#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 3.82 0.00 1.61 0.04 -1.26 -5.06 135.00 134.15 2kbt s PRO 781 Ca 0.00 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.40 2kbt s PRO 781 Cb 0.00 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2kbt s PRO 781 CO 0.00 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.03 2kbt n GLY 782 N -0.24 0.60 0.13 0.56 0.00 -1.26 -5.02 105.19 99.96 2kbt n GLY 782 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 1.69 -0.48 2.61 -1.04 -1.26 -4.96 114.28 110.85 2kbt n THR 783 Ca 0.00 -0.65 -0.16 0.00 -2.04 0.00 0.00 64.05 61.19 2kbt n THR 783 Cb 0.00 -1.57 0.15 0.00 -1.82 0.00 0.00 70.33 67.08 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 -3.38 -3.24 0.00 -1.42 3.72 -1.26 -5.05 117.46 106.83 2kbt n PHE 784 Ca -0.34 -0.49 0.00 0.00 -0.05 0.00 0.00 57.45 56.57 2kbt n PHE 784 Cb 1.04 -0.64 0.00 0.00 -0.94 0.00 0.00 39.48 38.94 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 -2.23 0.77 3.64 1.37 0.00 -1.26 -5.05 105.19 102.43 2kbt n GLY 785 Ca 0.08 0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.23 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 1.26 0.00 -0.22 2.61 -4.23 -1.26 -3.08 115.64 110.72 2kbt s THR 786 Ca 0.00 -1.34 -0.03 0.00 -1.18 0.00 0.00 61.69 59.14 2kbt s THR 786 Cb 0.00 -2.20 0.10 0.00 1.34 0.00 0.00 72.50 71.74 2kbt s THR 786 CO 0.00 0.00 0.22 0.00 -0.54 0.00 0.00 174.62 174.30 2kbt s ALA 787 N -3.93 -0.22 0.16 3.99 0.00 0.24 -3.98 121.76 118.02 2kbt s ALA 787 Ca 0.21 0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.89 2kbt s ALA 787 Cb -0.02 -1.40 -0.09 0.00 0.00 0.00 0.00 23.12 21.61 2kbt s ALA 787 CO 0.09 -1.33 1.46 0.21 0.00 0.00 0.00 175.76 176.19 2kbt s LYS 788 N 2.31 4.27 0.11 0.00 2.20 0.49 0.20 119.74 129.32 2kbt s LYS 788 Ca 0.07 2.22 -0.30 0.00 -0.36 0.00 0.00 55.97 57.60 2kbt s LYS 788 Cb -0.15 -3.19 -0.06 0.00 -1.51 0.00 0.00 37.83 32.92 2kbt s LYS 788 CO -0.18 -0.49 1.05 0.00 -0.36 0.00 0.00 175.35 175.37 2kbt s ALA 789 N 0.91 3.30 -2.35 3.13 0.00 0.01 0.13 121.76 126.90 2kbt s ALA 789 Ca 0.66 0.70 0.19 0.00 0.00 0.00 0.00 51.96 53.50 2kbt s ALA 789 Cb -0.40 -3.34 0.15 0.00 0.00 0.00 0.00 23.12 19.52 2kbt s ALA 789 CO 0.33 -0.18 1.09 0.54 0.00 0.00 0.00 175.76 177.54 2kbt n ARG 790 N 2.96 1.62 -3.64 0.00 5.12 0.24 -3.19 116.66 119.77 2kbt n ARG 790 Ca 0.04 -1.61 -0.07 0.00 -1.93 0.00 0.00 57.85 54.29 2kbt n ARG 790 Cb 0.48 -1.36 -0.07 0.00 -1.16 0.00 0.00 