#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1npe s PRO 737 N 0.00 2.17 0.09 3.69 0.02 -1.26 -4.90 135.00 134.80 1npe s PRO 737 Ca 0.00 1.37 -0.33 0.00 0.02 0.00 0.00 61.00 62.06 1npe s PRO 737 Cb 0.00 -1.87 -0.12 0.00 0.02 0.00 0.00 34.50 32.53 1npe s PRO 737 CO 0.00 -1.74 1.76 0.00 -0.33 0.00 0.00 177.00 176.69 1npe n PRO 739 N 5.13 2.90 -3.93 0.00 -0.04 -1.26 -4.84 135.00 132.96 1npe n PRO 739 Ca 0.19 -2.39 -0.10 0.00 -0.04 0.00 0.00 63.50 61.16 1npe n PRO 739 Cb 0.33 -3.10 -0.10 0.00 -0.04 0.00 0.00 33.50 30.58 1npe n PRO 739 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1npe s PRO 741 N -1.44 1.72 -1.43 0.00 0.02 -1.26 -4.46 135.00 128.15 1npe s PRO 741 Ca -0.15 0.41 -0.08 0.00 0.02 0.00 0.00 61.00 61.20 1npe s PRO 741 Cb -0.09 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.55 1npe s PRO 741 CO 0.00 -1.82 0.26 0.41 -0.33 0.00 0.00 177.00 175.52 1npe n GLY 742 N -2.35 -0.33 2.68 0.52 0.00 -1.26 -2.46 105.19 101.99 1npe n GLY 742 Ca 0.07 0.22 -0.11 0.00 0.00 0.00 0.00 46.02 46.19 1npe n GLY 742 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npe n GLY 743 N -2.32 -0.49 3.78 -0.02 0.00 -1.26 -4.92 105.19 99.95 1npe n GLY 743 Ca -0.27 0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1npe n GLY 743 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1npe s SER 744 N -2.18 7.30 0.77 1.61 0.15 -1.03 -5.05 113.70 115.28 1npe s SER 744 Ca 0.09 1.88 -0.12 0.00 0.70 0.00 0.00 55.95 58.50 1npe s SER 744 Cb -0.05 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.73 1npe s SER 744 CO 0.12 -0.09 1.11 -0.94 1.20 0.00 0.00 173.24 174.63 1npe s SER 745 N -1.56 4.81 0.15 5.45 1.04 -1.26 -4.81 113.70 117.52 1npe s SER 745 Ca 0.50 1.15 -0.05 0.00 0.48 0.00 0.00 55.95 58.03 1npe s SER 745 Cb -0.20 -1.87 -0.02 0.00 0.10 0.00 0.00 66.02 64.03 1npe s SER 745 CO 0.25 -1.75 0.18 0.00 0.98 0.00 0.00 173.24 172.90 1npe s ALA 747 N -4.00 1.24 -0.08 0.00 0.00 0.26 -4.94 121.76 114.23 1npe s ALA 747 Ca 0.20 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1npe s ALA 747 Cb 0.05 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.75 1npe s ALA 747 CO 0.01 0.21 -0.10 -1.50 0.00 0.00 0.00 175.76 174.37 1npe s ILE 748 N 0.15 1.06 -0.70 0.00 2.07 -1.26 0.39 121.20 122.90 1npe s ILE 748 Ca -0.04 -0.39 -0.13 0.00 -1.41 0.00 0.00 60.65 58.68 1npe s ILE 748 Cb -0.11 -1.01 0.18 0.00 0.13 0.00 0.00 42.46 41.65 1npe s ILE 748 CO 0.02 0.35 0.63 -0.69 -1.91 0.00 0.00 174.94 173.34 1npe s VAL 749 N 1.06 5.22 0.54 4.00 1.01 -0.79 -4.95 120.40 126.49 1npe s VAL 749 Ca -0.07 -2.20 0.33 0.00 0.00 0.00 0.00 61.98 60.04 1npe s VAL 749 Cb -0.14 -4.28 0.50 0.00 0.00 0.00 0.00 36.38 32.45 1npe s VAL 749 CO -0.01 -0.95 1.87 1.55 0.00 0.00 0.00 175.10 177.55 1npe h PRO 750 N 8.07 0.00 -0.67 2.72 0.13 -1.90 1.25 132.00 141.59 1npe h PRO 750 Ca -0.04 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.07 1npe h PRO 750 Cb 1.05 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.15 1npe h PRO 750 CO 0.84 0.00 0.34 -0.22 -0.23 0.00 0.00 178.00 178.72 1npe h LYS 751 N 0.00 0.96 -0.01 0.86 3.64 -1.98 -2.96 116.57 117.08 1npe h LYS 751 Ca 0.46 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 1npe h LYS 751 Cb 1.86 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 1npe h LYS 751 CO -0.00 0.75 -0.14 0.25 -2.27 0.00 0.00 179.45 178.04 1npe n THR 752 N -4.48 0.00 -0.75 1.00 -2.24 -0.65 -5.00 114.28 102.17 1npe n THR 752 Ca 0.05 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1npe n THR 752 Cb 0.12 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 1npe n THR 752 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1npe n LYS 753 N 0.34 -1.43 -2.65 -0.78 5.02 0.42 -4.95 118.16 114.14 1npe n LYS 753 Ca 0.07 0.31 -0.42 0.00 -2.02 0.00 0.00 58.31 56.26 1npe n LYS 753 Cb 0.33 -4.50 -0.03 0.00 -0.02 0.00 0.00 35.03 30.81 1npe n LYS 753 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1npe s GLU 754 N -1.49 4.58 -0.11 1.97 -1.05 -1.22 -4.77 118.70 116.60 1npe s GLU 754 Ca 0.00 1.51 -0.03 0.00 -0.15 0.00 0.00 54.97 56.30 1npe s GLU 754 Cb 0.00 -3.40 -0.03 0.00 -0.44 0.00 0.00 34.13 30.25 1npe s GLU 754 CO 0.00 -0.01 -0.00 0.14 0.95 0.00 0.00 175.26 176.34 1npe s VAL 755 N 0.66 4.25 -0.14 1.83 -7.23 -1.26 -1.89 120.40 116.61 1npe s VAL 755 Ca 0.52 -0.26 0.01 0.00 -1.81 0.00 0.00 61.98 60.44 1npe s VAL 755 Cb -0.24 -2.82 0.02 0.00 0.56 0.00 0.00 36.38 33.90 1npe s VAL 755 CO 0.29 0.56 -0.17 -0.69 -0.31 0.00 0.00 175.10 174.79 1npe s VAL 756 N -0.41 1.69 0.21 1.32 1.01 0.16 -4.46 120.40 119.91 1npe s VAL 756 Ca 0.08 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 1npe s VAL 756 Cb -0.12 -1.54 -0.08 0.00 0.00 0.00 0.00 36.38 34.63 1npe s VAL 756 CO 0.02 0.48 