 1.98 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 1sr2 h VAL 818 CO 0.04 0.00 0.01 -0.65 0.02 0.00 0.00 177.57 176.98 1sr2 h PRO 819 N -0.75 0.09 -0.91 1.57 0.11 -1.82 0.19 132.00 130.48 1sr2 h PRO 819 Ca -0.07 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1sr2 h PRO 819 Cb 0.58 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.63 1sr2 h PRO 819 CO 0.11 0.06 0.53 0.22 -0.21 0.00 0.00 178.00 178.71 1sr2 h ASP 820 N 0.09 1.12 0.51 -2.05 3.58 -1.75 -2.25 116.42 115.66 1sr2 h ASP 820 Ca 0.14 -0.08 -0.16 0.00 0.42 0.00 0.00 57.03 57.34 1sr2 h ASP 820 Cb 0.17 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.93 1sr2 h ASP 820 CO -0.22 0.87 -0.72 0.44 -2.88 0.00 0.00 179.24 176.73 1sr2 h ASP 821 N 1.27 0.21 0.10 2.28 5.19 -0.50 0.44 116.42 125.40 1sr2 h ASP 821 Ca 0.33 -0.14 -0.00 0.00 -0.62 0.00 0.00 57.03 56.59 1sr2 h ASP 821 Cb -0.02 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.43 1sr2 h ASP 821 CO -0.06 0.86 -0.05 0.58 -3.12 0.00 0.00 179.24 177.46 1sr2 h VAL 822 N 0.12 0.96 0.00 -1.35 2.07 -0.21 0.49 116.25 118.32 1sr2 h VAL 822 Ca -0.02 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.24 1sr2 h VAL 822 Cb 1.28 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 1sr2 h VAL 822 CO 0.11 0.05 -0.28 0.07 0.02 0.00 0.00 177.57 177.54 1sr2 h LYS 823 N -0.22 0.00 -0.23 1.57 2.10 -1.39 -2.10 116.57 116.30 1sr2 h LYS 823 Ca -0.01 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.61 1sr2 h LYS 823 Cb 0.18 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.50 1sr2 h LYS 823 CO 0.02 0.28 0.03 -0.09 -2.00 0.00 0.00 179.45 177.69 1sr2 h ARG 824 N 0.00 0.39 -0.79 0.07 2.43 -0.42 -0.97 114.38 115.08 1sr2 h ARG 824 Ca -0.00 -0.11 0.08 0.00 -0.81 0.00 0.00 59.98 59.14 1sr2 h ARG 824 Cb 0.75 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.19 1sr2 h ARG 824 CO 0.04 0.54 0.46 -0.07 -1.51 0.00 0.00 179.97 179.43 1sr2 h LEU 825 N 0.19 0.68 -0.94 3.80 3.38 0.38 0.16 115.31 122.96 1sr2 h LEU 825 Ca 0.07 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1sr2 h LEU 825 Cb 0.34 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 1sr2 h LEU 825 CO 0.01 0.41 0.62 1.88 0.09 0.00 0.00 178.44 181.45 1sr2 h TYR 826 N 0.81 1.16 -0.30 1.13 0.05 -1.18 0.37 116.97 119.00 1sr2 h TYR 826 Ca 0.37 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 59.13 1sr2 h TYR 826 Cb 0.27 -0.39 -0.01 0.00 1.01 0.00 0.00 36.73 37.62 1sr2 h TYR 826 CO -0.06 0.68 0.00 1.15 -1.05 0.00 0.00 178.16 178.88 1sr2 h THR 827 N 1.21 1.26 -0.20 -2.88 2.02 0.41 -0.55 112.91 114.17 1sr2 h THR 827 Ca 0.37 -0.94 -0.08 0.00 0.77 0.00 0.00 66.41 66.54 1sr2 h THR 827 Cb -0.03 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1sr2 h THR 827 CO -0.11 0.30 -0.21 -0.33 0.37 0.00 0.00 175.52 175.54 1sr2 h GLU 828 N 0.33 0.36 -0.13 6.66 4.39 -0.53 -1.81 114.58 123.85 1sr2 h GLU 828 Ca 0.09 -0.12 