#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbt h PRO 781 N 0.00 0.00 0.00 1.61 0.13 -2.07 -3.48 132.00 128.19 2kbt h PRO 781 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2kbt h PRO 781 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2kbt h PRO 781 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 2kbt n GLY 782 N 0.56 -0.55 3.03 1.56 0.00 -1.26 -5.13 105.19 103.40 2kbt n GLY 782 Ca 0.02 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2kbt n GLY 782 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kbt s THR 783 N -0.41 -0.03 0.23 2.61 2.01 -1.26 -5.16 115.64 113.63 2kbt s THR 783 Ca 0.00 0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.16 2kbt s THR 783 Cb 0.00 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 2kbt s THR 783 CO 0.00 0.05 0.18 0.49 -0.69 0.00 0.00 174.62 174.65 2kbt n PHE 784 N 3.86 -0.48 0.00 4.92 3.72 -1.26 -5.14 117.46 123.08 2kbt n PHE 784 Ca -0.22 -1.89 0.00 0.00 -0.05 0.00 0.00 57.45 55.29 2kbt n PHE 784 Cb 0.54 0.18 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 2kbt n PHE 784 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2kbt n GLY 785 N -0.37 2.30 3.69 1.37 0.00 -1.26 -5.05 105.19 105.86 2kbt n GLY 785 Ca 0.04 -0.25 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 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 1.57 0.00 -0.26 2.61 -4.23 -1.26 -3.36 115.64 110.70 2kbt s THR 786 Ca 0.00 -1.25 -0.02 0.00 -1.18 0.00 0.00 61.69 59.24 2kbt s THR 786 Cb 0.00 -2.47 0.11 0.00 1.34 0.00 0.00 72.50 71.48 2kbt s THR 786 CO 0.00 0.00 0.23 0.00 -0.54 0.00 0.00 174.62 174.31 2kbt s ALA 787 N -3.26 -0.14 0.11 3.99 0.00 0.12 -4.23 121.76 118.36 2kbt s ALA 787 Ca 0.20 -0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.51 2kbt s ALA 787 Cb -0.03 -1.56 -0.08 0.00 0.00 0.00 0.00 23.12 21.45 2kbt s ALA 787 CO 0.12 -1.55 1.52 0.21 0.00 0.00 0.00 175.76 176.06 2kbt s LYS 788 N 2.29 4.25 -0.06 0.00 2.20 -1.24 0.07 119.74 127.24 2kbt s LYS 788 Ca 0.08 2.22 -0.30 0.00 -0.36 0.00 0.00 55.97 57.62 2kbt s LYS 788 Cb -0.15 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.80 2kbt s LYS 788 CO -0.28 -0.58 1.22 0.00 -0.36 0.00 0.00 175.35 175.35 2kbt s ALA 789 N 1.62 3.52 -2.81 3.13 0.00 -0.10 0.52 121.76 127.65 2kbt s ALA 789 Ca 0.69 0.62 0.24 0.00 0.00 0.00 0.00 51.96 53.51 2kbt s ALA 789 Cb -0.39 -3.53 0.36 0.00 0.00 0.00 0.00 23.12 19.56 2kbt s ALA 789 CO 0.31 -0.81 1.36 0.54 0.00 0.00 0.00 175.76 177.15 2kbt n ARG 790 N 5.35 2.27 -3.64 0.00 