#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q7f n SER 757 N 0.00 7.08 0.21 4.39 3.41 -1.26 -4.05 113.62 123.40 1q7f n SER 757 Ca 0.00 -3.78 0.11 0.00 -0.26 0.00 0.00 58.87 54.94 1q7f n SER 757 Cb 0.00 -0.85 0.36 0.00 -0.26 0.00 0.00 64.21 63.46 1q7f n SER 757 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1q7f h GLN 758 N 2.13 0.00 -6.38 4.33 1.08 -2.00 -3.40 115.11 110.87 1q7f h GLN 758 Ca 0.55 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 57.22 1q7f h GLN 758 Cb 0.89 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.34 1q7f h GLN 758 CO 1.40 0.00 1.13 0.42 -0.95 0.00 0.00 178.83 180.83 1q7f s ILE 759 N -4.16 3.08 0.10 2.54 1.01 -1.26 -4.94 121.20 117.56 1q7f s ILE 759 Ca -0.02 0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.62 1q7f s ILE 759 Cb 0.06 -3.18 -0.06 0.00 0.01 0.00 0.00 42.46 39.28 1q7f s ILE 759 CO 0.21 -0.02 1.19 -0.54 0.00 0.00 0.00 174.94 175.78 1q7f s LYS 760 N 3.70 4.46 0.09 2.79 1.02 -1.26 -5.03 119.74 125.50 1q7f s LYS 760 Ca 0.81 1.79 0.08 0.00 0.02 0.00 0.00 55.97 58.66 1q7f s LYS 760 Cb -0.40 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.56 1q7f s LYS 760 CO 0.36 -0.19 -0.21 1.03 -0.92 0.00 0.00 175.35 175.42 1q7f s ARG 761 N 0.65 1.22 0.15 1.68 0.52 -1.26 -4.71 118.95 117.20 1q7f s ARG 761 Ca 0.57 -1.11 -0.15 0.00 -0.52 0.00 0.00 55.73 54.51 1q7f s ARG 761 Cb -0.30 -1.46 -0.07 0.00 0.52 0.00 0.00 34.95 33.64 1q7f s ARG 761 CO 0.31 0.35 0.58 -0.65 0.02 0.00 0.00 175.30 175.91 1q7f s GLN 762 N -1.70 4.04 0.30 3.54 -1.52 -0.08 -4.82 119.66 119.42 1q7f s GLN 762 Ca 0.07 0.57 -0.18 0.00 -1.95 0.00 0.00 55.36 53.87 1q7f s GLN 762 Cb -0.10 -2.94 -0.09 0.00 -0.22 0.00 0.00 33.01 29.66 1q7f s GLN 762 CO 0.04 0.47 0.77 1.03 -0.25 0.00 0.00 175.29 177.35 1q7f s ARG 763 N -1.91 4.15 0.04 2.91 0.52 -1.26 -0.71 118.95 122.70 1q7f s ARG 763 Ca 0.38 0.83 0.00 0.00 -0.52 0.00 0.00 55.73 56.42 1q7f s ARG 763 Cb -0.16 -2.58 -0.03 0.00 0.52 0.00 0.00 34.95 32.71 1q7f s ARG 763 CO 0.19 0.22 -0.04 0.00 0.02 0.00 0.00 175.30 175.69 1q7f s MET 764 N -2.61 0.50 0.31 3.54 0.23 0.00 -4.86 119.30 116.42 1q7f s MET 764 Ca 0.51 -0.90 0.08 0.00 -1.03 0.00 0.00 55.69 54.35 1q7f s MET 764 Cb -0.13 0.02 -0.06 0.00 -1.53 0.00 0.00 34.83 33.13 1q7f s MET 764 CO 0.19 -0.04 -0.08 0.96 -2.03 0.00 0.00 175.02 174.01 1q7f s ILE 765 N -2.42 1.96 0.10 3.16 -4.36 -1.26 -1.16 121.20 117.21 1q7f s ILE 765 Ca -0.05 -2.18 -0.02 0.00 -0.26 0.00 0.00 60.65 58.15 1q7f s ILE 765 Cb -0.03 -2.53 -0.05 0.00 1.25 0.00 0.00 42.46 41.10 1q7f s ILE 765 CO -0.04 -0.26 0.28 -0.72 0.24 0.00 0.00 174.94 174.45 1q7f s TYR 766 N -2.80 3.50 -0.87 1.37 -0.85 -1.26 -4.34 117.35 112.10 1q7f s TYR 766 Ca 0.31 0.37 0.08 0.00 -0.52 0.00 0.00 57.07 57.31 1q7f s TYR 766 Cb 0.03 -1.86 0.15 0.00 0.38 0.00 0.00 41.96 40.66 1q7f s TYR 766 CO 0.14 0.52 0.98 -2.39 -1.52 0.00 0.00 175.55 173.28 1q7f n HIS 767 N 0.14 0.18 -3.62 -3.49 1.44 -0.78 -5.00 115.22 104.09 1q7f n HIS 767 Ca -0.04 -0.26 -0.15 0.00 -2.01 0.00 0.00 57.72 55.26 1q7f n HIS 767 Cb 0.51 -0.02 -0.07 0.00 0.12 0.00 0.00 29.99 30.53 1q7f n HIS 767 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1q7f s LYS 769 N -0.25 0.97 0.09 0.00 -2.85 -1.26 -1.01 119.74 115.43 1q7f s LYS 769 Ca -0.04 0.09 -0.25 0.00 -1.00 0.00 0.00 55.97 54.77 1q7f s LYS 769 Cb -0.03 0.45 0.07 0.00 -2.06 0.00 0.00 37.83 36.26 1q7f s LYS 769 CO 0.04 -0.31 0.60 -0.59 0.10 0.00 0.00 175.35 175.20 1q7f s PHE 770 N -1.41 -0.55 0.00 1.78 -0.12 -0.64 -4.99 117.98 112.05 1q7f s PHE 770 Ca -0.11 0.53 0.00 0.00 -0.05 0.00 0.00 56.93 57.30 1q7f s PHE 770 Cb -0.01 0.49 0.00 0.00 -0.63 0.00 0.00 43.02 42.87 1q7f s PHE 770 CO 0.07 -0.76 0.00 0.41 -0.05 0.00 0.00 175.22 174.89 1q7f n GLY 771 N 0.03 2.73 3.66 1.99 0.00 -1.26 -1.12 105.19 111.23 1q7f n GLY 771 Ca -0.18 -1.78 -0.07 0.00 0.00 0.00 0.00 46.02 43.99 1q7f n GLY 771 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1q7f s GLU 772 N -3.79 1.29 0.37 1.61 -1.05 -0.75 -4.61 118.70 111.77 1q7f s GLU 772 Ca 0.00 -0.63 -0.28 0.00 -0.15 0.00 0.00 54.97 53.91 1q7f s GLU 772 Cb 0.00 0.49 -0.11 0.00 -0.44 0.00 0.00 34.13 34.08 1q7f s GLU 772 CO 0.00 -0.58 1.42 0.12 0.95 0.00 0.00 175.26 177.17 1q7f s PHE 773 N -3.52 2.73 -5.00 4.83 5.36 -1.26 -0.68 117.98 120.45 1q7f s PHE 773 Ca 0.08 1.26 0.00 0.00 -0.96 0.00 0.00 56.93 57.31 1q7f s PHE 773 Cb -0.02 -3.90 0.00 0.00 -0.34 0.00 0.00 43.02 38.76 1q7f s PHE 773 CO -0.02 -2.61 0.00 0.41 -1.46 0.00 0.00 175.22 171.54 1q7f n GLY 774 N 0.57 -2.15 0.00 13.12 0.00 -0.90 -4.70 105.19 111.13 1q7f n GLY 774 Ca 0.01 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1q7f n GLY 774 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1q7f n VAL 775 N -1.01 0.00 -2.27 1.61 0.24 -1.26 -3.45 118.33 112.19 1q7f n VAL 775 Ca 0.00 -0.48 -0.27 0.00 -2.04 0.00 0.00 64.34 61.56 1q7f n VAL 775 Cb 0.00 1.04 0.15 0.00 -1.47 0.00 0.00 33.84 33.56 1q7f n VAL 775 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1q7f s MET 776 N -0.20 1.12 0.13 7.34 -1.94 -1.26 -4.92 119.30 119.58 1q7f s MET 776 Ca 0.00 -0.80 -0.33 0.00 -1.71 0.00 0.00 55.69 52.86 1q7f s MET 776 Cb 0.00 -2.09 -0.12 0.00 2.01 0.00 0.00 34.83 34.63 1q7f s MET 776 CO 0.00 -1.95 1.73 0.39 -0.01 0.00 0.00 175.02 175.18 1q7f n GLU 777 N -3.31 2.52 -0.40 2.03 4.71 -1.26 -1.42 120.64 123.52 1q7f n GLU 777 Ca 0.15 0.91 0.00 0.00 -0.01 0.00 0.00 57.16 58.22 1q7f n GLU 777 Cb 0.60 -2.75 0.00 0.00 -1.01 0.00 0.00 31.44 28.28 1q7f n GLU 777 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1q7f n GLY 778 N 3.93 1.54 3.91 0.62 0.00 -1.26 -5.03 105.19 108.91 1q7f n GLY 778 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1q7f n GLY 778 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q7f s GLN 779 N -0.24 3.31 0.11 1.61 -0.21 -0.51 -4.01 119.66 119.72 1q7f s GLN 779 Ca 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 55.36 54.74 1q7f s GLN 779 Cb 0.00 -2.88 -0.04 0.00 1.00 0.00 0.00 33.01 31.08 1q7f s GLN 779 CO 0.00 0.51 -0.09 -0.06 -2.12 0.00 0.00 175.29 173.53 1q7f s PHE 780 N -1.76 1.05 -0.16 0.91 0.40 0.15 -4.68 117.98 113.88 1q7f s PHE 780 Ca 0.34 -0.80 0.01 0.00 -0.60 0.00 0.00 56.93 55.88 1q7f s PHE 780 Cb -0.11 -0.57 -0.10 0.00 0.51 0.00 0.00 43.02 42.75 1q7f s PHE 780 CO 0.27 -0.04 -0.15 0.25 0.70 0.00 0.00 175.22 176.26 1q7f n THR 781 N 0.07 0.93 -3.13 0.64 -2.24 -1.25 -2.12 114.28 107.17 1q7f n THR 781 Ca -0.13 -0.35 0.03 0.00 -2.27 0.00 0.00 64.05 61.33 1q7f n THR 781 Cb 0.60 -1.09 -0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1q7f n THR 781 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1q7f s GLU 782 N -2.32 0.53 -1.29 -0.78 2.12 -1.26 -4.87 118.70 110.83 1q7f s GLU 782 Ca -0.22 0.17 -0.18 0.00 0.36 0.00 0.00 54.97 55.10 1q7f s GLU 782 Cb 0.06 0.15 0.06 0.00 0.26 0.00 0.00 34.13 34.65 1q7f s GLU 782 CO 0.37 -0.89 1.75 -1.25 -0.54 0.00 0.00 175.26 174.71 1q7f s PRO 783 N 2.46 3.87 0.41 4.30 0.04 -1.26 -1.93 135.00 142.89 1q7f s PRO 783 Ca 0.15 -1.93 0.25 0.00 0.04 0.00 0.00 61.00 59.51 1q7f s PRO 783 Cb -0.05 -5.52 0.60 0.00 0.04 0.00 0.00 34.50 29.56 1q7f s PRO 783 CO -0.19 -2.39 1.70 0.66 0.04 0.00 0.00 177.00 176.82 1q7f h SER 784 N 7.75 0.00 -4.47 6.66 4.64 -1.66 -3.39 113.55 123.07 1q7f h SER 784 Ca 0.43 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.58 1q7f h SER 784 Cb 0.88 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.73 1q7f h SER 784 CO 1.44 0.00 -0.55 -0.83 -0.87 0.00 0.00 176.83 176.03 1q7f s GLY 785 N -4.08 0.01 -0.01 -0.77 0.00 -1.01 -4.36 107.32 97.10 1q7f s GLY 785 Ca 0.07 0.03 -0.03 0.00 0.00 0.00 0.00 44.72 44.79 1q7f s GLY 785 CO 0.63 -0.07 0.05 0.54 0.00 0.00 0.00 173.10 174.25 1q7f s VAL 786 N -0.78 0.05 0.18 1.40 0.11 -1.26 -0.89 120.40 119.20 1q7f s VAL 786 Ca -0.09 -0.41 -0.10 0.00 -2.93 0.00 0.00 61.98 58.45 1q7f s VAL 786 Cb -0.05 -0.22 -0.01 0.00 -1.53 0.00 0.00 36.38 34.58 1q7f s VAL 786 CO 0.01 -0.23 0.32 0.00 -3.33 0.00 0.00 175.10 171.87 1q7f s ALA 787 N -0.70 -0.05 -0.00 1.54 0.00 -0.28 -4.59 121.76 117.68 1q7f s ALA 787 Ca -0.08 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1q7f s ALA 787 Cb -0.05 0.90 -0.01 0.00 0.00 0.00 0.00 23.12 23.97 1q7f s ALA 787 CO 0.00 -0.68 -0.07 0.08 0.00 0.00 0.00 175.76 175.10 1q7f s VAL 788 N -3.97 0.51 0.53 0.00 1.01 -1.26 -0.69 120.40 116.52 1q7f s VAL 788 Ca 0.18 -0.32 0.04 0.00 0.00 0.00 0.00 61.98 61.87 1q7f s VAL 788 Cb 0.03 -0.44 0.10 0.00 0.00 0.00 0.00 36.38 36.06 1q7f s VAL 788 CO 0.01 0.12 0.73 -0.46 0.00 0.00 0.00 175.10 175.50 1q7f n ASN 789 N 2.84 1.37 0.19 3.32 0.23 -1.06 -4.76 115.26 117.40 1q7f n ASN 789 Ca -0.14 -2.07 0.15 0.00 -0.53 0.00 0.00 54.58 52.00 1q7f n ASN 789 Cb 0.58 -0.44 0.77 0.00 -2.08 0.00 0.00 39.78 38.61 1q7f n ASN 789 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1q7f h ALA 790 N -0.22 1.95 -0.04 -2.53 0.00 -1.92 0.51 119.26 117.00 1q7f h ALA 790 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1q7f h ALA 790 Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1q7f h ALA 790 CO 0.30 -0.26 0.00 1.04 0.00 0.00 0.00 179.25 180.32 1q7f n GLN 791 N -4.08 1.52 -1.16 0.00 3.00 -1.26 -4.90 117.38 110.50 1q7f n GLN 791 Ca 0.02 -0.76 -0.06 0.00 -0.01 0.00 0.00 57.00 56.19 1q7f n GLN 791 Cb 0.30 -1.45 -0.02 0.00 0.00 0.00 0.00 30.24 29.06 1q7f n GLN 791 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1q7f n ASN 792 N -0.06 -3.82 -4.77 1.08 5.03 0.17 -4.72 115.26 108.16 1q7f n ASN 792 Ca 0.19 0.14 -0.35 0.00 0.87 0.00 0.00 54.58 