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 1sr2 h GLU 828 Cb 0.43 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.04 1sr2 h GLU 828 CO 0.02 0.56 -0.34 0.00 -1.16 0.00 0.00 179.01 178.09 1sr2 h ALA 829 N 1.46 1.20 -0.53 3.43 0.00 -0.61 -0.05 119.26 124.15 1sr2 h ALA 829 Ca 0.06 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 1sr2 h ALA 829 Cb 0.55 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1sr2 h ALA 829 CO 0.04 0.53 0.01 0.00 0.00 0.00 0.00 179.25 179.83 1sr2 h ALA 830 N 1.43 0.71 0.00 0.00 0.00 -0.30 -1.83 119.26 119.27 1sr2 h ALA 830 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1sr2 h ALA 830 Cb 0.71 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1sr2 h ALA 830 CO 0.05 0.52 0.00 2.41 0.00 0.00 0.00 179.25 182.23 1sr2 n THR 831 N -4.30 0.16 -2.71 0.00 -1.04 -0.81 -4.87 114.28 100.72 1sr2 n THR 831 Ca 0.01 0.04 -0.19 0.00 -2.04 0.00 0.00 64.05 61.87 1sr2 n THR 831 Cb 0.32 -0.63 0.00 0.00 -1.82 0.00 0.00 70.33 68.20 1sr2 n THR 831 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1sr2 n SER 832 N -1.22 -5.19 -4.22 8.00 3.41 -0.58 -4.89 113.62 108.93 1sr2 n SER 832 Ca 0.13 -0.09 -0.44 0.00 -0.26 0.00 0.00 58.87 58.22 1sr2 n SER 832 Cb 0.17 -4.30 0.00 0.00 -0.26 0.00 0.00 64.21 59.83 1sr2 n SER 832 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1sr2 n ASP 833 N -2.14 5.40 0.19 4.04 -0.08 -0.14 -4.80 116.55 119.02 1sr2 n ASP 833 Ca -0.16 -3.08 0.13 0.00 -1.51 0.00 0.00 54.79 50.17 1sr2 n ASP 833 Cb 0.63 -1.47 0.70 0.00 2.34 0.00 0.00 41.12 43.32 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 6.44 0.00 -0.54 -0.67 0.04 -1.90 0.32 116.94 120.63 1sr2 h PHE 834 Ca 0.30 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.98 1sr2 h PHE 834 Cb 0.77 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.90 1sr2 h PHE 834 CO 1.07 0.00 -0.01 0.00 -0.60 0.00 0.00 178.31 178.77 1sr2 h ALA 835 N 1.91 0.97 0.07 2.45 0.00 -1.95 0.92 119.26 123.64 1sr2 h ALA 835 Ca 0.07 -0.29 -0.26 0.00 0.00 0.00 0.00 54.91 54.43 1sr2 h ALA 835 Cb 0.31 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1sr2 h ALA 835 CO -0.00 0.62 -1.12 0.00 0.00 0.00 0.00 179.25 178.75 1sr2 h ALA 836 N 1.13 0.19 -0.37 0.00 0.00 -1.37 -1.93 119.26 116.91 1sr2 h ALA 836 Ca 0.16 -0.78 0.06 0.00 0.00 0.00 0.00 54.91 54.34 1sr2 h ALA 836 Cb 0.51 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 1sr2 h ALA 836 CO 0.03 0.84 0.05 -0.07 0.00 0.00 0.00 179.25 180.10 1sr2 h LEU 837 N 0.19 -0.03 -0.97 0.00 3.38 -0.27 0.78 115.31 118.39 1sr2 h LEU 837 Ca -0.13 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1sr2 h LEU 837 Cb 1.79 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.62 1sr2 h LEU 837 CO 0.20 0.02 0.18 0.00 0.09 0.00 0.00 178.44 178.93 1sr2 h ALA 838 N 1.29 1.17 -0.15 1.53 0.00 -0.74 0.13 119.26 122.48 1sr2 h ALA 838 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1sr2 