5.12 0.77 -2.99 116.66 123.54 2kbt n ARG 790 Ca 0.11 -1.87 -0.06 0.00 -1.93 0.00 0.00 57.85 54.10 2kbt n ARG 790 Cb 0.46 -1.47 -0.07 0.00 -1.16 0.00 0.00 32.46 30.22 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 -1.88 -1.08 -0.29 -1.55 2.02 -1.16 -4.89 117.35 108.51 2kbt s TYR 791 Ca 0.32 2.12 -0.28 0.00 -0.37 0.00 0.00 57.07 58.85 2kbt s TYR 791 Cb 0.21 0.64 -0.03 0.00 -0.40 0.00 0.00 41.96 42.38 2kbt s TYR 791 CO 0.31 -0.54 1.94 -0.51 -1.57 0.00 0.00 175.55 175.18 2kbt s ASP 792 N 1.79 5.74 -0.23 2.29 1.01 -1.26 -4.40 116.67 121.60 2kbt s ASP 792 Ca -0.09 1.50 -0.11 0.00 0.71 0.00 0.00 52.55 54.55 2kbt s ASP 792 Cb -0.06 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 2kbt s ASP 792 CO -0.19 -1.80 0.20 0.12 0.21 0.00 0.00 175.17 173.70 2kbt s PHE 793 N 7.38 3.33 -0.38 4.23 5.36 -0.98 -4.91 117.98 132.00 2kbt s PHE 793 Ca 0.87 0.29 -0.20 0.00 -0.96 0.00 0.00 56.93 56.93 2kbt s PHE 793 Cb -0.26 -2.31 0.01 0.00 -0.34 0.00 0.00 43.02 40.12 2kbt s PHE 793 CO 0.34 0.06 0.59 0.00 -1.46 0.00 0.00 175.22 174.75 2kbt s ALA 795 N 2.62 2.62 0.04 0.00 0.00 -1.26 -4.82 121.76 120.96 2kbt s ALA 795 Ca 0.22 -0.51 0.18 0.00 0.00 0.00 0.00 51.96 51.84 2kbt s ALA 795 Cb -0.15 -4.15 0.47 0.00 0.00 0.00 0.00 23.12 19.29 2kbt s ALA 795 CO 0.15 -3.19 1.63 0.07 0.00 0.00 0.00 175.76 174.42 2kbt h ARG 796 N 12.60 0.00 -5.04 0.00 0.11 -1.94 -3.46 114.38 116.65 2kbt h ARG 796 Ca -0.28 0.00 -0.40 0.00 0.10 0.00 0.00 59.98 59.40 2kbt h ARG 796 Cb 1.13 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.07 2kbt h ARG 796 CO 1.17 0.41 -0.61 0.34 0.10 0.00 0.00 179.97 181.38 2kbt s ASP 797 N -6.41 1.72 0.00 0.08 2.15 -1.26 -5.01 116.67 107.93 2kbt s ASP 797 Ca 0.02 -1.37 0.24 0.00 0.43 0.00 0.00 52.55 51.86 2kbt s ASP 797 Cb 0.10 0.05 1.26 0.00 -0.30 0.00 0.00 42.92 44.02 2kbt s ASP 797 CO 0.70 -0.67 1.79 0.54 -0.17 0.00 0.00 175.17 177.37 2kbt n ARG 798 N -0.55 0.44 0.03 4.34 1.74 -1.26 -2.15 116.66 119.24 2kbt n ARG 798 Ca -0.01 0.05 0.12 0.00 -0.77 0.00 0.00 57.85 57.24 2kbt n ARG 798 Cb 0.66 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.87 2kbt n ARG 798 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2kbt n SER 799 N -1.22 0.53 -4.88 0.55 3.41 -1.26 -4.82 113.62 105.93 2kbt n SER 799 Ca 0.13 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.50 2kbt n SER 799 Cb 0.16 0.10 -0.04 0.00 -0.26 0.00 0.00 64.21 64.18 2kbt n SER 799 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2kbt s GLU 800 N -3.07 3.16 -0.10 