#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbt n PRO 781 N 0.00 0.44 0.00 1.61 -0.04 -1.26 -5.01 135.00 130.74 2kbt n PRO 781 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2kbt n PRO 781 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2kbt n PRO 781 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kbt n GLY 782 N 3.75 0.62 0.07 0.55 0.00 -1.26 -4.91 105.19 104.00 2kbt n GLY 782 Ca 0.00 -2.05 -0.05 0.00 0.00 0.00 0.00 46.02 43.92 2kbt n GLY 782 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2kbt n THR 783 N 3.40 1.34 -1.51 2.61 -1.04 -1.26 -5.00 114.28 112.82 2kbt n THR 783 Ca 0.00 0.22 -0.13 0.00 -2.04 0.00 0.00 64.05 62.10 2kbt n THR 783 Cb 0.00 -2.32 0.09 0.00 -1.82 0.00 0.00 70.33 66.27 2kbt n THR 783 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2kbt n PHE 784 N -4.43 -3.92 0.00 -1.42 3.01 -1.26 -5.11 117.46 104.33 2kbt n PHE 784 Ca -0.08 -0.55 0.00 0.00 1.01 0.00 0.00 57.45 57.83 2kbt n PHE 784 Cb 0.30 -0.45 0.00 0.00 -0.01 0.00 0.00 39.48 39.33 2kbt n PHE 784 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2kbt n GLY 785 N 1.16 2.70 3.55 1.37 0.00 -1.26 -5.00 105.19 107.72 2kbt n GLY 785 Ca 0.07 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 2kbt n GLY 785 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kbt s THR 786 N 3.04 0.00 -0.11 2.61 -4.23 -1.26 -3.25 115.64 112.44 2kbt s THR 786 Ca 0.00 -1.47 -0.04 0.00 -1.18 0.00 0.00 61.69 59.01 2kbt s THR 786 Cb 0.00 -2.35 0.06 0.00 1.34 0.00 0.00 72.50 71.54 2kbt s THR 786 CO 0.00 0.00 0.17 0.00 -0.54 0.00 0.00 174.62 174.25 2kbt s ALA 787 N -3.73 -0.15 -0.15 3.99 0.00 0.98 -3.86 121.76 118.84 2kbt s ALA 787 Ca 0.25 0.46 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 2kbt s ALA 787 Cb -0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2kbt s ALA 787 CO 0.12 -0.71 1.18 0.21 0.00 0.00 0.00 175.76 176.56 2kbt s LYS 788 N 2.29 4.27 0.24 0.00 2.20 0.31 0.14 119.74 129.21 2kbt s LYS 788 Ca 0.04 1.58 -0.30 0.00 -0.36 0.00 0.00 55.97 56.92 2kbt s LYS 788 Cb -0.13 -3.68 -0.10 0.00 -1.51 0.00 0.00 37.83 32.41 2kbt s LYS 788 CO -0.07 -0.61 1.47 0.00 -0.36 0.00 0.00 175.35 175.77 2kbt s ALA 789 N 3.08 3.65 -0.60 3.13 0.00 0.14 -0.55 121.76 130.62 2kbt s ALA 789 Ca 0.52 1.35 0.05 0.00 0.00 0.00 0.00 51.96 53.88 2kbt s ALA 789 Cb -0.20 -3.57 0.04 0.00 0.00 0.00 0.00 23.12 19.38 2kbt s ALA 789 CO 0.14 -0.77 0.67 0.54 0.00 0.00 0.00 175.76 176.34 2kbt n ARG 790 N 2.51 -0.24 -3.80 0.00 5.12 -1.11 -2.83 116.66 116.30 2kbt n ARG 790 Ca 0.08 -0.81 -0.13 0.00 -1.93 0.00 0.00 57.85 55.06 2kbt