#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kyd n SER 693 N 0.00 2.52 -4.91 1.61 7.64 -1.26 -5.01 113.62 114.21 1kyd n SER 693 Ca 0.00 0.99 -0.28 0.00 1.01 0.00 0.00 58.87 60.58 1kyd n SER 693 Cb 0.00 -1.55 0.08 0.00 -1.01 0.00 0.00 64.21 61.73 1kyd n SER 693 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1kyd s PRO 694 N -2.76 2.06 0.00 1.43 0.04 -1.26 -4.97 135.00 129.54 1kyd s PRO 694 Ca 0.70 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1kyd s PRO 694 Cb -0.43 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1kyd s PRO 694 CO 0.51 -1.48 0.00 0.41 0.04 0.00 0.00 177.00 176.47 1kyd n GLY 695 N -3.21 0.84 3.68 0.56 0.00 -1.26 -4.94 105.19 100.86 1kyd n GLY 695 Ca 0.08 -1.73 -0.45 0.00 0.00 0.00 0.00 46.02 43.92 1kyd n GLY 695 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1kyd n ILE 696 N 0.90 0.39 -2.73 -0.61 5.41 -1.26 -4.90 119.36 116.57 1kyd n ILE 696 Ca 0.00 -0.07 -0.43 0.00 1.00 0.00 0.00 62.75 63.25 1kyd n ILE 696 Cb 0.00 -1.94 0.00 0.00 -0.71 0.00 0.00 39.64 37.00 1kyd n ILE 696 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1kyd n ARG 697 N 5.65 3.73 -3.65 0.38 5.12 -1.26 -4.76 116.66 121.86 1kyd n ARG 697 Ca 0.19 -3.91 -0.16 0.00 -1.93 0.00 0.00 57.85 52.04 1kyd n ARG 697 Cb 0.33 -2.83 -0.15 0.00 -1.16 0.00 0.00 32.46 28.65 1kyd n ARG 697 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1kyd s LEU 698 N -0.37 -0.14 -0.17 0.55 2.96 -1.26 -4.72 118.68 115.53 1kyd s LEU 698 Ca 0.38 0.36 0.00 0.00 -0.22 0.00 0.00 54.13 54.64 1kyd s LEU 698 Cb 0.04 0.39 0.00 0.00 0.50 0.00 0.00 46.19 47.12 1kyd s LEU 698 CO 0.02 -0.25 0.00 0.61 -1.32 0.00 0.00 176.35 175.41 1kyd n GLY 699 N 5.33 0.50 4.02 7.98 0.00 -1.26 -5.03 105.19 116.73 1kyd n GLY 699 Ca -0.05 -0.99 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 1kyd n GLY 699 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kyd s SER 700 N -2.96 5.24 0.00 1.61 1.04 -1.26 -4.99 113.70 112.38 1kyd s SER 700 Ca 0.00 -0.64 0.25 0.00 0.48 0.00 0.00 55.95 56.04 1kyd s SER 700 Cb 0.00 -0.09 1.43 0.00 0.10 0.00 0.00 66.02 67.46 1kyd s SER 700 CO 0.00 -1.18 1.83 -1.54 0.98 0.00 0.00 173.24 173.33 1kyd n SER 701 N -2.16 0.00 -1.41 7.02 3.41 -1.26 -3.75 113.62 115.47 1kyd n SER 701 Ca 0.13 -0.64 0.04 0.00 -0.26 0.00 0.00 58.87 58.13 1kyd n SER 701 Cb 0.61 -0.05 0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1kyd n SER 701 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1kyd n GLU 702 N -1.05 0.00 -0.26 4.33 0.28 -1.26 0.42 120.64 123.10 1kyd n GLU 702 Ca 0.17 -1.90 0.07 0.00 -0.16 0.00 0.00 57.16 55.34 1kyd n GLU 702 Cb 0.10 -0.04 0.19 0.00 1.43 0.00 0.00 31.44 33.13 1kyd n GLU 702 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1kyd h ASP 703 N 0.90 -0.08 -0.19 -1.84 5.19 -1.85 -2.95 116.42 115.60 1kyd h ASP 703 Ca -0.21 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1kyd h ASP 703 Cb 1.85 0.24 0.00 0.00 0.18 0.00 0.00 39.33 41.60 1kyd h ASP 703 CO 0.09 -0.09 0.00 0.59 -3.12 0.00 0.00 179.24 176.71 1kyd n ASN 704 N -5.21 2.56 -0.22 6.45 3.02 -1.26 -4.76 115.26 115.83 1kyd n ASN 704 Ca 0.15 -1.75 -0.02 0.00 -0.03 0.00 0.00 54.58 52.93 1kyd n ASN 704 Cb 0.50 -0.12 0.05 0.00 -0.61 0.00 0.00 39.78 39.59 1kyd n ASN 704 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1kyd h PHE 705 N 2.57 -0.60 -0.00 3.10 3.57 -1.83 -1.56 116.94 122.20 1kyd h PHE 705 Ca 0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1kyd h PHE 705 Cb 0.66 0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 1kyd h PHE 705 CO 0.12 -0.33 0.02 0.00 -2.23 0.00 0.00 178.31 175.89 1kyd h ALA 706 N 1.41 1.09 0.00 2.41 0.00 -1.86 -1.46 119.26 120.85 1kyd h ALA 706 Ca 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1kyd h ALA 706 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1kyd h ALA 706 CO -0.70 -0.03 0.00 0.54 0.00 0.00 0.00 179.25 179.06 1kyd n ARG 707 N -3.16 0.28 -0.37 0.00 1.74 -0.59 -3.51 116.66 111.05 1kyd n ARG 707 Ca -0.03 0.04 0.07 0.00 -0.77 0.00 0.00 57.85 57.16 1kyd n ARG 707 Cb 0.09 -1.50 0.21 0.00 -1.02 0.00 0.00 32.46 30.24 1kyd n ARG 707 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1kyd n PHE 708 N -1.34 0.57 -0.00 -1.55 3.01 -0.55 -4.44 117.46 113.15 1kyd n PHE 708 Ca 0.11 -1.07 -0.21 0.00 1.01 0.00 0.00 57.45 57.29 1kyd n PHE 708 Cb 0.24 -0.28 -0.14 0.00 -0.01 0.00 0.00 39.48 39.29 1kyd n PHE 708 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1kyd h VAL 709 N 0.99 0.97 -0.59 -4.37 2.07 -1.71 -3.39 116.25 110.22 1kyd h VAL 709 Ca 0.03 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.18 1kyd h VAL 709 Cb 1.29 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.71 1kyd h VAL 709 CO 0.15 0.70 0.00 0.00 0.02 0.00 0.00 177.57 178.44 1kyd s LYS 711 N -1.09 0.91 -0.02 0.00 -2.85 -1.26 -4.23 119.74 111.21 1kyd s LYS 711 Ca 0.41 -0.54 0.16 0.00 -1.00 0.00 0.00 55.97 54.99 1kyd s LYS 711 Cb 0.22 0.40 -0.23 0.00 -2.06 0.00 0.00 37.83 36.16 1kyd s LYS 711 CO 0.27 -0.32 0.40 0.09 0.10 0.00 0.00 175.35 175.89 1kyd n ASN 712 N 0.30 1.27 -4.67 0.03 3.02 -1.26 -4.50 115.26 109.46 1kyd n ASN 712 Ca -0.18 -0.15 -0.33 0.00 -0.03 0.00 0.00 54.58 53.89 1kyd n ASN 712 Cb 0.61 1.59 -0.09 0.00 -0.61 0.00 0.00 39.78 41.28 1kyd n ASN 712 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1kyd s ASN 713 N -3.57 5.04 0.00 6.41 0.02 -1.26 -3.46 114.94 118.12 1kyd s ASN 713 Ca -0.04 -0.01 0.00 0.00 -1.02 0.00 0.00 52.86 51.79 1kyd s ASN 713 Cb 0.10 -1.31 0.00 0.00 0.02 0.00 0.00 41.25 40.07 1kyd s ASN 713 CO 0.65 0.30 0.00 0.61 0.02 0.00 0.00 177.10 178.68 1kyd n GLY 714 N 1.54 -0.20 3.50 0.66 0.00 -0.82 -4.98 105.19 104.89 1kyd n GLY 714 Ca -0.15 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.76 1kyd n GLY 714 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kyd s VAL 715 N -1.92 4.96 0.05 1.61 1.01 -1.26 -0.43 120.40 124.42 1kyd s VAL 715 Ca 0.00 -0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 1kyd s VAL 715 Cb 0.00 -4.13 -0.22 0.00 0.00 0.00 0.00 36.38 32.03 1kyd s VAL 715 CO 0.00 -0.52 1.17 0.25 0.00 0.00 0.00 175.10 176.00 1kyd h LEU 716 N 9.37 0.74 -7.41 3.92 5.85 -1.36 -3.48 115.31 122.94 1kyd h LEU 716 Ca -0.26 -0.72 -0.11 0.00 0.84 0.00 0.00 57.88 57.63 1kyd h LEU 716 Cb 1.10 -0.22 -0.21 0.00 0.37 0.00 0.00 40.66 41.70 1kyd h LEU 716 CO 0.85 1.36 -0.21 0.12 -0.34 0.00 0.00 178.44 180.22 1kyd s PHE 717 N -3.36 -0.28 -0.27 1.25 5.36 -1.04 -4.34 117.98 115.29 1kyd s PHE 717 Ca -0.12 0.51 -0.09 0.00 -0.96 0.00 0.00 56.93 56.27 1kyd s PHE 717 Cb 0.06 0.15 0.12 0.00 -0.34 0.00 0.00 43.02 43.00 1kyd s PHE 717 CO 0.87 -0.39 0.59 -2.00 -1.46 0.00 0.00 175.22 172.83 1kyd s GLU 718 N -1.07 0.51 0.00 10.12 2.12 -1.26 0.55 118.70 129.67 1kyd s GLU 718 Ca -0.11 1.34 0.00 0.00 0.36 0.00 0.00 54.97 56.56 1kyd s GLU 718 Cb -0.04 0.72 0.00 0.00 0.26 0.00 0.00 34.13 35.06 1kyd s GLU 718 CO 0.04 -0.21 0.00 0.27 -0.54 0.00 0.00 175.26 174.82 1kyd n ASN 719 N 5.41 0.37 -0.28 -1.70 0.23 -0.56 -5.00 115.26 113.72 1kyd n ASN 719 Ca -0.11 0.00 0.14 0.00 -0.53 0.00 0.00 54.58 54.07 1kyd n ASN 719 Cb 0.49 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.67 1kyd n ASN 719 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1kyd n GLN 720 N 0.00 1.03 -0.04 -3.83 6.02 -1.26 -4.19 117.38 115.10 1kyd n GLN 720 Ca 0.00 -0.55 -0.05 0.00 -0.01 0.00 0.00 57.00 56.39 1kyd n GLN 720 Cb 0.00 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.72 1kyd n GLN 720 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1kyd n LEU 721 N -0.50 1.38 -3.99 1.08 4.77 -1.26 -4.75 117.00 113.73 1kyd n LEU 721 Ca 0.15 -0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 1kyd n LEU 721 Cb 0.33 -0.05 -0.14 0.00 -2.33 0.00 0.00 43.42 41.23 1kyd n LEU 721 CO 0.23 0.40 -0.41 -0.22 -1.33 0.00 0.00 177.39 176.06 1kyd s LEU 722 N -5.00 2.04 -0.12 2.23 2.96 -1.26 -0.62 118.68 118.91 1kyd s LEU 722 Ca -0.08 -0.17 0.02 0.00 -0.22 0.00 0.00 54.13 53.68 1kyd s LEU 722 Cb 0.03 -0.31 0.00 0.00 0.50 0.00 0.00 46.19 46.41 1kyd s LEU 722 CO 0.26 0.04 -0.21 -1.58 -1.32 0.00 0.00 176.35 173.55 1kyd s GLN 723 N -0.34 3.12 -0.26 1.98 0.74 -0.52 -1.50 119.66 122.87 1kyd s GLN 723 Ca 0.01 -0.83 -0.04 0.00 0.05 0.00 0.00 55.36 54.55 1kyd s GLN 723 Cb -0.03 -2.43 0.01 0.00 1.10 0.00 0.00 33.01 31.65 1kyd s GLN 723 CO -0.00 0.11 0.01 0.42 -0.55 0.00 0.00 175.29 175.28 1kyd s ILE 724 N 0.53 3.49 0.36 -2.34 1.01 0.19 -0.20 121.20 124.24 1kyd s ILE 724 Ca -0.13 -0.73 0.08 0.00 0.00 0.00 0.00 60.65 59.87 1kyd s ILE 724 Cb -0.17 -2.74 -0.04 0.00 0.01 0.00 0.00 42.46 39.53 1kyd s ILE 724 CO 0.04 0.21 0.19 -0.83 0.00 0.00 0.00 174.94 174.55 1kyd s GLY 725 N 1.44 2.01 0.04 6.18 0.00 -0.14 -0.94 107.32 115.92 1kyd s GLY 725 Ca 0.03 -1.86 0.03 0.00 0.00 0.00 0.00 44.72 42.92 1kyd s GLY 725 CO -0.01 -1.76 -0.09 1.08 0.00 0.00 0.00 173.10 172.33 1kyd s LEU 726 N -3.90 2.25 -0.15 0.66 1.43 0.43 -1.05 118.68 118.34 1kyd s LEU 726 Ca 0.40 -0.54 -0.06 0.00 -1.03 0.00 0.00 54.13 52.90 1kyd s LEU 726 Cb -0.02 -0.23 0.07 0.00 0.03 0.00 0.00 46.19 46.04 1kyd s LEU 726 CO 0.24 -0.17 0.33 -0.75 0.23 0.00 0.00 176.35 176.22 1kyd s LYS 727 N -1.52 0.25 0.08 1.70 2.20 -0.73 -1.94 119.74 119.77 1kyd s LYS 727 Ca -0.08 0.79 0.02 0.00 -0.36 0.00 0.00 55.97 56.34 1kyd s LYS 727 Cb -0.10 0.05 -0.04 0.00 -1.51 0.00 0.00 37.83 36.24 1kyd s LYS 727 CO 0.01 -0.23 -0.07 -1.12 -0.36 0.00 0.00 175.35 173.58 1kyd s SER 728 N 2.07 1.04 -0.03 1.43 0.01 -1.22 0.13 113.70 117.12 1kyd s SER 728 Ca -0.03 -0.84 -0.04 0.00 1.31 0.00 0.00 55.95 56.35 1kyd s SER 728 Cb -0.11 0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.20 1kyd s SER 728 CO -0.10 -0.37 0.10 -1.83 0.41 0.00 0.00 173.24 171.44 1kyd s GLU 729 N -3.02 0.16 0.05 12.44 -1.05 -0.24 -4.84 118.70 122.20 1kyd s GLU 729 Ca 0.04 0.05 0.04 0.00 -0.15 0.00 0.00 54.97 54.94 1kyd s GLU 729 Cb -0.00 0.07 -0.02 0.00 -0.44 0.00 0.00 34.13 33.74 1kyd s GLU 729 CO -0.03 -0.03 -0.11 -0.06 0.95 0.00 0.00 175.26 175.99 1kyd s PHE 730 N -0.17 0.93 -0.24 4.83 0.40 -1.26 -0.88 117.98 121.58 1kyd s PHE 730 Ca -0.02 -0.43 -0.13 0.00 -0.60 0.00 0.00 56.93 55.74 1kyd s PHE 730 Cb -0.02 -0.54 0.08 0.00 0.51 0.00 0.00 43.02 43.05 1kyd s PHE 730 CO 0.00 -0.01 0.58 0.50 0.70 0.00 0.00 175.22 176.99 1kyd s ARG 731 N -1.45 0.58 7.10 0.44 3.52 -0.10 -5.00 118.95 124.05 1kyd s ARG 731 Ca -0.05 1.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.64 1kyd s ARG 731 Cb -0.09 0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.43 1kyd s ARG 731 CO 0.01 -0.16 0.00 0.94 -0.81 0.00 0.00 175.30 175.28 1kyd n GLN 732 N 4.40 0.00 -0.56 5.12 -0.06 -1.26 -1.14 117.38 123.87 1kyd n GLN 732 Ca -0.20 0.00 0.07 0.00 -2.00 0.00 0.00 57.00 54.86 1kyd n GLN 732 Cb 0.57 0.00 0.29 0.00 -4.06 0.00 0.00 30.24 27.04 1kyd n GLN 732 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 1kyd n ASN 733 N 3.83 4.14 -4.52 1.69 6.94 -1.26 -4.63 115.26 121.44 1kyd n ASN 733 Ca 0.00 -2.48 -0.25 0.00 -0.02 0.00 0.00 54.58 51.83 1kyd n ASN 733 Cb 0.00 -0.56 -0.10 0.00 -2.36 0.00 0.00 39.78 36.76 1kyd n ASN 733 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1kyd s LEU 734 N -1.75 2.70 0.24 -4.53 1.43 -0.29 -0.62 118.68 115.86 1kyd s LEU 734 Ca 0.41 -1.11 -0.19 0.00 -1.03 0.00 0.00 54.13 52.22 1kyd s LEU 734 Cb 0.28 -1.08 0.02 0.00 0.03 0.00 0.00 46.19 45.45 1kyd s LEU 734 CO 0.17 -0.10 0.61 -0.83 0.23 0.00 0.00 176.35 176.42 1kyd s GLY 735 N -3.58 0.00 -0.04 -3.19 0.00 -0.24 -0.92 107.32 99.36 1kyd s GLY 735 Ca 0.32 -0.35 -0.01 0.00 0.00 0.00 0.00 44.72 44.68 1kyd s GLY 735 CO 0.16 -0.23 0.03 -1.60 0.00 0.00 0.00 173.10 171.46 1kyd s ARG 736 N -3.92 0.11 -0.18 2.90 3.52 -0.06 -0.01 118.95 121.32 1kyd s ARG 736 Ca 0.12 0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.97 1kyd s ARG 736 Cb -0.03 -0.52 0.02 0.00 -1.56 0.00 0.00 34.95 32.85 1kyd s ARG 736 CO 0.03 -0.25 -0.19 1.41 -0.81 0.00 0.00 175.30 175.49 1kyd s MET 737 N 1.67 3.01 -0.08 5.12 -2.45 -0.24 -1.08 119.30 125.25 1kyd s MET 737 Ca -0.01 -0.82 -0.19 0.00 -1.25 0.00 0.00 55.69 53.42 1kyd s MET 737 Cb -0.13 -2.58 -0.04 0.00 1.25 0.00 0.00 34.83 33.33 1kyd s MET 737 CO -0.03 -0.19 0.53 -0.06 1.05 0.00 0.00 175.02 176.32 1kyd s PHE 738 N 1.25 3.56 -0.18 4.11 0.40 0.34 -0.85 117.98 126.62 1kyd s PHE 738 Ca 0.04 1.01 -0.01 0.00 -0.60 0.00 0.00 56.93 57.37 1kyd s PHE 738 Cb -0.13 -2.59 0.00 0.00 0.51 0.00 0.00 43.02 40.81 1kyd s PHE 738 CO -0.11 0.21 -0.14 0.42 0.70 0.00 0.00 175.22 176.30 1kyd s ILE 739 N 0.43 2.68 -0.19 0.64 1.01 0.84 -1.78 121.20 124.83 1kyd s ILE 739 Ca 0.29 -0.75 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 1kyd s ILE 739 Cb -0.16 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 1kyd s ILE 739 CO 0.13 0.50 0.03 -0.36 0.00 0.00 0.00 174.94 175.24 1kyd s PHE 740 N 1.11 3.11 -0.42 3.97 0.40 -0.22 -0.90 117.98 125.04 1kyd s PHE 740 Ca 0.00 -0.23 -0.07 0.00 -0.60 0.00 0.00 56.93 56.03 1kyd s PHE 740 Cb -0.14 -2.09 0.09 0.00 0.51 0.00 0.00 43.02 41.39 1kyd s PHE 740 CO -0.05 -0.09 0.24 0.71 0.70 0.00 0.00 175.22 176.74 1kyd s TYR 741 N 0.78 3.41 -0.25 0.36 1.51 0.33 -0.96 117.35 122.53 1kyd s TYR 741 Ca 0.02 -1.83 -0.14 0.00 -1.01 0.00 0.00 57.07 54.10 1kyd s TYR 741 Cb -0.14 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.62 1kyd s TYR 741 CO 0.02 -0.90 0.34 0.20 -1.11 0.00 0.00 175.55 174.10 1kyd s GLY 742 N 2.08 1.96 -0.57 0.71 0.00 0.72 -1.75 107.32 110.47 1kyd s GLY 742 Ca 0.04 -0.76 -0.25 0.00 0.00 0.00 0.00 44.72 43.75 1kyd s GLY 742 CO -0.00 0.83 0.99 0.21 0.00 0.00 0.00 173.10 175.13 1kyd s ASN 743 N 1.39 6.34 0.00 1.64 3.84 -0.05 -1.45 114.94 126.66 1kyd s ASN 743 Ca 0.14 -0.31 0.31 0.00 0.21 0.00 0.00 52.86 53.21 1kyd s ASN 743 Cb -0.15 -2.46 1.71 0.00 -0.55 0.00 0.00 41.25 39.80 1kyd s ASN 743 CO 0.09 -1.30 2.13 0.29 -2.79 0.00 0.00 177.10 175.52 1kyd n LYS 744 N 7.69 0.95 -3.25 0.43 5.02 0.20 -0.07 118.16 129.13 1kyd n LYS 744 Ca 0.03 -0.11 -0.22 0.00 -2.02 0.00 0.00 58.31 55.99 1kyd n LYS 744 Cb 0.48 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.04 1kyd n LYS 744 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1kyd s THR 745 N -2.13 1.88 -2.12 -0.18 -4.23 -1.26 -4.80 115.64 102.81 1kyd s THR 745 Ca 0.42 -1.12 0.22 0.00 -1.18 0.00 0.00 61.69 60.04 1kyd s THR 745 Cb 0.21 -2.00 0.58 0.00 1.34 0.00 0.00 72.50 72.63 1kyd s THR 745 CO 0.39 0.00 1.50 -1.54 -0.54 0.00 0.00 174.62 174.43 1kyd n SER 746 N -2.19 3.70 -4.39 3.99 3.41 -1.26 -1.19 113.62 115.68 1kyd n SER 746 Ca 0.12 -1.99 -0.33 0.00 -0.26 0.00 0.00 58.87 56.41 1kyd n SER 746 Cb 0.63 -0.42 -0.14 0.00 -0.26 0.00 0.00 64.21 64.01 1kyd n SER 746 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1kyd s THR 747 N -1.16 2.86 0.23 6.66 2.01 -1.26 -4.58 115.64 120.40 1kyd s THR 747 Ca 0.45 -0.77 -0.30 0.00 0.31 0.00 0.00 61.69 61.39 1kyd s THR 747 Cb 0.24 -2.14 -0.10 0.00 0.01 0.00 0.00 72.50 70.52 1kyd s THR 747 CO 0.32 0.56 1.40 -1.58 -0.69 0.00 0.00 174.62 174.64 1kyd s GLN 748 N -0.19 4.30 0.32 4.92 0.74 -1.26 -3.77 119.66 124.72 1kyd s GLN 748 Ca -0.01 2.22 -0.10 0.00 0.05 0.00 0.00 55.36 57.53 1kyd s GLN 748 Cb -0.13 -3.14 -0.07 0.00 1.10 0.00 0.00 33.01 30.77 1kyd s GLN 748 CO 0.03 -0.37 0.67 -0.06 -0.55 0.00 0.00 175.29 175.01 1kyd s PHE 749 N 0.08 3.44 0.11 1.67 0.08 0.13 -4.75 117.98 118.74 1kyd s PHE 749 Ca 0.59 0.98 0.08 0.00 0.12 0.00 0.00 56.93 58.69 1kyd s PHE 749 Cb -0.40 -2.36 -0.04 0.00 -0.57 0.00 0.00 43.02 39.65 1kyd s PHE 749 CO 0.41 0.08 -0.19 -0.51 -0.10 0.00 0.00 175.22 174.91 1kyd s LEU 750 N -3.35 2.33 -1.55 -0.37 1.43 -0.75 -1.62 118.68 114.80 1kyd s LEU 750 Ca 0.50 -0.72 -0.14 0.00 -1.03 0.00 0.00 54.13 52.73 1kyd s LEU 750 Cb -0.11 -0.78 0.09 0.00 0.03 0.00 0.00 46.19 45.42 1kyd s LEU 750 CO 0.25 -0.00 0.93 0.59 0.23 0.00 0.00 176.35 178.35 1kyd n ASN 751 N 0.91 -4.65 -4.58 2.29 4.13 -0.42 -0.65 115.26 112.28 1kyd n ASN 751 Ca -0.18 -0.77 -0.41 0.00 1.68 0.00 0.00 54.58 54.89 1kyd n ASN 751 Cb 0.55 -3.72 -0.03 0.00 -1.54 0.00 0.00 39.78 35.04 1kyd n ASN 751 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1kyd s PHE 752 N -3.27 1.56 -0.29 3.10 5.36 0.11 -4.26 117.98 120.28 1kyd s PHE 752 Ca 0.66 0.77 0.02 0.00 -0.96 0.00 0.00 56.93 57.42 1kyd s PHE 752 Cb -0.33 -4.01 0.09 0.00 -0.34 0.00 0.00 43.02 38.42 1kyd s PHE 752 CO 0.81 -2.98 0.02 0.99 -1.46 0.00 0.00 175.22 172.60 1kyd s THR 753 N 8.30 1.67 -0.15 0.12 2.01 0.13 -4.26 115.64 123.46 1kyd s THR 753 Ca 0.84 -1.70 -0.11 0.00 0.31 0.00 0.00 61.69 61.03 1kyd s THR 753 Cb -0.22 -2.11 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1kyd s THR 753 CO 0.30 -0.43 0.20 -2.16 -0.69 0.00 0.00 174.62 171.84 1kyd s PRO 754 N 1.26 3.98 -0.01 4.92 0.04 -1.26 -1.53 135.00 142.40 1kyd s PRO 754 Ca 0.04 -0.06 0.03 0.00 0.04 0.00 0.00 61.00 61.05 1kyd s PRO 754 Cb -0.19 -3.34 -0.01 0.00 0.04 0.00 0.00 34.50 31.01 1kyd s PRO 754 CO -0.12 0.44 -0.10 0.95 0.04 0.00 