h ALA 838 Cb 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1sr2 h ALA 838 CO -0.25 0.58 0.08 1.96 0.00 0.00 0.00 179.25 181.61 1sr2 h GLN 839 N 0.90 0.22 -0.29 0.00 1.08 -0.67 0.78 115.11 117.13 1sr2 h GLN 839 Ca 0.20 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.35 1sr2 h GLN 839 Cb 0.28 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 1sr2 h GLN 839 CO -0.01 0.26 0.12 1.15 -0.95 0.00 0.00 178.83 179.40 1sr2 h THR 840 N 0.13 1.18 -0.22 -0.54 2.02 -0.52 -1.62 112.91 113.33 1sr2 h THR 840 Ca 0.05 -0.54 -0.03 0.00 0.77 0.00 0.00 66.41 66.66 1sr2 h THR 840 Cb 0.11 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 1sr2 h THR 840 CO -0.01 0.19 -0.00 0.00 0.37 0.00 0.00 175.52 176.07 1sr2 h ALA 841 N 0.96 1.60 -0.49 6.16 0.00 -0.69 -1.52 119.26 125.28 1sr2 h ALA 841 Ca 0.10 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1sr2 h ALA 841 Cb 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1sr2 h ALA 841 CO -0.01 0.30 -0.19 1.25 0.00 0.00 0.00 179.25 180.60 1sr2 h HIS 842 N 0.31 1.12 -0.10 0.00 6.17 -0.36 0.05 115.15 122.34 1sr2 h HIS 842 Ca 0.07 -0.26 -0.12 0.00 0.71 0.00 0.00 60.37 60.78 1sr2 h HIS 842 Cb 0.22 -0.27 -0.01 0.00 2.52 0.00 0.00 27.41 29.87 1sr2 h HIS 842 CO 0.00 1.08 -0.45 0.07 0.71 0.00 0.00 177.93 179.34 1sr2 h ARG 843 N 0.85 0.24 -0.49 5.26 -0.00 -0.75 -2.03 114.38 117.46 1sr2 h ARG 843 Ca 0.12 -0.13 -0.13 0.00 -0.00 0.00 0.00 59.98 59.84 1sr2 h ARG 843 Cb 0.76 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.72 1sr2 h ARG 843 CO 0.06 0.65 -0.21 -0.07 -0.00 0.00 0.00 179.97 180.40 1sr2 h LEU 844 N 0.20 1.03 -0.30 0.08 3.38 -1.02 -1.42 115.31 117.27 1sr2 h LEU 844 Ca 0.01 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 57.66 1sr2 h LEU 844 Cb 0.88 -0.28 -0.08 0.00 0.09 0.00 0.00 40.66 41.26 1sr2 h LEU 844 CO 0.07 1.20 -0.28 0.11 0.09 0.00 0.00 178.44 179.62 1sr2 h LYS 845 N 0.87 -0.25 -0.43 1.13 1.57 -0.70 -0.62 116.57 118.12 1sr2 h LYS 845 Ca 0.11 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1sr2 h LYS 845 Cb 0.80 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.14 1sr2 h LYS 845 CO 0.07 -0.17 0.27 0.78 -0.57 0.00 0.00 179.45 179.83 1sr2 h GLY 846 N -0.26 0.61 1.30 3.86 0.00 -1.08 0.31 103.07 107.80 1sr2 h GLY 846 Ca 0.15 -0.21 -0.17 0.00 0.00 0.00 0.00 47.33 47.10 1sr2 h GLY 846 CO -0.45 0.20 -0.54 -0.39 0.00 0.00 0.00 176.54 175.36 1sr2 h VAL 847 N 0.56 1.29 -0.37 4.60 -1.51 -1.06 0.24 116.25 120.00 1sr2 h VAL 847 Ca 0.16 -1.75 -0.09 0.00 -1.23 0.00 0.00 66.70 63.80 1sr2 h VAL 847 Cb -0.03 1.67 -0.01 0.00 -2.13 0.00 0.00 31.29 30.79 1sr2 h VAL 847 CO -0.05 0.56 -0.13 -0.26 -1.23 0.00 0.00 177.57 176.46 1sr2 h PHE 848 N 0.57 0.84 0.00 5.19 0.04 -0.95 -1.75 116.94 120.88 1sr2 h PHE 848 Ca 0.02 -0.19 -0.05 0.00 2.80 0.00 0.00 57.97 60.54 1sr2 h PHE 848 Cb 1.11 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 