32.46 30.35 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 -1.59 -1.06 -0.32 -1.55 2.02 -1.20 -4.89 117.35 108.76 2kbt s TYR 791 Ca 0.22 2.10 -0.28 0.00 -0.37 0.00 0.00 57.07 58.73 2kbt s TYR 791 Cb 0.16 0.63 -0.03 0.00 -0.40 0.00 0.00 41.96 42.32 2kbt s TYR 791 CO 0.24 -0.53 1.93 0.34 -1.57 0.00 0.00 175.55 175.96 2kbt s ASP 792 N 1.76 5.69 -0.25 2.29 2.15 -1.26 -4.39 116.67 122.66 2kbt s ASP 792 Ca -0.10 1.39 -0.12 0.00 0.43 0.00 0.00 52.55 54.16 2kbt s ASP 792 Cb -0.06 -2.52 -0.05 0.00 -0.30 0.00 0.00 42.92 39.99 2kbt s ASP 792 CO -0.19 -1.86 0.23 0.12 -0.17 0.00 0.00 175.17 173.31 2kbt s PHE 793 N 7.58 3.29 -0.18 -5.34 5.36 -0.86 -4.90 117.98 122.94 2kbt s PHE 793 Ca 0.85 0.28 -0.22 0.00 -0.96 0.00 0.00 56.93 56.88 2kbt s PHE 793 Cb -0.24 -2.38 -0.02 0.00 -0.34 0.00 0.00 43.02 40.03 2kbt s PHE 793 CO 0.33 -0.05 0.69 0.00 -1.46 0.00 0.00 175.22 174.73 2kbt s ALA 795 N 1.84 3.49 -0.12 0.00 0.00 -1.26 -4.92 121.76 120.79 2kbt s ALA 795 Ca 0.32 -0.13 0.20 0.00 0.00 0.00 0.00 51.96 52.34 2kbt s ALA 795 Cb -0.16 -2.97 -0.27 0.00 0.00 0.00 0.00 23.12 19.72 2kbt s ALA 795 CO 0.12 -0.42 0.38 0.54 0.00 0.00 0.00 175.76 176.38 2kbt n ARG 796 N 4.67 0.66 -4.24 0.00 5.12 -1.26 -5.00 116.66 116.62 2kbt n ARG 796 Ca -0.01 -0.05 -0.15 0.00 -1.93 0.00 0.00 57.85 55.71 2kbt n ARG 796 Cb 0.50 -1.57 -0.09 0.00 -1.16 0.00 0.00 32.46 30.14 2kbt n ARG 796 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2kbt s ASP 797 N -5.11 0.70 0.00 0.55 1.11 -1.26 -5.01 116.67 107.65 2kbt s ASP 797 Ca -0.08 -1.49 0.13 0.00 0.18 0.00 0.00 52.55 51.28 2kbt s ASP 797 Cb 0.10 0.41 0.57 0.00 1.07 0.00 0.00 42.92 45.07 2kbt s ASP 797 CO 0.86 -0.89 1.38 -1.14 1.18 0.00 0.00 175.17 176.55 2kbt n ARG 798 N -0.39 0.06 -0.32 8.23 3.00 -1.26 -1.70 116.66 124.28 2kbt n ARG 798 Ca 0.03 0.24 0.04 0.00 -0.00 0.00 0.00 57.85 58.16 2kbt n ARG 798 Cb 0.65 -1.50 0.17 0.00 0.00 0.00 0.00 32.46 31.78 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 -1.43 2.63 -3.94 6.15 3.41 -1.26 -4.52 113.62 114.66 2kbt n SER 799 Ca 0.04 -2.27 -0.10 0.00 -0.26 0.00 0.00 58.87 56.28 2kbt n SER 799 Cb 0.13 -0.45 -0.12 0.00 -0.26 0.00 0.00 64.21 63.51 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 -1.70 0.20 -0.14 4.33 2.12 -0.69 -3.89 118.70 118.93 2kbt s GLU 800 Ca 0.24 -0.37 -0.07 0.00 0.36 0.00 0.00 54.97 55.13 2kbt s GLU 800 Cb 0.16 0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.55 2kbt s GLU 800 CO 0.10 -0.02 