n ARG 790 Cb 0.40 -1.09 -0.13 0.00 -1.16 0.00 0.00 32.46 30.48 2kbt n ARG 790 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2kbt s TYR 791 N -0.42 -0.17 -0.18 -1.55 1.51 -1.23 -4.90 117.35 110.40 2kbt s TYR 791 Ca 0.06 0.43 -0.29 0.00 -1.01 0.00 0.00 57.07 56.26 2kbt s TYR 791 Cb 0.04 0.03 -0.01 0.00 -0.11 0.00 0.00 41.96 41.91 2kbt s TYR 791 CO 0.06 -0.10 1.26 0.34 -1.11 0.00 0.00 175.55 176.00 2kbt s ASP 792 N 0.32 6.92 -0.18 2.29 -1.08 -1.26 -4.07 116.67 119.61 2kbt s ASP 792 Ca -0.02 1.64 -0.00 0.00 -0.52 0.00 0.00 52.55 53.65 2kbt s ASP 792 Cb -0.03 -2.54 0.05 0.00 -1.46 0.00 0.00 42.92 38.94 2kbt s ASP 792 CO -0.01 -0.79 -0.05 0.12 0.52 0.00 0.00 175.17 174.96 2kbt s PHE 793 N 3.58 1.79 0.13 -5.34 5.36 -1.07 -4.98 117.98 117.45 2kbt s PHE 793 Ca 0.55 -1.20 -0.24 0.00 -0.96 0.00 0.00 56.93 55.08 2kbt s PHE 793 Cb -0.21 -1.35 -0.07 0.00 -0.34 0.00 0.00 43.02 41.05 2kbt s PHE 793 CO 0.15 -0.65 0.73 0.00 -1.46 0.00 0.00 175.22 173.99 2kbt s ALA 795 N -0.96 3.38 0.60 0.00 0.00 -1.26 -4.88 121.76 118.64 2kbt s ALA 795 Ca 0.35 -2.26 0.28 0.00 0.00 0.00 0.00 51.96 50.33 2kbt s ALA 795 Cb -0.22 -3.64 1.43 0.00 0.00 0.00 0.00 23.12 20.69 2kbt s ALA 795 CO 0.24 -2.49 1.84 0.00 0.00 0.00 0.00 175.76 175.34 2kbt h ARG 796 N 9.16 0.00 -3.83 0.00 2.47 -1.95 -3.43 114.38 116.81 2kbt h ARG 796 Ca -0.23 0.00 -0.21 0.00 -1.26 0.00 0.00 59.98 58.28 2kbt h ARG 796 Cb 1.08 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 29.34 2kbt h ARG 796 CO 1.10 0.00 -0.07 0.34 0.56 0.00 0.00 179.97 181.90 2kbt s ASP 797 N -4.93 0.69 0.00 7.04 2.15 -1.26 -5.01 116.67 115.35 2kbt s ASP 797 Ca -0.04 -1.40 0.20 0.00 0.43 0.00 0.00 52.55 51.75 2kbt s ASP 797 Cb 0.14 0.71 1.07 0.00 -0.30 0.00 0.00 42.92 44.55 2kbt s ASP 797 CO 0.50 -1.40 1.62 0.54 -0.17 0.00 0.00 175.17 176.25 2kbt n ARG 798 N -0.56 0.39 0.21 4.34 1.74 -1.26 -2.12 116.66 119.40 2kbt n ARG 798 Ca -0.02 0.07 0.11 0.00 -0.77 0.00 0.00 57.85 57.24 2kbt n ARG 798 Cb 0.61 -1.50 0.17 0.00 -1.02 0.00 0.00 32.46 30.72 2kbt n ARG 798 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2kbt h SER 799 N 0.00 0.00 -3.17 0.55 4.64 -1.94 -3.41 113.55 110.23 2kbt h SER 799 Ca 0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 2kbt h SER 799 Cb 0.13 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.13 2kbt h SER 799 CO 0.00 0.06 -0.59 -0.70 -0.87 0.00 0.00 176.83 174.73 2kbt s GLU 800 N -3.19 2.92 0.01 4.77 2.56 -0.90 -2.92 118.70 121.95 2kbt s GLU 800 Ca 0.06 -0.67 -0.25 0.00 0.00 0.00 0.00 54.97 54.11 2kbt s GLU 800 Cb 0.05 -2.75 -0.05 0.00 2.00 