55.42 1q7f n ASN 792 Cb 0.29 -1.81 0.01 0.00 -1.02 0.00 0.00 39.78 37.25 1q7f n ASN 792 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1q7f s ASP 793 N -2.78 5.58 -0.27 6.41 1.01 -1.26 -3.18 116.67 122.18 1q7f s ASP 793 Ca 0.00 2.23 -0.09 0.00 0.71 0.00 0.00 52.55 55.40 1q7f s ASP 793 Cb 0.00 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 1q7f s ASP 793 CO 0.00 -1.32 0.12 -0.63 0.21 0.00 0.00 175.17 173.55 1q7f s ILE 794 N -1.74 4.68 -0.19 0.77 1.01 0.11 -2.57 121.20 123.28 1q7f s ILE 794 Ca 0.74 -0.08 -0.07 0.00 0.00 0.00 0.00 60.65 61.24 1q7f s ILE 794 Cb -0.25 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1q7f s ILE 794 CO 0.29 0.28 0.06 -0.63 0.00 0.00 0.00 174.94 174.94 1q7f s ILE 795 N 1.67 4.64 -0.05 2.92 1.01 0.13 -0.84 121.20 130.68 1q7f s ILE 795 Ca 0.06 -0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.66 1q7f s ILE 795 Cb -0.16 -3.10 0.01 0.00 0.01 0.00 0.00 42.46 39.22 1q7f s ILE 795 CO 0.06 0.44 -0.12 -0.69 0.00 0.00 0.00 174.94 174.64 1q7f s VAL 796 N 0.59 1.05 -0.28 2.92 1.01 0.48 -1.12 120.40 125.05 1q7f s VAL 796 Ca 0.03 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.30 1q7f s VAL 796 Cb -0.13 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.30 1q7f s VAL 796 CO 0.01 0.32 0.79 0.00 0.00 0.00 0.00 175.10 176.23 1q7f s ALA 797 N 0.37 3.57 -0.89 5.51 0.00 -0.07 -1.02 121.76 129.23 1q7f s ALA 797 Ca -0.08 -0.34 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 1q7f s ALA 797 Cb -0.12 -3.27 0.22 0.00 0.00 0.00 0.00 23.12 19.94 1q7f s ALA 797 CO 0.02 -1.09 0.79 0.34 0.00 0.00 0.00 175.76 175.82 1q7f s ASP 798 N 1.52 6.11 0.08 0.00 2.15 -0.31 -2.11 116.67 124.12 1q7f s ASP 798 Ca 0.33 -3.59 -0.17 0.00 0.43 0.00 0.00 52.55 49.55 1q7f s ASP 798 Cb -0.15 -1.95 -0.04 0.00 -0.30 0.00 0.00 42.92 40.48 1q7f s ASP 798 CO 0.11 -0.23 1.29 0.74 -0.17 0.00 0.00 175.17 176.91 1q7f h THR 799 N 4.16 0.00 0.00 1.71 2.02 -1.45 -1.43 112.91 117.93 1q7f h THR 799 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1q7f h THR 799 Cb 0.84 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1q7f h THR 799 CO 0.86 0.00 0.00 0.59 0.37 0.00 0.00 175.52 177.34 1q7f n ASN 800 N -4.21 0.00 -0.26 4.18 3.02 -1.26 -0.78 115.26 115.95 1q7f n ASN 800 Ca 0.01 -0.67 0.06 0.00 -0.03 0.00 0.00 54.58 53.94 1q7f n ASN 800 Cb 0.15 0.00 -0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1q7f n ASN 800 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1q7f n ASN 801 N -0.98 1.31 -3.82 6.41 3.02 -0.80 -5.00 115.26 115.41 1q7f n ASN 801 Ca 0.15 -1.16 -0.25 0.00 -0.03 0.00 0.00 54.58 53.30 1q7f n ASN 801 Cb 0.07 0.47 0.01 0.00 -0.61 0.00 0.00 39.78 39.72 1q7f n ASN 801 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1q7f n HIS 802 N -0.23 -1.78 -3.87 3.10 8.25 0.04 -4.43 115.22 116.30 1q7f n HIS 802 Ca 0.05 0.74 -0.10 0.00 -0.26 0.00 0.00 57.72 58.15 1q7f n HIS 802 Cb 0.24 -3.94 -0.06 0.00 1.12 0.00 0.00 29.99 27.36 1q7f n HIS 802 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1q7f s ARG 803 N -6.26 1.18 -0.09 -0.41 1.70 -1.15 -1.17 118.95 112.75 1q7f s ARG 803 Ca 0.07 -1.04 0.03 0.00 -0.47 0.00 0.00 55.73 54.32 1q7f s ARG 803 Cb -0.02 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.77 1q7f s ARG 803 CO 0.86 -0.45 -0.21 0.42 -1.08 0.00 0.00 175.30 174.84 1q7f s ILE 804 N -3.92 2.36 -0.03 4.99 -1.09 0.15 -1.17 121.20 122.49 1q7f s ILE 804 Ca 0.13 -0.93 0.06 0.00 -2.23 0.00 0.00 60.65 57.68 1q7f s ILE 804 Cb 0.02 -1.92 -0.02 0.00 -1.58 0.00 0.00 42.46 38.96 1q7f s ILE 804 CO -0.03 0.56 -0.19 -1.10 -1.23 0.00 0.00 174.94 172.95 1q7f s GLN 805 N 0.16 2.31 -0.05 2.79 -0.21 -0.19 -1.31 119.66 123.18 1q7f s GLN 805 Ca -0.12 -0.81 0.06 0.00 0.02 0.00 0.00 55.36 54.52 1q7f s GLN 805 Cb -0.16 -2.23 -0.02 0.00 1.00 0.00 0.00 33.01 31.61 1q7f s GLN 805 CO 0.06 0.59 -0.24 0.42 -2.12 0.00 0.00 175.29 174.01 1q7f s ILE 806 N -0.70 2.17 0.17 1.08 1.09 0.01 -0.38 121.20 124.64 1q7f s ILE 806 Ca 0.11 -1.04 0.04 0.00 -1.10 0.00 0.00 60.65 58.66 1q7f s ILE 806 Cb -0.10 -1.78 -0.05 0.00 -1.06 0.00 0.00 42.46 39.47 1q7f s ILE 806 CO 0.00 0.57 -0.07 -0.36 -0.10 0.00 0.00 174.94 174.99 1q7f s PHE 807 N -0.36 1.33 0.95 3.97 0.08 -0.02 -0.23 117.98 123.70 1q7f s PHE 807 Ca 0.03 -0.83 -0.16 0.00 0.12 0.00 0.00 56.93 56.09 1q7f s PHE 807 Cb -0.12 -0.72 0.19 0.00 -0.57 0.00 0.00 43.02 41.80 1q7f s PHE 807 CO 0.02 0.02 1.30 0.16 -0.10 0.00 0.00 175.22 176.62 1q7f s ASP 808 N -3.20 3.24 0.00 1.36 1.47 -0.10 0.07 116.67 119.50 1q7f s ASP 808 Ca 0.20 0.34 0.06 0.00 1.18 0.00 0.00 52.55 54.33 1q7f s ASP 808 Cb 0.04 -0.44 0.30 0.00 -0.34 0.00 0.00 42.92 42.48 1q7f s ASP 808 CO 0.03 -2.66 1.04 2.29 0.68 0.00 0.00 175.17 176.55 1q7f n LYS 809 N -3.73 0.08 -0.21 2.11 2.85 -1.19 -1.19 118.16 116.88 1q7f n LYS 809 Ca 0.14 0.23 0.09 0.00 -1.05 0.00 0.00 58.31 57.72 1q7f n LYS 809 Cb 0.60 -1.50 0.20 0.00 -0.65 0.00 0.00 35.03 33.68 1q7f n LYS 809 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1q7f n GLU 810 N -1.29 2.48 -0.71 -1.58 1.02 -1.26 -4.97 120.64 114.33 1q7f n GLU 810 Ca 0.03 -2.17 0.00 0.00 -0.02 0.00 0.00 57.16 55.00 1q7f n GLU 810 Cb 0.05 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1q7f n GLU 810 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1q7f n GLY 811 N 1.06 0.62 3.71 0.62 0.00 -0.33 -4.94 105.19 105.93 1q7f n GLY 811 Ca 0.16 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1q7f n GLY 811 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q7f s ARG 812 N -0.58 4.37 0.26 1.61 0.52 -1.26 -4.81 118.95 119.06 1q7f s ARG 812 Ca 0.00 0.72 -0.31 0.00 -0.52 0.00 0.00 55.73 55.62 1q7f s ARG 812 Cb 0.00 -3.47 -0.12 0.00 0.52 0.00 0.00 34.95 31.88 1q7f s ARG 812 CO 0.00 0.03 1.63 0.34 0.02 0.00 0.00 175.30 177.32 1q7f n PHE 813 N 3.98 2.76 -0.04 -0.53 7.35 -1.26 -0.92 117.46 128.79 1q7f n PHE 813 Ca -0.03 0.19 -0.09 0.00 -0.76 0.00 0.00 57.45 56.76 1q7f n PHE 813 Cb 0.51 -2.61 -0.03 0.00 0.35 0.00 0.00 39.48 37.70 1q7f n PHE 813 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1q7f n LYS 814 N 2.82 0.29 -3.82 -4.13 5.02 0.67 -4.87 118.16 114.15 1q7f n LYS 814 Ca 0.12 0.12 -0.03 0.00 -2.02 0.00 0.00 58.31 56.49 1q7f n LYS 814 Cb 0.35 -1.00 0.01 0.00 -0.02 0.00 0.00 35.03 34.36 1q7f n LYS 814 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1q7f s PHE 815 N -2.40 -0.01 0.07 2.13 -0.71 -1.14 -5.03 117.98 110.89 1q7f s PHE 815 Ca -0.17 -0.36 -0.00 0.00 -1.04 0.00 0.00 56.93 55.35 1q7f s PHE 815 Cb 0.04 0.68 -0.04 0.00 -1.21 0.00 0.00 43.02 42.49 1q7f s PHE 815 CO 0.24 -0.90 -0.02 1.14 -1.34 0.00 0.00 175.22 174.34 1q7f s GLN 816 N -2.63 0.71 -0.12 1.99 -2.07 -1.26 -0.81 119.66 115.47 1q7f s GLN 816 Ca 0.17 -1.28 -0.13 0.00 -1.82 0.00 0.00 55.36 52.30 1q7f s GLN 816 Cb -0.02 0.14 0.03 0.00 -1.09 0.00 0.00 33.01 32.07 1q7f s GLN 816 CO 0.04 -0.12 0.36 -0.59 -1.32 0.00 0.00 175.29 173.66 1q7f s PHE 817 N -3.89 -0.38 0.00 9.60 -0.12 -0.42 -4.99 117.98 117.78 1q7f s PHE 817 Ca 0.11 0.90 0.00 0.00 -0.05 0.00 0.00 56.93 57.89 1q7f s PHE 817 Cb 0.07 0.13 0.00 0.00 -0.63 0.00 0.00 43.02 42.60 1q7f s PHE 817 CO -0.07 -0.21 0.00 0.41 -0.05 0.00 0.00 175.22 175.30 1q7f n GLY 818 N 2.73 3.43 3.55 1.99 0.00 -1.26 0.29 105.19 115.92 1q7f n GLY 818 Ca -0.14 -1.68 -0.16 0.00 0.00 0.00 0.00 46.02 44.05 1q7f n GLY 818 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1q7f s GLU 819 N -4.34 0.95 -0.02 1.61 -1.05 -0.32 -4.56 118.70 110.96 1q7f s GLU 819 Ca 0.00 0.40 -0.35 0.00 -0.15 0.00 0.00 54.97 54.86 1q7f s GLU 819 Cb 0.00 0.45 -0.14 0.00 -0.44 0.00 0.00 34.13 34.00 1q7f s GLU 819 CO 0.00 -0.26 1.70 0.00 0.95 0.00 0.00 175.26 177.65 1q7f n GLY 821 N 3.84 1.99 0.36 0.00 0.00 -0.31 -4.79 105.19 106.28 1q7f n GLY 821 Ca 0.21 -1.08 0.03 0.00 0.00 0.00 0.00 46.02 45.18 1q7f n GLY 821 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1q7f n LYS 822 N -0.94 2.27 -2.88 1.61 5.02 -1.26 -3.21 118.16 118.77 1q7f n LYS 822 Ca 0.00 -1.63 -0.22 0.00 -2.02 0.00 0.00 58.31 54.44 1q7f n LYS 822 Cb 0.00 -1.16 0.02 0.00 -0.02 0.00 0.00 35.03 33.87 1q7f n LYS 822 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1q7f s ARG 823 N -0.90 2.91 0.43 1.97 1.81 -1.26 -4.97 118.95 118.94 1q7f s ARG 823 Ca 0.13 -0.57 -0.24 0.00 -1.72 0.00 0.00 55.73 53.32 1q7f s ARG 823 Cb 0.07 -2.54 -0.10 0.00 -0.45 0.00 0.00 34.95 31.94 1q7f s ARG 823 CO 0.09 -0.40 1.14 -0.25 -0.68 0.00 0.00 175.30 175.20 1q7f n ASP 824 N -2.16 1.89 0.00 0.23 10.43 -1.26 -0.96 116.55 124.71 1q7f n ASP 824 Ca 0.03 1.06 0.00 0.00 2.57 0.00 0.00 54.79 58.45 1q7f n ASP 824 Cb 0.58 -1.43 0.00 0.00 1.84 0.00 0.00 41.12 42.11 1q7f n ASP 824 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1q7f n SER 825 N 0.25 -2.19 -4.30 -2.24 7.64 -1.26 -5.01 113.62 106.52 1q7f n SER 825 Ca 0.08 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.72 1q7f n SER 825 Cb 0.40 -0.71 -0.12 0.00 -1.01 0.00 0.00 64.21 62.77 1q7f n SER 825 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1q7f s GLN 826 N -0.23 1.15 0.18 1.43 -0.21 -0.13 -4.18 119.66 117.67 1q7f s GLN 826 Ca 0.00 -1.19 0.07 0.00 0.02 0.00 0.00 55.36 54.26 1q7f s GLN 826 Cb 0.00 -1.42 -0.04 0.00 1.00 0.00 0.00 33.01 32.55 1q7f s GLN 826 CO 0.00 0.33 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.85 1q7f s LEU 827 N -1.96 2.53 -0.31 2.90 1.43 0.45 -4.63 118.68 119.08 1q7f s LEU 827 Ca 0.07 -0.98 -0.03 0.00 -1.03 0.00 0.00 54.13 52.16 1q7f s LEU 827 Cb -0.10 -0.63 0.11 0.00 0.03 0.00 0.00 46.19 45.60 1q7f s LEU 827 CO 0.04 -0.18 