1.02 0.00 0.00 0.00 0.00 175.10 176.62 1npe h THR 758 N 3.46 1.31 -2.16 0.00 2.02 -1.29 -3.46 112.91 112.80 1npe h THR 758 Ca -0.45 -1.08 -0.58 0.00 0.77 0.00 0.00 66.41 65.07 1npe h THR 758 Cb 1.21 1.75 -0.11 0.00 -1.74 0.00 0.00 68.15 69.26 1npe h THR 758 CO 0.70 0.31 -0.68 -1.00 0.37 0.00 0.00 175.52 175.23 1npe s HIS 759 N -4.59 2.55 0.00 3.16 3.76 -1.26 -5.06 115.29 113.86 1npe s HIS 759 Ca -0.14 -0.29 -0.02 0.00 -0.15 0.00 0.00 55.06 54.46 1npe s HIS 759 Cb 0.05 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.55 1npe s HIS 759 CO 0.73 0.63 0.02 0.00 -0.85 0.00 0.00 174.74 175.27 1npe s PRO 761 N -0.92 2.81 0.15 0.00 0.04 -1.26 -4.91 135.00 130.89 1npe s PRO 761 Ca -0.10 1.65 -0.34 0.00 0.04 0.00 0.00 61.00 62.24 1npe s PRO 761 Cb -0.06 -1.93 -0.15 0.00 0.04 0.00 0.00 34.50 32.40 1npe s PRO 761 CO -0.00 -1.29 1.41 2.41 0.04 0.00 0.00 177.00 179.57 1npe n THR 762 N -2.02 0.25 0.00 1.26 -1.04 -1.26 -1.92 114.28 109.54 1npe n THR 762 Ca 0.12 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1npe n THR 762 Cb 0.51 -1.17 0.00 0.00 -1.82 0.00 0.00 70.33 67.84 1npe n THR 762 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1npe n GLY 763 N 2.73 2.18 3.98 3.41 0.00 -1.26 -4.92 105.19 111.31 1npe n GLY 763 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 1npe n GLY 763 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1npe s THR 764 N -2.40 4.05 0.38 2.61 -4.23 -0.81 -0.11 115.64 115.13 1npe s THR 764 Ca 0.00 -1.01 -0.09 0.00 -1.18 0.00 0.00 61.69 59.41 1npe s THR 764 Cb 0.00 -3.40 0.03 0.00 1.34 0.00 0.00 72.50 70.48 1npe s THR 764 CO 0.00 -0.16 0.65 0.00 -0.54 0.00 0.00 174.62 174.58 1npe s ALA 765 N -2.18 0.05 0.00 3.99 0.00 0.61 -4.32 121.76 119.90 1npe s ALA 765 Ca 0.45 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1npe s ALA 765 Cb -0.09 0.89 0.00 0.00 0.00 0.00 0.00 23.12 23.92 1npe s ALA 765 CO 0.31 -0.89 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1npe n GLY 766 N -0.57 0.73 0.35 0.00 0.00 -1.26 -2.43 105.19 102.01 1npe n GLY 766 Ca -0.04 -1.84 0.01 0.00 0.00 0.00 0.00 46.02 44.15 1npe n GLY 766 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1npe h LYS 767 N 0.00 1.09 -0.28 1.61 1.57 -1.93 -2.63 116.57 116.00 1npe h LYS 767 Ca 0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1npe h LYS 767 Cb 0.00 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.06 1npe h LYS 767 CO 0.00 0.72 0.00 0.54 -0.57 0.00 0.00 179.45 180.14 1npe n ARG 768 N -4.53 3.02 -2.85 3.15 1.74 -1.26 -0.17 116.66 115.75 1npe n ARG 768 Ca 0.13 -2.81 -0.21 0.00 -0.77 0.00 0.00 57.85 54.19 1npe n ARG 768 Cb 0.14 -1.83 0.01 0.00 -1.02 0.00 0.00 32.46 29.76 1npe n ARG 768 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1npe n GLU 770 N -3.58 0.29 -4.30 0.00 0.00 -1.11 -4.63 120.64 107.31 1npe n GLU 770 Ca -0.13 0.03 -0.18 0.00 0.00 0.00 0.00 57.16 56.87 1npe n GLU 770 Cb 0.62 -1.50 -0.09 0.00 0.00 0.00 0.00 31.44 30.47 1npe n GLU 770 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.13 176.65 1npe s LEU 771 N -2.68 1.63 0.05 -1.84 0.05 -1.02 -4.48 118.68 110.38 1npe s LEU 771 Ca 0.23 -1.62 -0.04 0.00 0.05 0.00 0.00 54.13 52.74 1npe s LEU 771 Cb 0.18 0.37 -0.05 0.00 -2.05 0.00 0.00 46.19 44.64 1npe s LEU 771 CO 0.44 -0.96 0.26 0.00 -0.55 0.00 0.00 176.35 175.54 1npe s ASP 773 N -2.09 5.33 0.31 0.00 2.15 0.84 -4.60 116.67 118.60 1npe s ASP 773 Ca 0.32 1.74 -0.30 0.00 0.43 0.00 0.00 52.55 54.74 1npe s ASP 773 Cb -0.13 -2.51 -0.11 0.00 -0.30 0.00 0.00 42.92 39.86 1npe s ASP 773 CO 0.21 -1.48 1.58 -0.62 -0.17 0.00 0.00 175.17 174.69 1npe s ASP 774 N -3.34 6.35 0.00 -0.34 2.15 -1.26 -1.58 116.67 118.65 1npe s ASP 774 Ca 0.61 2.99 0.00 0.00 0.43 0.00 0.00 52.55 56.58 1npe s ASP 774 Cb -0.16 -2.64 0.00 0.00 -0.30 0.00 0.00 42.92 39.82 1npe s ASP 774 CO 0.49 -0.92 0.00 0.61 -0.17 0.00 0.00 175.17 175.18 1npe n GLY 775 N 1.79 0.38 3.35 2.66 0.00 -1.26 -5.00 105.19 107.10 1npe n GLY 775 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1npe n GLY 775 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1npe s TYR 776 N -2.00 1.62 0.03 1.61 1.51 -0.61 -1.91 117.35 117.60 1npe s TYR 776 Ca 0.00 -1.00 -0.12 0.00 -1.01 0.00 0.00 57.07 54.94 1npe s TYR 776 Cb 0.00 -0.97 0.01 0.00 -0.11 0.00 0.00 41.96 40.89 1npe s TYR 776 CO 0.00 -0.11 0.25 -0.59 -1.11 0.00 0.00 175.55 173.98 1npe s PHE 777 N -3.49 -0.03 -5.00 2.71 -0.71 -0.40 -4.30 117.98 106.75 1npe s PHE 777 Ca 0.32 -0.11 0.00 0.00 -1.04 0.00 0.00 56.93 56.10 1npe s PHE 777 Cb 0.07 0.03 0.00 0.00 -1.21 0.00 0.00 43.02 41.91 1npe s PHE 777 CO 0.11 -0.45 0.00 0.41 -1.34 0.00 0.00 175.22 173.95 1npe n GLY 778 N 0.74 0.30 2.65 1.99 0.00 0.05 -2.21 105.19 108.71 1npe n GLY 778 Ca -0.19 