0.00 177.00 178.22 1kyd s THR 755 N -0.10 0.79 -0.09 1.26 -4.23 0.11 -4.96 115.64 108.42 1kyd s THR 755 Ca 0.13 -0.41 -0.17 0.00 -1.18 0.00 0.00 61.69 60.06 1kyd s THR 755 Cb -0.12 -0.67 -0.05 0.00 1.34 0.00 0.00 72.50 73.00 1kyd s THR 755 CO 0.02 0.23 0.44 -0.76 -0.54 0.00 0.00 174.62 174.01 1kyd s LEU 756 N -0.15 4.32 -0.10 4.79 1.43 -1.26 -1.46 118.68 126.25 1kyd s LEU 756 Ca 0.02 0.82 0.01 0.00 -1.03 0.00 0.00 54.13 53.95 1kyd s LEU 756 Cb -0.05 -2.64 0.02 0.00 0.03 0.00 0.00 46.19 43.55 1kyd s LEU 756 CO -0.00 0.09 -0.12 -0.63 0.23 0.00 0.00 176.35 175.92 1kyd s ILE 757 N 0.22 1.22 -0.35 -0.59 1.01 0.08 -4.97 121.20 117.83 1kyd s ILE 757 Ca 0.24 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 1kyd s ILE 757 Cb -0.15 -1.16 0.06 0.00 0.01 0.00 0.00 42.46 41.22 1kyd s ILE 757 CO 0.10 0.39 0.11 0.00 0.00 0.00 0.00 174.94 175.54 1kyd s ALA 759 N 1.32 3.52 0.00 0.00 0.00 -1.26 -3.87 121.76 121.47 1kyd s ALA 759 Ca -0.01 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1kyd s ALA 759 Cb -0.20 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.42 1kyd s ALA 759 CO 0.01 -0.66 0.00 -0.25 0.00 0.00 0.00 175.76 174.86 1kyd n ASP 760 N 1.08 0.00 -0.28 0.00 8.00 -1.26 -1.02 116.55 123.07 1kyd n ASP 760 Ca 0.01 0.00 0.23 0.00 0.71 0.00 0.00 54.79 55.74 1kyd n ASP 760 Cb 0.42 0.00 0.55 0.00 -0.02 0.00 0.00 41.12 42.06 1kyd n ASP 760 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1kyd h ASP 761 N 0.00 0.36 0.13 -2.24 3.45 -2.02 0.69 116.42 116.79 1kyd h ASP 761 Ca 0.00 0.05 -0.02 0.00 0.43 0.00 0.00 57.03 57.49 1kyd h ASP 761 Cb 0.00 -0.01 -0.00 0.00 -0.56 0.00 0.00 39.33 38.76 1kyd h ASP 761 CO 0.00 0.10 -0.09 0.25 -1.57 0.00 0.00 179.24 177.93 1kyd h LEU 762 N 0.33 0.00 -2.78 1.55 5.85 -1.37 -1.22 115.31 117.68 1kyd h LEU 762 Ca 0.53 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.25 1kyd h LEU 762 Cb 1.46 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.49 1kyd h LEU 762 CO -0.20 0.09 0.02 1.56 -0.34 0.00 0.00 178.44 179.57 1kyd h GLN 763 N 0.00 0.00 0.00 1.25 1.08 0.37 -1.85 115.11 115.96 1kyd h GLN 763 Ca -0.00 0.00 -0.25 0.00 -1.45 0.00 0.00 58.65 56.94 1kyd h GLN 763 Cb 0.18 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.57 1kyd h GLN 763 CO 0.01 0.00 -1.96 2.41 -0.95 0.00 0.00 178.83 178.34 1kyd n THR 764 N -3.33 0.96 0.22 -0.54 -1.04 -0.54 -4.64 114.28 105.36 1kyd n THR 764 Ca -0.03 -0.36 0.07 0.00 -2.04 0.00 0.00 64.05 61.69 1kyd n THR 764 Cb 0.09 -1.14 0.50 0.00 -1.82 0.00 0.00 70.33 67.96 1kyd n THR 764 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1kyd h ASN 765 N -0.04 0.00 -3.88 8.00 2.35 -1.21 -3.43 115.58 117.37 1kyd h ASN 765 Ca -0.38 0.00 -0.49 0.00 -0.55 0.00 0.00 56.30 54.88 1kyd h ASN 765 Cb 1.57 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 39.63 1kyd h ASN 765 CO -0.07 0.26 -0.81 -0.22 -1.65 0.00 0.00 177.43 174.94 1kyd s LEU 766 N -7.70 1.86 -0.15 1.61 2.96 -0.71 0.58 118.68 117.14 1kyd s LEU 766 Ca -0.02 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 1kyd s LEU 766 Cb 0.13 -0.75 0.02 0.00 0.50 0.00 0.00 46.19 46.09 1kyd s LEU 766 CO 0.67 0.11 -0.19 0.21 -1.32 0.00 0.00 176.35 175.83 1kyd s ASN 767 N 0.09 2.92 -0.09 3.68 3.84 0.31 -4.64 114.94 121.06 1kyd s ASN 767 Ca -0.03 -0.57 0.02 0.00 0.21 0.00 0.00 52.86 52.49 1kyd s ASN 767 Cb -0.10 -1.35 -0.02 0.00 -0.55 0.00 0.00 41.25 39.24 1kyd s ASN 767 CO 0.01 0.02 -0.15 -0.76 -2.79 0.00 0.00 177.10 173.44 1kyd s LEU 768 N 1.10 2.66 -0.04 3.21 1.43 -1.26 -0.71 118.68 125.07 1kyd s LEU 768 Ca -0.01 -0.30 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 1kyd s LEU 768 Cb -0.14 -1.57 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 1kyd s LEU 768 CO -0.07 0.24 -0.14 -1.10 0.23 0.00 0.00 176.35 175.51 1kyd s GLN 769 N -0.09 1.51 0.14 1.70 -0.21 -0.13 -4.97 119.66 117.61 1kyd s GLN 769 Ca -0.02 -0.50 -0.15 0.00 0.02 0.00 0.00 55.36 54.70 1kyd s GLN 769 Cb -0.14 -1.33 0.03 0.00 1.00 0.00 0.00 33.01 32.56 1kyd s GLN 769 CO 0.04 0.19 0.40 -0.08 -2.12 0.00 0.00 175.29 173.72 1kyd s THR 770 N 0.11 0.07 0.07 -0.19 -1.32 -1.26 0.36 115.64 113.48 1kyd s THR 770 Ca -0.04 -0.75 -0.05 0.00 -1.21 0.00 0.00 61.69 59.65 1kyd s THR 770 Cb -0.11 -1.34 -0.05 0.00 -1.51 0.00 0.00 72.50 69.50 1kyd s THR 770 CO 0.02 -0.30 0.30 -0.54 -2.21 0.00 0.00 174.62 171.89 1kyd s LYS 771 N -3.84 3.58 0.66 7.08 -0.14 -1.26 -5.06 119.74 120.76 1kyd s LYS 771 Ca 0.06 -0.14 -0.16 0.00 -1.36 0.00 0.00 55.97 54.37 1kyd s LYS 771 Cb 0.02 -2.98 0.00 0.00 -1.68 0.00 0.00 37.83 33.18 1kyd s LYS 771 CO -0.09 0.57 1.14 -2.14 -0.76 0.00 0.00 175.35 174.07 1kyd s PRO 772 N -2.24 2.72 0.19 -1.68 0.02 -1.26 -4.80 135.00 127.95 1kyd s PRO 772 Ca 0.34 1.51 0.05 0.00 0.02 0.00 0.00 61.00 62.92 1kyd s PRO 772 Cb -0.13 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 1kyd s PRO 772 CO 0.22 -1.33 0.19 0.14 -0.33 0.00 0.00 177.00 175.88 1kyd s VAL 773 N -2.17 4.68 0.02 3.83 -7.23 -1.26 -5.04 120.40 113.23 1kyd s VAL 773 Ca 0.70 -1.07 -0.32 0.00 -1.81 0.00 0.00 61.98 59.47 1kyd s VAL 773 Cb -0.23 -3.43 -0.11 0.00 0.56 0.00 0.00 36.38 33.17 1kyd s VAL 773 CO 0.40 -0.17 1.89 -0.67 -0.31 0.00 0.00 175.10 176.24 1kyd n ASP 774 N -0.63 3.83 0.02 4.85 -0.08 -1.26 -4.85 116.55 118.42 1kyd n ASP 774 Ca -0.08 0.95 0.07 0.00 -1.51 0.00 0.00 54.79 54.23 1kyd n ASP 774 Cb 0.55 -1.47 0.31 0.00 2.34 0.00 0.00 41.12 42.86 1kyd n ASP 774 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1kyd n PRO 775 N 6.60 0.03 -3.93 -0.67 -0.04 -1.26 -4.59 135.00 131.13 1kyd n PRO 775 Ca 0.20 0.30 -0.35 0.00 -0.04 0.00 0.00 63.50 63.61 1kyd n PRO 775 Cb 0.35 -1.56 -0.13 0.00 -0.04 0.00 0.00 33.50 32.13 1kyd n PRO 775 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1kyd s THR 776 N -3.05 3.98 -0.27 0.52 2.01 -1.26 0.04 115.64 117.61 1kyd s THR 776 Ca 0.06 -0.29 0.01 0.00 0.31 0.00 0.00 61.69 61.78 1kyd s THR 776 Cb 0.09 -2.82 0.07 0.00 0.01 0.00 0.00 72.50 69.85 1kyd s THR 776 CO 0.26 0.40 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.88 1kyd s VAL 777 N 1.29 1.60 0.71 3.82 1.01 -0.64 -4.96 120.40 123.23 1kyd s VAL 777 Ca 0.04 -1.48 -0.16 0.00 0.00 0.00 0.00 61.98 60.38 1kyd s VAL 777 Cb -0.15 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1kyd s VAL 777 CO 0.01 -0.28 0.90 0.47 0.00 0.00 0.00 175.10 176.21 1kyd n ASP 778 N 4.61 0.27 -4.77 3.32 8.00 -1.26 0.19 116.55 126.91 1kyd n ASP 778 Ca -0.08 0.67 -0.41 0.00 0.71 0.00 0.00 54.79 55.69 1kyd n ASP 778 Cb 0.43 -1.38 -0.01 0.00 -0.02 0.00 0.00 41.12 40.14 1kyd n ASP 778 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1kyd s GLY 779 N -1.57 2.91 0.00 0.44 0.00 -1.25 -1.66 107.32 106.20 1kyd s GLY 779 Ca 0.73 1.44 0.00 0.00 0.00 0.00 0.00 44.72 46.88 1kyd s GLY 779 CO 0.51 2.13 0.00 0.61 0.00 0.00 0.00 173.10 176.35 1kyd n GLY 780 N 0.74 0.52 4.03 0.20 0.00 0.90 -4.88 105.19 106.69 1kyd n GLY 780 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 1kyd n GLY 780 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kyd s ALA 781 N -2.50 4.62 -0.01 4.61 0.00 -0.66 -4.83 121.76 122.99 1kyd s ALA 781 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 51.96 49.98 1kyd s ALA 781 Cb 0.00 -1.54 0.02 0.00 0.00 0.00 0.00 23.12 21.60 1kyd s ALA 781 CO 0.00 -0.71 0.00 -1.14 0.00 0.00 0.00 175.76 173.91 1kyd s GLN 782 N -4.59 0.14 0.16 0.00 0.74 -1.26 -0.87 119.66 113.97 1kyd s GLN 782 Ca 0.60 0.05 0.08 0.00 0.05 0.00 0.00 55.36 56.14 1kyd s GLN 782 Cb -0.07 -0.26 -0.04 0.00 1.10 0.00 0.00 33.01 33.73 1kyd s GLN 782 CO 0.37 -0.07 -0.09 0.14 -0.55 0.00 0.00 175.29 175.10 1kyd s VAL 783 N 0.56 3.31 0.16 1.34 -7.23 -0.72 -4.94 120.40 112.88 1kyd s VAL 783 Ca -0.05 -1.51 0.10 0.00 -1.81 0.00 0.00 61.98 58.72 1kyd s VAL 783 Cb -0.08 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 1kyd s VAL 783 CO -0.01 -0.04 -0.24 -1.58 -0.31 0.00 0.00 175.10 172.92 1kyd s GLN 784 N -2.64 1.39 -0.05 4.82 0.74 -1.26 -0.51 119.66 122.14 1kyd s GLN 784 Ca 0.24 -1.40 -0.00 0.00 0.05 0.00 0.00 55.36 54.24 1kyd s GLN 784 Cb -0.10 -1.73 0.03 0.00 1.10 0.00 0.00 33.01 32.31 1kyd s GLN 784 CO 0.15 0.39 -0.01 -1.14 -0.55 0.00 0.00 175.29 174.13 1kyd s GLN 785 N -2.38 0.62 -0.23 1.67 0.74 -0.08 -4.86 119.66 115.14 1kyd s GLN 785 Ca 0.16 0.03 -0.10 0.00 0.05 0.00 0.00 55.36 55.51 1kyd s GLN 785 Cb -0.09 -0.84 -0.05 0.00 1.10 0.00 0.00 33.01 33.14 1kyd s GLN 785 CO 0.07 -0.20 0.13 0.08 -0.55 0.00 0.00 175.29 174.82 1kyd s VAL 786 N 1.45 