#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kbt s PRO 781 N 0.00 3.02 0.00 1.61 0.04 -1.26 -4.74 135.00 133.67 2kbt s PRO 781 Ca 0.00 -0.37 0.00 0.00 0.04 0.00 0.00 61.00 60.67 2kbt s PRO 781 Cb 0.00 -4.85 0.00 0.00 0.04 0.00 0.00 34.50 29.69 2kbt s PRO 781 CO 0.00 -2.64 0.00 0.41 0.04 0.00 0.00 177.00 174.81 2kbt n GLY 782 N 6.35 2.36 0.20 0.56 0.00 -1.26 -5.08 105.19 108.33 2kbt n GLY 782 Ca 0.27 0.28 -0.07 0.00 0.00 0.00 0.00 46.02 46.50 2kbt n GLY 782 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2kbt h THR 783 N 0.00 0.00 -3.95 2.61 2.02 -2.01 -3.46 112.91 108.12 2kbt h THR 783 Ca 0.00 -0.60 -0.29 0.00 0.77 0.00 0.00 66.41 66.30 2kbt h THR 783 Cb 0.00 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.39 2kbt h THR 783 CO 0.00 0.00 -0.38 0.49 0.37 0.00 0.00 175.52 176.00 2kbt n PHE 784 N -4.82 -1.44 0.00 3.16 3.01 -1.26 -4.90 117.46 111.21 2kbt n PHE 784 Ca -0.05 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.48 2kbt n PHE 784 Cb 0.17 -2.99 0.00 0.00 -0.01 0.00 0.00 39.48 36.65 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 -0.90 0.63 3.71 1.37 0.00 -1.26 -4.13 105.19 104.60 2kbt n GLY 785 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.18 0.00 -0.25 2.61 -4.23 -1.26 -3.08 115.64 109.25 2kbt s THR 786 Ca 0.00 -1.23 -0.03 0.00 -1.18 0.00 0.00 61.69 59.25 2kbt s THR 786 Cb 0.00 -2.14 0.11 0.00 1.34 0.00 0.00 72.50 71.81 2kbt s THR 786 CO 0.00 0.00 0.24 0.00 -0.54 0.00 0.00 174.62 174.32 2kbt s ALA 787 N -3.93 -0.26 -0.02 3.99 0.00 0.30 -3.79 121.76 118.05 2kbt s ALA 787 Ca 0.18 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.73 2kbt s ALA 787 Cb -0.03 -1.53 -0.06 0.00 0.00 0.00 0.00 23.12 21.51 2kbt s ALA 787 CO 0.08 -1.46 1.54 0.21 0.00 0.00 0.00 175.76 176.14 2kbt s LYS 788 N 2.32 4.22 0.26 0.00 2.20 0.49 0.32 119.74 129.55 2kbt s LYS 788 Ca 0.08 2.11 -0.29 0.00 -0.36 0.00 0.00 55.97 57.50 2kbt s LYS 788 Cb -0.15 -3.75 -0.09 0.00 -1.51 0.00 0.00 37.83 32.33 2kbt s LYS 788 CO -0.23 -0.72 1.19 0.00 -0.36 0.00 0.00 175.35 175.22 2kbt s ALA 789 N 3.16 3.45 -1.51 3.13 0.00 -0.18 0.35 121.76 130.15 2kbt s ALA 789 Ca 0.69 1.01 0.14 0.00 0.00 0.00 0.00 51.96 53.81 2kbt s ALA 789 Cb -0.33 -3.40 0.04 0.00 0.00 0.00 0.00 23.12 19.44 2kbt s ALA 789 CO 0.28 -0.36 0.85 0.54 0.00 0.00 0.00 175.76 177.08 2kbt n ARG 790 N 1.55 1.52 -3.66 0.00 5.12 0.49 -3.38 116.66 118.30 2kbt n ARG 790 Ca 0.01 -0.99 -0.08 0.00 -1.93 0.00 0.00 57.85 54.86 2kbt n ARG 790 Cb 0.44 -1.24 -0.08 