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.16 1npe n GLY 778 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1npe n ASP 779 N 0.41 -2.58 -0.27 1.61 -0.08 0.39 -4.31 116.55 111.73 1npe n ASP 779 Ca 0.00 -2.78 0.12 0.00 -1.51 0.00 0.00 54.79 50.62 1npe n ASP 779 Cb 0.00 1.09 0.38 0.00 2.34 0.00 0.00 41.12 44.92 1npe n ASP 779 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1npe h PRO 780 N 5.12 0.67 -0.30 -0.67 0.13 -1.69 -0.06 132.00 135.21 1npe h PRO 780 Ca 0.11 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1npe h PRO 780 Cb 1.05 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1npe h PRO 780 CO 0.13 0.45 0.00 1.28 -0.23 0.00 0.00 178.00 179.62 1npe n LEU 781 N -4.56 3.00 -3.21 1.56 4.77 -1.26 -4.66 117.00 112.63 1npe n LEU 781 Ca 0.17 -1.52 -0.17 0.00 -0.03 0.00 0.00 56.01 54.47 1npe n LEU 781 Cb 0.47 -0.19 0.08 0.00 -2.33 0.00 0.00 43.42 41.45 1npe n LEU 781 CO 0.29 0.66 0.13 0.61 -1.33 0.00 0.00 177.39 177.75 1npe n GLY 782 N 1.06 -0.31 0.21 -0.72 0.00 -1.05 -4.91 105.19 99.47 1npe n GLY 782 Ca 0.15 0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.32 1npe n GLY 782 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1npe h SER 783 N -1.88 0.00 -0.34 1.61 0.02 -1.90 -3.36 113.55 107.70 1npe h SER 783 Ca -0.53 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.17 1npe h SER 783 Cb 1.31 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.60 1npe h SER 783 CO 0.46 0.28 -0.68 -0.46 -1.14 0.00 0.00 176.83 175.29 1npe n ASN 784 N -3.47 -0.43 0.00 3.07 6.94 -1.26 -5.12 115.26 114.99 1npe n ASN 784 Ca -0.00 -2.43 0.00 0.00 -0.02 0.00 0.00 54.58 52.13 1npe n ASN 784 Cb 0.45 0.32 0.00 0.00 -2.36 0.00 0.00 39.78 38.19 1npe n ASN 784 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1npe n GLY 785 N -0.62 1.52 3.55 4.83 0.00 -1.26 -5.13 105.19 108.08 1npe n GLY 785 Ca -0.01 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.18 1npe n GLY 785 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1npe n PRO 786 N -1.48 -0.01 -1.83 1.61 -0.04 -1.26 -4.34 135.00 127.65 1npe n PRO 786 Ca 0.00 0.06 -0.42 0.00 -0.04 0.00 0.00 63.50 63.10 1npe n PRO 786 Cb 0.00 -2.11 -0.03 0.00 -0.04 0.00 0.00 33.50 31.32 1npe n PRO 786 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1npe s VAL 787 N -2.21 2.32 -0.24 0.52 1.01 -1.26 -4.61 120.40 115.93 1npe s VAL 787 Ca 0.66 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.84 1npe s VAL 787 Cb -0.27 -3.15 0.08 0.00 0.00 0.00 0.00 36.38 33.03 1npe s VAL 787 CO 0.58 0.02 0.07 -0.13 0.00 0.00 0.00 175.10 175.64 1npe s ARG 788 N 0.98 0.56 0.40 2.72 0.52 -0.06 -4.99 118.95 119.08 1npe s ARG 788 Ca 0.71 -0.59 -0.27 0.00 -0.52 0.00 0.00 55.73 55.06 1npe s ARG 788 Cb -0.47 -1.92 -0.10 0.00 0.52 0.00 0.00 34.95 32.98 1npe s ARG 788 CO 0.33 -0.79 1.46 -0.51 0.02 0.00 0.00 175.30 175.81 1npe s LEU 789 N 1.85 4.26 0.22 2.53 1.43 -1.26 -0.46 118.68 127.25 1npe s LEU 789 Ca 0.03 2.98 -0.31 0.00 -1.03 0.00 0.00 54.13 55.81 1npe s LEU 789 Cb -0.17 -3.76 -0.11 0.00 0.03 0.00 0.00 46.19 42.19 1npe s LEU 789 CO -0.17 -0.95 1.56 0.00 0.23 0.00 0.00 176.35 177.02 1npe s ARG 791 N 0.41 0.49 0.57 0.00 1.70 -0.94 -4.92 118.95 116.26 1npe s ARG 791 Ca 0.67 -0.89 -0.20 0.00 -0.47 0.00 0.00 55.73 54.83 1npe s ARG 791 Cb -0.45 0.17 -0.05 0.00 -0.57 0.00 0.00 34.95 34.05 1npe s ARG 791 CO 0.38 -0.09 1.08 -2.30 -1.08 0.00 0.00 175.30 173.28 1npe n PRO 792 N 0.81 1.13 -1.60 3.89 -0.02 -1.26 -1.28 135.00 136.69 1npe n PRO 792 Ca -0.19 0.43 -0.49 0.00 -2.02 0.00 0.00 63.50 61.23 1npe n PRO 792 Cb 0.58 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.75 1npe n PRO 792 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1npe s GLN 794 N -0.19 2.92 -0.17 0.00 -0.21 -1.26 -4.90 119.66 115.85 1npe s GLN 794 Ca 0.75 -2.08 0.17 0.00 0.02 0.00 0.00 55.36 54.22 1npe s GLN 794 Cb -0.84 -4.11 0.45 0.00 1.00 0.00 0.00 33.01 29.51 1npe s GLN 794 CO 0.50 -1.25 1.18 0.00 -2.12 0.00 0.00 175.29 173.60 1npe n ASN 796 N -0.43 -3.83 -1.91 0.00 3.02 -1.25 -0.84 115.26 110.02 1npe n ASN 796 Ca 0.17 -0.46 -0.19 0.00 -0.03 0.00 0.00 54.58 54.07 1npe n ASN 796 Cb 0.91 -3.15 -0.05 0.00 -0.61 0.00 0.00 39.78 36.87 1npe n ASN 796 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1npe n ASP 797 N -2.35 -5.30 -1.80 6.41 8.00 -1.26 -4.86 116.55 115.40 1npe n ASP 797 Ca -0.01 0.29 -0.15 0.00 0.71 0.00 0.00 54.79 55.63 1npe n ASP 797 Cb 0.54 -4.59 0.20 0.00 -0.02 0.00 0.00 41.12 37.25 1npe n ASP 797 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1npe n ASN 798 N -1.52 3.32 -4.28 -2.24 3.02 -0.02 -4.94 115.26 108.60 1npe n ASN 798 Ca -0.21 -3.65 -0.19 0.00 -0.03 0.00 0.00 54.58 50.51 1npe n ASN 798 Cb 0.65 -0.75 -0.11 0.00 -0.61 0.00 0.00 