39.06 1sr2 h PHE 848 CO 0.06 0.91 -0.25 0.00 -0.60 0.00 0.00 178.31 178.43 1sr2 h ALA 849 N 0.81 1.50 -0.51 2.45 0.00 -0.85 0.56 119.26 123.23 1sr2 h ALA 849 Ca 0.09 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1sr2 h ALA 849 Cb 0.66 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1sr2 h ALA 849 CO 0.04 0.31 0.16 1.98 0.00 0.00 0.00 179.25 181.74 1sr2 h MET 850 N 0.00 0.79 -0.00 0.00 1.85 0.12 -1.47 114.93 116.22 1sr2 h MET 850 Ca -0.00 -0.17 0.00 0.00 -0.61 0.00 0.00 59.70 58.92 1sr2 h MET 850 Cb 0.46 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 32.38 1sr2 h MET 850 CO 0.03 0.74 -0.20 1.28 -0.40 0.00 0.00 176.91 178.36 1sr2 n LEU 851 N -4.49 0.23 -1.57 3.39 4.77 -0.72 -4.92 117.00 113.69 1sr2 n LEU 851 Ca 0.02 0.26 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1sr2 n LEU 851 Cb 0.20 -0.37 0.02 0.00 -2.33 0.00 0.00 43.42 40.93 1sr2 n LEU 851 CO 0.39 0.06 -0.00 0.59 -1.33 0.00 0.00 177.39 177.09 1sr2 n ASN 852 N -1.45 -3.75 -4.52 -1.43 5.03 0.62 -4.96 115.26 104.81 1sr2 n ASN 852 Ca 0.07 -0.14 -0.42 0.00 0.87 0.00 0.00 54.58 54.96 1sr2 n ASN 852 Cb 0.33 -2.65 -0.03 0.00 -1.02 0.00 0.00 39.78 36.41 1sr2 n ASN 852 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1sr2 s LEU 853 N -3.47 4.11 0.10 3.41 1.43 0.16 -4.91 118.68 119.50 1sr2 s LEU 853 Ca 0.14 -1.71 -0.24 0.00 -1.03 0.00 0.00 54.13 51.29 1sr2 s LEU 853 Cb -0.06 -2.50 -0.13 0.00 0.03 0.00 0.00 46.19 43.52 1sr2 s LEU 853 CO 0.18 -1.33 1.71 1.62 0.23 0.00 0.00 176.35 178.76 1sr2 h VAL 854 N 6.39 0.81 -0.90 -1.59 3.04 -1.93 -1.62 116.25 120.45 1sr2 h VAL 854 Ca 0.19 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.87 1sr2 h VAL 854 Cb 1.01 0.81 -0.04 0.00 -2.01 0.00 0.00 31.29 31.05 1sr2 h VAL 854 CO 1.31 0.00 0.53 -0.65 -1.01 0.00 0.00 177.57 177.74 1sr2 h PRO 855 N -0.19 1.23 -0.11 4.17 0.11 -1.98 0.28 132.00 135.51 1sr2 h PRO 855 Ca 0.00 -0.12 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 1sr2 h PRO 855 Cb 0.18 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.04 1sr2 h PRO 855 CO -0.02 0.88 0.03 0.78 -0.21 0.00 0.00 178.00 179.45 1sr2 h GLY 856 N 1.26 0.19 1.51 -0.55 0.00 -1.92 -1.51 103.07 102.04 1sr2 h GLY 856 Ca 0.32 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 1sr2 h GLY 856 CO -0.06 0.11 -0.08 1.70 0.00 0.00 0.00 176.54 178.21 1sr2 h LYS 857 N -0.02 0.60 -0.57 4.80 3.11 -0.97 -1.96 116.57 121.56 1sr2 h LYS 857 Ca 0.04 -0.17 0.04 0.00 -2.81 0.00 0.00 60.65 57.75 1sr2 h LYS 857 Cb 0.24 -0.07 -0.04 0.00 -1.00 0.00 0.00 32.23 31.36 1sr2 h LYS 857 CO -0.00 0.68 0.32 1.96 -2.81 0.00 0.00 179.45 179.60 1sr2 h GLN 858 N 0.56 0.61 -0.55 1.90 1.08 -0.24 -0.20 115.11 118.27 1sr2 h GLN 858 Ca 0.10 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 1sr2 h GLN 858 Cb 0.48 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.75 1sr2 h GLN 858 CO 0.03 0.40 0.27 -0.07 -0.95 0.00 0.00 178.83 178.51 1sr2 h LEU 859 N 0.63 0.71 -1.41 1.46 3.38 -0.82 -2.02 115.31 117.24 1sr2 h LEU 859 Ca 0.24 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1sr2 h LEU 859 Cb 0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1sr2 h LEU 859 CO -0.14 0.63 0.02 0.00 0.09 0.00 0.00 178.44 179.05 1sr2 h GLU 861 N 0.40 -0.29 -0.21 0.00 4.39 -0.61 -1.75 114.58 116.51 1sr2 h GLU 861 Ca 0.09 0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.78 1sr2 h GLU 861 Cb 0.23 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1sr2 h GLU 861 CO 0.00 0.05 -0.04 1.15 -1.16 0.00 0.00 179.01 179.02 1sr2 h THR 862 N -0.70 1.16 -0.17 1.13 2.02 -1.20 -1.89 112.91 113.25 1sr2 h THR 862 Ca -0.03 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.52 1sr2 h THR 862 Cb 0.48 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1sr2 h THR 862 CO 0.05 0.21 0.11 0.25 0.37 0.00 0.00 175.52 176.51 1sr2 h LEU 863 N 0.31 0.20 -1.39 2.58 6.46 -0.57 -0.31 115.31 122.58 1sr2 h LEU 863 Ca 0.07 -0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 1sr2 h LEU 863 Cb 0.27 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1sr2 h LEU 863 CO 0.01 0.16 0.22 -0.33 -0.62 0.00 0.00 178.44 177.88 1sr2 h GLU 864 N 0.22 0.63 -0.52 1.25 5.08 -0.72 0.82 114.58 121.34 1sr2 h GLU 864 Ca 0.06 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1sr2 h GLU 864 Cb -0.01 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1sr2 h GLU 864 CO -0.01 0.50 0.20 1.25 -1.00 0.00 0.00 179.01 179.95 1sr2 h HIS 865 N 0.64 0.80 -0.08 4.33 2.76 -0.90 0.14 115.15 122.84 1sr2 h HIS 865 Ca 0.16 -0.06 -0.06 0.00 -2.20 0.00 0.00 60.37 58.21 1sr2 h HIS 865 Cb 0.07 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.78 1sr2 h HIS 865 CO 0.00 0.66 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.99 1sr2 h LEU 866 N 0.70 0.12 -0.20 0.26 3.38 0.14 -0.42 115.31 119.29 1sr2 h LEU 866 Ca 0.17 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 1sr2 h LEU 866 Cb 0.20 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1sr2 h LEU 866 CO -0.01 0.36 -0.52 0.40 0.09 0.00 0.00 178.44 178.76 1sr2 h ILE 867 N 0.12 1.31 0.00 1.22 2.04 -0.44 0.20 117.51 121.97 1sr2 h ILE 867 Ca 0.02 -1.74 -0.04 0.00 1.00 0.00 0.00 64.86 64.10 1sr2 h ILE 867 Cb 0.48 1.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 1sr2 h ILE 867 CO 0.03 0.55 -0.19 0.08 0.00 0.00 0.00 178.15 178.62 1sr2 h ARG 868 N 0.42 0.00 -0.00 2.37 -0.00 -0.25 -0.27 114.38 116.65 1sr2 h ARG 868 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.97 1sr2 h ARG 868 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.11 1sr2 h ARG 868 CO 0.11 0.19 -0.28 0.39 -0.00 0.00 0.00 179.97 180.38 1sr2 n GLU 869 N -4.00 0.45 -3.32 0.08 1.02 -0.21 -4.94 120.64 109.72 1sr2 n GLU 869 Ca -0.02 -0.23 -0.24 0.00 -0.02 0.00 0.00 57.16 56.65 1sr2 n GLU 869 Cb 0.28 