0.00 -1.16 0.00 0.00 32.46 30.42 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 -1.52 -0.92 0.04 -1.55 2.02 -1.22 -4.89 117.35 109.31 2kbt s TYR 791 Ca 0.14 1.83 -0.30 0.00 -0.37 0.00 0.00 57.07 58.37 2kbt s TYR 791 Cb 0.12 0.51 -0.08 0.00 -0.40 0.00 0.00 41.96 42.11 2kbt s TYR 791 CO 0.29 -0.48 1.71 0.16 -1.57 0.00 0.00 175.55 175.66 2kbt s ASP 792 N 1.74 6.58 -0.29 2.29 -4.77 -1.26 -4.49 116.67 116.47 2kbt s ASP 792 Ca -0.09 2.48 -0.05 0.00 -3.30 0.00 0.00 52.55 51.59 2kbt s ASP 792 Cb -0.07 -2.55 0.02 0.00 -1.09 0.00 0.00 42.92 39.23 2kbt s ASP 792 CO -0.17 -0.93 0.04 0.12 0.70 0.00 0.00 175.17 174.93 2kbt s PHE 793 N 3.23 3.17 -0.54 2.11 5.36 -0.95 -4.91 117.98 125.44 2kbt s PHE 793 Ca 0.76 -1.32 -0.27 0.00 -0.96 0.00 0.00 56.93 55.14 2kbt s PHE 793 Cb -0.39 -2.19 0.03 0.00 -0.34 0.00 0.00 43.02 40.13 2kbt s PHE 793 CO 0.33 -0.67 1.10 0.00 -1.46 0.00 0.00 175.22 174.52 2kbt s ALA 795 N 4.51 3.49 -0.26 0.00 0.00 -1.26 -4.91 121.76 123.33 2kbt s ALA 795 Ca 0.40 1.16 0.07 0.00 0.00 0.00 0.00 51.96 53.60 2kbt s ALA 795 Cb -0.09 -3.45 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 2kbt s ALA 795 CO 0.25 -0.53 0.26 2.89 0.00 0.00 0.00 175.76 178.64 2kbt n ARG 796 N 1.30 3.79 -4.03 0.00 -4.01 -1.26 -5.02 116.66 107.43 2kbt n ARG 796 Ca 0.01 -0.01 -0.08 0.00 -1.04 0.00 0.00 57.85 56.73 2kbt n ARG 796 Cb 0.42 -0.90 -0.10 0.00 -3.04 0.00 0.00 32.46 28.85 2kbt n ARG 796 CO 0.00 0.00 0.00 0.34 -3.04 0.00 0.00 177.63 174.93 2kbt s ASP 797 N -1.89 0.37 0.15 2.89 2.15 -1.26 -5.01 116.67 114.07 2kbt s ASP 797 Ca 0.02 -0.76 0.14 0.00 0.43 0.00 0.00 52.55 52.38 2kbt s ASP 797 Cb 0.05 0.16 0.67 0.00 -0.30 0.00 0.00 42.92 43.50 2kbt s ASP 797 CO 0.28 -0.46 1.43 -2.11 -0.17 0.00 0.00 175.17 174.14 2kbt n ARG 798 N 0.79 0.08 -0.10 4.34 0.00 -1.26 -0.50 116.66 120.01 2kbt n ARG 798 Ca -0.19 0.49 0.06 0.00 -0.00 0.00 0.00 57.85 58.22 2kbt n ARG 798 Cb 0.58 -1.72 0.23 0.00 -0.00 0.00 0.00 32.46 31.55 2kbt n ARG 798 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2kbt n SER 799 N -1.89 1.28 -4.35 2.89 3.41 -1.26 -4.66 113.62 109.04 2kbt n SER 799 Ca 0.01 -1.86 -0.25 0.00 -0.26 0.00 0.00 58.87 56.50 2kbt n SER 799 Cb 0.08 -0.13 -0.12 0.00 -0.26 0.00 0.00 64.21 63.78 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 -1.73 1.30 -0.12 4.33 2.56 0.34 -3.11 118.70 122.27 2kbt s GLU 800 Ca 0.22 -1.33 -0.06 0.00 0.00 0.00 0.00 54.97 53.80 2kbt s GLU 800 Cb 0.11 -1.59 -0.04 0.00 2.00 0.00 0.00 34.13 34.62 2kbt s GLU 