0.15 -0.22 0.23 0.00 0.00 176.35 176.38 1q7f s LEU 828 N -3.15 0.80 -0.82 1.79 1.98 -1.25 -1.16 118.68 116.88 1q7f s LEU 828 Ca 0.20 -1.54 -0.00 0.00 -2.89 0.00 0.00 54.13 49.90 1q7f s LEU 828 Cb -0.01 -0.41 -0.01 0.00 0.66 0.00 0.00 46.19 46.42 1q7f s LEU 828 CO 0.06 -0.41 0.69 -1.22 -1.89 0.00 0.00 176.35 173.58 1q7f n TYR 829 N 4.92 -1.54 -2.05 5.38 4.01 -1.26 -4.34 117.16 122.28 1q7f n TYR 829 Ca -0.01 0.64 -0.42 0.00 -0.16 0.00 0.00 57.90 57.95 1q7f n TYR 829 Cb 0.41 -4.08 -0.03 0.00 -0.31 0.00 0.00 39.34 35.33 1q7f n TYR 829 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1q7f s PRO 830 N -4.83 4.27 -0.06 -0.72 0.04 -1.26 -0.54 135.00 131.90 1q7f s PRO 830 Ca 0.04 2.22 0.05 0.00 0.04 0.00 0.00 61.00 63.35 1q7f s PRO 830 Cb -0.00 -3.19 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 1q7f s PRO 830 CO 0.51 -0.52 0.01 0.27 0.04 0.00 0.00 177.00 177.31 1q7f n ASN 831 N 3.87 3.51 -4.30 6.66 2.04 0.51 -3.61 115.26 123.93 1q7f n ASN 831 Ca 0.12 -0.01 -0.17 0.00 -0.44 0.00 0.00 54.58 54.09 1q7f n ASN 831 Cb 0.40 0.52 -0.10 0.00 -2.53 0.00 0.00 39.78 38.07 1q7f n ASN 831 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1q7f s ARG 832 N -2.15 1.21 0.02 -3.83 1.81 -1.19 -2.39 118.95 112.44 1q7f s ARG 832 Ca -0.04 -1.51 -0.04 0.00 -1.72 0.00 0.00 55.73 52.42 1q7f s ARG 832 Cb 0.02 -0.94 -0.01 0.00 -0.45 0.00 0.00 34.95 33.57 1q7f s ARG 832 CO 0.23 0.15 0.05 0.14 -0.68 0.00 0.00 175.30 175.20 1q7f s VAL 833 N -3.01 0.11 0.13 3.52 -7.23 -1.26 -1.72 120.40 110.94 1q7f s VAL 833 Ca 0.19 -0.95 -0.10 0.00 -1.81 0.00 0.00 61.98 59.32 1q7f s VAL 833 Cb -0.00 -0.56 -0.00 0.00 0.56 0.00 0.00 36.38 36.38 1q7f s VAL 833 CO 0.04 -0.52 0.26 0.00 -0.31 0.00 0.00 175.10 174.57 1q7f s ALA 834 N -1.89 -0.21 -0.03 1.32 0.00 -0.28 -4.50 121.76 116.18 1q7f s ALA 834 Ca -0.11 -0.67 0.05 0.00 0.00 0.00 0.00 51.96 51.23 1q7f s ALA 834 Cb -0.06 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 1q7f s ALA 834 CO -0.02 -0.59 -0.17 0.08 0.00 0.00 0.00 175.76 175.06 1q7f s VAL 835 N -3.90 1.41 -0.84 0.00 1.01 -1.26 -0.03 120.40 116.79 1q7f s VAL 835 Ca 0.10 -0.73 -0.19 0.00 0.00 0.00 0.00 61.98 61.15 1q7f s VAL 835 Cb 0.04 -1.20 0.12 0.00 0.00 0.00 0.00 36.38 35.34 1q7f s VAL 835 CO -0.06 0.40 1.04 -0.69 0.00 0.00 0.00 175.10 175.79 1q7f s VAL 836 N -0.18 4.70 0.32 2.92 1.01 0.65 -4.66 120.40 125.16 1q7f s VAL 836 Ca 0.01 -1.33 0.08 0.00 0.00 0.00 0.00 61.98 60.74 1q7f s VAL 836 Cb -0.09 -4.72 0.37 0.00 0.00 0.00 0.00 36.38 31.94 1q7f s VAL 836 CO 0.01 -1.44 1.59 -0.09 0.00 0.00 0.00 175.10 175.17 1q7f h ARG 837 N 8.96 0.06 0.00 2.72 2.43 -1.92 0.56 114.38 127.19 1q7f h ARG 837 Ca 0.03 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1q7f h ARG 837 Cb 1.04 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 1q7f h ARG 837 CO 1.10 0.04 -0.45 -2.95 -1.51 0.00 0.00 179.97 176.20 1q7f h ASN 838 N 0.06 0.00 0.00 -3.80 -1.07 -1.97 -3.34 115.58 105.47 1q7f h ASN 838 Ca 0.66 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.85 1q7f h ASN 838 Cb 1.50 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.72 1q7f h ASN 838 CO -0.81 0.45 -1.77 -1.54 0.07 0.00 0.00 177.43 173.84 1q7f n SER 839 N -3.78 2.11 0.00 6.14 3.41 -0.62 -5.00 113.62 115.88 1q7f n SER 839 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1q7f n SER 839 Cb 0.51 0.91 0.00 0.00 -0.26 0.00 0.00 64.21 65.37 1q7f n SER 839 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1q7f n GLY 840 N 2.20 0.63 3.77 5.00 0.00 0.19 -4.67 105.19 112.31 1q7f n GLY 840 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1q7f n GLY 840 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1q7f s ASP 841 N -2.99 6.09 -0.22 1.61 1.11 -1.21 -3.48 116.67 117.57 1q7f s ASP 841 Ca 0.00 2.98 -0.07 0.00 0.18 0.00 0.00 52.55 55.63 1q7f s ASP 841 Cb 0.00 -2.66 -0.04 0.00 1.07 0.00 0.00 42.92 41.29 1q7f s ASP 841 CO 0.00 -1.04 0.07 -0.63 1.18 0.00 0.00 175.17 174.75 1q7f s ILE 842 N -1.17 4.58 -0.21 0.77 1.01 0.15 -0.26 121.20 126.08 1q7f s ILE 842 Ca 0.57 -0.09 -0.10 0.00 0.00 0.00 0.00 60.65 61.03 1q7f s ILE 842 Cb -0.45 -3.11 -0.05 0.00 0.01 0.00 0.00 42.46 38.87 1q7f s ILE 842 CO 0.59 0.39 0.13 -0.63 0.00 0.00 0.00 174.94 175.43 1q7f s ILE 843 N 1.02 5.36 -0.03 2.92 -1.09 0.96 -1.11 121.20 129.24 1q7f s ILE 843 Ca 0.04 0.18 0.06 0.00 -2.23 0.00 0.00 60.65 58.70 1q7f s ILE 843 Cb -0.14 -3.46 -0.01 0.00 -1.58 0.00 0.00 42.46 37.27 1q7f s ILE 843 CO 0.03 0.42 -0.21 -0.69 -1.23 0.00 0.00 174.94 173.26 1q7f s VAL 844 N 0.51 1.67 -0.08 2.92 1.01 0.12 -1.12 120.40 125.44 1q7f s VAL 844 Ca 0.08 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1q7f s VAL 844 Cb -0.12 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.84 1q7f s VAL 844 CO -0.00 0.47 -0.10 0.42 0.00 0.00 0.00 175.10 175.89 1q7f s THR 845 N -0.34 3.43 -0.23 3.92 -4.23 -0.70 0.16 115.64 117.65 1q7f s THR 845 Ca 0.04 -0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 59.92 1q7f s THR 845 Cb -0.10 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.31 1q7f s THR 845 CO 0.00 0.57 0.04 -1.61 -0.54 0.00 0.00 174.62 173.09 1q7f s GLU 846 N -0.48 3.67 0.46 3.99 2.02 0.67 -0.36 118.70 128.67 1q7f s GLU 846 Ca 0.07 -0.48 -0.18 0.00 0.02 0.00 0.00 54.97 54.40 1q7f s GLU 846 Cb -0.12 -3.22 -0.14 0.00 0.10 0.00 0.00 34.13 30.74 1q7f s GLU 846 CO 0.02 -0.08 -0.08 -2.13 0.02 0.00 0.00 175.26 173.01 1q7f n ARG 847 N 4.56 0.00 0.00 1.61 0.63 0.30 -2.71 116.66 121.05 1q7f n ARG 847 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 1q7f n ARG 847 Cb 0.52 -0.96 0.00 0.00 0.45 0.00 0.00 32.46 32.47 1q7f n ARG 847 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1q7f n SER 848 N 2.37 0.00 -0.30 6.15 2.88 -1.26 0.12 113.62 123.57 1q7f n SER 848 Ca 0.08 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.76 1q7f n SER 848 Cb 0.44 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.20 1q7f n SER 848 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1q7f h PRO 849 N 0.00 0.16 -1.81 -1.46 0.11 -1.86 -0.14 132.00 127.00 1q7f h PRO 849 Ca 0.00 -0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.48 1q7f h PRO 849 Cb 0.00 -0.04 -0.40 0.00 0.11 0.00 0.00 31.00 30.68 1q7f h PRO 849 CO 0.00 0.10 -0.45 2.41 -0.21 0.00 0.00 178.00 179.85 1q7f n THR 850 N -5.27 2.85 -1.47 -1.15 -1.04 0.32 -5.00 114.28 103.51 1q7f n THR 850 Ca 0.22 -5.10 -0.14 0.00 -2.04 0.00 0.00 64.05 57.00 1q7f n THR 850 Cb 0.72 -1.31 -0.11 0.00 -1.82 0.00 0.00 70.33 67.81 1q7f n THR 850 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1q7f n HIS 851 N -0.41 0.65 -3.78 -1.42 1.44 -0.07 -4.19 115.22 107.45 1q7f n HIS 851 Ca 0.39 -0.04 -0.10 0.00 -2.01 0.00 0.00 57.72 55.95 1q7f n HIS 851 Cb 0.53 -1.79 -0.07 0.00 0.12 0.00 0.00 29.99 28.78 1q7f n HIS 851 CO 0.00 0.00 0.00 -1.14 -2.81 0.00 0.00 176.34 172.39 1q7f s GLN 852 N 7.80 0.86 -0.05 -1.40 0.74 -1.10 -3.94 119.66 122.58 1q7f s GLN 852 Ca 0.87 -0.75 0.05 0.00 0.05 0.00 0.00 55.36 55.57 1q7f s GLN 852 Cb -0.27 0.36 -0.02 0.00 1.10 0.00 0.00 33.01 34.18 1q7f s GLN 852 CO 0.21 -0.29 -0.18 -1.50 -0.55 0.00 0.00 175.29 172.99 1q7f s ILE 853 N -3.35 2.74 0.04 -2.34 1.10 -0.56 -0.24 121.20 118.59 1q7f s ILE 853 Ca 0.01 -0.84 0.05 0.00 -0.51 0.00 0.00 60.65 59.36 1q7f s ILE 853 Cb 0.02 -2.05 -0.02 0.00 0.15 0.00 0.00 42.46 40.56 1q7f s ILE 853 CO -0.08 0.58 -0.15 -1.10 -2.11 0.00 0.00 174.94 172.08 1q7f s GLN 854 N -0.61 0.98 -0.13 3.50 -0.21 0.12 -1.26 119.66 122.06 1q7f s GLN 854 Ca 0.09 -0.78 0.02 0.00 0.02 0.00 0.00 55.36 54.70 1q7f s GLN 854 Cb -0.11 -1.01 0.01 0.00 1.00 0.00 0.00 33.01 32.91 1q7f s GLN 854 CO 0.01 0.25 -0.18 0.42 -2.12 0.00 0.00 175.29 173.67 1q7f s ILE 855 N -0.85 1.73 0.19 1.08 1.09 0.06 0.16 121.20 124.66 1q7f s ILE 855 Ca 0.02 -0.77 0.10 0.00 -1.10 0.00 0.00 60.65 58.90 1q7f s ILE 855 Cb -0.08 -1.57 -0.04 0.00 -1.06 0.00 0.00 42.46 39.71 1q7f s ILE 855 CO 0.01 0.49 -0.21 -0.31 -0.10 0.00 0.00 174.94 174.82 1q7f s TYR 856 N 1.04 2.06 0.84 3.97 2.02 -0.27 -0.02 117.35 126.98 1q7f s TYR 856 Ca -0.04 -0.41 -0.07 0.00 -0.37 0.00 0.00 57.07 56.18 1q7f s TYR 856 Cb -0.15 -1.00 0.18 0.00 -0.40 0.00 0.00 41.96 40.59 1q7f s TYR 856 CO -0.04 0.44 1.15 0.54 -1.57 0.00 0.00 175.55 176.07 1q7f s ASN 857 N -2.80 3.68 0.15 2.29 2.20 -0.31 0.32 114.94 120.46 1q7f s ASN 857 Ca 0.20 -0.24 0.10 0.00 -0.94 0.00 0.00 52.86 51.98 1q7f s ASN 857 Cb -0.06 0.08 0.53 0.00 -2.00 0.00 0.00 41.25 39.79 1q7f s ASN 857 CO 0.09 -2.33 1.29 0.00 -2.94 0.00 0.00 177.10 173.21 1q7f n GLN 858 N -3.26 0.06 0.00 3.55 10.64 -1.23 -1.29 117.38 125.86 1q7f n GLN 858 Ca 0.17 0.56 0.11 0.00 -1.83 0.00 0.00 57.00 56.01 1q7f n GLN 858 Cb 0.60 -1.71 0.07 0.00 -0.86 0.00 0.00 30.24 28.34 1q7f n GLN 858 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1q7f n TYR 859 N -1.84 0.00 -0.58 2.61 4.01 -1.26 -4.96 117.16 115.14 1q7f n TYR 859 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1q7f n TYR 859 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1q7f n TYR 859 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1q7f n GLY 860 N 1.29 0.65 3.72 2.72 0.00 -0.41 -5.05 105.19 108.11 1q7f n GLY 860 Ca 0.12 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 1q7f n GLY 860 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q7f s GLN 861 N -1.05 4.28 0.26 1.61 -0.21 -1.26 -4.85 119.66 118.44 1q7f s GLN 861 Ca 0.00 0.20 -0.31 0.00 0.02 0.00 0.00 55.36 55.27 1q7f s GLN 861 Cb 0.00 -3.44 -0.12 0.00 1.00 0.00 0.00 33.01 30.45 1q7f s GLN 861 CO 0.00 0.19 1.63 