4.33 2.12 -0.91 -2.49 118.70 121.74 2kbt s GLU 800 Ca 0.09 -0.82 -0.04 0.00 0.36 0.00 0.00 54.97 54.57 2kbt s GLU 800 Cb 0.16 -2.76 -0.04 0.00 0.26 0.00 0.00 34.13 31.75 2kbt s GLU 800 CO 0.69 0.46 0.06 -1.17 -0.54 0.00 0.00 175.26 174.76 2kbt s LEU 801 N -3.50 3.94 -0.42 2.70 0.20 0.28 -4.18 118.68 117.71 2kbt s LEU 801 Ca 0.33 0.29 -0.29 0.00 0.69 0.00 0.00 54.13 55.15 2kbt s LEU 801 Cb -0.10 -1.93 0.02 0.00 -0.43 0.00 0.00 46.19 43.76 2kbt s LEU 801 CO 0.26 0.39 1.15 -0.55 -0.29 0.00 0.00 176.35 177.31 2kbt s SER 802 N -0.95 6.70 0.23 3.68 0.15 -1.26 -4.43 113.70 117.81 2kbt s SER 802 Ca 0.14 0.69 0.07 0.00 0.70 0.00 0.00 55.95 57.55 2kbt s SER 802 Cb -0.12 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 2kbt s SER 802 CO 0.03 -1.16 0.15 -0.76 1.20 0.00 0.00 173.24 172.70 2kbt s LEU 803 N 4.30 3.71 -0.29 3.45 1.02 -0.76 -4.90 118.68 125.21 2kbt s LEU 803 Ca 0.49 -0.29 -0.04 0.00 0.02 0.00 0.00 54.13 54.31 2kbt s LEU 803 Cb -0.09 -2.25 0.16 0.00 0.02 0.00 0.00 46.19 44.02 2kbt s LEU 803 CO 0.27 -0.01 0.57 -0.75 0.02 0.00 0.00 176.35 176.45 2kbt s LYS 804 N -3.65 0.53 0.06 1.70 2.36 -1.26 -2.33 119.74 117.15 2kbt s LYS 804 Ca 0.32 1.06 -0.34 0.00 -2.55 0.00 0.00 55.97 54.46 2kbt s LYS 804 Cb -0.08 0.49 -0.18 0.00 -1.05 0.00 0.00 37.83 37.01 2kbt s LYS 804 CO 0.24 -0.50 0.85 0.39 1.55 0.00 0.00 175.35 177.88 2kbt n GLU 805 N 5.42 0.00 0.00 4.03 1.02 -1.26 0.27 120.64 130.13 2kbt n GLU 805 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2kbt n GLU 805 Cb 0.50 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 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 1.57 1.88 3.94 0.62 0.00 -1.16 -4.98 105.19 107.06 2kbt n GLY 806 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.88 6.08 -0.07 1.61 1.11 0.14 -4.94 116.67 118.72 2kbt s ASP 807 Ca 0.00 0.45 0.04 0.00 0.18 0.00 0.00 52.55 53.22 2kbt s ASP 807 Cb 0.00 -1.84 -0.02 0.00 1.07 0.00 0.00 42.92 42.13 2kbt s ASP 807 CO 0.00 -0.52 -0.18 0.27 1.18 0.00 0.00 175.17 175.92 2kbt s ILE 808 N -2.49 2.72 -0.35 0.77 -0.00 -1.26 -0.92 121.20 119.67 2kbt s ILE 808 Ca 0.45 -0.83 -0.12 0.00 -0.00 0.00 0.00 60.65 60.15 2kbt s ILE 808 Cb -0.10 -2.06 -0.00 0.00 -0.00 0.00 0.00 42.46 40.30 2kbt s ILE 808 CO 0.38 0.57 0.22 -0.63 -0.00 0.00 0.00 174.94 175.48 2kbt s ILE 809 N -0.33 4.93 -0.18 8.37 1.09 0.11 -4.80 121.20 130.39 2kbt s ILE 809 Ca 0.02 -0.47 -0.29 0.00 -1.10 0.00 0.00 60.65 58.81 2kbt s ILE 809 Cb -0.13 -3.60 -0.04 0.00 -1.06 0.00 0.00 42.46 37.64 2kbt s