800 CO 0.16 0.36 0.10 -1.17 -0.56 0.00 0.00 175.26 174.15 2kbt s LEU 801 N -2.25 4.14 -0.57 2.70 0.20 0.95 -4.14 118.68 119.71 2kbt s LEU 801 Ca 0.13 0.34 -0.28 0.00 0.69 0.00 0.00 54.13 55.01 2kbt s LEU 801 Cb -0.09 -2.00 0.03 0.00 -0.43 0.00 0.00 46.19 43.70 2kbt s LEU 801 CO 0.06 0.37 1.17 -0.55 -0.29 0.00 0.00 176.35 177.11 2kbt s SER 802 N -0.77 6.45 0.27 3.68 0.15 -1.26 -4.51 113.70 117.71 2kbt s SER 802 Ca 0.13 0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.88 2kbt s SER 802 Cb -0.12 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 2kbt s SER 802 CO 0.03 -1.45 0.47 -0.76 1.20 0.00 0.00 173.24 172.73 2kbt s LEU 803 N 4.85 4.13 -0.26 3.45 1.02 -0.83 -4.86 118.68 126.18 2kbt s LEU 803 Ca 0.42 0.45 -0.03 0.00 0.02 0.00 0.00 54.13 55.00 2kbt s LEU 803 Cb -0.08 -3.26 0.15 0.00 0.02 0.00 0.00 46.19 43.02 2kbt s LEU 803 CO 0.26 -0.16 0.48 -0.75 0.02 0.00 0.00 176.35 176.20 2kbt s LYS 804 N -3.74 0.44 0.12 1.70 2.36 -1.26 -2.24 119.74 117.13 2kbt s LYS 804 Ca 0.40 0.81 -0.30 0.00 -2.55 0.00 0.00 55.97 54.33 2kbt s LYS 804 Cb -0.10 0.06 -0.17 0.00 -1.05 0.00 0.00 37.83 36.57 2kbt s LYS 804 CO 0.31 -0.57 0.67 0.39 1.55 0.00 0.00 175.35 177.71 2kbt n GLU 805 N 5.40 0.00 -0.71 4.03 1.02 -1.26 -0.32 120.64 128.80 2kbt n GLU 805 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 2kbt n GLU 805 Cb 0.50 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.81 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 1.73 0.74 3.80 0.62 0.00 -1.22 -4.97 105.19 105.90 2kbt n GLY 806 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.47 5.02 -0.05 1.61 -0.00 0.56 -4.99 116.67 116.35 2kbt s ASP 807 Ca 0.00 -0.62 0.05 0.00 -0.00 0.00 0.00 52.55 51.97 2kbt s ASP 807 Cb 0.00 -0.86 -0.02 0.00 -0.00 0.00 0.00 42.92 42.04 2kbt s ASP 807 CO 0.00 -0.34 -0.18 0.27 -0.00 0.00 0.00 175.17 174.92 2kbt s ILE 808 N -2.36 2.69 -0.30 0.77 -0.00 -1.26 -1.01 121.20 119.72 2kbt s ILE 808 Ca 0.40 -0.85 -0.07 0.00 -0.00 0.00 0.00 60.65 60.12 2kbt s ILE 808 Cb -0.04 -2.03 0.01 0.00 -0.00 0.00 0.00 42.46 40.40 2kbt s ILE 808 CO 0.25 0.58 0.09 -0.63 -0.00 0.00 0.00 174.94 175.23 2kbt s ILE 809 N -0.50 4.05 -0.25 8.37 1.09 0.15 -4.82 121.20 129.29 2kbt s ILE 809 Ca 0.06 -0.67 -0.29 0.00 -1.10 0.00 0.00 60.65 58.66 2kbt s ILE 809 Cb -0.12 -3.09 -0.02 0.00 -1.06 0.00 0.00 42.46 38.17 2kbt s ILE 809 CO 0.01 0.07 1.68 -0.75 -0.10 0.00 0.00 174.94 175.85 2kbt s LYS 810 N 1.51 3.66 -0.10 2.79 2.47 -1.11 0.11 119.74 129.07 2kbt s LYS 