0.10 -1.17 -0.54 0.00 0.00 175.26 173.73 2kbt s LEU 801 N -0.87 4.13 -0.67 2.70 0.20 0.22 -3.98 118.68 120.41 2kbt s LEU 801 Ca -0.09 0.31 -0.27 0.00 0.69 0.00 0.00 54.13 54.77 2kbt s LEU 801 Cb -0.06 -2.01 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 2kbt s LEU 801 CO -0.01 0.33 1.46 -0.44 -0.29 0.00 0.00 176.35 177.40 2kbt s SER 802 N -0.53 5.92 0.30 3.68 0.01 -1.26 -4.53 113.70 117.28 2kbt s SER 802 Ca 0.12 -0.10 -0.01 0.00 1.31 0.00 0.00 55.95 57.26 2kbt s SER 802 Cb -0.12 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 2kbt s SER 802 CO 0.02 -1.96 0.52 -0.76 0.41 0.00 0.00 173.24 171.47 2kbt s LEU 803 N 6.70 4.07 -0.27 2.44 1.02 -0.56 -4.92 118.68 127.15 2kbt s LEU 803 Ca 0.47 0.52 -0.03 0.00 0.02 0.00 0.00 54.13 55.12 2kbt s LEU 803 Cb -0.10 -3.35 0.16 0.00 0.02 0.00 0.00 46.19 42.92 2kbt s LEU 803 CO 0.18 -0.21 0.51 -0.75 0.02 0.00 0.00 176.35 176.10 2kbt s LYS 804 N -3.86 0.47 0.09 1.70 2.36 -1.26 -2.02 119.74 117.23 2kbt s LYS 804 Ca 0.41 0.87 -0.32 0.00 -2.55 0.00 0.00 55.97 54.38 2kbt s LYS 804 Cb -0.10 0.19 -0.17 0.00 -1.05 0.00 0.00 37.83 36.69 2kbt s LYS 804 CO 0.33 -0.57 0.75 0.39 1.55 0.00 0.00 175.35 177.80 2kbt n GLU 805 N 5.40 0.00 -0.08 4.03 1.02 -1.26 0.10 120.64 129.85 2kbt n GLU 805 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2kbt n GLU 805 Cb 0.50 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 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 1.65 1.17 3.97 0.62 0.00 -1.19 -4.97 105.19 106.43 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 -2.88 6.32 -0.08 1.61 -0.00 0.11 -4.96 116.67 116.79 2kbt s ASP 807 Ca 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 52.55 52.65 2kbt s ASP 807 Cb 0.00 -1.87 -0.03 0.00 -0.00 0.00 0.00 42.92 41.02 2kbt s ASP 807 CO 0.00 -0.06 -0.07 0.27 -0.00 0.00 0.00 175.17 175.31 2kbt s ILE 808 N -1.96 3.71 -0.30 0.77 -0.00 -1.26 -0.81 121.20 121.35 2kbt s ILE 808 Ca 0.34 -0.47 -0.08 0.00 -0.00 0.00 0.00 60.65 60.45 2kbt s ILE 808 Cb -0.09 -2.53 0.01 0.00 -0.00 0.00 0.00 42.46 39.84 2kbt s ILE 808 CO 0.29 0.58 0.10 -0.63 -0.00 0.00 0.00 174.94 175.28 2kbt s ILE 809 N -0.58 4.15 -0.23 8.37 1.09 0.13 -4.83 121.20 129.30 2kbt s ILE 809 Ca 0.09 -0.63 -0.29 0.00 -1.10 0.00 0.00 60.65 58.72 2kbt s ILE 809 Cb -0.12 -3.14 -0.03 0.00 -1.06 0.00 0.00 42.46 38.11 2kbt s ILE 809 CO 0.02 0.06 1.72 -0.75 -0.10 0.00 0.00 174.94 175.89 2kbt s LYS 810 N 1.53 3.66 -0.44 2.79 2.47 -1.01 0.83 119.74 