ILE 809 CO 0.02 -0.07 1.67 -0.75 -0.10 0.00 0.00 174.94 175.71 2kbt s LYS 810 N 1.65 3.85 0.16 2.79 2.47 -0.70 0.16 119.74 130.12 2kbt s LYS 810 Ca 0.05 1.82 -0.30 0.00 -1.56 0.00 0.00 55.97 55.97 2kbt s LYS 810 Cb -0.18 -4.05 -0.07 0.00 -1.46 0.00 0.00 37.83 32.07 2kbt s LYS 810 CO 0.08 -1.24 1.00 0.42 0.16 0.00 0.00 175.35 175.78 2kbt s ILE 811 N 5.12 4.19 0.00 5.43 -1.09 -1.21 -1.13 121.20 132.50 2kbt s ILE 811 Ca 0.74 1.92 0.00 0.00 -2.23 0.00 0.00 60.65 61.08 2kbt s ILE 811 Cb -0.28 -4.23 0.00 0.00 -1.58 0.00 0.00 42.46 36.38 2kbt s ILE 811 CO 0.30 0.34 0.00 0.18 -1.23 0.00 0.00 174.94 174.53 2kbt n LEU 812 N 2.35 0.59 -3.97 2.97 4.77 -0.56 -4.59 117.00 118.55 2kbt n LEU 812 Ca 0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 2kbt n LEU 812 Cb 0.48 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.43 2kbt n LEU 812 CO 0.52 -0.02 -0.40 0.20 -1.33 0.00 0.00 177.39 176.35 2kbt s ASN 813 N -4.59 0.65 -0.48 -1.43 -0.87 -0.35 -5.01 114.94 102.85 2kbt s ASN 813 Ca 0.00 -0.15 0.03 0.00 -1.57 0.00 0.00 52.86 51.17 2kbt s ASN 813 Cb 0.00 -0.06 0.14 0.00 -0.02 0.00 0.00 41.25 41.31 2kbt s ASN 813 CO 0.00 0.03 0.26 -0.54 -2.57 0.00 0.00 177.10 174.28 2kbt s LYS 814 N -0.31 1.61 0.59 -0.60 1.02 -1.26 -0.72 119.74 120.07 2kbt s LYS 814 Ca 0.00 -2.32 0.31 0.00 0.02 0.00 0.00 55.97 53.98 2kbt s LYS 814 Cb -0.03 -2.76 1.29 0.00 -0.52 0.00 0.00 37.83 35.81 2kbt s LYS 814 CO -0.00 -1.15 1.63 0.87 -0.92 0.00 0.00 175.35 175.77 2kbt h LYS 815 N 6.54 0.00 0.00 1.68 1.79 -1.94 -3.44 116.57 121.20 2kbt h LYS 815 Ca -0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2kbt h LYS 815 Cb 0.90 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 2kbt h LYS 815 CO 0.57 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.35 2kbt n GLY 816 N -1.65 2.24 0.00 3.86 0.00 -1.26 -4.94 105.19 103.44 2kbt n GLY 816 Ca 0.19 -1.03 0.06 0.00 0.00 0.00 0.00 46.02 45.24 2kbt n GLY 816 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kbt n GLN 817 N -0.94 0.09 -4.95 1.61 1.13 -1.26 -4.55 117.38 108.51 2kbt n GLN 817 Ca 0.00 0.22 -0.28 0.00 -1.94 0.00 0.00 57.00 55.00 2kbt n GLN 817 Cb 0.00 -1.50 -0.16 0.00 0.11 0.00 0.00 30.24 28.69 2kbt n GLN 817 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2kbt s GLN 818 N -2.78 2.21 0.00 -1.09 -0.21 -1.26 -4.97 119.66 111.56 2kbt s GLN 818 Ca 0.09 -0.68 0.00 0.00 0.02 0.00 0.00 55.36 54.79 2kbt s GLN 818 Cb 0.09 -1.81 0.00 0.00 1.00 0.00 0.00 33.01 32.29 2kbt s GLN 818 CO 0.22 0.20 