#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 0.60 0.00 1.61 -0.04 -1.26 -4.03 135.00 131.88 2kbt n PRO 781 Ca 0.00 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2kbt n PRO 781 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 0.55 0.00 3.91 0.55 0.00 -1.26 -5.16 105.19 103.78 2kbt n GLY 782 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 2.92 0.00 2.61 2.01 -1.26 -5.03 115.64 116.90 2kbt s THR 783 Ca 0.00 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.02 2kbt s THR 783 Cb 0.00 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.27 2kbt s THR 783 CO 0.00 -0.28 0.68 0.49 -0.69 0.00 0.00 174.62 174.82 2kbt n PHE 784 N -2.90 0.00 0.00 4.92 3.01 -1.26 -4.79 117.46 116.44 2kbt n PHE 784 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.53 2kbt n PHE 784 Cb 0.59 -0.18 0.00 0.00 -0.01 0.00 0.00 39.48 39.88 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 -0.82 2.97 3.74 1.37 0.00 -1.26 -4.36 105.19 106.84 2kbt n GLY 785 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 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 0.00 0.00 -0.20 2.61 -4.23 -1.26 -4.10 115.64 108.46 2kbt s THR 786 Ca 0.00 -1.12 -0.04 0.00 -1.18 0.00 0.00 61.69 59.35 2kbt s THR 786 Cb 0.00 -2.90 0.08 0.00 1.34 0.00 0.00 72.50 71.02 2kbt s THR 786 CO 0.00 0.00 0.15 0.00 -0.54 0.00 0.00 174.62 174.23 2kbt s ALA 787 N -2.33 0.15 -0.27 3.99 0.00 0.20 -3.85 121.76 119.65 2kbt s ALA 787 Ca 0.19 -0.18 -0.29 0.00 0.00 0.00 0.00 51.96 51.67 2kbt s ALA 787 Cb -0.04 -1.21 -0.01 0.00 0.00 0.00 0.00 23.12 21.86 2kbt s ALA 787 CO 0.14 -1.26 1.37 0.21 0.00 0.00 0.00 175.76 176.22 2kbt s LYS 788 N 2.21 3.92 0.33 0.00 2.20 0.40 0.13 119.74 128.93 2kbt s LYS 788 Ca 0.05 1.39 -0.29 0.00 -0.36 0.00 0.00 55.97 56.76 2kbt s LYS 788 Cb -0.16 -3.91 -0.11 0.00 -1.51 0.00 0.00 37.83 32.15 2kbt s LYS 788 CO -0.14 -1.12 1.53 0.00 -0.36 0.00 0.00 175.35 175.25 2kbt s ALA 789 N 4.48 3.65 -0.76 3.13 0.00 0.11 -1.29 121.76 131.08 2kbt s ALA 789 Ca 0.60 1.56 0.09 0.00 0.00 0.00 0.00 51.96 54.20 2kbt s ALA 789 Cb -0.19 -3.62 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 2kbt s ALA 789 CO 0.24 -1.00 0.56 0.54 0.00 0.00 0.00 175.76 176.10 2kbt n ARG 790 N 1.29 2.48 -3.69 0.00 5.12 -0.02 -2.68 116.66 119.15 2kbt n ARG 790 Ca 0.04 -0.48 -0.11 0.00 -1.93 0.00 0.00 57.85 55.38 2kbt n ARG 790 Cb 0.39 -1.03 -0.11 0.00 -1.16 0.00 0.00 32.46 30.54 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 -1.37 -0.57 -0.24 -1.55 2.02 -1.13 -4.83 117.35 109.69 2kbt s TYR 791 Ca 0.07 1.22 -0.29 0.00 -0.37 0.00 0.00 57.07 57.70 2kbt s TYR 791 Cb 0.07 0.22 -0.03 0.00 -0.40 0.00 0.00 41.96 41.82 2kbt s TYR 791 CO 0.25 -0.34 1.86 -0.51 -1.57 0.00 0.00 175.55 175.24 2kbt s ASP 792 N 1.59 5.98 -0.33 2.29 1.01 -1.26 -4.37 116.67 121.57 2kbt s ASP 792 Ca -0.08 1.66 -0.11 0.00 0.71 0.00 0.00 52.55 54.73 2kbt s ASP 792 Cb -0.09 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.31 2kbt s ASP 792 CO -0.12 -1.58 0.19 0.12 0.21 0.00 0.00 175.17 173.99 2kbt s PHE 793 N 6.51 3.20 -0.17 4.23 5.36 -1.05 -4.91 117.98 131.15 2kbt s PHE 793 Ca 0.83 -0.51 -0.27 0.00 -0.96 0.00 0.00 56.93 56.02 2kbt s PHE 793 Cb -0.28 -2.41 -0.01 0.00 -0.34 0.00 0.00 43.02 39.99 2kbt s PHE 793 CO 0.33 -0.45 0.92 0.00 -1.46 0.00 0.00 175.22 174.56 2kbt s ALA 795 N 2.35 3.51 -0.15 0.00 