39.78 38.96 1npe n ASN 798 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1npe s ILE 799 N -3.26 1.52 -0.21 2.41 -4.36 -1.26 -0.41 121.20 115.64 1npe s ILE 799 Ca 0.52 -1.89 -0.17 0.00 -0.26 0.00 0.00 60.65 58.85 1npe s ILE 799 Cb 0.45 -1.73 -0.03 0.00 1.25 0.00 0.00 42.46 42.39 1npe s ILE 799 CO 0.07 -0.45 0.47 -0.62 0.24 0.00 0.00 174.94 174.65 1npe s ASP 800 N -2.72 6.50 0.55 4.36 -1.08 -1.26 -4.96 116.67 118.06 1npe s ASP 800 Ca 0.14 0.59 0.37 0.00 -0.52 0.00 0.00 52.55 53.13 1npe s ASP 800 Cb -0.04 -2.27 1.89 0.00 -1.46 0.00 0.00 42.92 41.04 1npe s ASP 800 CO 0.04 -0.15 2.12 -0.65 0.52 0.00 0.00 175.17 177.06 1npe h PRO 801 N 7.49 0.00 -0.00 4.34 0.11 -2.00 -1.63 132.00 140.30 1npe h PRO 801 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1npe h PRO 801 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1npe h PRO 801 CO 0.73 0.00 -0.27 -1.71 -0.21 0.00 0.00 178.00 176.53 1npe n ASN 802 N -2.87 0.72 -4.92 -2.05 5.15 -1.26 -4.89 115.26 105.13 1npe n ASN 802 Ca -0.02 -0.59 -0.26 0.00 -0.60 0.00 0.00 54.58 53.12 1npe n ASN 802 Cb 0.12 0.09 -0.01 0.00 -0.53 0.00 0.00 39.78 39.46 1npe n ASN 802 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1npe s ALA 803 N -2.65 3.50 0.22 5.20 0.00 -0.61 -5.11 121.76 122.31 1npe s ALA 803 Ca 0.21 -0.64 0.10 0.00 0.00 0.00 0.00 51.96 51.64 1npe s ALA 803 Cb 0.19 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1npe s ALA 803 CO 0.56 -0.23 -0.10 0.14 0.00 0.00 0.00 175.76 176.13 1npe s VAL 804 N -2.59 3.09 -1.12 0.00 -7.23 -1.26 -4.69 120.40 106.58 1npe s VAL 804 Ca 0.45 -1.89 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1npe s VAL 804 Cb -0.10 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.26 1npe s VAL 804 CO 0.42 -0.24 0.39 0.61 -0.31 0.00 0.00 175.10 175.97 1npe n GLY 805 N -0.33 -0.18 0.25 2.32 0.00 -1.26 -4.92 105.19 101.07 1npe n GLY 805 Ca -0.09 -0.15 0.04 0.00 0.00 0.00 0.00 46.02 45.83 1npe n GLY 805 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1npe h ASN 806 N -0.90 0.18 -5.10 1.61 2.35 -1.94 -3.41 115.58 108.37 1npe h ASN 806 Ca -0.38 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.26 1npe h ASN 806 Cb 1.26 -0.05 -0.15 0.00 0.05 0.00 0.00 38.32 39.43 1npe h ASN 806 CO 0.41 0.27 -0.31 0.00 -1.65 0.00 0.00 177.43 176.14 1npe s ASN 808 N -2.49 6.60 0.03 0.00 3.84 0.73 -4.80 114.94 118.85 1npe s ASN 808 Ca 0.00 2.49 0.11 0.00 0.21 0.00 0.00 52.86 55.67 1npe s ASN 808 Cb 0.02 -2.56 0.46 0.00 -0.55 0.00 0.00 41.25 38.62 1npe s ASN 808 CO -0.08 -0.89 1.34 0.54 -2.79 0.00 0.00 177.10 175.23 1npe n ARG 809 N 5.56 0.02 -0.09 0.43 1.74 -1.26 -0.90 116.66 122.16 1npe n ARG 809 Ca 0.16 0.35 -0.17 0.00 -0.77 0.00 0.00 57.85 57.42 1npe n ARG 809 Cb 0.40 -1.54 -0.06 0.00 -1.02 0.00 0.00 32.46 30.25 1npe n ARG 809 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1npe n LEU 810 N -1.57 1.57 0.00 0.55 7.94 -1.26 -0.77 117.00 123.46 1npe n LEU 810 Ca 0.02 0.27 -0.10 0.00 -1.11 0.00 0.00 56.01 55.09 1npe n LEU 810 Cb 0.12 -0.63 -0.14 0.00 0.53 0.00 0.00 43.42 43.30 1npe n LEU 810 CO 0.09 0.16 -0.40 0.71 -1.11 0.00 0.00 177.39 176.84 1npe h THR 811 N -0.76 1.02 0.00 1.96 1.35 -1.87 -3.28 112.91 111.33 1npe h THR 811 Ca -0.35 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 62.69 1npe h THR 811 Cb 1.23 2.54 0.00 0.00 -1.73 0.00 0.00 68.15 70.18 1npe h THR 811 CO -0.21 0.64 0.00 0.61 -0.25 0.00 0.00 175.52 176.30 1npe n GLY 812 N 1.56 0.70 3.67 5.82 0.00 -0.08 -4.95 105.19 111.90 1npe n GLY 812 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1npe n GLY 812 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1npe s GLU 813 N -0.79 4.14 0.07 1.61 2.12 -1.26 -4.56 118.70 120.04 1npe s GLU 813 Ca 0.00 2.61 -0.31 0.00 0.36 0.00 0.00 54.97 57.64 1npe s GLU 813 Cb 0.00 -4.02 -0.08 0.00 0.26 0.00 0.00 34.13 30.30 1npe s GLU 813 CO 0.00 -0.93 1.53 0.00 -0.54 0.00 0.00 175.26 175.32 1npe n LEU 815 N 5.08 0.00 -3.15 0.00 4.77 0.13 -4.78 117.00 119.06 1npe n LEU 815 Ca 0.14 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.88 1npe n LEU 815 Cb 0.41 0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.52 1npe n LEU 815 CO 0.61 0.06 -0.05 0.29 -1.33 0.00 0.00 177.39 176.97 1npe n LYS 816 N -2.12 2.02 -2.23 3.23 5.02 -1.17 -5.02 118.16 117.90 1npe n LYS 816 Ca -0.06 -4.12 -0.41 0.00 -2.02 0.00 0.00 58.31 51.70 1npe n LYS 816 Cb 0.50 -1.92 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 1npe n LYS 816 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1npe n ILE 818 N 0.91 0.00 -2.22 0.00 -5.35 0.46 -4.65 119.36 108.50 1npe n ILE 818 Ca -0.00 -0.39 -0.18 0.00 -0.27 0.00 0.00 62.75 61.90 1npe n ILE 818 Cb 0.43 -0.19 -0.02 0.00 -1.74 0.00 0.00 39.64 38.11 1npe n ILE 818 