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 2kbt n GLY 819 N 3.35 1.28 3.30 3.09 0.00 -1.26 -4.97 105.19 109.97 2kbt n GLY 819 Ca -0.19 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 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 1.18 0.05 1.61 -2.14 -1.26 -4.03 118.94 114.34 2kbt s TRP 820 Ca 0.00 -1.35 0.06 0.00 2.66 0.00 0.00 56.10 57.47 2kbt s TRP 820 Cb 0.00 -0.45 -0.02 0.00 -3.10 0.00 0.00 33.47 29.90 2kbt s TRP 820 CO 0.00 -0.78 -0.16 -1.58 -2.66 0.00 0.00 176.95 171.76 2kbt s TRP 821 N -3.88 1.40 -0.40 1.66 0.51 0.79 -4.19 118.94 114.84 2kbt s TRP 821 Ca 0.36 -0.37 -0.15 0.00 -2.12 0.00 0.00 56.10 53.83 2kbt s TRP 821 Cb 0.04 -0.83 0.01 0.00 -0.81 0.00 0.00 33.47 31.89 2kbt s TRP 821 CO 0.16 0.06 0.31 0.50 -0.51 0.00 0.00 176.95 177.47 2kbt s ARG 822 N -1.23 3.11 0.00 4.98 3.52 0.10 -2.44 118.95 126.99 2kbt s ARG 822 Ca 0.03 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 54.75 2kbt s ARG 822 Cb -0.08 -3.94 0.00 0.00 -1.56 0.00 0.00 34.95 29.37 2kbt s ARG 822 CO 0.02 -0.70 0.00 0.41 -0.81 0.00 0.00 175.30 174.22 2kbt n GLY 823 N 5.13 5.78 3.58 8.12 0.00 -1.19 -1.21 105.19 125.41 2kbt n GLY 823 Ca -0.11 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 2kbt n GLY 823 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kbt s GLU 824 N 1.53 0.60 -0.02 1.61 -6.30 -0.29 -3.24 118.70 112.59 2kbt s GLU 824 Ca 0.00 0.19 -0.00 0.00 -2.50 0.00 0.00 54.97 52.66 2kbt s GLU 824 Cb 0.00 0.28 0.03 0.00 0.00 0.00 0.00 34.13 34.44 2kbt s GLU 824 CO 0.00 -0.18 0.04 0.42 0.02 0.00 0.00 175.26 175.56 2kbt s ILE 825 N -0.98 -0.07 -2.07 -3.70 1.01 0.43 -1.73 121.20 114.10 2kbt s ILE 825 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2kbt s ILE 825 Cb -0.01 -0.09 0.00 0.00 0.01 0.00 0.00 42.46 42.37 2kbt s ILE 825 CO 0.01 0.11 0.00 -1.22 0.00 0.00 0.00 174.94 173.84 2kbt n TYR 826 N 4.38 -0.18 -0.51 3.97 4.01 -1.26 -0.08 117.16 127.48 2kbt n TYR 826 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 2kbt n TYR 826 Cb 0.50 -3.48 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 -0.59 0.75 3.57 2.72 0.00 -1.26 -5.03 105.19 105.35 2kbt n GLY 827 Ca -0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.49 3.81 0.47 1.61 0.52 0.89 -5.07 118.95 120.69 2kbt s ARG 828 Ca 0.00 -0.27 -0.05 0.00 -0.52 0.00 0.00 55.73 54.89 2kbt s ARG 828 Cb 0.00 -3.72 -0.04 0.00 0.52 0.00 0.00 34.95 31.71 2kbt s ARG 828 CO 0.00 -0.34 0.78 0.42 0.02 0.00 0.00 175.30 176.17 2kbt s ILE 829 N 1.94 4.91 -2.59 1.52 -1.09 -1.26 -0.42 