129.58 2kbt s LYS 810 Ca 0.03 1.68 -0.29 0.00 -1.56 0.00 0.00 55.97 55.83 2kbt s LYS 810 Cb -0.17 -4.10 0.02 0.00 -1.46 0.00 0.00 37.83 32.11 2kbt s LYS 810 CO 0.04 -1.46 1.32 0.42 0.16 0.00 0.00 175.35 175.82 2kbt s ILE 811 N 5.76 4.01 -0.25 5.43 -1.09 -1.18 -2.20 121.20 131.69 2kbt s ILE 811 Ca 0.76 1.02 0.05 0.00 -2.23 0.00 0.00 60.65 60.26 2kbt s ILE 811 Cb -0.26 -4.35 -0.18 0.00 -1.58 0.00 0.00 42.46 36.09 2kbt s ILE 811 CO 0.31 -0.85 -0.17 0.18 -1.23 0.00 0.00 174.94 173.18 2kbt n LEU 812 N 8.49 2.41 -3.85 2.97 4.77 0.11 -4.27 117.00 127.64 2kbt n LEU 812 Ca 0.15 -0.11 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 2kbt n LEU 812 Cb 0.48 -0.63 -0.13 0.00 -2.33 0.00 0.00 43.42 40.81 2kbt n LEU 812 CO 0.71 0.85 -0.29 0.21 -1.33 0.00 0.00 177.39 177.55 2kbt s ASN 813 N -6.30 -0.07 -0.63 -1.43 2.47 0.95 -4.98 114.94 104.95 2kbt s ASN 813 Ca -0.30 0.13 0.05 0.00 0.42 0.00 0.00 52.86 53.16 2kbt s ASN 813 Cb 0.08 0.14 0.17 0.00 -1.45 0.00 0.00 41.25 40.19 2kbt s ASN 813 CO 0.64 -0.03 0.46 1.17 -3.72 0.00 0.00 177.10 175.62 2kbt n LYS 814 N 3.02 1.43 -0.49 0.43 4.81 -1.26 0.33 118.16 126.43 2kbt n LYS 814 Ca -0.12 -4.16 0.43 0.00 -0.87 0.00 0.00 58.31 53.59 2kbt n LYS 814 Cb 0.59 -2.13 0.74 0.00 0.02 0.00 0.00 35.03 34.26 2kbt n LYS 814 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2kbt h LYS 815 N 5.42 0.00 0.00 1.64 1.57 -1.96 -3.44 116.57 119.80 2kbt h LYS 815 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 2kbt h LYS 815 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 2kbt h LYS 815 CO 0.63 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.92 2kbt n GLY 816 N -1.83 3.81 0.16 3.86 0.00 -1.26 -4.91 105.19 105.03 2kbt n GLY 816 Ca 0.34 -1.16 0.11 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.50 0.15 -3.67 1.61 3.00 -1.26 -3.74 117.38 111.97 2kbt n GLN 817 Ca 0.00 0.62 -0.37 0.00 -0.01 0.00 0.00 57.00 57.23 2kbt n GLN 817 Cb 0.00 -1.96 -0.09 0.00 0.00 0.00 0.00 30.24 28.19 2kbt n GLN 817 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 2kbt s GLN 818 N -3.54 2.73 0.00 -1.09 1.11 -1.26 -4.90 119.66 112.71 2kbt s GLN 818 Ca -0.02 -2.59 0.00 0.00 0.01 0.00 0.00 55.36 52.76 2kbt s GLN 818 Cb 0.07 -3.82 0.00 0.00 -1.01 0.00 0.00 33.01 28.25 2kbt s GLN 818 CO 0.23 -1.19 0.00 0.41 0.01 0.00 0.00 175.29 174.74 2kbt n GLY 819 N 3.43 0.07 3.29 3.09 0.00 -1.25 -5.06 105.19 108.76 2kbt n GLY 819 Ca 0.10 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.77 