810 Ca 0.03 1.61 -0.30 0.00 -1.56 0.00 0.00 55.97 55.75 2kbt s LYS 810 Cb -0.17 -4.09 -0.03 0.00 -1.46 0.00 0.00 37.83 32.08 2kbt s LYS 810 CO 0.03 -1.46 1.35 0.42 0.16 0.00 0.00 175.35 175.85 2kbt s ILE 811 N 5.71 4.04 -0.10 5.43 -1.09 -1.18 -2.80 121.20 131.22 2kbt s ILE 811 Ca 0.75 1.31 -0.04 0.00 -2.23 0.00 0.00 60.65 60.43 2kbt s ILE 811 Cb -0.25 -3.85 -0.05 0.00 -1.58 0.00 0.00 42.46 36.74 2kbt s ILE 811 CO 0.31 -0.08 -0.13 0.18 -1.23 0.00 0.00 174.94 174.00 2kbt n LEU 812 N 6.28 0.94 -4.37 2.97 4.77 -0.11 -4.46 117.00 123.02 2kbt n LEU 812 Ca 0.14 0.11 -0.26 0.00 -0.03 0.00 0.00 56.01 55.96 2kbt n LEU 812 Cb 0.44 -0.30 -0.12 0.00 -2.33 0.00 0.00 43.42 41.11 2kbt n LEU 812 CO 0.57 0.26 -0.53 0.21 -1.33 0.00 0.00 177.39 176.57 2kbt s ASN 813 N -5.81 3.09 -0.45 -1.43 2.47 -1.05 -4.99 114.94 106.78 2kbt s ASN 813 Ca -0.14 -0.79 0.04 0.00 0.42 0.00 0.00 52.86 52.39 2kbt s ASN 813 Cb 0.05 -0.20 0.17 0.00 -1.45 0.00 0.00 41.25 39.81 2kbt s ASN 813 CO 0.18 0.10 0.35 -0.54 -3.72 0.00 0.00 177.10 173.47 2kbt s LYS 814 N -2.32 1.09 0.56 0.43 1.02 -1.26 -2.10 119.74 117.16 2kbt s LYS 814 Ca 0.15 -2.21 0.50 0.00 0.02 0.00 0.00 55.97 54.43 2kbt s LYS 814 Cb -0.09 -1.70 1.74 0.00 -0.52 0.00 0.00 37.83 37.26 2kbt s LYS 814 CO 0.07 -1.35 1.58 0.87 -0.92 0.00 0.00 175.35 175.59 2kbt h LYS 815 N 5.75 0.00 0.00 1.68 1.79 -1.98 -3.44 116.57 120.37 2kbt h LYS 815 Ca 0.23 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 2kbt h LYS 815 Cb 0.89 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 2kbt h LYS 815 CO 0.41 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.19 2kbt n GLY 816 N -1.92 2.09 3.08 3.86 0.00 -1.26 -5.02 105.19 106.01 2kbt n GLY 816 Ca 0.44 -0.61 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2kbt n GLY 816 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2kbt n GLN 817 N 0.00 -1.11 -1.04 1.61 7.27 -1.26 -4.75 117.38 118.09 2kbt n GLN 817 Ca 0.00 -0.32 -0.17 0.00 0.07 0.00 0.00 57.00 56.58 2kbt n GLN 817 Cb 0.00 -1.36 -0.03 0.00 2.41 0.00 0.00 30.24 31.26 2kbt n GLN 817 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2kbt n GLN 818 N -0.18 1.91 0.00 3.69 6.02 -1.26 -4.55 117.38 123.02 2kbt n GLN 818 Ca 0.01 -1.49 0.00 0.00 -0.01 0.00 0.00 57.00 55.51 2kbt n GLN 818 Cb 0.55 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 30.05 2kbt n GLN 818 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kbt n GLY 819 N 1.04 0.14 3.30 1.08 0.00 -1.26 -4.93 105.19 104.55 2kbt n GLY 819 Ca 