0.00 0.00 34.13 33.39 2kbt s GLU 800 CO 0.68 0.57 0.78 -1.17 -0.56 0.00 0.00 175.26 175.56 2kbt s LEU 801 N -2.39 4.40 -0.61 2.70 0.20 0.50 -4.34 118.68 119.14 2kbt s LEU 801 Ca 0.30 1.42 -0.27 0.00 0.69 0.00 0.00 54.13 56.27 2kbt s LEU 801 Cb -0.12 -3.25 -0.01 0.00 -0.43 0.00 0.00 46.19 42.38 2kbt s LEU 801 CO 0.22 -0.06 1.74 -0.55 -0.29 0.00 0.00 176.35 177.41 2kbt s SER 802 N 0.34 5.49 0.04 3.68 0.15 -1.26 -4.52 113.70 117.62 2kbt s SER 802 Ca 0.40 0.26 -0.05 0.00 0.70 0.00 0.00 55.95 57.26 2kbt s SER 802 Cb -0.20 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.53 2kbt s SER 802 CO 0.23 -2.22 0.28 -0.22 1.20 0.00 0.00 173.24 172.50 2kbt s LEU 803 N 8.28 4.35 -0.29 3.45 2.96 -0.37 -4.77 118.68 132.28 2kbt s LEU 803 Ca 0.62 0.52 -0.03 0.00 -0.22 0.00 0.00 54.13 55.02 2kbt s LEU 803 Cb -0.12 -2.85 0.17 0.00 0.50 0.00 0.00 46.19 43.89 2kbt s LEU 803 CO 0.21 0.20 0.58 -0.75 -1.32 0.00 0.00 176.35 175.27 2kbt s LYS 804 N -2.05 0.54 0.38 1.98 2.36 -1.26 -2.59 119.74 119.09 2kbt s LYS 804 Ca 0.31 1.03 -0.21 0.00 -2.55 0.00 0.00 55.97 54.55 2kbt s LYS 804 Cb -0.13 0.49 -0.16 0.00 -1.05 0.00 0.00 37.83 36.99 2kbt s LYS 804 CO 0.20 -0.55 0.12 0.39 1.55 0.00 0.00 175.35 177.05 2kbt n GLU 805 N 5.43 0.00 -1.08 4.03 1.02 -1.26 -1.80 120.64 126.98 2kbt n GLU 805 Ca -0.03 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.08 2kbt n GLU 805 Cb 0.51 -0.99 -0.01 0.00 -0.02 0.00 0.00 31.44 30.93 2kbt n GLU 805 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kbt n GLY 806 N 2.28 0.58 3.39 0.62 0.00 -1.13 -5.00 105.19 105.94 2kbt n GLY 806 Ca 0.12 -0.92 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 2kbt n GLY 806 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2kbt s ASP 807 N -2.93 2.58 0.06 1.61 1.11 -0.75 -4.99 116.67 113.35 2kbt s ASP 807 Ca 0.00 -1.16 0.04 0.00 0.18 0.00 0.00 52.55 51.61 2kbt s ASP 807 Cb 0.00 -0.13 -0.04 0.00 1.07 0.00 0.00 42.92 43.82 2kbt s ASP 807 CO 0.00 -0.33 -0.00 0.27 1.18 0.00 0.00 175.17 176.28 2kbt s ILE 808 N -3.07 4.03 -0.22 0.77 -0.00 -1.26 0.26 121.20 121.72 2kbt s ILE 808 Ca 0.28 -0.86 0.01 0.00 -0.00 0.00 0.00 60.65 60.08 2kbt s ILE 808 Cb 0.03 -2.87 0.03 0.00 -0.00 0.00 0.00 42.46 39.65 2kbt s ILE 808 CO 0.10 0.21 -0.14 -0.63 -0.00 0.00 0.00 174.94 174.48 2kbt s ILE 809 N -1.22 2.29 -0.33 8.37 1.09 0.38 -4.79 121.20 126.99 2kbt s ILE 809 Ca 0.23 -1.14 -0.29 0.00 -1.10 0.00 0.00 60.65 58.36 2kbt s ILE 809 Cb -0.12 -2.11 0.00 0.00 -1.06 0.00 0.00 42.46 39.17 2kbt s ILE 809 CO 0.15 0.31 1.35 -0.75 -0.10 0.00 0.00 174.94 175.90 2kbt s LYS 