0.34 -2.12 0.00 0.00 175.29 175.34 1q7f n PHE 862 N 3.67 2.78 -0.05 0.91 7.35 -1.26 -1.17 117.46 129.70 1q7f n PHE 862 Ca -0.10 0.19 -0.06 0.00 -0.76 0.00 0.00 57.45 56.71 1q7f n PHE 862 Cb 0.52 -2.62 -0.02 0.00 0.35 0.00 0.00 39.48 37.71 1q7f n PHE 862 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1q7f n VAL 863 N 2.78 1.41 -3.75 -2.13 0.31 0.97 -4.88 118.33 113.04 1q7f n VAL 863 Ca 0.11 0.22 -0.02 0.00 -0.01 0.00 0.00 64.34 64.64 1q7f n VAL 863 Cb 0.36 -2.10 -0.01 0.00 -0.91 0.00 0.00 33.84 31.18 1q7f n VAL 863 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1q7f s ARG 864 N -2.62 1.03 0.04 5.55 1.70 -1.08 -5.02 118.95 118.55 1q7f s ARG 864 Ca -0.20 -0.59 -0.05 0.00 -0.47 0.00 0.00 55.73 54.42 1q7f s ARG 864 Cb 0.03 0.34 -0.01 0.00 -0.57 0.00 0.00 34.95 34.73 1q7f s ARG 864 CO 0.29 -0.47 0.08 -1.59 -1.08 0.00 0.00 175.30 172.53 1q7f s LYS 865 N -2.90 0.61 0.10 3.89 -2.85 -1.26 -0.76 119.74 116.56 1q7f s LYS 865 Ca 0.14 -0.84 -0.19 0.00 -1.00 0.00 0.00 55.97 54.09 1q7f s LYS 865 Cb -0.00 0.23 0.06 0.00 -2.06 0.00 0.00 37.83 36.07 1q7f s LYS 865 CO 0.01 -0.15 0.87 1.97 0.10 0.00 0.00 175.35 178.16 1q7f n PHE 866 N 0.62 -0.97 0.00 1.78 1.16 -0.39 -5.01 117.46 114.65 1q7f n PHE 866 Ca -0.18 -0.90 0.00 0.00 -1.87 0.00 0.00 57.45 54.50 1q7f n PHE 866 Cb 0.59 0.43 0.00 0.00 -1.61 0.00 0.00 39.48 38.89 1q7f n PHE 866 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1q7f n GLY 867 N -0.62 2.42 0.31 4.97 0.00 -1.26 -1.50 105.19 109.52 1q7f n GLY 867 Ca -0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.16 1q7f n GLY 867 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q7f h ALA 868 N 0.00 1.38 -0.00 4.61 0.00 -1.91 0.37 119.26 123.70 1q7f h ALA 868 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1q7f h ALA 868 Cb 0.00 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1q7f h ALA 868 CO 0.00 -0.48 -0.08 0.25 0.00 0.00 0.00 179.25 178.93 1q7f n THR 869 N -5.20 0.00 -0.08 0.00 -2.24 -1.26 -4.13 114.28 101.37 1q7f n THR 869 Ca 0.23 -0.04 -0.12 0.00 -2.27 0.00 0.00 64.05 61.85 1q7f n THR 869 Cb 0.73 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.68 1q7f n THR 869 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1q7f n ILE 870 N -1.07 0.85 -1.82 2.28 5.41 0.96 -5.03 119.36 120.94 1q7f n ILE 870 Ca 0.14 -0.30 -0.32 0.00 1.00 0.00 0.00 62.75 63.28 1q7f n ILE 870 Cb 0.27 -1.20 0.03 0.00 -0.71 0.00 0.00 39.64 38.02 1q7f n ILE 870 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1q7f s LEU 871 N -6.12 3.30 0.00 1.39 1.43 0.67 -4.99 118.68 114.36 1q7f s LEU 871 Ca -0.21 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.56 1q7f s LEU 871 Cb 0.06 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.77 1q7f s LEU 871 CO 0.33 -1.23 0.00 0.00 0.23 0.00 0.00 176.35 175.67 1q7f n GLN 872 N -2.60 0.00 -3.13 1.70 1.13 -1.26 -4.84 117.38 108.37 1q7f n GLN 872 Ca 0.08 0.00 -0.19 0.00 -1.94 0.00 0.00 57.00 54.95 1q7f n GLN 872 Cb 0.53 -0.23 -0.03 0.00 0.11 0.00 0.00 30.24 30.63 1q7f n GLN 872 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1q7f n HIS 873 N -2.63 -0.44 -1.70 1.08 8.25 -1.26 -4.43 115.22 114.09 1q7f n HIS 873 Ca 0.00 -3.49 -0.42 0.00 -0.26 0.00 0.00 57.72 53.55 1q7f n HIS 873 Cb 0.19 -0.13 -0.03 0.00 1.12 0.00 0.00 29.99 31.14 1q7f n HIS 873 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1q7f n PRO 874 N 0.75 2.82 0.00 -0.41 -0.04 -1.26 -2.62 135.00 134.23 1q7f n PRO 874 Ca 0.21 1.02 0.00 0.00 -0.04 0.00 0.00 63.50 64.70 1q7f n PRO 874 Cb 0.62 -2.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 1q7f n PRO 874 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1q7f n ARG 875 N 5.35 0.92 -3.57 0.54 5.12 -0.09 -4.69 116.66 120.24 1q7f n ARG 875 Ca 0.18 -0.27 -0.13 0.00 -1.93 0.00 0.00 57.85 55.70 1q7f n ARG 875 Cb 0.37 -0.74 -0.06 0.00 -1.16 0.00 0.00 32.46 30.88 1q7f n ARG 875 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1q7f s GLY 876 N -0.21 -0.38 -0.06 -0.13 0.00 -1.13 -4.35 107.32 101.07 1q7f s GLY 876 Ca 0.00 1.89 -0.16 0.00 0.00 0.00 0.00 44.72 46.44 1q7f s GLY 876 CO 0.00 1.18 0.38 0.54 0.00 0.00 0.00 173.10 175.20 1q7f s VAL 877 N -0.82 0.03 0.21 1.40 0.11 -1.26 -1.80 120.40 118.27 1q7f s VAL 877 Ca -0.04 -0.29 -0.18 0.00 -2.93 0.00 0.00 61.98 58.54 1q7f s VAL 877 Cb -0.01 -0.65 0.03 0.00 -1.53 0.00 0.00 36.38 34.22 1q7f s VAL 877 CO 0.03 -0.16 0.55 0.28 -3.33 0.00 0.00 175.10 172.47 1q7f s THR 878 N -0.89 0.02 -0.05 5.04 -1.32 -0.73 -4.64 115.64 113.07 1q7f s THR 878 Ca -0.10 -0.79 0.04 0.00 -1.21 0.00 0.00 61.69 59.63 1q7f s THR 878 Cb -0.04 -1.63 -0.00 0.00 -1.51 0.00 0.00 72.50 69.32 1q7f s THR 878 CO 0.04 -0.09 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.50 1q7f s VAL 879 N -3.88 1.45 0.77 5.08 1.01 -1.26 -0.74 120.40 122.83 1q7f s VAL 879 Ca 0.10 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 1q7f s VAL 879 Cb -0.02 -1.25 0.14 0.00 0.00 0.00 0.00 36.38 35.25 1q7f s VAL 879 CO -0.02 0.42 1.07 1.51 0.00 0.00 0.00 175.10 178.08 1q7f s ASP 880 N 0.16 4.08 0.00 3.32 3.84 0.04 -4.92 116.67 123.19 1q7f s ASP 880 Ca -0.07 -0.21 0.13 0.00 -0.00 0.00 0.00 52.55 52.40 1q7f s ASP 880 Cb -0.13 -0.10 0.74 0.00 -1.38 0.00 0.00 42.92 42.05 1q7f s ASP 880 CO 0.03 -2.05 1.24 -0.46 -0.00 0.00 0.00 175.17 173.93 1q7f n ASN 881 N -3.04 0.00 -0.85 2.11 6.94 -1.26 -1.70 115.26 117.45 1q7f n ASN 881 Ca 0.15 -0.26 0.07 0.00 -0.02 0.00 0.00 54.58 54.52 1q7f n ASN 881 Cb 0.60 -0.09 0.21 0.00 -2.36 0.00 0.00 39.78 38.15 1q7f n ASN 881 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1q7f n LYS 882 N -1.09 2.98 -0.99 -3.83 4.76 -1.26 -4.94 118.16 113.80 1q7f n LYS 882 Ca 0.09 -2.37 0.00 0.00 -2.87 0.00 0.00 58.31 53.16 1q7f n LYS 882 Cb 0.06 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.76 1q7f n LYS 882 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q7f n GLY 883 N 0.42 0.55 3.77 0.72 0.00 -0.69 -5.00 105.19 104.96 1q7f n GLY 883 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1q7f n GLY 883 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q7f s ARG 884 N -0.21 4.68 -0.29 1.61 0.52 -1.26 -4.00 118.95 120.01 1q7f s ARG 884 Ca 0.00 1.38 -0.09 0.00 -0.52 0.00 0.00 55.73 56.50 1q7f s ARG 884 Cb 0.00 -3.00 -0.02 0.00 0.52 0.00 0.00 34.95 32.46 1q7f s ARG 884 CO 0.00 0.38 0.13 0.42 0.02 0.00 0.00 175.30 176.25 1q7f s ILE 885 N -1.44 4.57 -0.20 1.52 1.01 0.12 -0.78 121.20 125.99 1q7f s ILE 885 Ca 0.46 -0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.74 1q7f s ILE 885 Cb -0.21 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 1q7f s ILE 885 CO 0.27 0.17 0.10 -0.63 0.00 0.00 0.00 174.94 174.85 1q7f s ILE 886 N 1.63 5.02 -0.07 2.92 1.09 0.08 -0.83 121.20 131.03 1q7f s ILE 886 Ca 0.05 0.05 0.04 0.00 -1.10 0.00 0.00 60.65 59.69 1q7f s ILE 886 Cb -0.16 -3.29 0.00 0.00 -1.06 0.00 0.00 42.46 37.95 1q7f s ILE 886 CO 0.06 0.42 -0.19 -0.69 -0.10 0.00 0.00 174.94 174.44 1q7f s VAL 887 N 0.63 1.61 -0.05 2.92 1.01 0.18 -1.78 120.40 124.92 1q7f s VAL 887 Ca 0.05 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.27 1q7f s VAL 887 Cb -0.13 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 1q7f s VAL 887 CO 0.01 0.46 -0.08 0.54 0.00 0.00 0.00 175.10 176.03 1q7f s VAL 888 N 0.32 3.62 0.06 2.92 0.11 -0.75 -0.73 120.40 125.96 1q7f s VAL 888 Ca -0.12 -0.59 0.06 0.00 -2.93 0.00 0.00 61.98 58.40 1q7f s VAL 888 Cb -0.15 -2.50 -0.03 0.00 -1.53 0.00 0.00 36.38 32.17 1q7f s VAL 888 CO 0.05 0.54 -0.17 -1.61 -3.33 0.00 0.00 175.10 170.59 1q7f s GLU 889 N -0.97 1.04 0.56 1.54 2.02 -0.46 -0.91 118.70 121.52 1q7f s GLU 889 Ca 0.14 -0.91 0.08 0.00 0.02 0.00 0.00 54.97 54.30 1q7f s GLU 889 Cb -0.11 -1.11 0.07 0.00 0.10 0.00 0.00 34.13 33.08 1q7f s GLU 889 CO 0.03 0.27 0.65 0.00 0.02 0.00 0.00 175.26 176.23 1q7f n LYS 891 N -2.07 -1.06 0.00 0.00 4.81 -1.26 -4.06 118.16 114.52 1q7f n LYS 891 Ca 0.09 0.22 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 1q7f n LYS 891 Cb 0.62 -4.26 0.00 0.00 0.02 0.00 0.00 35.03 31.41 1q7f n LYS 891 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1q7f n VAL 892 N -1.58 0.00 -3.67 3.15 0.24 -1.26 -5.08 118.33 110.12 1q7f n VAL 892 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.03 1q7f n VAL 892 Cb 0.22 0.19 0.01 0.00 -1.47 0.00 0.00 33.84 32.79 1q7f n VAL 892 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 1q7f n MET 893 N 0.00 -1.65 -3.61 7.34 2.81 -1.16 -4.77 117.12 116.08 1q7f n MET 893 Ca 0.00 0.99 -0.11 0.00 -1.81 0.00 0.00 57.70 56.77 1q7f n MET 893 Cb 0.00 -2.42 -0.05 0.00 -0.71 0.00 0.00 33.22 30.05 1q7f n MET 893 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 1q7f s ARG 894 N -4.17 1.07 -0.03 0.03 1.70 -1.17 -0.97 118.95 115.41 1q7f s ARG 894 Ca 0.11 -0.61 0.07 0.00 -0.47 0.00 0.00 55.73 54.83 1q7f s ARG 894 Cb -0.01 0.48 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 1q7f s ARG 894 CO 0.88 -0.42 -0.24 0.08 -1.08 0.00 0.00 175.30 174.52 1q7f s VAL 895 N -3.54 2.17 -0.05 4.99 1.01 -0.08 -1.35 120.40 123.55 1q7f s VAL 895 Ca 0.01 -1.06 0.03 0.00 0.00 0.00 0.00 61.98 60.96 1q7f s VAL 895 Cb 0.01 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.63 1q7f s VAL 895 CO -0.10 0.58 -0.11 -0.63 0.00 0.00 0.00 175.10 174.84 1q7f s ILE 896 N -0.51 0.99 -0.18 2.22 1.01 0.09 -1.45 121.20 123.37 1q7f s ILE 896 Ca 0.07 -0.43 -0.01 0.00 0.00 0.00 0.00 60.65 60.28 1q7f s ILE 896 Cb -0.11 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.47 1q7f s ILE 896 CO 0.00 0.31 -0.13 -0.63 0.00 0.00 0.00 174.94 174.49 