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.25 1sr2 n GLU 869 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1sr2 n LYS 870 N -1.07 -5.83 -3.01 3.49 4.76 -0.11 -4.92 118.16 111.46 1sr2 n LYS 870 Ca 0.10 0.82 -0.44 0.00 -2.87 0.00 0.00 58.31 55.91 1sr2 n LYS 870 Cb 0.33 -5.74 -0.02 0.00 -1.84 0.00 0.00 35.03 27.77 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 -2.96 6.83 0.12 4.39 2.15 -0.06 -4.92 116.67 122.22 1sr2 s ASP 871 Ca 0.44 -2.52 -0.27 0.00 0.43 0.00 0.00 52.55 50.63 1sr2 s ASP 871 Cb -0.20 -2.36 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 1sr2 s ASP 871 CO 0.54 -0.85 1.62 0.58 -0.17 0.00 0.00 175.17 176.89 1sr2 h VAL 872 N 5.20 0.31 -0.90 1.11 2.07 -1.91 0.10 116.25 122.23 1sr2 h VAL 872 Ca 0.20 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.82 1sr2 h VAL 872 Cb 0.97 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 1sr2 h VAL 872 CO 1.10 0.00 0.58 1.55 0.02 0.00 0.00 177.57 180.82 1sr2 h PRO 873 N -0.46 0.85 -0.44 1.57 0.13 -1.98 0.30 132.00 131.96 1sr2 h PRO 873 Ca 0.06 -0.05 -0.10 0.00 -0.87 0.00 0.00 66.00 65.04 1sr2 h PRO 873 Cb 0.55 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 1sr2 h PRO 873 CO -0.27 0.56 -0.11 0.78 -0.23 0.00 0.00 178.00 178.73 1sr2 h GLY 874 N 0.87 0.92 0.92 1.56 0.00 -1.74 -1.88 103.07 103.72 1sr2 h GLY 874 Ca 0.42 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 1sr2 h GLY 874 CO -0.19 0.70 -0.26 -2.22 0.00 0.00 0.00 176.54 174.57 1sr2 h ILE 875 N 0.68 0.44 -0.86 2.60 2.04 0.39 -1.02 117.51 121.78 1sr2 h ILE 875 Ca 0.11 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1sr2 h ILE 875 Cb 0.65 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1sr2 h ILE 875 CO 0.04 0.02 0.57 1.05 0.00 0.00 0.00 178.15 179.84 1sr2 h GLU 876 N -0.83 1.12 -0.45 2.37 4.11 -1.03 0.33 114.58 120.19 1sr2 h GLU 876 Ca -0.08 -0.07 -0.09 0.00 0.07 0.00 0.00 59.36 59.20 1sr2 h GLU 876 Cb 0.60 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1sr2 h GLU 876 CO 0.12 0.74 -0.07 -0.22 0.07 0.00 0.00 179.01 179.66 1sr2 h LYS 877 N 1.15 0.79 -0.13 1.06 3.64 -1.27 -1.73 116.57 120.08 1sr2 h LYS 877 Ca 0.32 -0.24 -0.16 0.00 -1.27 0.00 0.00 60.65 59.30 1sr2 h LYS 877 Cb -0.11 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1sr2 h LYS 877 CO -0.07 0.84 -0.58 1.88 -2.27 0.00 0.00 179.45 179.24 1sr2 h TYR 878 N 0.72 0.53 -0.68 1.91 -1.99 0.06 -0.87 116.97 116.66 1sr2 h TYR 878 Ca 0.13 -0.20 -0.05 0.00 2.00 0.00 0.00 58.73 60.62 1sr2 h TYR 878 Cb 0.53 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 39.14 1sr2 h TYR 878 CO 0.03 0.90 0.24 0.82 -0.00 0.00 0.00 178.16 180.15 1sr2 h ILE 879 N 0.31 1.25 0.00 -2.88 2.04 -0.70 0.19 117.51 117.72 1sr2 h ILE 879 Ca -0.00 -0.81 -0.09 0.00 1.00 0.00 0.00 64.86 64.96 1sr2 h ILE 879 Cb 1.11 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1sr2 h ILE 879 CO 0.10 0.32 -0.43 0.77 0.00 0.00 0.00 