121.20 124.20 2kbt s ILE 829 Ca 0.11 0.22 0.00 0.00 -2.23 0.00 0.00 60.65 58.75 2kbt s ILE 829 Cb -0.16 -3.85 0.00 0.00 -1.58 0.00 0.00 42.46 36.86 2kbt s ILE 829 CO 0.11 -0.81 0.00 0.61 -1.23 0.00 0.00 174.94 173.62 2kbt n GLY 830 N -2.16 -2.00 3.45 6.18 0.00 -1.20 -4.77 105.19 104.70 2kbt n GLY 830 Ca 0.01 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.08 2.44 0.03 1.61 0.52 -1.04 -3.14 118.94 117.28 2kbt s TRP 831 Ca 0.00 -0.31 -0.24 0.00 0.02 0.00 0.00 56.10 55.57 2kbt s TRP 831 Cb 0.00 -1.30 0.06 0.00 -1.15 0.00 0.00 33.47 31.07 2kbt s TRP 831 CO 0.00 0.37 0.55 -0.59 0.02 0.00 0.00 176.95 177.30 2kbt s PHE 832 N -1.13 -0.47 0.45 -1.98 -0.71 -1.02 0.10 117.98 113.22 2kbt s PHE 832 Ca 0.16 0.61 -0.22 0.00 -1.04 0.00 0.00 56.93 56.45 2kbt s PHE 832 Cb -0.10 0.36 -0.09 0.00 -1.21 0.00 0.00 43.02 41.98 2kbt s PHE 832 CO 0.08 -0.63 1.05 -1.25 -1.34 0.00 0.00 175.22 173.13 2kbt s PRO 833 N -2.14 3.95 0.00 1.99 0.04 -1.26 -0.15 135.00 137.43 2kbt s PRO 833 Ca -0.07 1.43 0.21 0.00 0.04 0.00 0.00 61.00 62.61 2kbt s PRO 833 Cb -0.01 -2.28 0.90 0.00 0.04 0.00 0.00 34.50 33.15 2kbt s PRO 833 CO 0.01 -0.31 1.63 -1.13 0.04 0.00 0.00 177.00 177.23 2kbt n SER 834 N -0.59 1.11 0.00 6.66 3.41 -1.26 -3.10 113.62 119.86 2kbt n SER 834 Ca 0.07 -1.59 0.11 0.00 -0.26 0.00 0.00 58.87 57.20 2kbt n SER 834 Cb 0.51 -0.06 -0.00 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.05 0.76 -0.31 4.04 3.02 -1.26 -3.97 115.26 117.49 2kbt n ASN 835 Ca 0.16 -0.64 0.07 0.00 -0.03 0.00 0.00 54.58 54.14 2kbt n ASN 835 Cb 0.25 0.81 -0.00 0.00 -0.61 0.00 0.00 39.78 40.23 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 -1.60 0.00 -4.54 3.10 4.02 -1.18 -5.00 117.16 111.96 2kbt n TYR 836 Ca 0.04 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.69 2kbt n TYR 836 Cb 0.36 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.63 2kbt n TYR 836 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2kbt n VAL 837 N -0.17 0.00 -4.68 -0.72 0.24 -1.24 -0.16 118.33 111.61 2kbt n VAL 837 Ca 0.06 -1.84 -0.30 0.00 -2.04 0.00 0.00 64.34 60.22 2kbt n VAL 837 Cb 0.29 0.44 -0.09 0.00 -1.47 0.00 0.00 33.84 33.01 2kbt n VAL 837 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2kbt s GLU 838 N -3.36 2.07 -0.15 7.34 0.41 0.18 -4.76 118.70 120.44 2kbt s GLU 838 Ca 0.04 -2.28 -0.12 0.00 -0.41 0.00 0.00 54.97 52.20 2kbt s GLU 838 Cb 0.00 -1.38 0.04 0.00 -1.78 0.00 0.00 34.13 31.01 2kbt s GLU 838 CO 0.03 -0.30 0.38 -1.21 -0.49 0.00 0.00 175.26 173.67 2kbt