5.15 -0.22 1.34 1.01 -1.26 -0.11 120.40 127.77 1kyd s VAL 786 Ca -0.03 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.01 1kyd s VAL 786 Cb -0.13 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 1kyd s VAL 786 CO -0.03 0.37 -0.04 -0.69 0.00 0.00 0.00 175.10 174.72 1kyd s VAL 787 N 0.93 3.48 -0.23 2.92 1.01 -0.03 -4.03 120.40 124.43 1kyd s VAL 787 Ca 0.06 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 1kyd s VAL 787 Cb -0.13 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1kyd s VAL 787 CO 0.03 0.42 0.60 0.20 0.00 0.00 0.00 175.10 176.36 1kyd s ASN 788 N 1.38 6.59 -0.13 3.32 0.01 0.16 -1.08 114.94 125.19 1kyd s ASN 788 Ca 0.05 0.72 -0.04 0.00 -0.71 0.00 0.00 52.86 52.88 1kyd s ASN 788 Cb -0.14 -2.33 -0.03 0.00 0.41 0.00 0.00 41.25 39.15 1kyd s ASN 788 CO -0.02 -0.31 -0.00 -0.63 -1.51 0.00 0.00 177.10 174.63 1kyd s ILE 789 N 2.21 4.23 -0.12 0.60 1.01 0.99 -0.96 121.20 129.16 1kyd s ILE 789 Ca 0.26 -0.25 -0.00 0.00 0.00 0.00 0.00 60.65 60.66 1kyd s ILE 789 Cb -0.16 -2.83 0.02 0.00 0.01 0.00 0.00 42.46 39.51 1kyd s ILE 789 CO 0.09 0.53 -0.09 -0.70 0.00 0.00 0.00 174.94 174.77 1kyd s GLU 790 N -0.14 1.71 -0.19 2.79 2.12 0.11 -1.08 118.70 124.02 1kyd s GLU 790 Ca 0.04 -0.33 -0.20 0.00 0.36 0.00 0.00 54.97 54.84 1kyd s GLU 790 Cb -0.13 -1.70 -0.03 0.00 0.26 0.00 0.00 34.13 32.54 1kyd s GLU 790 CO 0.02 -0.25 0.59 0.00 -0.54 0.00 0.00 175.26 175.09 1kyd h ILE 792 N 5.15 0.90 -4.03 0.00 1.08 -0.12 -1.25 117.51 119.24 1kyd h ILE 792 Ca -0.32 -2.18 -0.20 0.00 -0.39 0.00 0.00 64.86 61.76 1kyd h ILE 792 Cb 1.15 2.22 -0.09 0.00 -3.07 0.00 0.00 36.82 37.02 1kyd h ILE 792 CO 0.76 0.32 -0.22 -0.55 -0.69 0.00 0.00 178.15 177.77 1kyd s SER 793 N -6.87 0.50 0.47 1.72 0.15 -1.07 -2.19 113.70 106.42 1kyd s SER 793 Ca -0.29 -1.30 -0.23 0.00 0.70 0.00 0.00 55.95 54.83 1kyd s SER 793 Cb 0.06 0.61 -0.07 0.00 -1.71 0.00 0.00 66.02 64.90 1kyd s SER 793 CO 0.60 -1.19 1.26 1.51 1.20 0.00 0.00 173.24 176.61 1kyd s ASP 794 N -3.16 5.96 0.06 5.45 -4.77 -1.26 -4.77 116.67 114.19 1kyd s ASP 794 Ca 0.29 2.53 -0.04 0.00 -3.30 0.00 0.00 52.55 52.03 1kyd s ASP 794 Cb 0.00 -2.62 -0.02 0.00 -1.09 0.00 0.00 42.92 39.19 1kyd s ASP 794 CO 0.16 -1.08 0.07 0.72 0.70 0.00 0.00 175.17 175.74 1kyd s PHE 795 N -1.39 0.35 -0.07 2.11 -0.12 -1.26 -4.95 117.98 112.63 1kyd s PHE 795 Ca 0.64 -0.82 -0.00 0.00 -0.05 0.00 0.00 56.93 56.69 1kyd s PHE 795 Cb -0.35 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 41.76 1kyd s PHE 795 CO 0.42 -0.44 -0.07 2.41 -0.05 0.00 0.00 175.22 177.49 1kyd n THR 796 N 0.13 0.42 -0.99 -4.49 -1.04 -1.26 -4.52 114.28 102.53 1kyd n THR 796 Ca -0.15 -0.15 -0.29 0.00 -2.04 0.00 0.00 64.05 61.42 1kyd n THR 796 Cb 0.61 -0.95 0.18 0.00 -1.82 0.00 0.00 70.33 68.36 1kyd n THR 796 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1kyd s GLU 797 N -2.14 0.39 0.09 -2.82 0.41 -1.26 -4.99 118.70 108.37 1kyd s GLU 797 Ca -0.10 0.77 0.10 0.00 -0.41 0.00 0.00 54.97 55.33 1kyd s GLU 797 Cb 0.03 -1.71 -0.03 0.00 -1.78 0.00 0.00 34.13 30.63 1kyd s GLU 797 CO 0.16 -2.83 -0.26 0.00 -0.49 0.00 0.00 175.26 171.85 1kyd s ALA 798 N -2.80 2.23 0.79 5.21 0.00 -1.26 -4.95 121.76 120.97 1kyd s ALA 798 Ca 0.66 -1.34 -0.11 0.00 0.00 0.00 0.00 51.96 51.17 1kyd s ALA 798 Cb -0.20 -0.41 0.07 0.00 0.00 0.00 0.00 23.12 22.58 1kyd s ALA 798 CO 0.59 0.51 1.10 -2.14 0.00 0.00 0.00 175.76 175.82 1kyd s PRO 799 N -1.64 2.08 -0.09 0.00 0.02 -1.26 -4.72 135.00 129.40 1kyd s PRO 799 Ca 0.12 1.23 0.01 0.00 0.02 0.00 0.00 61.00 62.38 1kyd s PRO 799 Cb -0.10 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 1kyd s PRO 799 CO 0.04 -1.79 -0.10 0.08 -0.33 0.00 0.00 177.00 174.90 1kyd s VAL 800 N -2.85 3.37 -0.28 3.83 1.01 0.17 -1.14 120.40 124.51 1kyd s VAL 800 Ca 0.62 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 1kyd s VAL 800 Cb -0.18 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 1kyd s VAL 800 CO 0.56 0.56 0.11 -0.22 0.00 0.00 0.00 175.10 176.11 1kyd s LEU 801 N -0.34 3.77 -0.16 3.92 2.96 0.44 -0.74 118.68 128.53 1kyd s LEU 801 Ca 0.04 -0.37 -0.03 0.00 -0.22 0.00 0.00 54.13 53.55 1kyd s LEU 801 Cb -0.13 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.58 1kyd s LEU 801 CO 0.02 -0.11 -0.05 0.21 -1.32 0.00 0.00 176.35 175.11 1kyd s ASN 802 N 1.61 4.65 -0.13 3.68 3.84 -0.54 -1.10 114.94 126.96 1kyd s ASN 802 Ca 0.05 -0.19 0.02 0.00 0.21 0.00 0.00 52.86 52.96 1kyd s ASN 802 Cb -0.16 -1.76 0.01 0.00 -0.55 0.00 0.00 41.25 38.79 1kyd s ASN 802 CO 0.05 0.14 -0.21 -0.63 -2.79 0.00 0.00 177.10 173.66 1kyd s ILE 803 N 0.52 1.95 0.00 -5.21 1.09 0.19 0.07 121.20 119.81 1kyd s ILE 803 Ca -0.04 -0.92 0.06 0.00 -1.10 0.00 0.00 60.65 58.65 1kyd s ILE 803 Cb -0.14 -1.73 -0.02 0.00 -1.06 0.00 0.00 42.46 39.51 1kyd s ILE 803 CO 0.03 0.53 -0.17 -1.10 -0.10 0.00 0.00 174.94 174.12 1kyd s GLN 804 N 0.81 1.34 0.17 2.79 -0.21 -0.58 -0.49 119.66 123.50 1kyd s GLN 804 Ca -0.08 -0.68 -0.24 0.00 0.02 0.00 0.00 55.36 54.38 1kyd s GLN 804 Cb -0.16 -1.33 0.06 0.00 1.00 0.00 0.00 33.01 32.58 1kyd s GLN 804 CO -0.01 0.36 0.87 -0.59 -2.12 0.00 0.00 175.29 173.80 1kyd s PHE 805 N -0.51 -0.18 -0.06 0.91 -0.12 -0.70 0.22 117.98 117.54 1kyd s PHE 805 Ca 0.06 -0.15 0.00 0.00 -0.05 0.00 0.00 56.93 56.80 1kyd s PHE 805 Cb -0.07 0.65 -0.03 0.00 -0.63 0.00 0.00 43.02 42.93 1kyd s PHE 805 CO -0.00 -0.91 -0.04 1.03 -0.05 0.00 0.00 175.22 175.25 1kyd s ARG 806 N -3.46 2.82 -0.13 1.99 1.81 0.17 -0.60 118.95 121.55 1kyd s ARG 806 Ca 0.11 -0.51 -0.04 0.00 -1.72 0.00 0.00 55.73 53.56 1kyd s ARG 806 Cb -0.03 -2.66 0.07 0.00 -0.45 0.00 0.00 34.95 31.88 1kyd s ARG 806 CO 0.02 0.67 0.23 -0.47 -0.68 0.00 0.00 175.30 175.07 1kyd s TYR 807 N -0.87 -0.34 -1.54 -0.53 5.04 -0.76 -1.82 117.35 116.54 1kyd s TYR 807 Ca 0.14 0.72 -0.05 0.00 -2.44 0.00 0.00 57.07 55.44 1kyd s TYR 807 Cb -0.11 -0.16 0.01 0.00 0.35 0.00 0.00 41.96 42.05 1kyd s TYR 807 CO 0.03 -0.39 0.50 0.41 -1.34 0.00 0.00 175.55 174.76 1kyd n GLY 808 N 5.34 -0.52 2.38 8.97 0.00 -1.26 -1.54 105.19 118.56 1kyd n GLY 808 Ca -0.05 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1kyd n GLY 808 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyd n GLY 809 N -1.40 0.56 3.67 -0.02 0.00 -1.26 -5.03 105.19 101.72 1kyd n GLY 809 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 1kyd n GLY 809 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1kyd s THR 810 N -2.36 3.66 -0.10 2.61 -4.23 -0.59 -5.10 115.64 109.54 1kyd s THR 810 Ca 0.00 -1.63 -0.27 0.00 -1.18 0.00 0.00 61.69 58.61 1kyd s THR 810 Cb 0.00 -2.90 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 1kyd s THR 810 CO 0.00 -0.24 0.88 -0.36 -0.54 0.00 0.00 174.62 174.36 1kyd s PHE 811 N -2.01 3.52 -0.09 3.99 0.08 -1.26 -1.83 117.98 120.38 1kyd s PHE 811 Ca 0.29 1.43 0.04 0.00 0.12 0.00 0.00 56.93 58.81 1kyd s PHE 811 Cb -0.08 -3.04 -0.01 0.00 -0.57 0.00 0.00 43.02 39.33 1kyd s PHE 811 CO 0.20 -0.13 -0.23 -0.65 -0.10 0.00 0.00 175.22 174.31 1kyd s GLN 812 N 1.62 2.89 -0.05 0.44 -1.52 0.23 -4.98 119.66 118.29 1kyd s GLN 812 Ca 0.43 -0.86 -0.01 0.00 -1.95 0.00 0.00 55.36 52.98 1kyd s GLN 812 Cb -0.18 -2.29 0.03 0.00 -0.22 0.00 0.00 33.01 30.34 1kyd s GLN 812 CO 0.18 0.27 0.01 1.21 -0.25 0.00 0.00 175.29 176.71 1kyd s ASN 813 N 0.12 1.20 -0.02 5.90 2.47 -1.26 -1.73 114.94 121.62 1kyd s ASN 813 Ca -0.11 -0.04 0.04 0.00 0.42 0.00 0.00 52.86 53.17 1kyd s ASN 813 Cb -0.16 -0.33 -0.01 0.00 -1.45 0.00 0.00 41.25 39.30 1kyd s ASN 813 CO 0.06 -0.17 -0.15 -0.69 -3.72 0.00 0.00 177.10 172.43 1kyd s VAL 814 N 1.73 1.18 -0.06 -5.21 1.01 0.36 -4.99 120.40 114.42 1kyd s VAL 814 Ca 0.01 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1kyd s VAL 814 Cb -0.13 -0.99 0.03 0.00 0.00 0.00 0.00 36.38 35.29 1kyd s VAL 814 CO -0.04 0.34 -0.00 -0.55 0.00 0.00 0.00 175.10 174.85 1kyd s SER 815 N -0.25 1.22 0.01 3.32 0.15 -1.26 0.56 113.70 117.46 1kyd s SER 815 Ca 0.04 -0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1kyd s SER 815 Cb -0.07 -0.39 -0.01 0.00 -1.71 0.00 0.00 66.02 63.85 1kyd s SER 815 CO -0.00 -0.15 -0.01 0.54 1.20 0.00 0.00 173.24 174.81 1kyd s VAL 816 N 1.59 0.05 0.14 4.45 0.11 -0.25 -4.38 120.40 122.11 1kyd s VAL 816 Ca -0.01 -0.41 -0.30 0.00 -2.93 0.00 0.00 61.98 58.32 1kyd s VAL 816 Cb -0.13 -0.13 -0.07 0.00 -1.53 0.00 0.00 36.38 34.52 1kyd s VAL 816 CO -0.03 -0.23 1.18 -0.54 -3.33 0.00 0.00 175.10 172.15 1kyd s LYS 817 N -0.66 4.49 -0.09 1.54 1.02 0.17 -0.42 119.74 