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1npe n TYR 819 N -0.49 -0.91 -1.54 4.28 4.01 -1.26 -1.46 117.16 119.78 1npe n TYR 819 Ca -0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.54 1npe n TYR 819 Cb 0.11 -3.54 -0.07 0.00 -0.31 0.00 0.00 39.34 35.53 1npe n TYR 819 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1npe n ASN 820 N -1.77 -5.14 -4.69 7.72 3.02 -1.26 -3.49 115.26 109.65 1npe n ASN 820 Ca -0.21 0.42 -0.26 0.00 -0.03 0.00 0.00 54.58 54.50 1npe n ASN 820 Cb 0.65 -4.20 0.11 0.00 -0.61 0.00 0.00 39.78 35.73 1npe n ASN 820 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1npe s THR 821 N -2.67 2.18 0.17 3.41 -4.23 -0.54 -1.62 115.64 112.34 1npe s THR 821 Ca 0.00 -0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.15 1npe s THR 821 Cb 0.00 -2.90 0.03 0.00 1.34 0.00 0.00 72.50 70.97 1npe s THR 821 CO 0.00 0.00 0.46 0.00 -0.54 0.00 0.00 174.62 174.54 1npe n ALA 822 N -3.11 -1.10 0.00 3.99 0.00 0.18 -4.49 120.51 115.98 1npe n ALA 822 Ca 0.11 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1npe n ALA 822 Cb 0.60 0.46 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1npe n ALA 822 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1npe n GLY 823 N -0.32 0.37 0.37 0.00 0.00 -1.26 -1.61 105.19 102.75 1npe n GLY 823 Ca -0.04 -1.79 0.23 0.00 0.00 0.00 0.00 46.02 44.42 1npe n GLY 823 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1npe h PHE 824 N 0.00 0.85 -0.06 1.61 3.57 -1.99 -0.63 116.94 120.29 1npe h PHE 824 Ca 0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1npe h PHE 824 Cb 0.00 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.50 1npe h PHE 824 CO 0.00 -0.03 -0.00 0.66 -2.23 0.00 0.00 178.31 176.71 1npe n TYR 825 N -4.84 0.21 -3.14 0.41 4.01 -1.26 -1.21 117.16 111.34 1npe n TYR 825 Ca 0.29 -0.97 -0.23 0.00 -0.16 0.00 0.00 57.90 56.83 1npe n TYR 825 Cb 0.91 -0.19 0.04 0.00 -0.31 0.00 0.00 39.34 39.80 1npe n TYR 825 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1npe n ASP 827 N -2.61 4.10 -3.80 0.00 5.75 -0.64 -4.49 116.55 114.86 1npe n ASP 827 Ca -0.09 -2.33 -0.12 0.00 -0.01 0.00 0.00 54.79 52.25 1npe n ASP 827 Cb 0.61 -0.52 -0.06 0.00 -1.03 0.00 0.00 41.12 40.11 1npe n ASP 827 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1npe s ARG 828 N -1.70 1.58 0.20 0.11 1.70 -0.63 -4.85 118.95 115.36 1npe s ARG 828 Ca 0.44 -1.53 -0.01 0.00 -0.47 0.00 0.00 55.73 54.17 1npe s ARG 828 Cb 0.28 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 35.02 1npe s ARG 828 CO 0.23 -0.62 0.39 0.00 -1.08 0.00 0.00 175.30 174.21 1npe s LYS 830 N -3.33 1.78 0.15 0.00 1.02 -0.64 -4.60 119.74 114.12 1npe s LYS 830 Ca 0.38 0.92 -0.32 0.00 0.02 0.00 0.00 55.97 56.97 1npe s LYS 830 Cb -0.11 -1.86 -0.12 0.00 -0.52 0.00 0.00 37.83 35.22 1npe s LYS 830 CO 0.29 -1.91 1.74 -1.91 -0.92 0.00 0.00 175.35 172.64 1npe n GLU 831 N -3.67 2.61 -0.33 1.68 4.07 -1.26 -2.10 120.64 121.63 1npe n GLU 831 Ca 0.08 0.94 0.00 0.00 -0.06 0.00 0.00 57.16 58.12 1npe n GLU 831 Cb 0.54 -2.79 0.00 0.00 -0.06 0.00 0.00 31.44 29.13 1npe n GLU 831 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1npe n GLY 832 N 3.96 0.83 3.25 8.31 0.00 -1.26 -5.01 105.19 115.26 1npe n GLY 832 Ca 0.17 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 1npe n GLY 832 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1npe s PHE 833 N -2.00 1.30 0.10 1.61 0.40 -0.89 -0.69 117.98 117.82 1npe s PHE 833 Ca 0.00 -0.71 -0.02 0.00 -0.60 0.00 0.00 56.93 55.60 1npe s PHE 833 Cb 0.00 -0.66 -0.04 0.00 0.51 0.00 0.00 43.02 42.83 1npe s PHE 833 CO 0.00 0.11 0.05 -0.59 0.70 0.00 0.00 175.22 175.49 1npe s PHE 834 N -3.07 0.67 -1.67 0.36 -0.12 0.11 -4.76 117.98 109.51 1npe s PHE 834 Ca 0.15 -1.11 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 1npe s PHE 834 Cb 0.01 -0.39 0.00 0.00 -0.63 0.00 0.00 43.02 42.00 1npe s PHE 834 CO 0.01 -0.49 0.00 0.41 -0.05 0.00 0.00 175.22 175.11 1npe n GLY 835 N -0.03 0.51 3.24 1.99 0.00 -0.24 -0.17 105.19 110.49 1npe n GLY 835 Ca -0.09 -2.17 -0.39 0.00 0.00 0.00 0.00 46.02 43.37 1npe n GLY 835 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1npe s ASN 836 N -4.00 5.44 0.61 1.61 3.04 -1.16 -4.77 114.94 115.71 1npe s ASN 836 Ca 0.00 -1.47 0.33 0.00 0.04 0.00 0.00 52.86 51.76 1npe s ASN 836 Cb 0.00 -1.91 1.97 0.00 -1.54 0.00 0.00 41.25 39.77 1npe s ASN 836 CO 0.00 -0.46 2.28 1.55 -3.04 0.00 0.00 177.10 177.43 1npe h PRO 837 N 8.27 0.00 -0.11 0.43 0.13 -1.88 -1.14 132.00 137.69 1npe h PRO 837 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1npe h PRO 837 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1npe h PRO 837 CO 0.69 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.74 1npe n LEU 838 N -3.66 1.42 -4.76 1.56 4.77 -1.26 -4.92 117.00 110.15 1npe n LEU 838 Ca -0.03 -0.57 -0.40 0.00 -0.03 0.00 0.00 56.01 54.99 1npe n LEU 838 Cb 0.08 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1npe n LEU 838 CO 0.26 0.28 1.06 0.00 -1.33 0.00 0.00 177.39 177.66 1npe s ALA 839 N -1.86 3.17 0.06 -1.18 0.00 -0.43 -4.94 121.76 116.58 1npe s ALA 839 Ca 0.33 1.46 -0.23 0.00 0.00 0.00 0.00 51.96 53.52 1npe s ALA 839 Cb 0.18 -3.59 -0.15 0.00 0.00 0.00 0.00 23.12 19.55 1npe s ALA 839 CO 0.28 -1.25 1.58 -1.35 0.00 0.00 0.00 175.76 175.01 1npe h PRO 840 N 2.15 0.06 -6.18 0.00 0.11 -1.91 -3.42 132.00 122.81 1npe h PRO 840 Ca -0.51 -0.01 -0.57 0.00 0.11 0.00 0.00 66.00 65.02 1npe h PRO 840 Cb 1.27 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.33 1npe h PRO 840 CO 0.60 0.22 0.66 1.21 -0.21 0.00 0.00 178.00 180.48 1npe s ASN 841 N -5.42 7.18 0.55 -2.05 3.84 -1.26 -4.93 114.94 112.85 1npe s ASN 841 Ca -0.14 1.46 0.23 0.00 0.21 0.00 0.00 52.86 54.62 1npe s ASN 841 Cb 0.05 -2.55 1.52 0.00 -0.55 0.00 0.00 41.25 39.72 1npe s ASN 841 CO 0.67 -0.54 2.18 1.55 -2.79 0.00 0.00 177.10 178.17 1npe h PRO 842 N 7.25 0.00 -0.02 0.43 0.13 -1.99 -2.89 132.00 134.91 1npe h PRO 842 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1npe h PRO 842 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1npe h PRO 842 CO 0.91 0.00 0.01 0.00 -0.23 0.00 0.00 178.00 178.69 1npe h ALA 843 N 1.97 0.03 -0.78 -0.56 0.00 -1.96 -2.91 119.26 115.05 1npe h ALA 843 Ca 0.02 -0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.34 1npe h ALA 843 Cb 0.09 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 17.64 1npe h ALA 843 CO -0.00 -0.47 0.72 -0.40 0.00 0.00 0.00 179.25 179.10 1npe n ASP 844 N -5.07 7.12 0.00 0.00 5.68 -1.09 -4.74 116.55 118.45 1npe n ASP 844 Ca -0.07 -3.51 0.00 0.00 -0.50 0.00 0.00 54.79 50.71 1npe n ASP 844 Cb 0.03 -1.08 0.00 0.00 -1.14 0.00 0.00 41.12 38.94 1npe n ASP 844 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1npe n LYS 845 N -0.14 0.00 -3.46 0.11 5.02 -1.10 -4.13 118.16 114.46 1npe n LYS 845 Ca 0.50 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 56.36 1npe n LYS 845 Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.42 1npe n LYS 845 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1npe s LYS 847 N 1.67 2.76 0.25 0.00 3.01 0.77 -4.55 119.74 123.64 1npe s LYS 847 Ca 0.05 -0.95 -0.30 0.00 -1.01 0.00 0.00 55.97 53.76 1npe s LYS 847 Cb -0.20 -2.55 -0.10 0.00 -1.01 0.00 0.00 37.83 33.97 1npe s LYS 847 CO 0.09 0.47 1.43 0.00 0.51 0.00 0.00 175.35 177.86 1npe s ALA 848 N -1.77 3.62 0.18 5.17 0.00 -1.26 0.07 121.76 127.77 1npe s ALA 848 Ca 0.30 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.46 1npe s ALA 848 Cb -0.10 -3.55 0.09 0.00 0.00 0.00 0.00 23.12 19.57 1npe s ALA 848 CO 0.22 -0.73 1.78 0.00 0.00 0.00 0.00 175.76 177.02 1npe n ALA 850 N -2.34 -1.77 -1.91 0.00 0.00 -1.26 -4.79 120.51 108.44 1npe n ALA 850 Ca 0.04 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 52.97 1npe n ALA 850 Cb 0.11 -2.54 -0.03 0.00 0.00 0.00 0.00 19.45 17.00 1npe n ALA 850 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1npe s ASN 852 N 0.12 6.74 0.50 0.00 2.47 0.65 -4.90 114.94 120.51 1npe s ASN 852 Ca 0.55 2.21 0.34 0.00 0.42 0.00 0.00 52.86 56.38 1npe s ASN 852 Cb -0.38 -2.55 1.69 0.00 -1.45 0.00 0.00 41.25 38.56 1npe s ASN 852 CO 0.43 -0.83 2.02 1.55 -3.72 0.00 0.00 177.10 176.54 1npe h PRO 853 N 8.59 0.00 0.09 0.43 0.13 -1.91 -1.81 132.00 137.52 1npe h PRO 853 Ca -0.39 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.38 1npe h PRO 853 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1npe h PRO 853 CO 0.93 0.00 -2.06 0.66 -0.23 0.00 0.00 178.00 177.31 1npe n TYR 854 N -2.75 0.97 1.20 1.56 4.01 -1.26 -4.44 117.16 116.46 1npe n TYR 854 Ca -0.01 0.22 0.13 0.00 -0.16 0.00 0.00 57.90 58.08 1npe n TYR 854 Cb 0.13 -1.12 0.36 0.00 -0.31 0.00 0.00 39.34 38.40 1npe n TYR 854 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1npe n GLY 855 N 1.99 -0.73 3.81 2.72 0.00 -1.15 -4.15 105.19 107.69 1npe n GLY 855 Ca -0.35 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 1npe n GLY 855 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npe s THR 856 N -2.59 5.41 0.12 2.61 2.01 -0.69 -0.19 115.64 122.32 1npe s THR 856 Ca 0.22 0.29 -0.34 0.00 0.31 0.00 0.00 61.69 62.17 1npe s THR 856 Cb 0.19 -3.47 -0.14 0.00 0.01 0.00 0.00 72.50 69.09 1npe s THR 856 CO 0.55 0.53 1.59 0.52 -0.69 0.00 0.00 174.62 177.12 1npe n VAL 857 N 2.63 0.07 -1.30 3.82 0.31 0.32 -2.02 118.33 122.16 1npe n VAL 857 Ca -0.17 -0.01 -0.12 0.00 -0.01 0.00 0.00 64.34 64.03 1npe n VAL 857 Cb 0.53 -1.49 -0.05 0.00 -0.91 0.00 0.00 33.84 31.92 1npe n VAL 857 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1npe