810 N 1.25 3.82 -0.29 2.79 2.47 -1.16 -0.01 119.74 128.61 2kbt s LYS 810 Ca 0.00 1.19 -0.29 0.00 -1.56 0.00 0.00 55.97 55.31 2kbt s LYS 810 Cb -0.16 -3.93 -0.01 0.00 -1.46 0.00 0.00 37.83 32.28 2kbt s LYS 810 CO -0.09 -1.25 1.47 0.42 0.16 0.00 0.00 175.35 176.07 2kbt s ILE 811 N 4.70 3.89 -0.21 5.43 -1.09 -1.20 -2.88 121.20 129.83 2kbt s ILE 811 Ca 0.58 0.98 -0.09 0.00 -2.23 0.00 0.00 60.65 59.90 2kbt s ILE 811 Cb -0.16 -3.95 -0.09 0.00 -1.58 0.00 0.00 42.46 36.67 2kbt s ILE 811 CO 0.26 -0.44 -0.26 0.18 -1.23 0.00 0.00 174.94 173.45 2kbt n LEU 812 N 8.29 1.66 -4.07 2.97 4.77 0.11 -4.64 117.00 126.10 2kbt n LEU 812 Ca 0.17 0.21 -0.21 0.00 -0.03 0.00 0.00 56.01 56.15 2kbt n LEU 812 Cb 0.46 -0.62 -0.15 0.00 -2.33 0.00 0.00 43.42 40.78 2kbt n LEU 812 CO 0.65 0.48 -0.46 0.21 -1.33 0.00 0.00 177.39 176.95 2kbt s ASN 813 N -6.74 1.39 -0.66 -1.43 2.47 0.67 -4.98 114.94 105.65 2kbt s ASN 813 Ca -0.29 -0.22 0.04 0.00 0.42 0.00 0.00 52.86 52.81 2kbt s ASN 813 Cb 0.11 -0.15 0.16 0.00 -1.45 0.00 0.00 41.25 39.92 2kbt s ASN 813 CO 0.38 0.14 0.44 -0.75 -3.72 0.00 0.00 177.10 173.59 2kbt s LYS 814 N -0.32 2.37 -0.77 0.43 2.20 -1.26 0.38 119.74 122.77 2kbt s LYS 814 Ca 0.04 -3.16 -0.26 0.00 -0.36 0.00 0.00 55.97 52.24 2kbt s LYS 814 Cb -0.05 -3.42 -0.09 0.00 -1.51 0.00 0.00 37.83 32.77 2kbt s LYS 814 CO -0.00 -1.24 2.20 0.15 -0.36 0.00 0.00 175.35 176.09 2kbt s LYS 815 N -1.14 2.09 0.42 4.03 -0.14 -1.23 -4.70 119.74 119.07 2kbt s LYS 815 Ca 0.23 0.35 0.00 0.00 -1.36 0.00 0.00 55.97 55.19 2kbt s LYS 815 Cb -0.10 -4.81 0.00 0.00 -1.68 0.00 0.00 37.83 31.23 2kbt s LYS 815 CO -0.12 -3.77 0.00 0.41 -0.76 0.00 0.00 175.35 171.11 2kbt n GLY 816 N 6.61 -2.43 0.22 -3.33 0.00 -1.26 -4.31 105.19 100.69 2kbt n GLY 816 Ca 0.41 -1.14 0.10 0.00 0.00 0.00 0.00 46.02 45.39 2kbt n GLY 816 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2kbt h GLN 817 N -1.28 0.00 -6.37 1.61 5.75 -1.96 -3.44 115.11 109.42 2kbt h GLN 817 Ca -0.06 0.00 -0.62 0.00 -0.15 0.00 0.00 58.65 57.83 2kbt h GLN 817 Cb 1.26 0.00 -0.25 0.00 1.07 0.00 0.00 27.48 29.56 2kbt h GLN 817 CO 0.04 0.18 -0.85 1.14 -2.65 0.00 0.00 178.83 176.69 2kbt s GLN 818 N -3.39 1.43 0.00 1.69 0.00 -1.26 -4.98 119.66 113.14 2kbt s GLN 818 Ca 0.03 -1.08 0.00 0.00 -0.00 0.00 0.00 55.36 54.31 2kbt s GLN 818 Cb 0.08 -1.64 0.00 0.00 0.00 0.00 0.00 33.01 31.45 2kbt s GLN 818 CO 0.65 0.41 0.00 0.41 0.00 0.00 0.00 175.29 176.76 2kbt n GLY 819 N 1.54 1.20 3.30 2.60 0.00 -1.26 -4.94 105.19 107.62 2kbt n GLY 819 Ca -0.18 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.86 2kbt