s GLU 839 N -3.82 0.43 -0.04 1.61 0.41 -1.26 -3.65 118.70 112.39 2kbt s GLU 839 Ca 0.17 0.57 0.00 0.00 -0.41 0.00 0.00 54.97 55.30 2kbt s GLU 839 Cb 0.04 0.17 0.00 0.00 -1.78 0.00 0.00 34.13 32.56 2kbt s GLU 839 CO 0.09 -0.07 0.00 -3.47 -0.49 0.00 0.00 175.26 171.31 2kbt n ASP 840 N 3.14 -1.10 -0.29 -0.19 2.03 -1.26 -4.71 116.55 114.16 2kbt n ASP 840 Ca -0.15 0.49 0.02 0.00 0.52 0.00 0.00 54.79 55.67 2kbt n ASP 840 Cb 0.57 -1.08 0.22 0.00 -0.72 0.00 0.00 41.12 40.11 2kbt n ASP 840 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 2kbt h TYR 841 N 0.00 1.05 -2.36 -0.67 -0.00 -1.89 -3.42 116.97 109.67 2kbt h TYR 841 Ca -0.01 0.03 -0.07 0.00 0.00 0.00 0.00 58.73 58.68 2kbt h TYR 841 Cb 1.00 -0.35 -0.23 0.00 0.00 0.00 0.00 36.73 37.15 2kbt h TYR 841 CO 0.89 0.59 -0.09 -1.54 -0.00 0.00 0.00 178.16 178.01 2kbt s SER 842 N -6.11 -0.64 0.31 0.10 1.04 -1.26 -5.17 113.70 101.97 2kbt s SER 842 Ca -0.12 1.16 0.00 0.00 0.48 0.00 0.00 55.95 57.48 2kbt s SER 842 Cb 0.19 1.12 -0.04 0.00 0.10 0.00 0.00 66.02 67.39 2kbt s SER 842 CO 0.80 -0.20 0.51 -0.70 0.98 0.00 0.00 173.24 174.63 2kbt s GLU 843 N 0.80 3.50 -0.25 4.02 2.12 -1.26 -4.98 118.70 122.64 2kbt s GLU 843 Ca -0.04 -0.34 -0.01 0.00 0.36 0.00 0.00 54.97 54.94 2kbt s GLU 843 Cb -0.05 -2.70 0.13 0.00 0.26 0.00 0.00 34.13 31.76 2kbt s GLU 843 CO -0.06 0.21 2.19 2.48 -0.54 0.00 0.00 175.26 179.54 2kbt n TYR 844 N -1.51 1.16 -1.08 5.30 4.11 -1.26 -4.98 117.16 118.89 2kbt n TYR 844 Ca -0.05 -1.75 -0.35 0.00 -0.00 0.00 0.00 57.90 55.75 2kbt n TYR 844 Cb 0.56 -0.95 0.02 0.00 -0.00 0.00 0.00 39.34 38.97 2kbt n TYR 844 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 2kbt n LEU 845 N 0.75 -4.20 -4.80 -3.48 4.77 -1.26 -4.87 117.00 103.90 2kbt n LEU 845 Ca 0.27 0.46 -0.33 0.00 -0.03 0.00 0.00 56.01 56.37 2kbt n LEU 845 Cb 0.58 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.89 2kbt n LEU 845 CO 0.28 -4.89 0.71 -2.16 -1.33 0.00 0.00 177.39 170.01 2kbt s PRO 846 N -1.26 3.58 0.33 3.23 0.04 -1.26 -5.03 135.00 134.62 2kbt s PRO 846 Ca 0.48 1.25 -0.20 0.00 0.04 0.00 0.00 61.00 62.57 2kbt s PRO 846 Cb -0.36 -2.07 -0.10 0.00 0.04 0.00 0.00 34.50 32.02 2kbt s PRO 846 CO 0.67 -0.60 0.84 -1.21 0.04 0.00 0.00 177.00 176.74 2kbt s GLU 847 N -3.71 4.27 0.00 4.56 8.01 -1.26 -5.28 118.70 125.30 2kbt s GLU 847 Ca 0.65 1.00 0.00 0.00 0.01 0.00 0.00 54.97 56.63 2kbt s GLU 847 Cb -0.16 -2.56 0.00 0.00 -4.31 0.00 0.00 34.13 27.11 2kbt s GLU 847 CO 0.29 0.19 0.40 2.41 0.01 0.00 0.00 175.26 178.56