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 1.09 0.02 1.61 -2.14 -1.26 -3.99 118.94 114.27 2kbt s TRP 820 Ca 0.00 -1.30 0.07 0.00 2.66 0.00 0.00 56.10 57.53 2kbt s TRP 820 Cb 0.00 -0.43 -0.02 0.00 -3.10 0.00 0.00 33.47 29.92 2kbt s TRP 820 CO 0.00 -0.75 -0.21 -1.58 -2.66 0.00 0.00 176.95 171.76 2kbt s TRP 821 N -4.00 1.82 -0.54 1.66 0.51 0.82 -3.66 118.94 115.54 2kbt s TRP 821 Ca 0.36 -0.36 -0.18 0.00 -2.12 0.00 0.00 56.10 53.79 2kbt s TRP 821 Cb 0.05 -1.11 0.09 0.00 -0.81 0.00 0.00 33.47 31.68 2kbt s TRP 821 CO 0.14 0.05 0.62 0.50 -0.51 0.00 0.00 176.95 177.74 2kbt s ARG 822 N -0.95 3.06 0.00 4.98 3.52 0.15 -2.64 118.95 127.08 2kbt s ARG 822 Ca 0.08 -1.22 0.00 0.00 -0.13 0.00 0.00 55.73 54.46 2kbt s ARG 822 Cb -0.08 -4.20 0.00 0.00 -1.56 0.00 0.00 34.95 29.11 2kbt s ARG 822 CO 0.01 -1.34 0.00 0.41 -0.81 0.00 0.00 175.30 173.56 2kbt n GLY 823 N 5.23 5.34 3.37 8.12 0.00 -1.20 -0.03 105.19 126.02 2kbt n GLY 823 Ca -0.09 -1.96 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 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 -0.76 1.14 -0.13 1.61 2.12 -0.93 -2.84 118.70 118.91 2kbt s GLU 824 Ca 0.00 -0.51 -0.06 0.00 0.36 0.00 0.00 54.97 54.76 2kbt s GLU 824 Cb 0.00 0.52 0.05 0.00 0.26 0.00 0.00 34.13 34.96 2kbt s GLU 824 CO 0.00 -0.46 0.30 0.42 -0.54 0.00 0.00 175.26 174.98 2kbt s ILE 825 N -3.47 -0.12 -1.78 -3.70 1.01 0.26 -2.40 121.20 111.00 2kbt s ILE 825 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.81 2kbt s ILE 825 Cb 0.00 -0.47 0.00 0.00 0.01 0.00 0.00 42.46 42.01 2kbt s ILE 825 CO -0.10 0.06 0.00 -1.22 0.00 0.00 0.00 174.94 173.68 2kbt n TYR 826 N 4.45 -0.46 -0.57 3.97 4.02 -1.26 0.51 117.16 127.81 2kbt n TYR 826 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.68 2kbt n TYR 826 Cb 0.53 -3.25 0.00 0.00 -0.02 0.00 0.00 39.34 36.60 2kbt n TYR 826 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2kbt n GLY 827 N -0.52 0.68 3.40 2.72 0.00 -1.26 -5.04 105.19 105.17 2kbt n GLY 827 Ca -0.19 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.15 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 -0.77 3.15 0.36 1.61 3.00 0.18 -5.08 118.95 121.40 2kbt s ARG 828 Ca 0.00 -0.84 -0.10 0.00 0.00 0.00 0.00 55.73 54.79 2kbt s ARG 828 Cb 0.00 -3.55 -0.07 0.00 0.00 0.00 0.00 34.95 31.33 2kbt s ARG 828 CO 0.00 -0.49 0.71 0.42 0.00 0.00 0.00 175.30 175.94 2kbt s ILE 829 N 1.57 4.81 -0.89 1.52 -1.09 -1.26 -0.58 121.20 125.28 2kbt