0.34 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.22 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 0.20 1.17 -0.01 1.61 -2.14 -1.26 -4.02 118.94 114.48 2kbt s TRP 820 Ca 0.00 -1.34 0.03 0.00 2.66 0.00 0.00 56.10 57.45 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 -0.09 -1.58 -2.66 0.00 0.00 176.95 171.84 2kbt s TRP 821 N -3.89 0.82 0.24 1.66 0.51 0.76 -4.20 118.94 114.84 2kbt s TRP 821 Ca 0.36 -0.16 -0.26 0.00 -2.12 0.00 0.00 56.10 53.91 2kbt s TRP 821 Cb 0.04 -0.54 -0.09 0.00 -0.81 0.00 0.00 33.47 32.07 2kbt s TRP 821 CO 0.16 -0.03 0.87 0.50 -0.51 0.00 0.00 176.95 177.94 2kbt s ARG 822 N -0.13 4.64 0.00 4.98 3.52 -0.89 -2.90 118.95 128.17 2kbt s ARG 822 Ca 0.02 1.28 0.00 0.00 -0.13 0.00 0.00 55.73 56.91 2kbt s ARG 822 Cb -0.04 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.25 2kbt s ARG 822 CO -0.00 0.45 0.00 0.41 -0.81 0.00 0.00 175.30 175.35 2kbt n GLY 823 N 1.18 1.96 3.44 8.12 0.00 -1.20 -0.94 105.19 117.74 2kbt n GLY 823 Ca -0.02 -0.81 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 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 -0.27 1.18 -0.17 1.61 2.12 -1.12 -2.82 118.70 119.24 2kbt s GLU 824 Ca 0.00 -0.38 -0.12 0.00 0.36 0.00 0.00 54.97 54.83 2kbt s GLU 824 Cb 0.00 0.55 0.05 0.00 0.26 0.00 0.00 34.13 34.99 2kbt s GLU 824 CO 0.00 -0.51 0.43 0.42 -0.54 0.00 0.00 175.26 175.06 2kbt s ILE 825 N -3.43 -0.01 -1.24 -3.70 1.01 -0.04 -2.77 121.20 111.02 2kbt s ILE 825 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.70 2kbt s ILE 825 Cb -0.01 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.85 2kbt s ILE 825 CO -0.10 0.02 0.00 -1.22 0.00 0.00 0.00 174.94 173.63 2kbt n TYR 826 N 3.53 -0.14 -0.57 3.97 4.01 -1.26 0.63 117.16 127.32 2kbt n TYR 826 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2kbt n TYR 826 Cb 0.56 -2.61 0.00 0.00 -0.31 0.00 0.00 39.34 36.98 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 0.03 0.81 3.22 2.72 0.00 -1.26 -5.06 105.19 105.65 2kbt n GLY 827 Ca -0.12 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.25 3.05 0.34 1.61 1.81 0.20 -5.11 118.95 119.61 2kbt s ARG 828 Ca 0.00 -0.83 -0.11 0.00 -1.72 0.00 0.00 55.73 53.07 2kbt s ARG 828 Cb 0.00 -2.92 -0.07 0.00 -0.45 0.00 0.00 34.95 31.51 2kbt s ARG 828 CO 0.00 -0.29 0.71 0.42 -0.68 0.00 0.00 175.30 175.45 2kbt s ILE 829 N 1.37 4.79 -0.71 1.52 -1.09 -1.26 -0.86 121.20 124.96 2kbt s ILE 829 Ca 0.03 0.66 0.00 0.00 -2.23 0.00 0.00 60.65 59.11 2kbt s ILE 829 Cb -0.15 