125.79 1kyd s LYS 817 Ca -0.07 1.80 -0.21 0.00 0.02 0.00 0.00 55.97 57.51 1kyd s LYS 817 Cb -0.05 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 1kyd s LYS 817 CO -0.00 -0.11 0.61 -0.51 -0.92 0.00 0.00 175.35 174.41 1kyd s LEU 818 N 0.18 4.30 -1.29 3.17 1.43 -0.29 -4.87 118.68 121.31 1kyd s LEU 818 Ca 0.54 1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 54.57 1kyd s LEU 818 Cb -0.31 -2.92 -0.06 0.00 0.03 0.00 0.00 46.19 42.93 1kyd s LEU 818 CO 0.34 -0.07 2.47 -0.81 0.23 0.00 0.00 176.35 178.51 1kyd n PRO 819 N 3.72 2.83 -3.65 1.29 -0.04 -1.26 -4.09 135.00 133.79 1kyd n PRO 819 Ca -0.04 -2.00 -0.39 0.00 -0.04 0.00 0.00 63.50 61.03 1kyd n PRO 819 Cb 0.51 -2.79 -0.12 0.00 -0.04 0.00 0.00 33.50 31.07 1kyd n PRO 819 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1kyd s ILE 820 N 3.03 4.45 0.24 0.52 1.01 -1.26 -4.88 121.20 124.31 1kyd s ILE 820 Ca 0.55 -0.68 0.10 0.00 0.00 0.00 0.00 60.65 60.63 1kyd s ILE 820 Cb 0.15 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.19 1kyd s ILE 820 CO -0.04 -0.07 -0.18 0.42 0.00 0.00 0.00 174.94 175.07 1kyd s THR 821 N 1.56 2.19 0.28 2.92 -4.23 -1.26 -4.77 115.64 112.32 1kyd s THR 821 Ca 0.03 -2.28 0.01 0.00 -1.18 0.00 0.00 61.69 58.26 1kyd s THR 821 Cb -0.18 -2.17 0.26 0.00 1.34 0.00 0.00 72.50 71.75 1kyd s THR 821 CO 0.06 -0.44 1.79 0.25 -0.54 0.00 0.00 174.62 175.74 1kyd h LEU 822 N 2.50 0.72 -1.56 4.79 5.85 -1.94 -1.48 115.31 124.18 1kyd h LEU 822 Ca -0.40 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1kyd h LEU 822 Cb 1.24 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1kyd h LEU 822 CO 0.59 0.33 0.00 -0.55 -0.34 0.00 0.00 178.44 178.47 1kyd h ASN 823 N 0.78 0.00 0.44 1.25 -1.07 -1.94 -2.48 115.58 112.55 1kyd h ASN 823 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.86 1kyd h ASN 823 Cb 0.63 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.88 1kyd h ASN 823 CO -0.33 0.00 0.00 0.11 0.07 0.00 0.00 177.43 177.28 1kyd h LYS 824 N 0.00 0.00 -0.85 4.14 1.79 -1.51 -2.71 116.57 117.43 1kyd h LYS 824 Ca 0.00 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.08 1kyd h LYS 824 Cb 0.16 0.00 -0.23 0.00 -1.58 0.00 0.00 32.23 30.57 1kyd h LYS 824 CO 0.00 0.00 0.46 1.19 -1.08 0.00 0.00 179.45 180.02 1kyd n PHE 825 N -2.48 2.66 -2.75 -1.35 3.01 -0.93 -4.75 117.46 110.86 1kyd n PHE 825 Ca 0.00 -1.63 -0.38 0.00 1.01 0.00 0.00 57.45 56.45 1kyd n PHE 825 Cb 0.15 -0.82 -0.06 0.00 -0.01 0.00 0.00 39.48 38.74 1kyd n PHE 825 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1kyd s PHE 826 N -3.20 3.80 -0.25 1.38 2.99 -1.02 -1.08 117.98 120.59 1kyd s PHE 826 Ca 0.55 1.83 -0.00 0.00 0.00 0.00 0.00 56.93 59.31 1kyd s PHE 826 Cb 0.46 -2.96 0.04 0.00 0.00 0.00 0.00 43.02 40.56 1kyd s PHE 826 CO 0.10 0.27 -0.08 -1.14 -0.00 0.00 0.00 175.22 174.37 1kyd s GLN 827 N -1.69 2.63 0.31 0.44 0.74 -0.03 -4.85 119.66 117.21 1kyd s GLN 827 Ca 0.46 -1.10 -0.29 0.00 0.05 0.00 0.00 55.36 54.48 1kyd s GLN 827 Cb -0.22 -2.94 -0.10 0.00 1.10 0.00 0.00 33.01 30.85 1kyd s GLN 827 CO 0.28 -0.46 1.24 -1.25 -0.55 0.00 0.00 175.29 174.55 1kyd s PRO 828 N 1.25 4.45 -0.26 1.67 0.04 -1.24 -0.83 135.00 140.07 1kyd s PRO 828 Ca -0.03 2.08 0.01 0.00 0.04 0.00 0.00 61.00 63.10 1kyd s PRO 828 Cb -0.18 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.32 1kyd s PRO 828 CO -0.05 -0.07 -0.01 0.95 0.04 0.00 0.00 177.00 177.86 1kyd s THR 829 N -1.07 1.50 0.35 1.26 -4.23 -1.01 -4.81 115.64 107.63 1kyd s THR 829 Ca 0.48 -1.40 -0.25 0.00 -1.18 0.00 0.00 61.69 59.33 1kyd s THR 829 Cb -0.37 -1.88 -0.09 0.00 1.34 0.00 0.00 72.50 71.49 1kyd s THR 829 CO 0.48 -0.28 1.02 -1.61 -0.54 0.00 0.00 174.62 173.69 1kyd s GLU 830 N 1.37 4.39 -0.02 3.99 0.41 -1.26 -4.59 118.70 122.99 1kyd s GLU 830 Ca -0.00 1.48 -0.29 0.00 -0.41 0.00 0.00 54.97 55.75 1kyd s GLU 830 Cb -0.19 -2.72 0.10 0.00 -1.78 0.00 0.00 34.13 29.54 1kyd s GLU 830 CO -0.10 0.07 0.84 0.00 -0.49 0.00 0.00 175.26 175.58 1kyd s MET 831 N -2.20 0.87 0.63 1.61 0.23 -1.26 -5.14 119.30 114.05 1kyd s MET 831 Ca 0.53 -0.13 -0.14 0.00 -1.03 0.00 0.00 55.69 54.92 1kyd s MET 831 Cb -0.22 0.41 -0.02 0.00 -1.53 0.00 0.00 34.83 33.47 1kyd s MET 831 CO 0.28 -0.34 1.07 0.00 -2.03 0.00 0.00 175.02 173.99 1kyd s ALA 832 N -2.43 2.67 0.29 3.16 0.00 -1.26 -4.82 121.76 119.37 1kyd s ALA 832 Ca 0.00 0.34 0.04 0.00 0.00 0.00 0.00 51.96 52.33 1kyd s ALA 832 Cb -0.01 -3.23 0.64 0.00 0.00 0.00 0.00 23.12 20.52 1kyd s ALA 832 CO -0.04 -1.01 1.81 0.66 0.00 0.00 0.00 175.76 177.19 1kyd h SER 833 N 0.05 0.86 -0.20 0.00 4.64 -1.94 -1.23 113.55 115.73 1kyd h SER 833 Ca -0.46 0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 60.84 1kyd h SER 833 Cb 1.22 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 1kyd h SER 833 CO 0.57 0.40 -0.16 0.06 -0.87 0.00 0.00 176.83 176.82 1kyd h GLN 834 N 0.89 0.61 -0.37 4.77 -0.00 -1.93 -0.70 115.11 118.38 1kyd h GLN 834 Ca 0.53 -0.20 -0.13 0.00 -0.00 0.00 0.00 58.65 58.84 1kyd h GLN 834 Cb 0.67 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.48 28.09 1kyd h GLN 834 CO -0.31 0.75 -0.29 -0.44 -0.00 0.00 0.00 178.83 178.54 1kyd h ASP 835 N 0.55 0.81 -0.16 0.06 3.32 -1.65 -1.98 116.42 117.37 1kyd h ASP 835 Ca 0.09 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.81 1kyd h ASP 835 Cb 0.59 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1kyd h ASP 835 CO 0.04 1.05 0.07 0.15 -1.72 0.00 0.00 179.24 178.83 1kyd h PHE 836 N 0.67 0.23 -0.24 4.55 3.57 -0.65 -2.06 116.94 123.01 1kyd h PHE 836 Ca 0.08 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 1kyd h PHE 836 Cb 0.82 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 1kyd h PHE 836 CO 0.04 0.27 -0.15 0.74 -2.23 0.00 0.00 178.31 176.99 1kyd h PHE 837 N 0.12 0.43 -0.26 0.41 -1.00 -1.07 0.88 116.94 116.45 1kyd h PHE 837 Ca 0.05 -0.06 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1kyd h PHE 837 Cb 0.13 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.56 1kyd h PHE 837 CO -0.02 0.54 0.17 0.37 -1.61 0.00 0.00 178.31 177.76 1kyd h GLN 838 N 0.37 0.34 -0.25 1.51 4.15 -1.15 -1.11 115.11 118.98 1kyd h GLN 838 Ca 0.07 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.32 1kyd h GLN 838 Cb 0.48 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.09 1kyd h GLN 838 CO 0.03 0.23 -0.44 0.00 -1.93 0.00 0.00 178.83 176.72 1kyd h ARG 839 N 0.35 0.63 -0.94 1.69 3.08 -0.97 -3.09 114.38 115.14 1kyd h ARG 839 Ca 0.10 -0.34 0.04 0.00 0.07 0.00 0.00 59.98 59.85 1kyd h ARG 839 Cb -0.04 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 1kyd h ARG 839 CO -0.02 0.95 0.61 2.35 -1.07 0.00 0.00 179.97 182.79 1kyd h TRP 840 N 0.51 1.13 -0.28 3.04 2.91 -0.28 -2.11 115.95 120.87 1kyd h TRP 840 Ca 0.03 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.08 1kyd h TRP 840 Cb 0.97 -0.38 0.00 0.00 -0.51 0.00 0.00 29.16 29.24 1kyd h TRP 840 CO 0.04 0.64 0.00 1.63 -1.03 0.00 0.00 178.44 179.72 1kyd n LYS 841 N -4.45 1.71 -0.03 2.65 5.02 -0.47 -3.56 118.16 119.02 1kyd n LYS 841 Ca 0.13 -1.09 0.13 0.00 -2.02 0.00 0.00 58.31 55.45 1kyd n LYS 841 Cb 0.12 -1.27 0.31 0.00 -0.02 0.00 0.00 35.03 34.18 1kyd n LYS 841 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1kyd n GLN 842 N 0.37 2.03 -2.58 1.97 6.02 -0.79 -4.89 117.38 119.50 1kyd n GLN 842 Ca 0.11 -1.50 -0.42 0.00 -0.01 0.00 0.00 57.00 55.18 1kyd n GLN 842 Cb 0.27 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 30.04 1kyd n GLN 842 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1kyd s LEU 843 N -1.88 4.30 -0.02 1.08 0.20 -1.23 -4.91 118.68 116.22 1kyd s LEU 843 Ca 0.34 1.71 -0.00 0.00 0.69 0.00 0.00 54.13 56.87 1kyd s LEU 843 Cb 0.20 -3.56 -0.01 0.00 -0.43 0.00 0.00 46.19 42.39 1kyd s LEU 843 CO 0.31 -0.45 -0.02 -1.54 -0.29 0.00 0.00 176.35 174.36 1kyd n SER 844 N 4.68 3.23 -4.63 3.68 3.41 -1.26 -4.99 113.62 117.73 1kyd n SER 844 Ca 0.09 -0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.27 1kyd n SER 844 Cb 0.48 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.37 1kyd n SER 844 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1kyd s ASN 845 N -4.34 6.34 0.57 4.04 3.84 -1.26 -4.89 114.94 119.24 1kyd s ASN 845 Ca -0.02 1.66 0.26 0.00 0.21 0.00 0.00 52.86 54.97 1kyd s ASN 845 Cb 0.01 -2.53 1.68 0.00 -0.55 0.00 0.00 41.25 39.86 1kyd s ASN 845 CO 0.04 -1.28 2.23 1.55 -2.79 0.00 0.00 177.10 176.84 1kyd h PRO 846 N 10.90 0.00 0.00 0.43 0.13 -1.95 -0.41 132.00 141.10 1kyd h PRO 846 Ca -0.34 