n GLY 819 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2kbt s TRP 820 N 0.00 1.16 -0.03 1.61 -2.14 -1.26 -3.98 118.94 114.29 2kbt s TRP 820 Ca 0.00 -1.34 0.04 0.00 2.66 0.00 0.00 56.10 57.46 2kbt s TRP 820 Cb 0.00 -0.44 -0.00 0.00 -3.10 0.00 0.00 33.47 29.92 2kbt s TRP 820 CO 0.00 -0.78 -0.14 -1.58 -2.66 0.00 0.00 176.95 171.80 2kbt s TRP 821 N -3.90 1.34 -0.47 1.66 0.51 0.42 -3.54 118.94 114.96 2kbt s TRP 821 Ca 0.36 -0.35 -0.24 0.00 -2.12 0.00 0.00 56.10 53.76 2kbt s TRP 821 Cb 0.04 -0.91 0.03 0.00 -0.81 0.00 0.00 33.47 31.82 2kbt s TRP 821 CO 0.15 -0.11 0.87 0.50 -0.51 0.00 0.00 176.95 177.85 2kbt s ARG 822 N 0.03 3.44 0.20 4.98 3.00 0.16 -2.72 118.95 128.04 2kbt s ARG 822 Ca -0.02 -0.03 0.04 0.00 -1.00 0.00 0.00 55.73 54.72 2kbt s ARG 822 Cb -0.09 -3.96 -0.02 0.00 0.00 0.00 0.00 34.95 30.89 2kbt s ARG 822 CO 0.01 -1.23 0.15 0.41 0.00 0.00 0.00 175.30 174.64 2kbt n GLY 823 N 4.99 3.43 3.21 8.12 0.00 -1.22 0.08 105.19 123.79 2kbt n GLY 823 Ca 0.04 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.10 2kbt n GLY 823 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kbt s GLU 824 N -2.82 1.09 -0.26 1.61 -1.05 -1.14 -2.83 118.70 113.30 2kbt s GLU 824 Ca 0.21 -1.48 -0.10 0.00 -0.15 0.00 0.00 54.97 53.44 2kbt s GLU 824 Cb 0.01 0.28 0.11 0.00 -0.44 0.00 0.00 34.13 34.08 2kbt s GLU 824 CO 0.15 -0.35 0.57 0.42 0.95 0.00 0.00 175.26 177.00 2kbt s ILE 825 N -4.09 -0.68 -1.90 1.83 1.01 0.09 -2.96 121.20 114.51 2kbt s ILE 825 Ca 0.29 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.00 2kbt s ILE 825 Cb 0.07 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.67 2kbt s ILE 825 CO 0.06 0.02 0.00 -1.22 0.00 0.00 0.00 174.94 173.81 2kbt n TYR 826 N 5.19 -0.47 -0.48 3.97 4.01 -1.26 0.20 117.16 128.32 2kbt n TYR 826 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 2kbt n TYR 826 Cb 0.51 -3.49 0.00 0.00 -0.31 0.00 0.00 39.34 36.05 2kbt n TYR 826 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kbt n GLY 827 N -0.60 0.76 3.48 2.72 0.00 -1.26 -5.04 105.19 105.25 2kbt n GLY 827 Ca -0.21 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2kbt n GLY 827 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kbt s ARG 828 N -0.53 3.12 0.33 1.61 0.52 0.13 -5.07 118.95 119.06 2kbt s ARG 828 Ca 0.00 -0.90 -0.06 0.00 -0.52 0.00 0.00 55.73 54.25 2kbt s ARG 828 Cb 0.00 -3.93 -0.05 0.00 0.52 0.00 0.00 34.95 31.48 2kbt s ARG 828 CO 0.00 -0.68 0.62 0.42 0.02 0.00 0.00 175.30 175.69 2kbt s ILE 829 N 1.73 4.96 -2.84 1.52 -1.09 -1.26 -0.73 121.20 123.49 2kbt s ILE 829 Ca 0.06 0.19 0.00 