1q7f s ILE 897 N 0.44 2.71 0.33 2.92 1.01 0.71 -0.65 121.20 128.66 1q7f s ILE 897 Ca -0.09 -0.73 0.09 0.00 0.00 0.00 0.00 60.65 59.92 1q7f s ILE 897 Cb -0.13 -2.17 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 1q7f s ILE 897 CO 0.02 0.49 0.06 -0.36 0.00 0.00 0.00 174.94 175.15 1q7f s PHE 898 N 1.15 2.63 0.45 3.97 0.08 -0.01 0.11 117.98 126.34 1q7f s PHE 898 Ca 0.01 -0.39 0.08 0.00 0.12 0.00 0.00 56.93 56.76 1q7f s PHE 898 Cb -0.14 -1.50 0.02 0.00 -0.57 0.00 0.00 43.02 40.83 1q7f s PHE 898 CO -0.05 0.45 0.61 0.16 -0.10 0.00 0.00 175.22 176.29 1q7f s ASP 899 N -3.76 5.56 0.00 1.36 3.84 -0.51 -0.70 116.67 122.45 1q7f s ASP 899 Ca 0.35 -0.49 0.07 0.00 -0.00 0.00 0.00 52.55 52.47 1q7f s ASP 899 Cb -0.02 -0.49 0.32 0.00 -1.38 0.00 0.00 42.92 41.35 1q7f s ASP 899 CO 0.21 -0.86 1.08 0.00 -0.00 0.00 0.00 175.17 175.59 1q7f n GLN 900 N -1.92 0.08 -0.06 2.11 6.02 -1.26 -1.88 117.38 120.47 1q7f n GLN 900 Ca 0.09 0.24 0.11 0.00 -0.01 0.00 0.00 57.00 57.44 1q7f n GLN 900 Cb 0.59 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 30.48 1q7f n GLN 900 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1q7f n ASN 901 N -1.31 2.98 0.00 1.08 3.02 -1.26 -4.96 115.26 114.81 1q7f n ASN 901 Ca 0.03 -1.92 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 1q7f n ASN 901 Cb 0.06 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 1q7f n ASN 901 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1q7f n GLY 902 N 1.26 0.14 3.71 7.41 0.00 -0.79 -5.04 105.19 111.88 1q7f n GLY 902 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1q7f n GLY 902 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1q7f s ASN 903 N -2.20 6.78 -0.68 1.61 0.01 -1.26 -4.78 114.94 114.43 1q7f s ASN 903 Ca 0.00 2.33 -0.27 0.00 -0.71 0.00 0.00 52.86 54.21 1q7f s ASN 903 Cb 0.00 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 39.10 1q7f s ASN 903 CO 0.00 -0.71 1.42 -0.69 -1.51 0.00 0.00 177.10 175.61 1q7f s VAL 904 N 1.51 3.67 0.23 1.60 1.01 -1.26 -1.43 120.40 125.72 1q7f s VAL 904 Ca 0.66 0.43 0.02 0.00 0.00 0.00 0.00 61.98 63.09 1q7f s VAL 904 Cb -0.37 -4.63 -0.03 0.00 0.00 0.00 0.00 36.38 31.35 1q7f s VAL 904 CO 0.30 -1.53 1.56 -0.07 0.00 0.00 0.00 175.10 175.36 1q7f h LEU 905 N 13.69 0.41 -7.00 3.92 3.38 -0.65 -3.48 115.31 125.59 1q7f h LEU 905 Ca -0.27 -0.22 0.19 0.00 0.09 0.00 0.00 57.88 57.67 1q7f h LEU 905 Cb 1.08 -0.12 -0.20 0.00 0.09 0.00 0.00 40.66 41.52 1q7f h LEU 905 CO 1.25 0.88 0.71 -2.28 0.09 0.00 0.00 178.44 179.08 1q7f s HIS 906 N -3.92 -0.21 -0.02 1.13 5.04 -0.99 -5.01 115.29 111.31 1q7f s HIS 906 Ca -0.05 0.20 -0.19 0.00 -1.54 0.00 0.00 55.06 53.48 1q7f s HIS 906 Cb 0.12 0.51 0.03 0.00 0.04 0.00 0.00 32.58 33.28 1q7f s HIS 906 CO 0.81 -0.29 0.40 -1.59 -2.34 0.00 0.00 174.74 171.73 1q7f s LYS 907 N -2.20 0.76 0.06 2.88 -2.85 -1.26 -0.21 119.74 116.92 1q7f s LYS 907 Ca 0.06 -0.07 -0.26 0.00 -1.00 0.00 0.00 55.97 54.70 1q7f s LYS 907 Cb -0.01 0.34 0.07 0.00 -2.06 0.00 0.00 37.83 36.17 1q7f s LYS 907 CO -0.05 -0.22 0.63 -0.59 0.10 0.00 0.00 175.35 175.22 1q7f s PHE 908 N -1.28 -0.58 0.39 1.78 -0.12 -0.53 -5.00 117.98 112.64 1q7f s PHE 908 Ca -0.13 0.69 0.01 0.00 -0.05 0.00 0.00 56.93 57.45 1q7f s PHE 908 Cb -0.04 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.81 1q7f s PHE 908 CO 0.06 -0.73 0.59 0.20 -0.05 0.00 0.00 175.22 175.29 1q7f s GLY 909 N -2.01 1.44 -0.06 1.99 0.00 -1.26 -0.90 107.32 106.52 1q7f s GLY 909 Ca -0.05 -1.00 0.06 0.00 0.00 0.00 0.00 44.72 43.74 1q7f s GLY 909 CO -0.02 -0.90 1.11 0.00 0.00 0.00 0.00 173.10 173.29 1q7f n SER 911 N -0.17 0.49 0.09 0.00 3.41 -1.21 -0.86 113.62 115.37 1q7f n SER 911 Ca -0.21 0.69 -0.08 0.00 -0.26 0.00 0.00 58.87 59.02 1q7f n SER 911 Cb 0.79 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1q7f n SER 911 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1q7f h LYS 912 N 0.00 0.17 0.00 4.33 3.64 -1.91 -3.37 116.57 119.42 1q7f h LYS 912 Ca 0.00 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1q7f h LYS 912 Cb 0.12 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1q7f h LYS 912 CO 0.00 0.93 -1.01 0.72 -2.27 0.00 0.00 179.45 177.82 1q7f n HIS 913 N -3.65 0.00 -4.15 1.91 8.25 -0.56 -5.05 115.22 111.97 1q7f n HIS 913 Ca -0.03 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.14 1q7f n HIS 913 Cb 0.80 -0.11 -0.08 0.00 1.12 0.00 0.00 29.99 31.72 1q7f n HIS 913 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1q7f s LEU 914 N -3.12 3.42 0.02 2.41 1.43 -0.04 -5.02 118.68 117.78 1q7f s LEU 914 Ca -0.01 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1q7f s LEU 914 Cb 0.05 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 44.14 1q7f s LEU 914 CO 0.28 0.14 0.00 -0.62 0.23 0.00 0.00 176.35 176.38 1q7f n GLU 915 N 0.29 0.00 -3.12 1.70 1.02 -1.26 -4.69 120.64 114.58 1q7f n GLU 915 Ca -0.10 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.85 1q7f n GLU 915 Cb 0.53 -0.44 -0.05 0.00 -0.02 0.00 0.00 31.44 31.46 1q7f n GLU 915 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1q7f n PHE 916 N -3.03 -1.75 -2.06 -0.32 7.35 -1.26 -4.78 117.46 111.60 1q7f n PHE 916 Ca 0.00 -2.74 -0.41 0.00 -0.76 0.00 0.00 57.45 53.55 1q7f n PHE 916 Cb 0.37 0.55 -0.02 0.00 0.35 0.00 0.00 39.48 40.73 1q7f n PHE 916 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1q7f s PRO 917 N 0.00 4.29 0.00 -7.13 0.04 -1.26 -1.93 135.00 129.01 1q7f s PRO 917 Ca 0.33 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1q7f s PRO 917 Cb 0.09 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1q7f s PRO 917 CO -0.15 -0.27 0.50 0.27 0.04 0.00 0.00 177.00 177.39 1q7f n ASN 918 N 0.69 0.00 -3.53 6.66 0.23 -0.04 -4.68 115.26 114.58 1q7f n ASN 918 Ca 0.00 -1.14 -0.09 0.00 -0.53 0.00 0.00 54.58 52.83 1q7f n ASN 918 Cb 0.42 -0.03 -0.03 0.00 -2.08 0.00 0.00 39.78 38.06 1q7f n ASN 918 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1q7f s GLY 919 N -0.14 -0.39 -0.27 4.83 0.00 -1.24 -4.75 107.32 105.37 1q7f s GLY 919 Ca 0.00 1.39 -0.25 0.00 0.00 0.00 0.00 44.72 45.85 1q7f s GLY 919 CO 0.00 0.58 0.75 0.54 0.00 0.00 0.00 173.10 174.97 1q7f s VAL 920 N -2.41 0.00 0.07 1.40 0.11 -1.26 -1.51 120.40 116.81 1q7f s VAL 920 Ca 0.03 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.04 1q7f s VAL 920 Cb -0.01 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1q7f s VAL 920 CO -0.05 0.00 0.06 0.68 -3.33 0.00 0.00 175.10 172.46 1q7f s VAL 921 N 0.32 0.18 0.09 2.04 -7.23 -0.66 -4.54 120.40 110.61 1q7f s VAL 921 Ca 0.00 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 58.60 1q7f s VAL 921 Cb -0.05 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 1q7f s VAL 921 CO 0.00 -0.82 -0.07 0.68 -0.31 0.00 0.00 175.10 174.59 1q7f s VAL 922 N -3.91 0.69 0.00 1.32 -7.23 -1.26 -0.56 120.40 109.44 1q7f s VAL 922 Ca 0.08 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1q7f s VAL 922 Cb 0.07 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 35.49 1q7f s VAL 922 CO -0.09 -0.79 0.00 -0.46 -0.31 0.00 0.00 175.10 173.45 1q7f n ASN 923 N 0.20 0.88 -4.20 4.85 2.04 -1.14 -5.00 115.26 112.89 1q7f n ASN 923 Ca -0.14 -0.55 -0.40 0.00 -0.44 0.00 0.00 54.58 53.05 1q7f n ASN 923 Cb 0.60 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.80 1q7f n ASN 923 CO 0.00 0.00 0.00 1.51 -0.44 0.00 0.00 177.26 178.33 1q7f s ASP 924 N -0.60 6.35 0.00 0.53 3.84 -1.26 -4.15 116.67 121.37 1q7f s ASP 924 Ca 0.00 -3.41 0.00 0.00 -0.00 0.00 0.00 52.55 49.14 1q7f s ASP 924 Cb 0.00 -2.03 0.00 0.00 -1.38 0.00 0.00 42.92 39.51 1q7f s ASP 924 CO 0.00 -0.29 0.00 0.29 -0.00 0.00 0.00 175.17 175.17 1q7f n LYS 925 N 2.84 0.00 -3.76 2.11 5.02 -1.26 -5.00 118.16 118.12 1q7f n LYS 925 Ca 0.19 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.23 1q7f n LYS 925 Cb 0.39 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.42 1q7f n LYS 925 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1q7f n GLN 926 N 0.00 -3.25 -5.07 1.97 6.02 -1.26 -4.97 117.38 110.82 1q7f n GLN 926 Ca 0.00 0.52 -0.30 0.00 -0.01 0.00 0.00 57.00 57.21 1q7f n GLN 926 Cb 0.00 -4.70 -0.17 0.00 1.02 0.00 0.00 30.24 26.39 1q7f n GLN 926 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1q7f s GLU 927 N -6.10 2.48 -0.20 -1.09 2.02 -1.26 -3.00 118.70 111.56 1q7f s GLU 927 Ca 0.15 -0.77 -0.05 0.00 0.02 0.00 0.00 54.97 54.32 1q7f s GLU 927 Cb -0.05 -1.99 -0.03 0.00 0.10 0.00 0.00 34.13 32.16 1q7f s GLU 927 CO 0.85 0.23 0.01 0.42 0.02 0.00 0.00 175.26 176.78 1q7f s ILE 928 N 0.18 4.02 -0.37 -1.63 1.01 0.22 -2.90 121.20 121.73 1q7f s ILE 928 Ca -0.11 -0.29 -0.08 0.00 0.00 0.00 0.00 60.65 60.16 1q7f s ILE 928 Cb -0.15 -2.82 0.05 0.00 0.01 0.00 0.00 42.46 39.55 1q7f s ILE 928 CO 0.05 0.43 0.18 -0.36 0.00 0.00 0.00 174.94 175.24 1q7f s PHE 929 N 0.98 3.28 -0.18 3.97 0.08 0.27 -0.93 117.98 125.45 1q7f s PHE 929 Ca 0.02 -1.33 -0.03 0.00 0.12 0.00 0.00 56.93 55.71 1q7f s PHE 929 Cb -0.14 -2.52 -0.02 0.00 -0.57 0.00 0.00 43.02 39.77 1q7f s PHE 929 CO 0.02 -0.74 -0.06 0.42 -0.10 0.00 0.00 175.22 174.76 1q7f s ILE 930 N 1.45 3.50 0.20 0.64 1.01 -0.28 -1.66 121.20 126.06 1q7f s ILE 930 Ca 0.01 -0.48 -0.27 0.00 0.00 0.00 0.00 60.65 59.91 1q7f s ILE 930 Cb -0.20 -2.54 -0.08 0.00 0.01 0.00 0.00 42.46 39.64 1q7f s ILE 930 CO 0.04 0.47 0.83 -0.94 0.00 0.00 0.00 174.94 175.34 1q7f s SER 931 N 0.80 7.47 -0.22 3.58 1.04 -0.57 -0.81 113.70 124.99 1q7f s SER 931 Ca -0.02 1.75 0.00 0.00 0.48 0.00 0.00 55.95 58.16 1q7f s SER 931 Cb -0.15 -2.54 0.06 0.00 0.10 0.00 0.00 66.02 63.49 1q7f s SER 931 CO 0.02 0.18 -0.05 -0.62 0.98 0.00 0.00 173.24 173.75 1q7f s ASP 932 N -1.19 3.61 0.44 7.02 3.68 -0.20 -0.86 116.67 129.18 1q7f s ASP 932 Ca 0.38 -1.07 0.10 0.00 2.13 0.00 0.00 52.55 54.10 1q7f s ASP 932 Cb -0.24 -1.09 0.99 0.00 -1.45 0.00 0.00 42.92 41.13 1q7f s ASP 932 CO 0.28 -0.23 2.08 -1.13 0.13 0.00 0.00 175.17 176.29 1q7f h ASN 933 N 8.01 0.29 0.60 -0.34 -0.73 -1.48 -2.50 115.58 119.42 1q7f h ASN 933 Ca -0.19 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 57.97 1q7f h ASN 933 Cb 1.08 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 39.60 1q7f h ASN 933 CO 0.41 0.23 -1.29 0.54 -0.37 0.00 0.00 177.43 176.95 1q7f n ARG 934 N -4.48 0.55 0.00 6.67 5.12 -1.26 -3.85 116.66 119.42 1q7f n ARG 934 Ca 0.01 0.01 0.13 0.00 -1.93 0.00 0.00 57.85 56.06 1q7f n ARG 934 Cb 0.09 -1.69 0.36 0.00 -1.16 0.00 0.00 32.46 30.05 1q7f n ARG 934 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1q7f n ALA 935 N -2.13 3.07 -3.84 7.54 0.00 -1.12 -4.96 120.51 119.07 1q7f n ALA 935 Ca -0.01 -0.43 -0.27 0.00 0.00 0.00 0.00 53.44 52.74 1q7f n ALA 935 Cb 0.53 -1.11 0.03 0.00 0.00 0.00 0.00 19.45 18.90 1q7f n ALA 935 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1q7f n HIS 936 N -0.52 -2.12 -3.87 0.00 8.25 -0.96 -4.48 115.22 111.52 1q7f n HIS 936 Ca 0.12 0.87 0.00 0.00 -0.26 0.00 0.00 57.72 58.46 1q7f n HIS 936 Cb 0.36 -4.11 0.01 0.00 1.12 0.00 0.00 29.99 27.37 1q7f n HIS 936 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1q7f s VAL 938 N -2.13 2.79 -0.10 0.00 1.01 0.26 -1.04 120.40 121.19 1q7f s VAL 938 Ca 0.18 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.36 1q7f s VAL 938 Cb -0.01 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 1q7f s VAL 938 CO 0.01 0.56 -0.07 -0.54 0.00 0.00 0.00 175.10 175.07 1q7f s LYS 939 N -0.20 3.04 -0.10 2.72 -0.14 0.01 -0.59 119.74 124.48 1q7f s LYS 939 Ca -0.01 -0.55 -0.01 0.00 -1.36 0.00 0.00 55.97 54.05 1q7f s LYS 939 Cb -0.13 -2.68 -0.03 0.00 -1.68 0.00 0.00 37.83 33.31 1q7f s LYS 939 CO 0.03 0.52 -0.07 0.08 -0.76 0.00 0.00 175.35 175.15 1q7f s VAL 940 N -0.41 3.65 0.15 3.17 1.01 0.77 -1.13 120.40 127.61 1q7f s VAL 940 Ca 0.06 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.60 1q7f s VAL 940 Cb -0.12 -2.53 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1q7f s VAL 940 CO 0.02 0.56 -0.07 -0.36 0.00 0.00 0.00 175.10 175.25 1q7f s PHE 941 N -0.30 1.25 0.48 5.22 0.08 -0.11 0.43 117.98 125.03 1q7f s PHE 941 Ca 0.04 -0.83 0.07 0.00 0.12 0.00 0.00 56.93 56.33 1q7f s PHE 941 Cb -0.13 -0.67 0.03 0.00 -0.57 0.00 0.00 43.02 41.69 1q7f s PHE 941 CO 0.02 0.01 0.66 0.54 -0.10 0.00 0.00 175.22 176.35 1q7f s ASN 942 N -3.17 5.45 0.58 1.36 4.22 -1.04 0.70 114.94 123.05 1q7f s ASN 942 Ca 0.18 -0.39 0.30 0.00 -2.14 0.00 0.00 52.86 50.81 1q7f s ASN 942 Cb 0.04 -0.55 1.79 0.00 1.28 0.00 0.00 41.25 43.81 1q7f s ASN 942 CO 0.01 -0.96 2.22 1.88 -2.04 0.00 0.00 177.10 178.21 1q7f h TYR 943 N 0.41 0.00 0.00 1.54 -1.99 -1.90 -0.27 116.97 114.76 1q7f h TYR 943 Ca -0.39 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.34 1q7f h TYR 943 Cb 1.28 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.01 1q7f h TYR 943 CO 0.37 0.03 0.00 0.93 -0.00 0.00 0.00 178.16 179.49 1q7f h GLU 944 N 0.00 0.00 0.00 4.88 3.07 -1.94 -3.47 114.58 117.12 1q7f h GLU 944 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1q7f h GLU 944 Cb 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1q7f h GLU 944 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1q7f n GLY 945 N 0.78 1.03 3.72 -3.84 0.00 -0.11 -4.89 105.19 101.88 1q7f n GLY 945 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1q7f n GLY 945 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q7f s GLN 946 N -0.74 4.46 0.18 1.61 -2.07 -1.26 -4.81 119.66 117.04 1q7f s GLN 946 Ca 0.00 1.00 -0.32 0.00 -1.82 0.00 0.00 55.36 54.22 1q7f s GLN 946 Cb 0.00 -3.44 -0.11 0.00 -1.09 0.00 0.00 33.01 28.37 1q7f s GLN 946 CO 0.00 0.06 1.69 -0.47 -1.32 0.00 0.00 175.29 175.25 1q7f s TYR 947 N 0.77 2.84 -0.24 9.60 6.14 -1.26 -2.48 117.35 132.72 1q7f s TYR 947 Ca 0.40 0.37 -0.13 0.00 0.64 0.00 0.00 57.07 58.35 1q7f s TYR 947 Cb -0.19 -4.08 -0.10 0.00 0.42 0.00 0.00 41.96 38.01 1q7f s TYR 947 CO 0.20 -4.14 -0.33 1.28 0.64 0.00 0.00 175.55 173.21 1q7f n LEU 948 N 4.23 1.82 -3.81 6.97 4.77 0.17 -4.96 117.00 126.19 1q7f n LEU 948 Ca 0.16 0.31 -0.03 0.00 -0.03 0.00 0.00 56.01 56.42 1q7f n LEU 948 Cb 0.37 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1q7f n LEU 948 CO 0.63 0.40 0.78 0.00 -1.33 0.00 0.00 177.39 177.88 1q7f s ARG 949 N -2.53 1.23 0.04 3.23 1.70 -1.17 -5.00 118.95 116.45 1q7f s ARG 949 Ca -0.35 -0.74 0.09 0.00 -0.47 0.00 0.00 55.73 54.26 1q7f s ARG 949 Cb 0.12 0.38 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 1q7f s ARG 949 CO 0.44 -0.57 -0.26 -1.14 -1.08 0.00 0.00 175.30 172.70 1q7f s GLN 950 N -2.68 1.86 -0.09 3.89 0.74 -1.26 -0.16 119.66 121.97 1q7f s GLN 950 Ca 0.17 -1.08 0.03 0.00 0.05 0.00 0.00 55.36 54.53 1q7f s GLN 950 Cb -0.02 -2.01 0.01 0.00 1.10 0.00 0.00 33.01 32.09 1q7f s GLN 950 CO 0.04 0.52 -0.18 0.42 -0.55 0.00 0.00 175.29 175.53 1q7f s ILE 951 N -0.79 1.63 0.00 -2.34 1.01 0.24 -4.99 121.20 115.96 1q7f s ILE 951 Ca 0.12 -0.77 0.00 0.00 0.00 0.00 0.00 60.65 60.00 1q7f s ILE 951 Cb -0.10 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.93 1q7f s ILE 951 CO 0.02 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.03 1q7f n GLY 952 N 3.68 -2.01 0.00 6.18 0.00 -1.26 -0.57 105.19 111.21 1q7f n GLY 952 Ca -0.21 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1q7f n GLY 952 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q7f n GLY 953 N 0.00 1.13 3.71 -0.02 0.00 -0.82 -4.79 105.19 104.40 1q7f n GLY 953 Ca 0.00 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 1q7f n GLY 953 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1q7f n GLU 954 N -0.86 2.36 0.00 1.61 2.13 -1.16 -0.60 120.64 124.12 1q7f n GLU 954 Ca 0.00 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.66 1q7f n GLU 954 Cb 0.00 -2.57 0.00 0.00 0.27 0.00 0.00 31.44 29.14 1q7f n GLU 954 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1q7f n GLY 955 N 2.29 3.09 0.77 8.31 0.00 -1.26 -4.79 105.19 113.60 1q7f n GLY 955 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 1q7f n GLY 955 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1q7f n ILE 956 N -2.00 1.26 -3.67 -0.61 5.41 0.15 -4.32 119.36 115.59 1q7f n ILE 956 Ca 0.00 0.30 -0.27 0.00 1.00 0.00 0.00 62.75 63.78 1q7f n ILE 956 Cb 0.00 -1.80 -0.10 0.00 -0.71 0.00 0.00 39.64 37.02 1q7f n ILE 956 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1q7f n THR 957 N -3.76 1.17 -2.07 1.39 -2.24 0.23 -4.91 114.28 104.09 1q7f n THR 957 Ca -0.05 -4.65 -0.32 0.00 -2.27 0.00 0.00 64.05 56.76 1q7f n THR 957 Cb 0.18 -2.06 0.00 0.00 -2.10 0.00 0.00 70.33 66.35 1q7f n THR 957 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1q7f s ASN 958 N -1.42 6.08 -0.30 3.42 0.01 -1.26 -3.69 114.94 117.77 1q7f s ASN 958 Ca 0.30 1.65 -0.08 0.00 -0.71 0.00 0.00 52.86 54.02 1q7f s ASN 958 Cb 0.03 -2.51 0.01 0.00 0.41 0.00 0.00 41.25 39.19 1q7f s ASN 958 CO -0.14 -0.96 0.18 -1.22 -1.51 0.00 0.00 177.10 173.45 1q7f n TYR 959 N -2.13 -0.40 -2.17 2.20 4.01 -1.25 -4.63 117.16 112.79 1q7f n TYR 959 Ca 0.07 0.05 -0.39 0.00 -0.16 0.00 0.00 57.90 57.48 1q7f n TYR 959 Cb 0.53 -0.73 -0.01 0.00 -0.31 0.00 0.00 39.34 38.82 1q7f n TYR 959 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1q7f s PRO 960 N -5.07 3.96 0.00 -0.72 0.04 -1.26 -3.92 135.00 128.03 1q7f s PRO 960 Ca 0.11 1.98 0.08 0.00 0.04 0.00 0.00 61.00 63.21 1q7f s PRO 960 Cb -0.06 -2.67 0.02 0.00 0.04 0.00 0.00 34.50 31.83 1q7f s PRO 960 CO 0.26 -0.44 0.63 0.44 0.04 0.00 0.00 177.00 177.93 1q7f n ILE 961 N 0.01 0.00 -3.63 0.56 -6.64 0.11 -3.79 119.36 105.98 1q7f n ILE 961 Ca 0.04 -0.44 0.04 0.00 -1.77 0.00 0.00 62.75 60.62 1q7f n ILE 961 Cb 0.45 1.12 0.00 0.00 -1.44 0.00 0.00 39.64 39.78 1q7f n ILE 961 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 1q7f s GLY 962 N -1.07 -0.45 -0.04 3.28 0.00 -1.15 -4.53 107.32 103.37 1q7f s GLY 962 Ca 0.08 0.81 -0.14 0.00 0.00 0.00 0.00 44.72 45.46 1q7f s GLY 962 CO 0.18 1.06 0.32 0.54 0.00 0.00 0.00 173.10 175.19 1q7f s VAL 963 N -2.08 0.05 0.17 1.40 0.11 -1.26 -1.48 120.40 117.30 1q7f s VAL 963 Ca 0.17 -0.38 -0.04 0.00 -2.93 0.00 0.00 61.98 58.80 1q7f s VAL 963 Cb 0.06 -0.59 -0.03 0.00 -1.53 0.00 0.00 36.38 34.30 1q7f s VAL 963 CO -0.06 -0.21 0.18 -0.83 -3.33 0.00 0.00 175.10 170.85 1q7f s GLY 964 N -1.02 0.90 -0.01 6.54 0.00 0.12 -4.68 107.32 109.18 1q7f s GLY 964 Ca -0.11 -1.30 -0.00 0.00 0.00 0.00 0.00 44.72 43.31 1q7f s GLY 964 CO 0.03 -1.15 0.02 -1.50 0.00 0.00 0.00 173.10 170.50 1q7f s ILE 965 N -4.05 -0.02 0.44 0.90 2.07 -1.26 -0.48 121.20 118.80 1q7f s ILE 965 Ca 0.25 0.08 0.05 0.00 -1.41 0.00 0.00 60.65 59.63 1q7f s ILE 965 Cb 0.05 -0.05 0.05 0.00 0.13 0.00 0.00 42.46 42.65 1q7f s ILE 965 CO 0.04 0.03 0.44 -0.46 -1.91 0.00 0.00 174.94 173.09 1q7f n ASN 966 N 3.50 2.12 0.18 4.50 0.23 -0.85 -4.96 115.26 119.97 1q7f n ASN 966 Ca -0.18 -2.39 0.12 0.00 -0.53 0.00 0.00 54.58 51.60 1q7f n ASN 966 Cb 0.56 -0.15 0.63 0.00 -2.08 0.00 0.00 39.78 38.75 1q7f n ASN 966 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1q7f h SER 967 N 0.35 0.00 -0.26 0.53 4.64 -1.95 -0.72 113.55 116.14 1q7f h SER 967 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1q7f h SER 967 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1q7f h SER 967 CO 0.39 