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1kyd h PRO 846 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1kyd h PRO 846 CO 1.00 0.00 -0.00 1.96 -0.23 0.00 0.00 178.00 180.73 1kyd h GLN 847 N 0.00 0.00 -0.00 0.86 1.08 -2.00 -2.28 115.11 112.77 1kyd h GLN 847 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1kyd h GLN 847 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1kyd h GLN 847 CO 0.00 0.00 -0.06 1.04 -0.95 0.00 0.00 178.83 178.86 1kyd n GLN 848 N -3.09 0.43 -4.08 1.46 6.02 -0.16 -4.40 117.38 113.56 1kyd n GLN 848 Ca -0.01 -0.07 -0.35 0.00 -0.01 0.00 0.00 57.00 56.56 1kyd n GLN 848 Cb 0.22 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.86 1kyd n GLN 848 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1kyd s GLU 849 N -2.62 3.59 -0.11 -1.09 2.12 -0.86 -2.53 118.70 117.20 1kyd s GLU 849 Ca 0.26 -0.53 0.00 0.00 0.36 0.00 0.00 54.97 55.06 1kyd s GLU 849 Cb 0.20 -3.06 0.02 0.00 0.26 0.00 0.00 34.13 31.55 1kyd s GLU 849 CO 0.49 -0.00 -0.10 0.08 -0.54 0.00 0.00 175.26 175.18 1kyd s VAL 850 N 1.02 1.20 0.07 3.70 1.01 -0.07 -4.97 120.40 122.36 1kyd s VAL 850 Ca 0.02 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.63 1kyd s VAL 850 Cb -0.14 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1kyd s VAL 850 CO 0.01 0.39 -0.12 -1.10 0.00 0.00 0.00 175.10 174.29 1kyd s GLN 851 N 1.41 2.17 -0.10 2.72 -0.21 -1.26 -0.50 119.66 123.89 1kyd s GLN 851 Ca 0.00 -0.96 -0.04 0.00 0.02 0.00 0.00 55.36 54.38 1kyd s GLN 851 Cb -0.13 -2.30 0.05 0.00 1.00 0.00 0.00 33.01 31.63 1kyd s GLN 851 CO -0.06 0.53 0.22 1.21 -2.12 0.00 0.00 175.29 175.07 1kyd s ASN 852 N -1.84 0.20 -0.27 5.90 2.47 -0.17 -5.00 114.94 116.24 1kyd s ASN 852 Ca 0.18 0.48 -0.03 0.00 0.42 0.00 0.00 52.86 53.91 1kyd s ASN 852 Cb -0.11 0.45 0.02 0.00 -1.45 0.00 0.00 41.25 40.16 1kyd s ASN 852 CO 0.10 -0.21 -0.01 -0.63 -3.72 0.00 0.00 177.10 172.63 1kyd s ILE 853 N 1.89 3.27 0.09 -5.21 1.01 -1.26 -0.86 121.20 120.13 1kyd s ILE 853 Ca -0.03 -0.91 -0.02 0.00 0.00 0.00 0.00 60.65 59.70 1kyd s ILE 853 Cb -0.11 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 1kyd s ILE 853 CO -0.08 0.15 0.03 0.72 0.00 0.00 0.00 174.94 175.77 1kyd s PHE 854 N 1.39 0.62 0.11 3.97 -0.12 -0.65 -4.98 117.98 118.33 1kyd s PHE 854 Ca 0.01 -1.09 -0.30 0.00 -0.05 0.00 0.00 56.93 55.50 1kyd s PHE 854 Cb -0.17 -0.39 -0.06 0.00 -0.63 0.00 0.00 43.02 41.77 1kyd s PHE 854 CO -0.02 -0.46 1.05 0.15 -0.05 0.00 0.00 175.22 175.90 1kyd s LYS 855 N -3.97 4.59 0.23 1.99 1.02 -1.26 -1.07 119.74 121.28 1kyd s LYS 855 Ca 0.14 1.59 -0.32 0.00 0.02 0.00 0.00 55.97 57.41 1kyd s LYS 855 Cb 0.07 -3.35 -0.12 0.00 -0.52 0.00 0.00 37.83 33.91 1kyd s LYS 855 CO -0.05 0.04 1.61 0.00 -0.92 0.00 0.00 175.35 176.03 1kyd n ALA 856 N 3.03 2.24 0.95 5.17 0.00 0.58 -4.85 120.51 127.63 1kyd n ALA 856 Ca 0.04 0.40 0.11 0.00 0.00 0.00 0.00 53.44 53.99 1kyd n ALA 856 Cb 0.48 -2.44 -0.00 0.00 0.00 0.00 0.00 19.45 17.49 1kyd n ALA 856 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1kyd n LYS 857 N 3.00 1.30 -3.91 0.00 5.02 0.08 -4.96 118.16 118.69 1kyd n LYS 857 Ca 0.13 -0.98 -0.09 0.00 -2.02 0.00 0.00 58.31 55.36 1kyd n LYS 857 Cb 0.34 -1.44 -0.08 0.00 -0.02 0.00 0.00 35.03 33.82 1kyd n LYS 857 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1kyd s HIS 858 N -2.38 0.20 0.26 2.13 3.76 -1.26 -5.04 115.29 112.97 1kyd s HIS 858 Ca 0.18 -0.59 -0.28 0.00 -0.15 0.00 0.00 55.06 54.22 1kyd s HIS 858 Cb 0.17 -0.13 -0.15 0.00 1.11 0.00 0.00 32.58 33.59 1kyd s HIS 858 CO 0.54 -0.45 0.92 -2.30 -0.85 0.00 0.00 174.74 172.60 1kyd n PRO 859 N 0.30 1.07 -1.99 8.40 -0.02 -1.26 -4.81 135.00 136.69 1kyd n PRO 859 Ca -0.17 0.38 -0.41 0.00 -2.02 0.00 0.00 63.50 61.28 1kyd n PRO 859 Cb 0.61 -1.68 -0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1kyd n PRO 859 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1kyd n MET 860 N 0.85 3.96 -2.82 -0.52 2.81 -1.26 -4.96 117.12 115.19 1kyd n MET 860 Ca 0.12 -3.23 -0.42 0.00 -1.81 0.00 0.00 57.70 52.36 1kyd n MET 860 Cb 0.30 -2.82 -0.04 0.00 -0.71 0.00 0.00 33.22 29.95 1kyd n MET 860 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1kyd s ASP 861 N 1.05 6.92 0.16 7.83 -1.08 -1.26 -4.99 116.67 125.31 1kyd s ASP 861 Ca 0.50 1.15 -0.23 0.00 -0.52 0.00 0.00 52.55 53.45 1kyd s ASP 861 Cb 0.15 -2.47 0.06 0.00 -1.46 0.00 0.00 42.92 39.19 1kyd s ASP 861 CO -0.05 -0.56 1.60 0.74 0.52 0.00 0.00 175.17 177.41 1kyd h THR 862 N 5.43 0.24 -0.63 1.71 2.02 -1.99 0.31 112.91 120.00 1kyd h THR 862 Ca -0.22 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 1kyd h THR 862 Cb 1.08 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1kyd h THR 862 CO 0.91 0.00 0.12 -0.33 0.37 0.00 0.00 175.52 176.58 1kyd h GLU 863 N -0.26 1.03 -0.68 6.66 4.39 -2.00 -1.23 114.58 122.49 1kyd h GLU 863 Ca 0.17 -0.27 -0.07 0.00 0.34 0.00 0.00 59.36 59.53 1kyd h GLU 863 Cb 0.54 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 1kyd h GLU 863 CO -0.53 0.95 0.14 0.82 -1.16 0.00 0.00 179.01 179.23 1kyd h ILE 864 N 0.94 1.26 -0.21 3.13 2.04 -1.92 -1.41 117.51 121.34 1kyd h ILE 864 Ca 0.19 -1.00 0.03 0.00 1.00 0.00 0.00 64.86 65.08 1kyd h ILE 864 Cb 0.41 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1kyd h ILE 864 CO 0.01 0.38 0.05 0.74 0.00 0.00 0.00 178.15 179.32 1kyd h THR 865 N 1.04 0.91 -0.54 -0.27 2.02 -0.55 0.35 112.91 115.87 1kyd h THR 865 Ca 0.21 -0.05 0.06 0.00 0.77 0.00 0.00 66.41 67.40 1kyd h THR 865 Cb 0.40 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.53 1kyd h THR 865 CO 0.01 0.02 0.25 0.11 0.37 0.00 0.00 175.52 176.28 1kyd h LYS 866 N 0.13 0.47 0.00 6.66 1.57 -0.88 -1.44 116.57 123.08 1kyd h LYS 866 Ca 0.09 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1kyd h LYS 866 Cb 0.08 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1kyd h LYS 866 CO -0.12 0.31 -0.26 0.00 -0.57 0.00 0.00 179.45 178.81 1kyd h ALA 867 N 1.31 1.44 -0.10 3.86 0.00 -0.63 -2.00 119.26 123.14 1kyd h ALA 867 Ca 0.24 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1kyd h ALA 867 Cb 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1kyd h ALA 867 CO -0.19 0.32 -0.34 0.87 0.00 0.00 0.00 179.25 179.91 1kyd h LYS 868 N 0.00 0.41 -0.54 0.00 1.57 -0.02 -1.17 116.57 116.81 1kyd h LYS 868 Ca -0.00 -0.31 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 1kyd h LYS 868 Cb 0.50 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1kyd h LYS 868 CO 0.03 0.93 0.26 0.82 -0.57 0.00 0.00 179.45 180.93 1kyd h ILE 869 N -0.04 1.20 -0.21 1.86 2.04 -1.11 0.35 117.51 121.60 1kyd h ILE 869 Ca -0.02 -0.56 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 1kyd h ILE 869 Cb 0.98 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1kyd h ILE 869 CO 0.07 0.22 0.08 0.40 0.00 0.00 0.00 178.15 178.92 1kyd h ILE 870 N 0.73 1.18 -0.10 -0.67 2.04 -1.41 -2.21 117.51 117.05 1kyd h ILE 870 Ca 0.19 -0.55 -0.05 0.00 1.00 0.00 0.00 64.86 65.45 1kyd h ILE 870 Cb 0.11 1.14 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1kyd h ILE 870 CO -0.02 0.18 -0.16 1.23 0.00 0.00 0.00 178.15 179.38 1kyd h GLY 871 N 0.18 0.18 1.56 5.37 0.00 -1.01 -1.80 103.07 107.56 1kyd h GLY 871 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1kyd h GLY 871 CO -0.00 0.10 0.28 -2.75 0.00 0.00 0.00 176.54 174.16 1kyd h PHE 872 N 0.16 0.56 0.00 5.60 3.57 0.30 -3.41 116.94 123.72 1kyd h PHE 872 Ca 0.03 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1kyd h PHE 872 Cb 0.38 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.93 1kyd h PHE 872 CO 0.00 0.36 0.00 0.41 -2.23 0.00 0.00 178.31 176.86 1kyd n GLY 873 N -1.43 2.45 3.82 2.40 0.00 -0.68 -4.56 105.19 107.19 1kyd n GLY 873 Ca 0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 1kyd n GLY 873 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1kyd s SER 874 N -0.20 3.60 0.45 1.61 1.04 -1.25 -3.73 113.70 115.21 1kyd s SER 874 Ca 0.00 0.82 -0.21 0.00 0.48 0.00 0.00 55.95 57.03 1kyd s SER 874 Cb 0.00 -1.29 -0.09 0.00 0.10 0.00 0.00 66.02 64.74 1kyd s SER 874 CO 0.00 -2.48 1.01 0.00 0.98 0.00 0.00 173.24 172.75 1kyd s ALA 875 N -3.42 2.97 -0.33 5.32 0.00 0.22 -4.55 121.76 121.98 1kyd s ALA 875 Ca 0.65 0.55 -0.12 0.00 0.00 0.00 0.00 51.96 53.04 1kyd s ALA 875 Cb -0.12 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 1kyd s ALA 875 CO 0.52 -0.13 0.21 -1.17 0.00 0.00 0.00 175.76 175.19 1kyd s LEU 876 N -3.22 4.36 -0.36 0.00 2.96 -1.26 -2.72 118.68 118.45 1kyd s LEU 876 Ca 0.64 -0.42 -0.05 0.00 -0.22 0.00 0.00 54.13 54.08 1kyd s LEU 876 Cb -0.15 -2.10 0.06 0.00 0.50 0.00 0.00 46.19 44.51 1kyd s LEU 876 CO 0.19 -0.21 0.12 -0.76 -1.32 0.00 0.00 176.35 174.37 1kyd s LEU 877 N 1.69 4.55 0.54 -0.68 1.43 0.12 -5.01 118.68 121.33 1kyd s LEU 877 Ca 0.06 -1.44 -0.01 0.00 -1.03 0.00 0.00 54.13 51.71 1kyd s LEU 877 Cb -0.17 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.23 1kyd s LEU 877 CO 0.09 -0.39 0.78 -1.61 0.23 0.00 0.00 176.35 175.45 1kyd s GLU 878 N 1.31 2.70 -0.04 1.70 0.41 -1.26 -3.70 118.70 119.82 1kyd s GLU 878 Ca 0.00 -0.56 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 1kyd s GLU 878 Cb -0.21 -2.45 0.00 0.00 -1.78 0.00 0.00 34.13 29.69 1kyd s GLU 878 CO 0.00 -0.63 0.00 0.39 -0.49 0.00 0.00 175.26 174.53 1kyd n GLU 879 N -2.35 -0.28 -0.02 1.61 1.02 -1.26 -4.89 120.64 114.47 1kyd n GLU 879 Ca 0.06 0.14 -0.04 0.00 -0.02 0.00 0.00 57.16 57.29 1kyd n GLU 879 Cb 0.59 -3.42 -0.01 0.00 -0.02 0.00 0.00 31.44 28.58 1kyd n GLU 879 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1kyd n VAL 880 N -2.86 1.31 -2.32 2.62 0.31 -1.26 -4.55 118.33 111.57 1kyd n VAL 880 Ca -0.00 0.27 -0.42 0.00 -0.01 0.00 0.00 64.34 64.17 1kyd n VAL 880 Cb 0.08 -1.95 -0.03 0.00 -0.91 0.00 0.00 33.84 31.03 1kyd n VAL 880 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1kyd s ASP 881 N -5.88 6.94 0.49 4.52 -1.08 -1.26 -4.89 116.67 115.50 1kyd s ASP 881 Ca -0.14 2.01 0.23 0.00 -0.52 0.00 0.00 52.55 54.12 1kyd s ASP 881 Cb 0.02 -2.56 1.28 0.00 -1.46 0.00 0.00 42.92 40.19 1kyd s ASP 881 CO 0.21 -0.65 1.94 -0.65 0.52 0.00 0.00 175.17 176.54 1kyd h PRO 882 N 7.57 0.16 -6.51 4.34 0.11 -2.00 -3.35 132.00 132.32 1kyd h PRO 882 Ca -0.37 -0.01 -0.57 0.00 0.11 0.00 0.00 66.00 65.16 1kyd h PRO 882 Cb 1.18 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.18 1kyd h PRO 882 CO 0.89 0.11 0.88 1.21 -0.21 0.00 0.00 178.00 180.87 1kyd s ASN 883 N -5.97 6.76 0.15 -2.05 3.84 -1.26 -4.91 114.94 111.51 1kyd s ASN 883 Ca -0.06 0.72 0.20 0.00 0.21 0.00 0.00 52.86 53.92 1kyd s ASN 883 Cb 0.21 -2.54 0.83 0.00 -0.55 0.00 0.00 41.25 39.19 1kyd s ASN 883 CO 0.75 -1.08 1.60 -0.81 -2.79 0.00 0.00 177.10 174.78 1kyd n PRO 884 N 7.38 0.11 0.03 0.43 -0.04 -1.26 -2.42 135.00 139.24 1kyd n PRO 884 Ca 0.12 0.36 0.13 0.00 -0.04 0.00 0.00 63.50 64.07 1kyd n PRO 884 Cb 0.48 -1.72 0.45 0.00 -0.04 0.00 0.00 33.50 32.66 1kyd n PRO 884 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1kyd n ALA 885 N -1.66 2.61 -1.95 0.55 0.00 -1.26 -4.84 120.51 113.95 1kyd n ALA 885 Ca 0.03 -0.14 -0.25 0.00 0.00 0.00 0.00 53.44 53.07 1kyd n ALA 885 Cb 0.20 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.34 1kyd n ALA 885 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1kyd s ASN 886 N -3.52 4.97 0.00 0.00 0.01 -1.02 -4.70 114.94 110.68 1kyd s ASN 886 Ca 0.12 0.41 0.06 0.00 -0.71 0.00 0.00 52.86 52.73 1kyd s ASN 886 Cb 0.16 -1.13 -0.02 0.00 0.41 0.00 0.00 41.25 40.67 1kyd s ASN 886 CO 0.60 -1.47 -0.17 -0.36 -1.51 0.00 0.00 177.10 174.19 1kyd s PHE 887 N -3.14 1.54 -0.02 2.20 0.40 -0.24 -4.97 117.98 113.76 1kyd s PHE 887 Ca 0.59 -0.31 0.04 0.00 -0.60 0.00 0.00 56.93 56.65 1kyd s PHE 887 Cb -0.11 -0.97 -0.01 0.00 0.51 0.00 0.00 43.02 42.45 1kyd s PHE 887 CO 0.44 0.00 -0.14 0.08 0.70 0.00 0.00 175.22 176.30 1kyd s VAL 888 N -0.53 1.16 0.10 -0.44 1.01 -1.24 -0.23 120.40 120.22 1kyd s VAL 888 Ca 0.06 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.47 1kyd s VAL 888 Cb -0.07 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1kyd s VAL 888 CO 0.00 0.33 -0.10 -0.83 0.00 0.00 0.00 175.10 174.50 1kyd s GLY 889 N -0.20 0.86 -0.17 4.51 0.00 -0.15 0.15 107.32 112.33 1kyd s GLY 889 Ca 0.03 -1.20 -0.16 0.00 0.00 0.00 0.00 44.72 43.38 1kyd s GLY 889 CO 0.00 -1.27 0.47 0.00 0.00 0.00 0.00 173.10 172.30 1kyd s ALA 890 N -2.44 -1.16 0.01 3.20 0.00 -1.10 -0.93 121.76 119.34 1kyd s ALA 890 Ca 0.06 1.32 -0.29 0.00 0.00 0.00 0.00 51.96 53.04 1kyd s ALA 890 Cb -0.03 -0.76 0.11 0.00 0.00 0.00 0.00 23.12 22.44 1kyd s ALA 890 CO 0.00 -0.22 1.25 0.20 0.00 0.00 0.00 175.76 176.99 1kyd s GLY 891 N 0.22 -0.29 -0.10 0.00 0.00 -0.17 -0.61 107.32 106.37 1kyd s GLY 891 Ca -0.00 0.41 0.03 0.00 0.00 0.00 0.00 44.72 45.16 1kyd s GLY 891 CO 0.01 1.77 -0.19 -0.42 0.00 0.00 0.00 173.10 174.26 1kyd s ILE 892 N -2.34 2.49 -0.18 0.90 1.01 -0.01 0.01 121.20 123.08 1kyd s ILE 892 Ca 0.19 -0.88 -0.21 0.00 0.00 0.00 0.00 60.65 59.75 1kyd s ILE 892 Cb 0.03 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 1kyd s ILE 892 CO -0.02 0.55 0.65 -0.63 0.00 0.00 0.00 174.94 175.49 1kyd s ILE 893 N 0.21 5.02 -0.21 2.92 -1.09 0.13 -0.85 121.20 127.32 1kyd s ILE 893 Ca -0.12 1.24 -0.09 0.00 -2.23 0.00 0.00 60.65 59.45 1kyd s ILE 893 Cb -0.16 -3.97 -0.04 0.00 -1.58 0.00 0.00 42.46 36.71 1kyd s ILE 893 CO 0.07 0.13 0.11 -1.00 -1.23 0.00 0.00 174.94 173.02 1kyd s HIS 894 N 1.74 3.29 0.05 3.97 3.76 -0.24 -0.91 115.29 126.94 1kyd s HIS 894 Ca 0.30 0.13 -0.01 0.00 -0.15 0.00 0.00 55.06 55.33 1kyd s HIS 894 Cb -0.16 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.31 1kyd s HIS 894 CO 0.11 0.10 -0.02 0.95 -0.85 0.00 0.00 174.74 175.03 1kyd s THR 895 N 0.74 0.21 0.22 1.30 -4.23 -1.02 -4.18 115.64 108.69 1kyd s THR 895 Ca 0.06 -1.79 -0.07 0.00 -1.18 0.00 0.00 61.69 58.70 1kyd s THR 895 Cb -0.13 -1.53 0.17 0.00 1.34 0.00 0.00 72.50 72.35 1kyd s THR 895 CO 0.02 -0.97 1.76 0.50 -0.54 0.00 0.00 174.62 175.38 1kyd h LYS 896 N 3.13 0.48 -0.00 3.99 3.64 -1.11 -3.13 116.57 123.58 1kyd h LYS 896 Ca -0.34 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1kyd h LYS 896 Cb 1.14 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1kyd h LYS 896 CO 0.65 0.32 -0.65 0.25 -2.27 0.00 0.00 179.45 177.76 1kyd n THR 897 N -4.94 0.00 -3.59 1.00 -2.24 -0.93 -4.97 114.28 98.61 1kyd n THR 897 Ca 0.11 -0.04 -0.13 0.00 -2.27 0.00 0.00 64.05 61.72 1kyd n THR 897 Cb 0.30 0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 69.08 1kyd n THR 897 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1kyd s THR 898 N -2.90 0.00 -0.22 4.28 -4.23 -1.18 -5.11 115.64 106.28 1kyd s THR 898 Ca 0.12 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.59 1kyd s THR 898 Cb 0.17 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 73.00 1kyd s THR 898 CO 0.73 0.00 -0.02 -1.10 -0.54 0.00 0.00 174.62 173.68 1kyd s GLN 899 N -0.39 3.46 -0.24 3.99 -1.52 -1.26 -2.42 119.66 121.28 1kyd s GLN 899 Ca -0.03 -0.59 -0.06 0.00 -1.95 0.00 0.00 55.36 52.74 1kyd s GLN 899 Cb -0.03 -3.04 -0.02 0.00 -0.22 0.00 0.00 33.01 29.70 1kyd s GLN 899 CO 0.02 -0.13 0.03 0.42 -0.25 0.00 0.00 175.29 175.37 1kyd s ILE 900 N 1.34 3.96 0.05 1.08 1.09 -0.09 -4.94 121.20 123.69 1kyd s ILE 900 Ca 0.04 -0.29 -0.30 0.00 -1.10 0.00 0.00 60.65 59.00 1kyd s ILE 900 Cb -0.14 -2.83 -0.04 0.00 -1.06 0.00 0.00 42.46 38.38 1kyd s ILE 900 CO -0.01 0.38 0.96 -0.83 -0.10 0.00 0.00 174.94 175.34 1kyd s GLY 901 N 1.52 2.95 -0.03 6.18 0.00 -1.26 0.21 107.32 116.89 1kyd s GLY 901 Ca 0.06 0.55 0.03 0.00 0.00 0.00 0.00 44.72 45.36 1kyd s GLY 901 CO 0.01 1.56 -0.11 0.00 0.00 0.00 0.00 173.10 174.56 1kyd s LEU 903 N 0.08 2.15 -0.01 0.00 1.43 0.59 -1.00 118.68 121.92 1kyd s LEU 903 Ca -0.02 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 52.52 1kyd s LEU 903 Cb -0.09 -0.62 0.02 0.00 0.03 0.00 0.00 46.19 45.53 1kyd s LEU 903 CO 0.01 0.05 0.26 -1.48 0.23 0.00 0.00 176.35 175.42 1kyd s LEU 904 N -1.05 1.06 -0.04 1.79 0.05 -0.11 -1.16 118.68 119.23 1kyd s LEU 904 Ca 0.02 0.00 0.01 0.00 0.05 0.00 0.00 54.13 54.21 1kyd s LEU 904 Cb -0.08 1.09 0.02 0.00 -2.05 0.00 0.00 46.19 45.18 1kyd s LEU 904 CO 0.01 -0.42 -0.05 -0.60 -0.55 0.00 0.00 176.35 174.74 1kyd s ARG 905 N -1.34 0.84 -0.17 1.48 3.52 -0.65 -0.97 118.95 121.67 1kyd s ARG 905 Ca -0.14 -0.11 0.01 0.00 -0.13 0.00 0.00 55.73 55.35 1kyd s ARG 905 Cb -0.06 -0.83 0.02 0.00 -1.56 0.00 0.00 34.95 32.52 1kyd s ARG 905 CO 0.03 -0.07 -0.16 -1.17 -0.81 0.00 0.00 175.30 173.12 1kyd s LEU 906 N 0.87 1.95 -0.32 -0.88 2.96 0.68 -0.88 118.68 123.07 1kyd s LEU 906 Ca -0.12 -0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 53.17 1kyd s LEU 906 Cb -0.14 -1.31 0.06 0.00 0.50 0.00 0.00 46.19 45.30 1kyd s LEU 906 CO 0.00 -0.04 0.03 -1.61 -1.32 0.00 0.00 176.35 173.41 1kyd s GLU 907 N 1.39 2.28 0.35 1.98 2.02 0.54 -1.07 118.70 126.19 1kyd s GLU 907 Ca 0.04 -1.41 -0.20 0.00 0.02 0.00 0.00 54.97 53.43 1kyd s GLU 907 Cb -0.13 -3.24 -0.10 0.00 0.10 0.00 0.00 34.13 