n GLN 858 N 3.73 -1.37 -2.37 5.55 6.02 -1.26 -2.12 117.38 125.57 1npe n GLN 858 Ca 0.18 0.73 -0.20 0.00 -0.01 0.00 0.00 57.00 57.70 1npe n GLN 858 Cb 0.28 -4.93 -0.01 0.00 1.02 0.00 0.00 30.24 26.59 1npe n GLN 858 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1npe n GLN 859 N -1.61 -1.71 -1.75 -1.09 6.02 -0.86 -4.95 117.38 111.43 1npe n GLN 859 Ca -0.12 0.99 -0.38 0.00 -0.01 0.00 0.00 57.00 57.48 1npe n GLN 859 Cb 0.42 -5.64 0.05 0.00 1.02 0.00 0.00 30.24 26.09 1npe n GLN 859 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1npe s GLN 860 N -4.99 3.00 -0.01 -1.09 -0.21 -0.90 -4.95 119.66 110.51 1npe s GLN 860 Ca 0.00 2.23 0.18 0.00 0.02 0.00 0.00 55.36 57.79 1npe s GLN 860 Cb 0.00 -2.17 -0.23 0.00 1.00 0.00 0.00 33.01 31.61 1npe s GLN 860 CO 0.00 -1.30 0.61 -1.13 -2.12 0.00 0.00 175.29 171.35 1npe n SER 861 N -1.22 0.83 -4.91 5.90 3.41 -1.26 -4.76 113.62 111.61 1npe n SER 861 Ca 0.12 -0.55 -0.27 0.00 -0.26 0.00 0.00 58.87 57.90 1npe n SER 861 Cb 0.45 1.33 0.06 0.00 -0.26 0.00 0.00 64.21 65.79 1npe n SER 861 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1npe s SER 862 N -3.25 5.13 0.32 4.04 0.01 -1.26 -4.49 113.70 114.20 1npe s SER 862 Ca 0.01 0.72 -0.15 0.00 1.31 0.00 0.00 55.95 57.84 1npe s SER 862 Cb 0.13 -1.48 0.02 0.00 0.21 0.00 0.00 66.02 64.90 1npe s SER 862 CO 0.74 -1.43 0.65 0.00 0.41 0.00 0.00 173.24 173.61 1npe n ASN 864 N -0.88 3.13 0.13 0.00 2.85 -0.87 -4.86 115.26 114.76 1npe n ASN 864 Ca -0.04 1.05 0.19 0.00 -0.11 0.00 0.00 54.58 55.67 1npe n ASN 864 Cb 0.60 -1.40 0.77 0.00 1.24 0.00 0.00 39.78 40.99 1npe n ASN 864 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1npe h PRO 865 N 6.79 0.00 0.00 1.20 0.13 -1.93 0.26 132.00 138.45 1npe h PRO 865 Ca -0.46 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.41 1npe h PRO 865 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 1npe h PRO 865 CO 0.90 0.00 -1.81 0.28 -0.23 0.00 0.00 178.00 177.14 1npe n VAL 866 N -3.92 1.15 0.12 1.56 0.31 -1.26 -1.08 118.33 115.20 1npe n VAL 866 Ca 0.05 -0.17 0.04 0.00 -0.01 0.00 0.00 64.34 64.25 1npe n VAL 866 Cb 0.48 -1.84 0.02 0.00 -0.91 0.00 0.00 33.84 31.58 1npe n VAL 866 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1npe h THR 867 N -0.70 0.53 0.00 2.52 1.35 -1.97 -3.42 112.91 111.21 1npe h THR 867 Ca -0.40 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 63.64 1npe h THR 867 Cb 1.28 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.85 1npe h THR 867 CO -0.24 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 175.94 1npe n GLY 868 N 1.24 1.24 3.66 5.82 0.00 0.08 -4.97 105.19 112.26 1npe n GLY 868 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1npe n GLY 868 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1npe n GLN 869 N -2.00 2.79 -2.07 1.61 -0.06 -1.26 -4.35 117.38 112.04 1npe n GLN 869 Ca 0.00 1.02 -0.32 0.00 -2.00 0.00 0.00 57.00 55.70 1npe n GLN 869 Cb 0.00 -2.98 -0.00 0.00 -4.06 0.00 0.00 30.24 23.19 1npe n GLN 869 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1npe s GLN 871 N -4.60 3.35 0.47 0.00 0.74 -1.26 -4.83 119.66 113.54 1npe s GLN 871 Ca 0.58 -0.70 -0.22 0.00 0.05 0.00 0.00 55.36 55.07 1npe s GLN 871 Cb -0.11 -4.89 -0.07 0.00 1.10 0.00 0.00 33.01 29.03 1npe s GLN 871 CO 0.43 -2.28 1.14 0.00 -0.55 0.00 0.00 175.29 174.04 1npe s LEU 873 N -3.18 2.57 0.07 0.00 1.43 0.73 -4.68 118.68 115.63 1npe s LEU 873 Ca 0.65 0.89 -0.37 0.00 -1.03 0.00 0.00 54.13 54.27 1npe s LEU 873 Cb -0.27 -3.45 -0.17 0.00 0.03 0.00 0.00 46.19 42.34 1npe s LEU 873 CO 0.32 -1.81 1.33 -2.65 0.23 0.00 0.00 176.35 173.77 1npe n PRO 874 N -3.27 1.07 -1.40 1.29 -0.02 -1.26 -1.87 135.00 129.54 1npe n PRO 874 Ca 0.08 0.39 -0.14 0.00 -2.02 0.00 0.00 63.50 61.81 1npe n PRO 874 Cb 0.60 -2.02 -0.06 0.00 -0.02 0.00 0.00 33.50 32.00 1npe n PRO 874 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1npe n HIS 875 N 2.52 0.00 -4.48 6.00 8.25 -1.26 -2.20 115.22 124.04 1npe n HIS 875 Ca 0.19 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.31 1npe n HIS 875 Cb 0.18 -2.53 -0.12 0.00 1.12 0.00 0.00 29.99 28.64 1npe n HIS 875 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1npe s VAL 876 N -2.45 3.82 0.43 1.59 1.01 -0.78 -0.74 120.40 123.28 1npe s VAL 876 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.60 1npe s VAL 876 Cb 0.00 -2.64 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1npe s VAL 876 CO 0.00 0.53 0.08 -1.54 0.00 0.00 0.00 175.10 174.17 1npe n SER 877 N 3.12 2.13 0.00 3.32 3.41 0.71 -4.67 113.62 121.64 1npe n SER 877 Ca -0.18 -3.11 0.00 0.00 -0.26 0.00 0.00 58.87 55.33 1npe n SER 877 Cb 0.53 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1npe n SER 877 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1npe