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.94 1q7f n ASN 968 N -2.33 2.62 -0.01 4.97 5.03 -1.26 -4.91 115.26 119.37 1q7f n ASN 968 Ca -0.01 -1.87 -0.00 0.00 0.87 0.00 0.00 54.58 53.57 1q7f n ASN 968 Cb 0.06 -0.17 -0.00 0.00 -1.02 0.00 0.00 39.78 38.66 1q7f n ASN 968 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1q7f n GLY 969 N 1.33 0.44 3.74 7.41 0.00 -0.28 -4.62 105.19 113.21 1q7f n GLY 969 Ca 0.18 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1q7f n GLY 969 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q7f s GLU 970 N -0.36 4.71 -0.25 1.61 2.02 -1.26 -2.97 118.70 122.20 1q7f s GLU 970 Ca 0.00 1.60 -0.10 0.00 0.02 0.00 0.00 54.97 56.49 1q7f s GLU 970 Cb 0.00 -3.29 -0.05 0.00 0.10 0.00 0.00 34.13 30.89 1q7f s GLU 970 CO 0.00 0.26 0.16 0.42 0.02 0.00 0.00 175.26 176.12 1q7f s ILE 971 N -0.61 5.25 -0.22 -1.63 -1.09 0.93 -2.01 121.20 121.81 1q7f s ILE 971 Ca 0.45 0.14 -0.07 0.00 -2.23 0.00 0.00 60.65 58.95 1q7f s ILE 971 Cb -0.27 -3.46 -0.03 0.00 -1.58 0.00 0.00 42.46 37.12 1q7f s ILE 971 CO 0.34 0.33 0.06 -0.76 -1.23 0.00 0.00 174.94 173.67 1q7f s LEU 972 N 1.24 3.51 -0.19 2.97 1.43 0.37 -1.20 118.68 126.81 1q7f s LEU 972 Ca 0.07 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.00 1q7f s LEU 972 Cb -0.14 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 1q7f s LEU 972 CO 0.06 0.04 -0.03 -0.63 0.23 0.00 0.00 176.35 176.02 1q7f s ILE 973 N 1.19 3.75 -0.06 -0.59 1.01 -0.30 -0.70 121.20 125.50 1q7f s ILE 973 Ca 0.04 -0.39 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 1q7f s ILE 973 Cb -0.14 -2.68 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 1q7f s ILE 973 CO 0.03 0.44 -0.02 0.00 0.00 0.00 0.00 174.94 175.40 1q7f s ALA 974 N 0.94 3.21 0.17 9.38 0.00 -0.55 -1.30 121.76 133.62 1q7f s ALA 974 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 50.99 1q7f s ALA 974 Cb -0.14 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.59 1q7f s ALA 974 CO 0.01 0.60 0.34 0.16 0.00 0.00 0.00 175.76 176.88 1q7f s ASP 975 N -1.02 -0.04 -0.26 0.00 1.47 -0.66 0.06 116.67 116.21 1q7f s ASP 975 Ca 0.14 -0.73 0.12 0.00 1.18 0.00 0.00 52.55 53.26 1q7f s ASP 975 Cb -0.11 0.47 0.46 0.00 -0.34 0.00 0.00 42.92 43.40 1q7f s ASP 975 CO 0.04 -0.92 1.18 -3.20 0.68 0.00 0.00 175.17 172.94 1q7f n ASN 976 N -0.24 3.60 -4.55 2.11 4.05 -1.25 0.26 115.26 119.24 1q7f n ASN 976 Ca -0.09 -3.32 -0.43 0.00 0.45 0.00 0.00 54.58 51.20 1q7f n ASN 976 Cb 0.63 -0.39 -0.06 0.00 1.23 0.00 0.00 39.78 41.19 1q7f n ASN 976 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 177.26 171.93 1q7f s HIS 977 N -3.43 3.07 -0.36 1.20 2.46 -1.26 -4.23 115.29 112.73 1q7f s HIS 977 Ca 0.43 0.24 -0.14 0.00 0.47 0.00 0.00 55.06 56.06 1q7f s HIS 977 Cb 0.38 -3.42 0.02 0.00 -0.13 0.00 0.00 32.58 29.43 1q7f s HIS 977 CO -0.00 -0.83 0.40 0.09 -2.47 0.00 0.00 174.74 171.93 1q7f n ASN 978 N 6.41 -7.49 -1.29 9.88 3.02 -1.26 -4.78 115.26 119.74 1q7f n ASN 978 Ca 0.01 0.66 0.00 0.00 -0.03 0.00 0.00 54.58 55.22 1q7f n ASN 978 Cb 0.48 -4.49 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 1q7f n ASN 978 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1q7f n ASN 979 N 0.12 -6.99 -4.64 6.41 3.02 -1.26 -4.76 115.26 107.16 1q7f n ASN 979 Ca 0.05 1.51 -0.43 0.00 -0.03 0.00 0.00 54.58 55.67 1q7f n ASN 979 Cb 0.38 -3.99 -0.03 0.00 -0.61 0.00 0.00 39.78 35.52 1q7f n ASN 979 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1q7f n PHE 980 N -2.31 2.32 -4.66 3.10 7.35 -1.26 -4.45 117.46 117.55 1q7f n PHE 980 Ca 0.00 -0.26 -0.30 0.00 -0.76 0.00 0.00 57.45 56.12 1q7f n PHE 980 Cb 0.37 -2.77 -0.13 0.00 0.35 0.00 0.00 39.48 37.30 1q7f n PHE 980 CO 0.00 0.00 0.00 -0.80 -0.76 0.00 0.00 176.76 175.20 1q7f s ASN 981 N 5.62 3.67 -0.09 -2.13 0.01 0.14 -0.75 114.94 121.41 1q7f s ASN 981 Ca 0.93 -0.48 0.03 0.00 -0.71 0.00 0.00 52.86 52.62 1q7f s ASN 981 Cb -0.44 -0.53 0.01 0.00 0.41 0.00 0.00 41.25 40.71 1q7f s ASN 981 CO 0.41 0.25 -0.17 -0.76 -1.51 0.00 0.00 177.10 175.32 1q7f s LEU 982 N -1.50 1.80 -0.13 0.60 1.02 -0.50 -1.66 118.68 118.31 1q7f s LEU 982 Ca 0.14 -0.42 0.00 0.00 0.02 0.00 0.00 54.13 53.88 1q7f s LEU 982 Cb -0.10 -1.08 0.02 0.00 0.02 0.00 0.00 46.19 45.04 1q7f s LEU 982 CO 0.05 0.06 -0.12 -0.89 0.02 0.00 0.00 176.35 175.47 1q7f s THR 983 N 0.70 1.39 -0.18 5.49 2.01 -0.42 -0.36 115.64 124.28 1q7f s THR 983 Ca -0.13 -0.52 -0.05 0.00 0.31 0.00 0.00 61.69 61.30 1q7f s THR 983 Cb -0.16 -1.33 -0.03 0.00 0.01 0.00 0.00 72.50 70.99 1q7f s THR 983 CO 0.03 0.43 0.01 -0.63 -0.69 0.00 0.00 174.62 173.77 1q7f s ILE 984 N 1.53 4.25 -0.01 1.82 1.01 0.61 -1.15 121.20 129.26 1q7f s ILE 984 Ca 0.04 -0.22 0.08 0.00 0.00 0.00 0.00 60.65 60.55 1q7f s ILE 984 Cb -0.13 -2.90 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 1q7f s ILE 984 CO -0.09 0.46 -0.26 -0.36 0.00 0.00 0.00 174.94 174.69 1q7f s PHE 985 N 0.54 2.31 0.77 3.97 0.08 -0.34 -1.45 117.98 123.85 1q7f s PHE 985 Ca -0.00 -0.43 -0.11 0.00 0.12 0.00 0.00 56.93 56.51 1q7f s PHE 985 Cb -0.14 -1.47 0.05 0.00 -0.57 0.00 0.00 43.02 40.90 1q7f s PHE 985 CO 0.02 -0.01 1.08 0.95 -0.10 0.00 0.00 175.22 177.16 1q7f s THR 986 N -0.64 3.35 -0.42 0.64 -4.23 -0.26 -0.05 115.64 114.03 1q7f s THR 986 Ca 0.10 0.44 0.16 0.00 -1.18 0.00 0.00 61.69 61.21 1q7f s THR 986 Cb -0.10 -3.15 0.16 0.00 1.34 0.00 0.00 72.50 70.75 1q7f s THR 986 CO -0.00 -0.57 1.49 0.00 -0.54 0.00 0.00 174.62 174.99 1q7f n GLN 987 N -3.37 0.10 -0.03 3.99 10.64 -1.16 -0.37 117.38 127.18 1q7f n GLN 987 Ca 0.07 0.59 0.12 0.00 -1.83 0.00 0.00 57.00 55.96 1q7f n GLN 987 Cb 0.55 -1.83 0.54 0.00 -0.86 0.00 0.00 30.24 28.64 1q7f n GLN 987 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 1q7f n ASP 988 N -2.05 1.13 -0.46 2.61 2.03 -1.26 -4.93 116.55 113.63 1q7f n ASP 988 Ca -0.01 -1.49 -0.05 0.00 0.52 0.00 0.00 54.79 53.76 1q7f n ASP 988 Cb 0.03 -0.04 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1q7f n ASP 988 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1q7f n GLY 989 N 1.08 0.59 3.64 0.27 0.00 0.50 -5.02 105.19 106.25 1q7f n GLY 989 Ca 0.18 -0.78 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 1q7f n GLY 989 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1q7f s GLN 990 N -3.00 4.02 -0.74 1.61 -0.21 -1.26 -4.87 119.66 115.22 1q7f s GLN 990 Ca 0.00 -0.31 -0.26 0.00 0.02 0.00 0.00 55.36 54.82 1q7f s GLN 990 Cb 0.00 -3.38 0.04 0.00 1.00 0.00 0.00 33.01 30.67 1q7f s GLN 990 CO 0.00 0.15 1.21 -1.17 -2.12 0.00 0.00 175.29 173.36 1q7f s LEU 991 N 0.75 3.49 0.00 2.90 0.20 -1.26 -1.10 118.68 123.67 1q7f s LEU 991 Ca 0.06 -0.65 0.22 0.00 0.69 0.00 0.00 54.13 54.44 1q7f s LEU 991 Cb -0.13 -2.52 -0.19 0.00 -0.43 0.00 0.00 46.19 42.91 1q7f s LEU 991 CO 0.02 -1.72 0.80 2.30 -0.29 0.00 0.00 176.35 177.46 1q7f n ILE 992 N 6.29 0.04 -3.68 6.68 -5.35 -0.53 -4.97 119.36 117.84 1q7f n ILE 992 Ca 0.03 -0.22 -0.12 0.00 -0.27 0.00 0.00 62.75 62.17 1q7f n ILE 992 Cb 0.48 0.47 -0.09 0.00 -1.74 0.00 0.00 39.64 38.76 1q7f n ILE 992 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1q7f s SER 993 N -3.73 -0.62 -0.14 7.28 0.15 -1.16 -5.01 113.70 110.46 1q7f s SER 993 Ca 0.02 1.12 -0.02 0.00 0.70 0.00 0.00 55.95 57.77 1q7f s SER 993 Cb 0.15 1.07 0.04 0.00 -1.71 0.00 0.00 66.02 65.58 1q7f s SER 993 CO 0.87 -0.20 0.00 0.00 1.20 0.00 0.00 173.24 175.11 1q7f s ALA 994 N 0.79 1.01 0.26 5.45 0.00 -1.26 -0.28 121.76 127.72 1q7f s ALA 994 Ca -0.04 -0.52 0.11 0.00 0.00 0.00 0.00 51.96 51.51 1q7f s ALA 994 Cb -0.05 -1.01 -0.05 0.00 0.00 0.00 0.00 23.12 22.01 1q7f s ALA 994 CO -0.06 -0.82 -0.17 -0.51 0.00 0.00 0.00 175.76 174.20 1q7f s LEU 995 N 1.85 2.69 -0.07 0.00 1.43 0.51 -0.90 118.68 124.18 1q7f s LEU 995 Ca 0.02 -0.91 -0.08 0.00 -1.03 0.00 0.00 54.13 52.12 1q7f s LEU 995 Cb -0.15 -1.25 0.02 0.00 0.03 0.00 0.00 46.19 44.85 1q7f s LEU 995 CO -0.07 0.05 0.22 -1.83 0.23 0.00 0.00 176.35 174.95 1q7f s GLU 996 N -3.36 0.33 0.62 1.70 -1.05 0.12 -1.41 118.70 115.66 1q7f s GLU 996 Ca 0.28 0.18 -0.15 0.00 -0.15 0.00 0.00 54.97 55.13 1q7f s GLU 996 Cb -0.06 0.15 -0.02 0.00 -0.44 0.00 0.00 34.13 33.77 1q7f s GLU 996 CO 0.15 -0.06 1.08 -1.54 0.95 0.00 0.00 175.26 175.85 1q7f s SER 997 N -0.21 5.45 0.11 0.83 1.04 0.07 -0.82 113.70 120.18 1q7f s SER 997 Ca -0.03 1.91 -0.10 0.00 0.48 0.00 0.00 55.95 58.21 1q7f s SER 997 Cb -0.03 -2.54 -0.14 0.00 0.10 0.00 0.00 66.02 63.41 1q7f s SER 997 CO 0.01 -1.39 1.28 0.50 0.98 0.00 0.00 173.24 174.61 1q7f h LYS 998 N 0.25 0.62 -6.64 4.02 3.64 -1.50 -3.44 116.57 113.52 1q7f h LYS 998 Ca -0.47 -0.60 -0.46 0.00 -1.27 0.00 0.00 60.65 57.85 1q7f h LYS 998 Cb 1.23 0.16 0.02 0.00 -0.41 0.00 0.00 32.23 33.23 1q7f h LYS 998 CO 0.56 1.21 -0.13 0.14 -2.27 0.00 0.00 179.45 178.96 1q7f s VAL 999 N -3.45 4.02 0.14 2.00 -7.23 -1.26 -5.09 120.40 109.52 1q7f s VAL 999 Ca -0.08 -0.57 -0.10 0.00 -1.81 0.00 0.00 61.98 59.42 1q7f s VAL 999 Cb 0.08 -3.47 -0.06 0.00 0.56 0.00 0.00 36.38 33.49 1q7f s VAL 999 CO 0.89 -0.31 0.46 -0.54 -0.31 0.00 0.00 175.10 175.30 1q7f s LYS 1000N -4.50 3.80 0.21 4.82 -0.14 -1.26 -4.48 119.74 118.19 1q7f s LYS 1000Ca 0.48 0.23 0.11 0.00 -1.36 0.00 0.00 55.97 55.42 1q7f s LYS 1000Cb -0.10 -2.88 -0.05 0.00 -1.68 0.00 0.00 37.83 33.12 1q7f s LYS 1000CO 0.37 0.47 -0.21 -1.01 -0.76 0.00 0.00 175.35 174.21 1q7f s HIS 1001N -1.54 2.14 0.75 3.18 3.76 -1.26 -5.03 115.29 117.29 1q7f s HIS 1001Ca 0.38 -0.39 -0.13 0.00 -0.15 0.00 0.00 55.06 54.77 1q7f s HIS 1001Cb -0.13 -1.02 0.17 0.00 1.11 0.00 0.00 32.58 32.71 1q7f s HIS 1001CO 0.20 0.51 0.99 0.00 -0.85 