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 2kbt s ILE 829 CO -0.06 -0.32 0.00 0.61 -1.23 0.00 0.00 174.94 173.94 2kbt n GLY 830 N -0.77 -0.87 3.27 6.18 0.00 -1.13 -4.63 105.19 107.24 2kbt n GLY 830 Ca 0.02 -0.75 -0.17 0.00 0.00 0.00 0.00 46.02 45.12 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 1.44 -0.01 1.61 0.52 -1.18 -3.28 118.94 115.05 2kbt s TRP 831 Ca 0.00 -0.61 -0.29 0.00 0.02 0.00 0.00 56.10 55.22 2kbt s TRP 831 Cb 0.00 -0.73 0.08 0.00 -1.15 0.00 0.00 33.47 31.67 2kbt s TRP 831 CO 0.00 0.18 0.72 -0.59 0.02 0.00 0.00 176.95 177.28 2kbt s PHE 832 N -2.62 -0.56 0.44 -1.98 -0.71 -1.14 -0.03 117.98 111.37 2kbt s PHE 832 Ca 0.14 0.79 -0.22 0.00 -1.04 0.00 0.00 56.93 56.60 2kbt s PHE 832 Cb -0.02 0.46 -0.09 0.00 -1.21 0.00 0.00 43.02 42.16 2kbt s PHE 832 CO 0.03 -0.63 1.05 -1.25 -1.34 0.00 0.00 175.22 173.08 2kbt s PRO 833 N -1.96 3.98 0.00 1.99 0.04 -1.26 -0.17 135.00 137.62 2kbt s PRO 833 Ca -0.05 1.44 0.22 0.00 0.04 0.00 0.00 61.00 62.65 2kbt s PRO 833 Cb -0.00 -2.32 1.02 0.00 0.04 0.00 0.00 34.50 33.23 2kbt s PRO 833 CO 0.02 -0.29 1.69 0.45 0.04 0.00 0.00 177.00 178.91 2kbt n SER 834 N -0.51 0.86 -0.17 6.66 2.88 -1.26 -2.97 113.62 119.11 2kbt n SER 834 Ca 0.07 -1.51 0.11 0.00 -1.33 0.00 0.00 58.87 56.21 2kbt n SER 834 Cb 0.51 -0.04 0.04 0.00 -0.75 0.00 0.00 64.21 63.97 2kbt n SER 834 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2kbt n ASN 835 N -0.24 1.21 -0.02 -3.46 3.02 -1.26 -4.02 115.26 110.50 2kbt n ASN 835 Ca 0.16 -1.00 0.04 0.00 -0.03 0.00 0.00 54.58 53.75 2kbt n ASN 835 Cb 0.21 0.61 -0.05 0.00 -0.61 0.00 0.00 39.78 39.94 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 -0.97 0.00 -4.45 3.10 4.02 -1.16 -5.01 117.16 112.69 2kbt n TYR 836 Ca 0.07 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.73 2kbt n TYR 836 Cb 0.37 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.59 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 -1.77 2.16 -0.07 -0.72 -7.23 -1.22 -0.38 120.40 111.17 2kbt s VAL 837 Ca 0.04 -2.29 -0.00 0.00 -1.81 0.00 0.00 61.98 57.92 2kbt s VAL 837 Cb 0.07 -2.34 0.02 0.00 0.56 0.00 0.00 36.38 34.69 2kbt s VAL 837 CO 0.34 -0.39 -0.03 -1.61 -0.31 0.00 0.00 175.10 173.11 2kbt s GLU 838 N -3.59 0.86 0.53 4.82 0.41 0.15 -4.83 118.70 117.05 2kbt s GLU 838 Ca 0.29 -0.04 0.03 0.00 -0.41 0.00 0.00 54.97 54.84 2kbt s GLU 838 Cb -0.01 -1.03 0.03 0.00 -1.78 0.00 0.00 34.13 31.34 2kbt s GLU 838 CO 0.13 -0.21 0.26 -0.85 -0.49 0.00 0.00 175.26 174.10 2kbt n GLU 839 