0.00 -2.23 0.00 0.00 60.65 58.67 2kbt s ILE 829 Cb -0.18 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 2kbt s ILE 829 CO 0.10 -0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.02 2kbt n GLY 830 N -1.13 -0.54 3.20 6.18 0.00 -1.13 -4.51 105.19 107.26 2kbt n GLY 830 Ca -0.01 -0.89 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 2kbt n GLY 830 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kbt s TRP 831 N -3.00 1.45 -0.00 1.61 0.52 -1.15 -3.46 118.94 114.91 2kbt s TRP 831 Ca 0.00 -0.40 -0.15 0.00 0.02 0.00 0.00 56.10 55.57 2kbt s TRP 831 Cb 0.00 -0.83 0.02 0.00 -1.15 0.00 0.00 33.47 31.51 2kbt s TRP 831 CO 0.00 0.09 0.33 -0.59 0.02 0.00 0.00 176.95 176.80 2kbt s PHE 832 N -1.02 -0.19 0.45 -1.98 -0.71 -1.10 -0.37 117.98 113.05 2kbt s PHE 832 Ca 0.03 0.25 -0.22 0.00 -1.04 0.00 0.00 56.93 55.95 2kbt s PHE 832 Cb -0.09 0.11 -0.09 0.00 -1.21 0.00 0.00 43.02 41.75 2kbt s PHE 832 CO 0.02 -0.43 1.05 -1.25 -1.34 0.00 0.00 175.22 173.27 2kbt s PRO 833 N -1.58 3.95 0.00 1.99 0.04 -1.26 -0.44 135.00 137.70 2kbt s PRO 833 Ca -0.12 1.43 0.20 0.00 0.04 0.00 0.00 61.00 62.56 2kbt s PRO 833 Cb -0.04 -2.28 0.99 0.00 0.04 0.00 0.00 34.50 33.21 2kbt s PRO 833 CO 0.03 -0.32 1.67 -1.13 0.04 0.00 0.00 177.00 177.29 2kbt n SER 834 N -0.60 0.71 0.01 6.66 3.41 -1.26 -2.90 113.62 119.66 2kbt n SER 834 Ca 0.08 -1.52 0.11 0.00 -0.26 0.00 0.00 58.87 57.27 2kbt n SER 834 Cb 0.51 -0.04 -0.01 0.00 -0.26 0.00 0.00 64.21 64.41 2kbt n SER 834 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2kbt n ASN 835 N -0.32 0.73 -1.00 4.04 3.02 -1.26 -4.04 115.26 116.42 2kbt n ASN 835 Ca 0.15 -0.58 -0.00 0.00 -0.03 0.00 0.00 54.58 54.12 2kbt n ASN 835 Cb 0.18 0.86 0.21 0.00 -0.61 0.00 0.00 39.78 40.42 2kbt n ASN 835 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2kbt n TYR 836 N -1.67 0.90 -3.72 3.10 4.02 -1.14 -4.99 117.16 113.66 2kbt n TYR 836 Ca 0.03 -1.44 -0.10 0.00 -0.01 0.00 0.00 57.90 56.38 2kbt n TYR 836 Cb 0.37 -0.42 -0.04 0.00 -0.02 0.00 0.00 39.34 39.23 2kbt n TYR 836 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2kbt s VAL 837 N -3.16 0.04 -0.06 -0.72 -7.23 -1.26 -2.75 120.40 105.26 2kbt s VAL 837 Ca 0.43 -0.76 -0.00 0.00 -1.81 0.00 0.00 61.98 59.84 2kbt s VAL 837 Cb 0.38 -1.47 0.03 0.00 0.56 0.00 0.00 36.38 35.88 2kbt s VAL 837 CO 0.01 -0.19 -0.01 -1.61 -0.31 0.00 0.00 175.10 172.98 2kbt s GLU 838 N -3.86 0.67 0.19 4.82 0.41 0.29 -4.86 118.70 116.36 2kbt s GLU 838 Ca 0.08 0.03 0.09 0.00 -0.41 0.00 0.00 54.97 54.75 2kbt s GLU 838 Cb 0.00 -0.90 -0.04 0.00 -1.78 0.00 0.00 34.13 31.41 