0.00 0.00 174.74 175.60 1q7f n ALA 1002N -0.03 -1.26 -1.57 -1.40 0.00 -1.26 -4.91 120.51 110.08 1q7f n ALA 1002Ca -0.10 -1.30 -0.51 0.00 0.00 0.00 0.00 53.44 51.53 1q7f n ALA 1002Cb 0.58 -0.07 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 1q7f n ALA 1002CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1q7f n GLN 1003N -3.19 1.01 -3.58 0.00 7.27 -1.26 -4.67 117.38 112.95 1q7f n GLN 1003Ca 0.12 0.36 -0.38 0.00 0.07 0.00 0.00 57.00 57.17 1q7f n GLN 1003Cb 0.44 -1.88 -0.11 0.00 2.41 0.00 0.00 30.24 31.09 1q7f n GLN 1003CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1q7f h PHE 1005N 8.34 0.55 -2.58 0.00 0.05 -1.41 -3.46 116.94 118.42 1q7f h PHE 1005Ca -0.35 -0.40 0.09 0.00 3.82 0.00 0.00 57.97 61.13 1q7f h PHE 1005Cb 1.19 -0.02 -0.11 0.00 2.00 0.00 0.00 35.95 39.01 1q7f h PHE 1005CO 0.76 1.60 0.38 0.34 -0.18 0.00 0.00 178.31 181.21 1q7f s ASP 1006N -7.13 -0.34 0.03 2.17 3.68 -1.22 -4.87 116.67 108.99 1q7f s ASP 1006Ca -0.18 -0.21 -0.03 0.00 2.13 0.00 0.00 52.55 54.26 1q7f s ASP 1006Cb 0.05 0.52 -0.02 0.00 -1.45 0.00 0.00 42.92 42.02 1q7f s ASP 1006CO 0.80 -0.90 0.02 0.68 0.13 0.00 0.00 175.17 175.91 1q7f s VAL 1007N -3.44 0.14 -0.16 1.11 -7.23 -1.26 -1.23 120.40 108.33 1q7f s VAL 1007Ca 0.07 -1.19 -0.10 0.00 -1.81 0.00 0.00 61.98 58.94 1q7f s VAL 1007Cb -0.02 -0.82 0.05 0.00 0.56 0.00 0.00 36.38 36.15 1q7f s VAL 1007CO -0.04 -0.66 0.39 0.00 -0.31 0.00 0.00 175.10 174.48 1q7f s ALA 1008N -2.51 -0.99 0.30 1.32 0.00 -0.66 -4.82 121.76 114.40 1q7f s ALA 1008Ca -0.06 1.35 -0.16 0.00 0.00 0.00 0.00 51.96 53.10 1q7f s ALA 1008Cb -0.02 -0.82 -0.09 0.00 0.00 0.00 0.00 23.12 22.20 1q7f s ALA 1008CO -0.05 -0.23 0.73 -0.51 0.00 0.00 0.00 175.76 175.70 1q7f s LEU 1009N 1.00 4.12 0.49 0.00 1.02 -1.26 -0.24 118.68 123.81 1q7f s LEU 1009Ca -0.06 1.30 0.06 0.00 0.02 0.00 0.00 54.13 55.45 1q7f s LEU 1009Cb -0.07 -3.98 0.03 0.00 0.02 0.00 0.00 46.19 42.20 1q7f s LEU 1009CO -0.08 -0.16 0.68 -0.04 0.02 0.00 0.00 176.35 176.77 1q7f s MET 1010N -2.79 2.61 0.00 1.70 -1.94 0.13 -4.76 119.30 114.25 1q7f s MET 1010Ca 0.52 -1.20 0.11 0.00 -1.71 0.00 0.00 55.69 53.41 1q7f s MET 1010Cb -0.11 -2.66 0.32 0.00 2.01 0.00 0.00 34.83 34.39 1q7f s MET 1010CO 0.18 -0.53 1.26 -0.40 -0.01 0.00 0.00 175.02 175.52 1q7f n ASP 1011N -2.08 1.83 -0.27 3.03 3.85 -1.26 -4.13 116.55 117.52 1q7f n ASP 1011Ca 0.10 -1.99 0.09 0.00 -0.71 0.00 0.00 54.79 52.27 1q7f n ASP 1011Cb 0.60 -0.23 0.17 0.00 -1.35 0.00 0.00 41.12 40.31 1q7f n ASP 1011CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 1q7f n ASP 1012N 0.50 2.22 0.00 -1.12 5.68 -1.26 -4.97 116.55 117.60 1q7f n ASP 1012Ca 0.12 -3.34 0.00 0.00 -0.50 0.00 0.00 54.79 51.07 1q7f n ASP 1012Cb 0.29 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.80 1q7f n ASP 1012CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1q7f n GLY 1013N -1.31 0.71 3.44 6.12 0.00 -1.26 -4.99 105.19 107.91 1q7f n GLY 1013Ca 0.17 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.57 1q7f n GLY 1013CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q7f s SER 1014N -2.36 3.39 -0.01 1.61 0.01 -1.26 -1.02 113.70 114.06 1q7f s SER 1014Ca 0.00 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.27 1q7f s SER 1014Cb 0.00 -0.27 0.00 0.00 0.21 0.00 0.00 66.02 65.97 1q7f s SER 1014CO 0.00 0.01 -0.06 0.54 0.41 0.00 0.00 173.24 174.14 1q7f s VAL 1015N -2.51 0.50 -0.18 3.43 0.11 0.44 -0.70 120.40 121.49 1q7f s VAL 1015Ca 0.28 -0.22 -0.09 0.00 -2.93 0.00 0.00 61.98 59.01 1q7f s VAL 1015Cb -0.05 -0.45 -0.05 0.00 -1.53 0.00 0.00 36.38 34.31 1q7f s VAL 1015CO 0.13 0.16 0.13 -0.69 -3.33 0.00 0.00 175.10 171.50 1q7f s VAL 1016N 0.15 5.37 -0.15 2.04 1.01 0.67 -1.02 120.40 128.47 1q7f s VAL 1016Ca -0.01 0.17 -0.02 0.00 0.00 0.00 0.00 61.98 62.12 1q7f s VAL 1016Cb -0.06 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 1q7f s VAL 1016CO -0.00 0.48 -0.09 -0.22 0.00 0.00 0.00 175.10 175.27 1q7f s LEU 1017N 0.06 2.89 -0.20 3.92 0.20 0.10 -1.65 118.68 124.02 1q7f s LEU 1017Ca 0.09 -0.28 -0.08 0.00 0.69 0.00 0.00 54.13 54.55 1q7f s LEU 1017Cb -0.11 -1.68 -0.04 0.00 -0.43 0.00 0.00 46.19 43.93 1q7f s LEU 1017CO -0.01 0.14 0.09 0.00 -0.29 0.00 0.00 176.35 176.29 1q7f s ALA 1018N 0.50 3.48 0.18 5.97 0.00 -0.37 -0.52 121.76 131.00 1q7f s ALA 1018Ca -0.07 -0.77 0.08 0.00 0.00 0.00 0.00 51.96 51.20 1q7f s ALA 1018Cb -0.15 -2.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.89 1q7f s ALA 1018CO 0.04 0.09 -0.16 0.45 0.00 0.00 0.00 175.76 176.17 1q7f s SER 1019N 0.52 2.57 0.22 0.00 0.15 0.22 -1.09 113.70 116.29 1q7f s SER 1019Ca 0.05 -0.92 0.19 0.00 0.70 0.00 0.00 55.95 55.96 1q7f s SER 1019Cb -0.12 -0.14 0.88 0.00 -1.71 0.00 0.00 66.02 64.93 1q7f s SER 1019CO 0.00 -0.10 1.57 1.17 1.20 0.00 0.00 173.24 177.08 1q7f n LYS 1020N 0.05 0.13 -0.27 5.44 4.81 0.29 -2.36 118.16 126.25 1q7f n LYS 1020Ca -0.11 0.49 -0.02 0.00 -0.87 0.00 0.00 58.31 57.80 1q7f n LYS 1020Cb 0.58 -1.81 0.07 0.00 0.02 0.00 0.00 35.03 33.89 1q7f n LYS 1020CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1q7f n ASP 1021N -2.06 2.71 -1.96 3.14 5.68 -1.26 -4.83 116.55 117.97 1q7f n ASP 1021Ca 0.01 -2.32 -0.17 0.00 -0.50 0.00 0.00 54.79 51.81 1q7f n ASP 1021Cb 0.12 -0.57 -0.01 0.00 -1.14 0.00 0.00 41.12 39.53 1q7f n ASP 1021CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 1q7f n TYR 1022N 0.12 -0.85 -4.09 2.11 4.01 -0.99 -4.77 117.16 112.69 1q7f n TYR 1022Ca 0.11 0.03 -0.10 0.00 -0.16 0.00 0.00 57.90 57.78 1q7f n TYR 1022Cb 0.65 -3.43 -0.10 0.00 -0.31 0.00 0.00 39.34 36.14 1q7f n TYR 1022CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1q7f s ARG 1023N -4.88 0.62 -0.08 -0.72 0.52 -1.21 -1.81 118.95 111.39 1q7f s ARG 1023Ca 0.01 -1.07 0.04 0.00 -0.52 0.00 0.00 55.73 54.19 1q7f s ARG 1023Cb -0.01 -0.04 -0.01 0.00 0.52 0.00 0.00 34.95 35.41 1q7f s ARG 1023CO 0.02 -0.04 -0.19 -0.51 0.02 0.00 0.00 175.30 174.60 1q7f s LEU 1024N -2.46 2.39 0.01 2.53 2.01 -0.27 -0.61 118.68 122.29 1q7f s LEU 1024Ca 0.02 -0.39 0.07 0.00 0.01 0.00 0.00 54.13 53.84 1q7f s LEU 1024Cb 0.01 -1.48 -0.02 0.00 0.01 0.00 0.00 46.19 44.71 1q7f s LEU 1024CO -0.05 0.24 -0.22 -0.31 1.01 0.00 0.00 176.35 177.03 1q7f s TYR 1025N -0.14 1.93 -0.20 0.29 2.02 0.32 -1.62 117.35 119.95 1q7f s TYR 1025Ca -0.03 -0.37 -0.03 0.00 -0.37 0.00 0.00 57.07 56.27 1q7f s TYR 1025Cb -0.14 -1.20 -0.01 0.00 -0.40 0.00 0.00 41.96 40.22 1q7f s TYR 1025CO 0.04 0.04 -0.07 0.42 -1.57 0.00 0.00 175.55 174.40 1q7f s ILE 1026N -0.66 3.24 -0.08 2.71 1.01 -0.18 0.02 121.20 127.27 1q7f s ILE 1026Ca 0.08 -0.55 0.03 0.00 0.00 0.00 0.00 60.65 60.21 1q7f s ILE 1026Cb -0.09 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.92 1q7f s ILE 1026CO 0.01 0.46 -0.17 -0.31 0.00 0.00 0.00 174.94 174.93 1q7f s TYR 1027N 1.17 2.67 -0.39 3.97 1.51 -0.19 -1.87 117.35 124.23 1q7f s TYR 1027Ca 0.02 -0.48 -0.25 0.00 -1.01 0.00 0.00 57.07 55.35 1q7f s TYR 1027Cb -0.14 -1.70 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 1q7f s TYR 1027CO -0.02 -0.06 0.91 1.03 -1.11 0.00 0.00 175.55 176.30 1q7f s ARG 1028N -0.20 3.76 0.08 -0.62 1.81 -1.26 -0.42 118.95 122.10 1q7f s ARG 1028Ca -0.01 0.45 0.22 0.00 -1.72 0.00 0.00 55.73 54.68 1q7f s ARG 1028Cb -0.13 -3.83 -0.14 0.00 -0.45 0.00 0.00 34.95 30.40 1q7f s ARG 1028CO 0.03 -1.00 0.80 2.48 -0.68 0.00 0.00 175.30 176.93 1q7f n TYR 1029N 6.82 0.45 -3.08 -0.53 0.18 -0.19 -4.85 117.16 115.97 1q7f n TYR 1029Ca 0.06 0.13 -0.39 0.00 1.88 0.00 0.00 57.90 59.58 1q7f n TYR 1029Cb 0.48 -0.68 -0.05 0.00 -0.38 0.00 0.00 39.34 38.71 1q7f n TYR 1029CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1q7f s VAL 1030N -3.40 4.92 0.49 -3.48 0.11 -1.17 -5.06 120.40 112.81 1q7f s VAL 1030Ca -0.03 1.43 0.07 0.00 -2.93 0.00 0.00 61.98 60.52 1q7f s VAL 1030Cb 0.12 -4.02 0.02 0.00 -1.53 0.00 0.00 36.38 30.97 1q7f s VAL 1030CO 0.84 0.34 0.48 0.00 -3.33 0.00 0.00 175.10 173.43 1q7f s GLN 1031N 0.25 2.41 0.13 1.54 -2.07 -1.26 -5.06 119.66 115.60 1q7f s GLN 1031Ca 0.36 -1.70 -0.30 0.00 -1.82 0.00 0.00 55.36 51.90 1q7f s GLN 1031Cb -0.19 -2.36 -0.06 0.00 -1.09 0.00 0.00 33.01 29.31 1q7f s GLN 1031CO 0.19 -0.46 1.01 -0.51 -1.32 0.00 0.00 175.29 174.20 1q7f s LEU 1032N -4.29 4.49 -0.14 2.60 1.02 -1.26 -4.99 118.68 116.11 1q7f s LEU 1032Ca 0.47 1.89 -0.29 0.00 0.02 0.00 0.00 54.13 56.21 1q7f s LEU 1032Cb -0.04 -3.59 -0.05 0.00 0.02 0.00 0.00 46.19 42.53 1q7f s LEU 1032CO 0.28 -0.13 1.88 0.00 0.02 0.00 0.00 176.35 178.40 1q7f s ALA 1033N -0.02 3.22 0.81 4.21 0.00 -1.26 -4.94 121.76 123.78 1q7f s ALA 1033Ca 0.48 0.81 -0.15 0.00 0.00 0.00 0.00 51.96 53.09 1q7f s ALA 1033Cb -0.25 -3.91 -0.04 0.00 0.00 0.00 0.00 23.12 18.92 1q7f s ALA 1033CO 0.31 -2.06 0.28 -2.30 0.00 0.00 0.00 175.76 171.99 1q7f n PRO 1034N 7.91 0.07 -1.72 0.00 -0.02 -1.26 -4.81 135.00 135.16 1q7f n PRO 1034Ca 0.22 0.06 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 1q7f n PRO 1034Cb 0.44 -1.68 -0.03 0.00 -0.02 0.00 0.00 33.50 32.21 1q7f n PRO 1034CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1q7f n VAL 1035N -2.71 0.12 0.00 -1.45 0.24 -1.26 -1.91 118.33 111.37 1q7f n VAL 1035Ca 0.07 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 1q7f n VAL 1035Cb 0.52 -1.96 0.00 0.00 -1.47 0.00 0.00 33.84 30.92 1q7f n VAL 1035CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1q7f n GLY 1036N 3.73 2.48 0.00 7.63 0.00 -1.26 -5.33 105.19 112.44 1q7f n GLY 1036Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1q7f n GLY 1036CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19