n GLY 878 N -0.73 1.31 0.20 5.00 0.00 -1.26 -2.69 105.19 107.02 1npe n GLY 878 Ca -0.12 -1.64 -0.03 0.00 0.00 0.00 0.00 46.02 44.23 1npe n GLY 878 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1npe h ARG 879 N 0.00 0.32 -0.08 1.61 2.43 -1.94 -1.33 114.38 115.40 1npe h ARG 879 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1npe h ARG 879 Cb 0.00 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1npe h ARG 879 CO 0.00 0.21 0.00 -0.40 -1.51 0.00 0.00 179.97 178.27 1npe n ASP 880 N -5.02 1.21 -3.45 -3.80 5.75 -1.26 -0.45 116.55 109.52 1npe n ASP 880 Ca 0.05 -1.53 -0.23 0.00 -0.01 0.00 0.00 54.79 53.08 1npe n ASP 880 Cb 0.21 -0.05 0.08 0.00 -1.03 0.00 0.00 41.12 40.33 1npe n ASP 880 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1npe n GLY 882 N -1.92 3.33 2.92 0.00 0.00 -1.22 -3.80 105.19 104.50 1npe n GLY 882 Ca -0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 1npe n GLY 882 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npe s THR 883 N -1.92 0.43 0.40 2.61 2.01 -1.09 -5.05 115.64 113.03 1npe s THR 883 Ca 0.35 -0.15 -0.23 0.00 0.31 0.00 0.00 61.69 61.97 1npe s THR 883 Cb 0.24 -0.42 -0.10 0.00 0.01 0.00 0.00 72.50 72.24 1npe s THR 883 CO 0.14 0.16 1.00 0.00 -0.69 0.00 0.00 174.62 175.23 1npe s ASP 885 N -1.78 5.81 0.07 0.00 1.01 0.08 -4.73 116.67 117.13 1npe s ASP 885 Ca 0.59 2.41 -0.35 0.00 0.71 0.00 0.00 52.55 55.90 1npe s ASP 885 Cb -0.17 -2.61 -0.14 0.00 1.01 0.00 0.00 42.92 41.01 1npe s ASP 885 CO 0.22 -1.17 1.61 -2.65 0.21 0.00 0.00 175.17 173.39 1npe n PRO 886 N -0.81 1.90 -0.20 8.23 -0.02 -1.26 -1.04 135.00 141.79 1npe n PRO 886 Ca 0.09 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1npe n PRO 886 Cb 0.48 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1npe n PRO 886 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npe n GLY 887 N 3.50 0.74 3.27 -1.23 0.00 -1.26 -5.07 105.19 105.15 1npe n GLY 887 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 1npe n GLY 887 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1npe s TYR 888 N -2.21 1.68 0.33 1.61 1.51 -0.21 -4.80 117.35 115.27 1npe s TYR 888 Ca 0.00 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.67 1npe s TYR 888 Cb 0.00 -0.91 -0.03 0.00 -0.11 0.00 0.00 41.96 40.91 1npe s TYR 888 CO 0.00 0.20 0.22 0.71 -1.11 0.00 0.00 175.55 175.57 1npe s TYR 889 N -1.37 1.68 -0.78 2.71 2.02 0.77 -4.63 117.35 117.75 1npe s TYR 889 Ca 0.07 -1.54 -0.01 0.00 -0.37 0.00 0.00 57.07 55.22 1npe s TYR 889 Cb -0.09 -0.79 -0.00 0.00 -0.40 0.00 0.00 41.96 40.68 1npe s TYR 889 CO 0.04 -0.71 0.69 -1.71 -1.57 0.00 0.00 175.55 172.29 1npe n ASN 890 N -1.30 -7.03 0.15 2.29 4.05 -1.26 -0.19 115.26 111.97 1npe n ASN 890 Ca 0.04 -0.32 0.04 0.00 0.45 0.00 0.00 54.58 54.79 1npe n ASN 890 Cb 0.63 -4.44 0.45 0.00 1.23 0.00 0.00 39.78 37.65 1npe n ASN 890 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1npe h LEU 891 N 0.17 0.16 0.00 1.20 5.85 -1.94 -2.72 115.31 118.02 1npe h LEU 891 Ca -0.18 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1npe h LEU 891 Cb 1.11 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1npe h LEU 891 CO 0.33 0.29 0.00 0.00 -0.34 0.00 0.00 178.44 178.71 1npe n GLN 892 N -4.33 0.37 0.24 1.25 0.00 -1.26 -2.83 117.38 110.82 1npe n GLN 892 Ca -0.01 0.00 0.09 0.00 0.00 0.00 0.00 57.00 57.08 1npe n GLN 892 Cb 0.23 -1.45 0.59 0.00 0.00 0.00 0.00 30.24 29.61 1npe n GLN 892 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1npe h SER 893 N 0.00 0.00 0.00 2.61 4.64 -1.78 -3.46 113.55 115.56 1npe h SER 893 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1npe h SER 893 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1npe h SER 893 CO 0.00 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.76 1npe n GLY 894 N -0.60 0.37 0.00 -0.77 0.00 -1.13 -4.79 105.19 98.28 1npe n GLY 894 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1npe n GLY 894 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1npe n GLN 895 N -1.78 1.11 0.00 1.61 -0.06 -1.26 -4.99 117.38 112.01 1npe n GLN 895 Ca 0.00 -0.93 0.00 0.00 -2.00 0.00 0.00 57.00 54.07 1npe n GLN 895 Cb 0.14 -0.89 0.00 0.00 -4.06 0.00 0.00 30.24 25.43 1npe n GLN 895 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1npe n GLY 896 N -0.24 2.37 3.73 1.69 0.00 -1.26 -4.38 105.19 107.11 1npe n GLY 896 Ca 0.00 -1.86 -0.35 0.00 0.00 0.00 0.00 46.02 43.81 1npe n GLY 896 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npe s GLU 898 N -3.66 1.65 0.00 0.00 -1.05 0.74 -4.71 118.70 111.68 1npe s GLU 898 Ca 0.77 -1.95 0.00 0.00 -0.15 0.00 0.00 54.97 53.64 1npe s GLU 898 Cb -0.32 0.10 0.00 0.00 -0.44 0.00 0.00 34.13 33.47 1npe s GLU 898 CO 0.42 -0.54 0.00 2.89 0.95 0.00 0.00 175.26 178.98