2kbt s GLU 838 CO -0.05 -0.22 -0.06 -1.83 -0.49 0.00 0.00 175.26 172.61 2kbt s GLU 839 N 1.54 2.18 -1.23 1.61 4.04 -1.26 0.12 118.70 125.70 2kbt s GLU 839 Ca -0.02 -1.24 -0.01 0.00 0.04 0.00 0.00 54.97 53.74 2kbt s GLU 839 Cb -0.13 -2.21 -0.01 0.00 0.02 0.00 0.00 34.13 31.80 2kbt s GLU 839 CO -0.03 0.43 0.86 -3.47 -1.84 0.00 0.00 175.26 171.21 2kbt n ASP 840 N -0.12 -2.25 -4.75 0.83 4.64 -1.25 -4.98 116.55 108.66 2kbt n ASP 840 Ca -0.10 -0.73 -0.36 0.00 -1.38 0.00 0.00 54.79 52.23 2kbt n ASP 840 Cb 0.56 -4.63 -0.08 0.00 -1.04 0.00 0.00 41.12 35.92 2kbt n ASP 840 CO 0.00 0.00 0.00 -0.72 -0.82 0.00 0.00 177.20 175.66 2kbt s TYR 841 N -3.49 3.33 0.75 -0.67 -0.85 -1.26 -5.10 117.35 110.05 2kbt s TYR 841 Ca 0.06 0.31 -0.12 0.00 -0.52 0.00 0.00 57.07 56.80 2kbt s TYR 841 Cb -0.01 -1.86 0.18 0.00 0.38 0.00 0.00 41.96 40.65 2kbt s TYR 841 CO 0.77 0.54 0.42 -1.13 -1.52 0.00 0.00 175.55 174.63 2kbt n SER 842 N 2.19 -2.93 -4.19 -0.18 3.41 -1.26 -5.05 113.62 105.61 2kbt n SER 842 Ca -0.19 -0.42 -0.17 0.00 -0.26 0.00 0.00 58.87 57.83 2kbt n SER 842 Cb 0.54 -0.52 -0.11 0.00 -0.26 0.00 0.00 64.21 63.86 2kbt n SER 842 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2kbt s GLU 843 N -3.70 0.89 -1.02 4.33 2.02 -1.26 -4.79 118.70 115.17 2kbt s GLU 843 Ca 0.32 -1.12 -0.04 0.00 0.02 0.00 0.00 54.97 54.16 2kbt s GLU 843 Cb -0.06 -0.73 0.00 0.00 0.10 0.00 0.00 34.13 33.44 2kbt s GLU 843 CO 0.27 0.14 0.47 0.98 0.02 0.00 0.00 175.26 177.14 2kbt n TYR 844 N 0.77 -1.41 -0.95 1.61 4.19 -1.26 -4.95 117.16 115.16 2kbt n TYR 844 Ca -0.17 0.40 -0.36 0.00 3.31 0.00 0.00 57.90 61.08 2kbt n TYR 844 Cb 0.56 -3.39 0.06 0.00 0.49 0.00 0.00 39.34 37.06 2kbt n TYR 844 CO 0.00 0.00 0.00 1.28 0.91 0.00 0.00 176.86 179.05 2kbt n LEU 845 N -2.88 -4.38 -4.79 2.98 4.32 -1.26 -4.93 117.00 106.07 2kbt n LEU 845 Ca -0.06 0.14 -0.29 0.00 -0.02 0.00 0.00 56.01 55.78 2kbt n LEU 845 Cb 0.57 -0.77 0.13 0.00 -1.62 0.00 0.00 43.42 41.74 2kbt n LEU 845 CO 0.33 -4.75 0.72 -2.16 -1.22 0.00 0.00 177.39 170.31 2kbt s PRO 846 N -2.29 1.15 0.15 3.23 0.04 -1.26 -5.09 135.00 130.92 2kbt s PRO 846 Ca 0.42 0.29 -0.12 0.00 0.04 0.00 0.00 61.00 61.63 2kbt s PRO 846 Cb -0.11 -1.84 0.01 0.00 0.04 0.00 0.00 34.50 32.60 2kbt s PRO 846 CO 0.76 -2.19 0.34 -1.21 0.04 0.00 0.00 177.00 174.75 2kbt s GLU 847 N -5.28 1.12 0.00 4.56 8.01 -1.26 -5.26 118.70 120.59 2kbt s GLU 847 Ca 0.64 -0.95 0.32 0.00 0.01 0.00 0.00 54.97 54.98 2kbt s GLU 847 Cb -0.15 0.42 1.84 0.00 -4.31 0.00 0.00 34.13 31.93 2kbt s GLU 847 CO 0.53 -0.43 2.19 -2.37 0.01 0.00 0.00 175.26 175.20