N 4.69 0.72 -4.23 1.61 0.28 -1.26 0.18 120.64 122.63 2kbt n GLU 839 Ca -0.15 -3.51 -0.33 0.00 -0.16 0.00 0.00 57.16 53.02 2kbt n GLU 839 Cb 0.50 0.59 -0.07 0.00 1.43 0.00 0.00 31.44 33.89 2kbt n GLU 839 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2kbt n ASP 840 N -1.64 -0.02 -0.08 -1.84 2.03 -1.25 -4.82 116.55 108.93 2kbt n ASP 840 Ca -0.09 -1.25 -0.09 0.00 0.52 0.00 0.00 54.79 53.88 2kbt n ASP 840 Cb 0.63 -1.80 -0.10 0.00 -0.72 0.00 0.00 41.12 39.13 2kbt n ASP 840 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kbt n TYR 841 N -4.63 0.00 -3.69 -0.67 0.18 -1.26 -5.02 117.16 102.06 2kbt n TYR 841 Ca -0.29 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.36 2kbt n TYR 841 Cb 0.68 -0.69 -0.09 0.00 -0.38 0.00 0.00 39.34 38.85 2kbt n TYR 841 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2kbt s SER 842 N -5.18 -0.56 0.45 9.48 1.04 -1.26 -5.17 113.70 112.50 2kbt s SER 842 Ca -0.15 1.04 0.05 0.00 0.48 0.00 0.00 55.95 57.38 2kbt s SER 842 Cb 0.05 1.03 0.05 0.00 0.10 0.00 0.00 66.02 67.25 2kbt s SER 842 CO 0.51 -0.18 0.44 -0.62 0.98 0.00 0.00 173.24 174.36 2kbt n GLU 843 N 3.13 0.78 -1.85 4.02 1.02 -1.26 -5.02 120.64 121.46 2kbt n GLU 843 Ca -0.15 -2.70 -0.36 0.00 -0.02 0.00 0.00 57.16 53.93 2kbt n GLU 843 Cb 0.56 0.13 0.04 0.00 -0.02 0.00 0.00 31.44 32.16 2kbt n GLU 843 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2kbt n TYR 844 N -1.71 3.10 -1.10 -0.32 9.36 -1.26 -5.04 117.16 120.18 2kbt n TYR 844 Ca 0.03 -2.62 -0.37 0.00 3.32 0.00 0.00 57.90 58.26 2kbt n TYR 844 Cb 0.50 -1.04 0.04 0.00 -0.63 0.00 0.00 39.34 38.20 2kbt n TYR 844 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2kbt n LEU 845 N -0.65 -4.28 -4.74 2.98 7.99 -1.26 -4.85 117.00 112.19 2kbt n LEU 845 Ca 0.54 0.39 -0.41 0.00 -0.01 0.00 0.00 56.01 56.52 2kbt n LEU 845 Cb 0.46 -0.86 -0.04 0.00 -0.11 0.00 0.00 43.42 42.87 2kbt n LEU 845 CO 0.55 -5.22 0.80 -2.16 -1.51 0.00 0.00 177.39 169.86 2kbt s PRO 846 N -1.80 4.61 0.86 3.23 0.04 -1.26 -5.04 135.00 135.64 2kbt s PRO 846 Ca 0.49 1.75 -0.13 0.00 0.04 0.00 0.00 61.00 63.16 2kbt s PRO 846 Cb -0.31 -3.25 0.11 0.00 0.04 0.00 0.00 34.50 31.10 2kbt s PRO 846 CO 0.74 0.12 1.18 -1.21 0.04 0.00 0.00 177.00 177.86 2kbt s GLU 847 N -0.72 1.51 0.00 4.56 8.01 -1.26 -5.29 118.70 125.51 2kbt s GLU 847 Ca 0.48 0.11 0.22 0.00 0.01 0.00 0.00 54.97 55.79 2kbt s GLU 847 Cb -0.30 -1.90 1.32 0.00 -4.31 0.00 0.00 34.13 28.94 2kbt s GLU 847 CO 0.37 -1.91 1.70 0.25 0.01 0.00 0.00 175.26 175.67