s ILE 829 Ca 0.03 0.59 0.00 0.00 -2.23 0.00 0.00 60.65 59.04 2kbt s ILE 829 Cb -0.18 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.01 2kbt s ILE 829 CO 0.05 -0.39 0.00 0.61 -1.23 0.00 0.00 174.94 173.98 2kbt n GLY 830 N -0.97 -1.39 3.38 6.18 0.00 -1.13 -4.75 105.19 106.51 2kbt n GLY 830 Ca 0.02 -1.04 -0.30 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.16 2.40 0.00 1.61 0.52 -1.25 -3.23 118.94 116.83 2kbt s TRP 831 Ca 0.00 -0.36 -0.17 0.00 0.02 0.00 0.00 56.10 55.58 2kbt s TRP 831 Cb 0.00 -1.42 0.03 0.00 -1.15 0.00 0.00 33.47 30.93 2kbt s TRP 831 CO 0.00 0.16 0.38 -0.59 0.02 0.00 0.00 176.95 176.91 2kbt s PHE 832 N -0.83 -0.25 0.44 -1.98 -0.71 -1.08 0.73 117.98 114.31 2kbt s PHE 832 Ca 0.12 0.32 -0.22 0.00 -1.04 0.00 0.00 56.93 56.12 2kbt s PHE 832 Cb -0.10 0.16 -0.09 0.00 -1.21 0.00 0.00 43.02 41.78 2kbt s PHE 832 CO 0.03 -0.48 1.04 -1.25 -1.34 0.00 0.00 175.22 173.23 2kbt s PRO 833 N -1.75 3.97 0.00 1.99 0.04 -1.26 -0.13 135.00 137.87 2kbt s PRO 833 Ca -0.10 1.43 0.20 0.00 0.04 0.00 0.00 61.00 62.58 2kbt s PRO 833 Cb -0.03 -2.30 1.01 0.00 0.04 0.00 0.00 34.50 33.22 2kbt s PRO 833 CO 0.02 -0.30 1.68 -1.13 0.04 0.00 0.00 177.00 177.32 2kbt n SER 834 N -0.54 0.64 0.00 6.66 3.41 -1.26 -2.85 113.62 119.68 2kbt n SER 834 Ca 0.07 -1.51 0.11 0.00 -0.26 0.00 0.00 58.87 57.28 2kbt n SER 834 Cb 0.51 -0.04 0.02 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.37 0.81 -0.40 4.04 3.02 -1.26 -3.95 115.26 117.15 2kbt n ASN 835 Ca 0.15 -0.72 0.06 0.00 -0.03 0.00 0.00 54.58 54.04 2kbt n ASN 835 Cb 0.17 0.73 0.03 0.00 -0.61 0.00 0.00 39.78 40.10 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 -1.50 0.00 -4.54 3.10 4.02 -1.13 -5.00 117.16 112.10 2kbt n TYR 836 Ca 0.05 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.68 2kbt n TYR 836 Cb 0.33 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.56 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 -1.18 1.11 -0.09 -0.72 -7.23 -1.24 -0.59 120.40 110.46 2kbt s VAL 837 Ca 0.12 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.26 2kbt s VAL 837 Cb 0.10 -2.59 0.05 0.00 0.56 0.00 0.00 36.38 34.50 2kbt s VAL 837 CO 0.20 0.00 0.18 -1.61 -0.31 0.00 0.00 175.10 173.56 2kbt s GLU 838 N -3.81 0.09 0.39 4.82 0.41 0.35 -4.81 118.70 116.13 2kbt s GLU 838 Ca 0.28 0.55 0.08 0.00 -0.41 0.00 0.00 54.97 55.46 2kbt s GLU 838 Cb 0.06 -0.19 -0.04 0.00 -1.78 0.00 0.00 34.13 32.18 2kbt s GLU 838 CO 0.14 -0.25 0.20 -1.83 -0.49 