178.15 178.91 1sr2 h SER 880 N 0.97 0.00 -0.03 1.72 4.64 -1.15 0.73 113.55 120.43 1sr2 h SER 880 Ca 0.22 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.40 1sr2 h SER 880 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1sr2 h SER 880 CO -0.01 0.43 -0.43 -0.78 -0.87 0.00 0.00 176.83 175.17 1sr2 h ASP 881 N 0.00 0.60 0.20 4.97 1.82 -0.56 0.27 116.42 123.72 1sr2 h ASP 881 Ca -0.00 -0.28 -0.12 0.00 -0.39 0.00 0.00 57.03 56.23 1sr2 h ASP 881 Cb 0.82 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 40.65 1sr2 h ASP 881 CO 0.06 0.95 -0.47 0.40 -1.61 0.00 0.00 179.24 178.57 1sr2 h ILE 882 N 0.46 1.33 -0.25 2.25 2.04 -0.52 0.89 117.51 123.71 1sr2 h ILE 882 Ca 0.03 -1.67 -0.11 0.00 1.00 0.00 0.00 64.86 64.12 1sr2 h ILE 882 Cb 0.94 1.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.77 1sr2 h ILE 882 CO 0.08 0.50 -0.26 -0.78 0.00 0.00 0.00 178.15 177.70 1sr2 h ASP 883 N 0.26 0.66 -0.09 1.72 3.58 -0.39 0.30 116.42 122.46 1sr2 h ASP 883 Ca 0.02 -0.48 -0.14 0.00 0.42 0.00 0.00 57.03 56.84 1sr2 h ASP 883 Cb 0.92 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 1sr2 h ASP 883 CO 0.08 1.00 -0.44 0.77 -2.88 0.00 0.00 179.24 177.77 1sr2 h SER 884 N 0.32 0.68 0.35 2.28 4.64 -0.48 0.11 113.55 121.44 1sr2 h SER 884 Ca 0.04 -0.32 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1sr2 h SER 884 Cb 0.82 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.69 1sr2 h SER 884 CO 0.06 1.02 -0.44 0.22 -0.87 0.00 0.00 176.83 176.82 1sr2 h TYR 885 N 0.51 -1.22 -0.10 4.77 3.20 -0.53 -1.89 116.97 121.71 1sr2 h TYR 885 Ca 0.04 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.82 1sr2 h TYR 885 Cb 0.97 0.49 -0.01 0.00 1.54 0.00 0.00 36.73 39.71 1sr2 h TYR 885 CO 0.04 -0.58 -0.40 0.28 -1.64 0.00 0.00 178.16 175.87 1sr2 h VAL 886 N -0.83 1.30 -0.81 1.81 2.07 -0.93 -0.75 116.25 118.12 1sr2 h VAL 886 Ca -0.03 -1.48 0.08 0.00 0.82 0.00 0.00 66.70 66.10 1sr2 h VAL 886 Cb 0.76 1.66 -0.07 0.00 -1.52 0.00 0.00 31.29 32.13 1sr2 h VAL 886 CO -0.12 0.44 0.47 0.11 0.02 0.00 0.00 177.57 178.49 1sr2 h LYS 887 N 0.19 0.80 0.00 1.57 1.57 -0.39 0.69 116.57 121.01 1sr2 h LYS 887 Ca 0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1sr2 h LYS 887 Cb 0.79 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1sr2 h LYS 887 CO 0.06 0.53 -1.00 -1.13 -0.57 0.00 0.00 179.45 177.34 1sr2 n SER 888 N -4.72 0.82 0.01 0.86 3.41 -0.75 -3.83 113.62 109.42 1sr2 n SER 888 Ca 0.12 0.29 0.13 0.00 -0.26 0.00 0.00 58.87 59.16 1sr2 n SER 888 Cb 0.23 0.47 0.41 0.00 -0.26 0.00 0.00 64.21 65.07 1sr2 n SER 888 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1sr2 n LEU 889 N -2.61 0.31 0.00 1.04 4.32 -0.31 -5.11 117.00 114.63 1sr2 n LEU 889 Ca 0.00 0.26 0.10 0.00 -0.02 0.00 0.00 56.01 56.35 1sr2 n LEU 889 Cb 0.54 -0.36 0.60 0.00 -1.62 0.00 0.00 43.42 42.59 1sr2 n LEU 889 CO 0.40 0.04 0.80 0.18 -1.22 0.00 0.00 177.39 177.59