30.76 1kyd s GLU 907 CO -0.11 -0.72 0.85 -2.14 0.02 0.00 0.00 175.26 173.16 1kyd s PRO 908 N 1.20 4.21 -0.45 0.39 0.02 -1.26 -0.45 135.00 138.67 1kyd s PRO 908 Ca -0.02 0.97 0.03 0.00 0.02 0.00 0.00 61.00 62.00 1kyd s PRO 908 Cb -0.20 -2.45 0.13 0.00 0.02 0.00 0.00 34.50 31.99 1kyd s PRO 908 CO -0.02 0.14 0.22 1.21 -0.33 0.00 0.00 177.00 178.21 1kyd s ASN 909 N -2.05 3.96 0.28 2.53 3.84 0.22 -4.95 114.94 118.77 1kyd s ASN 909 Ca 0.55 -2.63 -0.01 0.00 0.21 0.00 0.00 52.86 50.98 1kyd s ASN 909 Cb -0.12 -1.24 0.46 0.00 -0.55 0.00 0.00 41.25 39.80 1kyd s ASN 909 CO 0.17 -0.28 1.90 -0.07 -2.79 0.00 0.00 177.10 176.04 1kyd h LEU 910 N 6.84 0.98 -0.18 3.21 4.07 -1.96 0.10 115.31 128.37 1kyd h LEU 910 Ca -0.04 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.89 1kyd h LEU 910 Cb 0.93 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.46 1kyd h LEU 910 CO 0.55 0.64 -0.02 0.06 -1.08 0.00 0.00 178.44 178.58 1kyd h GLN 911 N 1.12 0.33 -0.00 1.13 -0.00 -1.95 -3.05 115.11 112.68 1kyd h GLN 911 Ca 0.41 -0.11 0.00 0.00 -0.00 0.00 0.00 58.65 58.94 1kyd h GLN 911 Cb 0.16 -0.02 0.00 0.00 -0.00 0.00 0.00 27.48 27.61 1kyd h GLN 911 CO -0.15 0.56 -0.03 0.00 -0.00 0.00 0.00 178.83 179.21 1kyd n ALA 912 N -2.34 2.47 -3.33 0.06 0.00 -1.12 -4.91 120.51 111.35 1kyd n ALA 912 Ca -0.05 -0.14 -0.18 0.00 0.00 0.00 0.00 53.44 53.07 1kyd n ALA 912 Cb 0.24 -1.45 0.07 0.00 0.00 0.00 0.00 19.45 18.31 1kyd n ALA 912 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1kyd n GLN 913 N -1.39 -6.21 -4.21 0.00 1.13 -0.07 -4.91 117.38 101.72 1kyd n GLN 913 Ca 0.10 0.69 -0.12 0.00 -1.94 0.00 0.00 57.00 55.72 1kyd n GLN 913 Cb 0.30 -5.27 -0.10 0.00 0.11 0.00 0.00 30.24 25.28 1kyd n GLN 913 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1kyd s MET 914 N -5.78 1.04 0.04 -1.09 -1.94 -0.65 -0.31 119.30 110.62 1kyd s MET 914 Ca 0.33 -1.50 0.04 0.00 -1.71 0.00 0.00 55.69 52.85 1kyd s MET 914 Cb -0.15 -0.08 -0.02 0.00 2.01 0.00 0.00 34.83 36.59 1kyd s MET 914 CO 0.60 -0.18 -0.11 0.71 -0.01 0.00 0.00 175.02 176.03 1kyd s TYR 915 N -3.80 0.97 -0.24 -0.03 1.51 -0.23 0.71 117.35 116.24 1kyd s TYR 915 Ca 0.24 -0.37 -0.01 0.00 -1.01 0.00 0.00 57.07 55.91 1kyd s TYR 915 Cb 0.07 -0.57 0.03 0.00 -0.11 0.00 0.00 41.96 41.37 1kyd s TYR 915 CO 0.03 -0.00 -0.09 0.50 -1.11 0.00 0.00 175.55 174.88 1kyd s ARG 916 N -1.22 2.82 -0.12 -0.62 3.52 0.41 -1.63 118.95 122.12 1kyd s ARG 916 Ca -0.02 -0.98 0.01 0.00 -0.13 0.00 0.00 55.73 54.62 1kyd s ARG 916 Cb -0.08 -2.92 -0.01 0.00 -1.56 0.00 0.00 34.95 30.38 1kyd s ARG 916 CO 0.01 -0.38 -0.16 -1.17 -0.81 0.00 0.00 175.30 172.79 1kyd s LEU 917 N 1.30 2.54 -0.12 -0.88 2.96 -0.04 -0.34 118.68 124.10 1kyd s LEU 917 Ca 0.00 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1kyd s LEU 917 Cb -0.16 -1.55 0.02 0.00 0.50 0.00 0.00 46.19 44.99 1kyd s LEU 917 CO -0.06 0.18 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.11 1kyd s THR 918 N 0.27 1.54 -0.14 3.68 2.01 -0.06 -1.00 115.64 121.95 1kyd s THR 918 Ca -0.12 -0.65 -0.03 0.00 0.31 0.00 0.00 61.69 61.20 1kyd s THR 918 Cb -0.16 -1.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 1kyd s THR 918 CO 0.06 0.45 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.66 1kyd s LEU 919 N 1.14 3.33 -0.16 4.42 2.01 0.35 -1.63 118.68 128.15 1kyd s LEU 919 Ca -0.03 -0.06 -0.01 0.00 0.01 0.00 0.00 54.13 54.03 1kyd s LEU 919 Cb -0.14 -1.79 0.04 0.00 0.01 0.00 0.00 46.19 44.31 1kyd s LEU 919 CO -0.04 0.22 -0.02 -0.13 1.01 0.00 0.00 176.35 177.38 1kyd s ARG 920 N 0.08 1.07 0.17 1.70 0.52 -0.30 -0.89 118.95 121.30 1kyd s ARG 920 Ca 0.00 -0.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.82 1kyd s ARG 920 Cb -0.13 -1.84 -0.04 0.00 0.52 0.00 0.00 34.95 33.46 1kyd s ARG 920 CO 0.02 -0.46 0.11 0.95 0.02 0.00 0.00 175.30 175.94 1kyd s THR 921 N 1.75 0.05 -2.00 0.02 -4.23 -1.05 -0.30 115.64 109.88 1kyd s THR 921 Ca 0.01 -1.93 0.15 0.00 -1.18 0.00 0.00 61.69 58.74 1kyd s THR 921 Cb -0.15 -2.27 0.43 0.00 1.34 0.00 0.00 72.50 71.85 1kyd s THR 921 CO -0.07 -0.22 1.53 -1.54 -0.54 0.00 0.00 174.62 173.78 1kyd n SER 922 N -0.19 0.00 -3.66 3.99 3.41 -0.66 -4.67 113.62 111.84 1kyd n SER 922 Ca -0.02 -1.39 -0.13 0.00 -0.26 0.00 0.00 58.87 57.07 1kyd n SER 922 Cb 0.65 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.47 1kyd n SER 922 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1kyd s LYS 923 N -2.00 0.16 0.21 4.33 2.20 -1.26 -4.97 119.74 118.41 1kyd s LYS 923 Ca 0.23 0.76 -0.15 0.00 -0.36 0.00 0.00 55.97 56.45 1kyd s LYS 923 Cb 0.10 -0.03 0.23 0.00 -1.51 0.00 0.00 37.83 36.63 1kyd s LYS 923 CO 0.18 -0.29 1.60 0.38 -0.36 0.00 0.00 175.35 176.85 1kyd h ASP 924 N 8.28 -0.82 0.32 1.43 2.03 -1.83 -0.23 116.42 125.59 1kyd h ASP 924 Ca -0.14 0.22 -0.02 0.00 -0.73 0.00 0.00 57.03 56.36 1kyd h ASP 924 Cb 1.11 0.49 -0.00 0.00 -0.83 0.00 0.00 39.33 40.10 1kyd h ASP 924 CO 0.14 -0.26 -0.09 0.71 -1.03 0.00 0.00 179.24 178.71 1kyd h THR 925 N -0.05 0.50 0.03 1.15 1.35 -1.98 -1.23 112.91 112.68 1kyd h THR 925 Ca 0.31 -0.42 -0.19 0.00 -0.55 0.00 0.00 66.41 65.55 1kyd h THR 925 Cb 0.53 1.28 0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1kyd h THR 925 CO -0.72 0.09 -0.76 0.58 -0.25 0.00 0.00 175.52 174.46 1kyd h VAL 926 N 0.00 1.40 -0.70 6.82 2.07 -1.48 -1.15 116.25 123.21 1kyd h VAL 926 Ca -0.00 -2.19 0.02 0.00 0.82 0.00 0.00 66.70 65.34 1kyd h VAL 926 Cb 0.27 2.63 -0.04 0.00 -1.52 0.00 0.00 31.29 32.64 1kyd h VAL 926 CO 0.01 0.65 0.45 0.28 0.02 0.00 0.00 177.57 178.98 1kyd h SER 927 N -0.01 0.77 0.23 0.57 0.02 -0.90 0.23 113.55 114.46 1kyd h SER 927 Ca -0.10 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 1kyd h SER 927 Cb 1.47 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1kyd h SER 927 CO 0.15 0.55 -0.11 -0.61 -1.14 0.00 0.00 176.83 175.66 1kyd h GLN 928 N 0.91 -0.30 -0.55 3.45 5.75 -1.25 -1.50 115.11 121.62 1kyd h GLN 928 Ca 0.26 0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.73 1kyd h GLN 928 Cb -0.06 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1kyd h GLN 928 CO -0.07 -0.12 0.14 -0.09 -2.65 0.00 0.00 178.83 176.04 1kyd h ARG 929 N -0.43 0.87 -0.44 1.69 9.65 -1.03 -1.82 114.38 122.87 1kyd h ARG 929 Ca -0.03 -0.21 -0.09 0.00 -1.10 0.00 0.00 59.98 58.55 1kyd h ARG 929 Cb 0.33 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.77 1kyd h ARG 929 CO 0.05 0.82 -0.08 -0.07 2.80 0.00 0.00 179.97 183.49 1kyd h LEU 930 N 0.77 0.76 -0.61 3.80 3.38 -0.99 -0.87 115.31 121.56 1kyd h LEU 930 Ca 0.17 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1kyd h LEU 930 Cb 0.33 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1kyd h LEU 930 CO 0.00 0.88 0.09 0.00 0.09 0.00 0.00 178.44 179.50 1kyd h GLU 932 N 0.93 -0.22 0.15 0.00 5.08 -1.10 -1.85 114.58 117.57 1kyd h GLU 932 Ca 0.18 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1kyd h GLU 932 Cb 0.44 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1kyd h GLU 932 CO 0.01 -0.04 -0.15 -0.07 -1.00 0.00 0.00 179.01 177.76 1kyd h LEU 933 N -0.37 -0.40 -0.93 1.33 3.38 -1.05 -2.79 115.31 114.48 1kyd h LEU 933 Ca -0.02 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1kyd h LEU 933 Cb 0.29 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1kyd h LEU 933 CO 0.04 -0.23 -0.01 0.25 0.09 0.00 0.00 178.44 178.58 1kyd h LEU 934 N -0.33 0.74 -1.71 1.67 5.85 -1.16 -2.63 115.31 117.75 1kyd h LEU 934 Ca 0.00 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 1kyd h LEU 934 Cb 0.32 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1kyd h LEU 934 CO -0.04 0.82 -0.02 0.28 -0.34 0.00 0.00 178.44 179.14 1kyd h SER 935 N 0.72 0.14 1.01 1.25 0.02 -1.22 -1.42 113.55 114.06 1kyd h SER 935 Ca 0.14 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1kyd h SER 935 Cb 0.45 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1kyd h SER 935 CO 0.02 0.19 0.00 -0.33 -1.14 0.00 0.00 176.83 175.57 1kyd h GLU 936 N 0.16 0.00 0.00 3.45 4.39 -1.19 -3.16 114.58 118.23 1kyd h GLU 936 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1kyd h GLU 936 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1kyd h GLU 936 CO 0.00 0.00 -0.28 1.04 -1.16 0.00 0.00 179.01 178.61 1kyd n GLN 937 N -2.36 0.17 0.00 2.33 1.13 -0.53 -5.00 117.38 113.11 1kyd n GLN 937 Ca 0.03 0.09 0.03 0.00 -1.94 0.00 0.00 57.00 55.21 1kyd n GLN 937 Cb 0.30 -1.65 0.02 0.00 0.11 0.00 0.00 30.24 29.03 1kyd n GLN 937 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81