0.00 0.00 175.26 173.02 2kbt s GLU 839 N 1.92 2.31 -1.66 1.61 4.04 -1.26 0.19 118.70 125.85 2kbt s GLU 839 Ca -0.02 -1.70 -0.08 0.00 0.04 0.00 0.00 54.97 53.21 2kbt s GLU 839 Cb -0.12 -2.10 0.08 0.00 0.02 0.00 0.00 34.13 32.01 2kbt s GLU 839 CO -0.07 -0.05 0.23 -3.47 -1.84 0.00 0.00 175.26 170.06 2kbt n ASP 840 N -1.25 -0.10 -0.09 0.83 2.03 -1.26 -4.80 116.55 111.92 2kbt n ASP 840 Ca -0.01 -1.26 -0.13 0.00 0.52 0.00 0.00 54.79 53.92 2kbt n ASP 840 Cb 0.63 -1.67 -0.14 0.00 -0.72 0.00 0.00 41.12 39.22 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 -4.40 0.24 -3.57 -0.67 0.18 -1.26 -5.02 117.16 102.65 2kbt n TYR 841 Ca -0.17 0.07 -0.15 0.00 1.88 0.00 0.00 57.90 59.53 2kbt n TYR 841 Cb 0.61 -1.04 -0.06 0.00 -0.38 0.00 0.00 39.34 38.48 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 -5.99 -0.48 -0.17 9.48 1.04 -1.26 -5.18 113.70 111.14 2kbt s SER 842 Ca -0.17 0.32 -0.29 0.00 0.48 0.00 0.00 55.95 56.28 2kbt s SER 842 Cb 0.07 0.49 0.12 0.00 0.10 0.00 0.00 66.02 66.80 2kbt s SER 842 CO 0.76 -0.67 0.96 -0.70 0.98 0.00 0.00 173.24 174.58 2kbt s GLU 843 N -2.01 0.63 -1.15 4.02 2.12 -1.26 -4.99 118.70 116.06 2kbt s GLU 843 Ca -0.08 0.25 -0.03 0.00 0.36 0.00 0.00 54.97 55.48 2kbt s GLU 843 Cb -0.01 0.30 -0.02 0.00 0.26 0.00 0.00 34.13 34.66 2kbt s GLU 843 CO 0.02 -0.18 0.95 0.98 -0.54 0.00 0.00 175.26 176.49 2kbt n TYR 844 N 1.05 -2.27 -1.18 5.30 4.19 -1.26 -4.95 117.16 118.05 2kbt n TYR 844 Ca -0.12 0.90 -0.34 0.00 3.31 0.00 0.00 57.90 61.65 2kbt n TYR 844 Cb 0.57 -4.68 0.12 0.00 0.49 0.00 0.00 39.34 35.84 2kbt n TYR 844 CO 0.00 0.00 0.00 -0.51 0.91 0.00 0.00 176.86 177.26 2kbt s LEU 845 N -6.04 3.17 0.31 2.98 2.01 -1.26 -4.95 118.68 114.90 2kbt s LEU 845 Ca 0.17 2.36 -0.28 0.00 0.01 0.00 0.00 54.13 56.40 2kbt s LEU 845 Cb -0.02 -4.59 -0.09 0.00 0.01 0.00 0.00 46.19 41.49 2kbt s LEU 845 CO 0.74 -2.59 1.08 -2.16 1.01 0.00 0.00 176.35 174.43 2kbt s PRO 846 N -4.10 4.52 0.74 1.29 0.04 -1.26 -4.97 135.00 131.26 2kbt s PRO 846 Ca 0.73 1.71 -0.17 0.00 0.04 0.00 0.00 61.00 63.31 2kbt s PRO 846 Cb -0.29 -3.02 -0.13 0.00 0.04 0.00 0.00 34.50 31.10 2kbt s PRO 846 CO 0.50 0.13 -0.27 0.39 0.04 0.00 0.00 177.00 177.79 2kbt n GLU 847 N 0.87 0.04 0.00 4.56 1.02 -1.26 -5.28 120.64 120.59 2kbt n GLU 847 Ca 0.00 0.02 0.16 0.00 -0.02 0.00 0.00 57.16 57.32 2kbt n GLU 847 Cb 0.46 -1.15 0.85 0.00 -0.02 0.00 0.00 31.44 31.59 2kbt n GLU 847 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56