0.00 -1.26 -4.95 121.76 121.26 2kbt s ALA 795 Ca 0.42 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.60 2kbt s ALA 795 Cb -0.17 -2.80 -0.01 0.00 0.00 0.00 0.00 23.12 20.14 2kbt s ALA 795 CO 0.12 0.34 0.22 2.89 0.00 0.00 0.00 175.76 179.34 2kbt n ARG 796 N 1.54 4.42 -3.97 0.00 -4.01 -1.26 -5.05 116.66 108.33 2kbt n ARG 796 Ca -0.07 -0.17 -0.10 0.00 -1.04 0.00 0.00 57.85 56.47 2kbt n ARG 796 Cb 0.50 -0.72 -0.07 0.00 -3.04 0.00 0.00 32.46 29.13 2kbt n ARG 796 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 2kbt s ASP 797 N -0.92 0.05 0.01 2.89 -0.00 -1.26 -5.01 116.67 112.42 2kbt s ASP 797 Ca 0.01 -0.89 0.15 0.00 -0.00 0.00 0.00 52.55 51.83 2kbt s ASP 797 Cb 0.02 0.43 0.65 0.00 -0.00 0.00 0.00 42.92 44.02 2kbt s ASP 797 CO 0.07 -0.88 1.49 0.54 -0.00 0.00 0.00 175.17 176.39 2kbt n ARG 798 N -0.21 0.01 0.12 8.23 1.74 -1.26 -1.55 116.66 123.73 2kbt n ARG 798 Ca -0.07 0.25 0.12 0.00 -0.77 0.00 0.00 57.85 57.37 2kbt n ARG 798 Cb 0.63 -1.51 0.19 0.00 -1.02 0.00 0.00 32.46 30.75 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 -2.93 0.55 4.64 -1.95 -3.43 113.55 110.44 2kbt h SER 799 Ca 0.00 -0.07 -0.61 0.00 -0.47 0.00 0.00 61.79 60.63 2kbt h SER 799 Cb 0.26 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.31 2kbt h SER 799 CO 0.00 0.04 -0.48 -0.70 -0.87 0.00 0.00 176.83 174.81 2kbt s GLU 800 N -3.20 3.46 -0.11 4.77 2.12 -0.59 -1.97 118.70 123.18 2kbt s GLU 800 Ca 0.06 -0.41 -0.05 0.00 0.36 0.00 0.00 54.97 54.93 2kbt s GLU 800 Cb 0.10 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.44 2kbt s GLU 800 CO 0.69 0.60 0.07 -1.17 -0.54 0.00 0.00 175.26 174.91 2kbt s LEU 801 N -2.54 4.00 -0.44 2.70 0.20 0.26 -4.21 118.68 118.65 2kbt s LEU 801 Ca 0.36 0.31 -0.27 0.00 0.69 0.00 0.00 54.13 55.22 2kbt s LEU 801 Cb -0.13 -1.95 0.03 0.00 -0.43 0.00 0.00 46.19 43.71 2kbt s LEU 801 CO 0.28 0.39 1.00 -0.55 -0.29 0.00 0.00 176.35 177.18 2kbt s SER 802 N -0.93 6.60 0.27 3.68 0.15 -1.26 -4.50 113.70 117.70 2kbt s SER 802 Ca 0.14 0.36 0.07 0.00 0.70 0.00 0.00 55.95 57.22 2kbt s SER 802 Cb -0.12 -2.49 -0.03 0.00 -1.71 0.00 0.00 66.02 61.67 2kbt s SER 802 CO 0.03 -1.07 0.28 -0.76 1.20 0.00 0.00 173.24 172.92 2kbt s LEU 803 N 3.91 3.92 -0.29 3.45 1.02 -0.67 -4.86 118.68 125.16 2kbt s LEU 803 Ca 0.41 -0.21 -0.03 0.00 0.02 0.00 0.00 54.13 54.33 2kbt s LEU 803 Cb -0.10 -2.49 0.17 0.00 0.02 0.00 0.00 46.19 43.80 2kbt s LEU 803 CO 0.26 -0.13 0.58 -0.75 0.02 0.00 0.00 176.35 176.33 2kbt s LYS 804 N -3.93 0.55 0.12 1.70 2.36 -1.26 -2.52 119.74 116.75 2kbt s LYS 804 Ca 0.36 1.04 -0.31 0.00 -2.55 0.00 0.00 55.97 54.50 2kbt s LYS 804 Cb -0.08 0.51 -0.17 0.00 -1.05 0.00 0.00 37.83 37.04 2kbt s LYS 804 CO 0.27 -0.55 0.68 0.39 1.55 0.00 0.00 175.35 177.69 2kbt n GLU 805 N 5.43 0.00 -0.69 4.03 1.02 -1.26 -0.30 120.64 128.87 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 0.51 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.80 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 1.72 0.75 3.85 0.62 0.00 -1.09 -4.98 105.19 106.06 2kbt n GLY 806 Ca 0.18 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.52 5.33 0.01 1.61 -0.00 0.59 -4.95 116.67 116.74 2kbt s ASP 807 Ca 0.00 -0.46 0.05 0.00 -0.00 0.00 0.00 52.55 52.13 2kbt s ASP 807 Cb 0.00 -1.02 -0.03 0.00 -0.00 0.00 0.00 42.92 41.86 2kbt s ASP 807 CO 0.00 -0.32 -0.11 0.27 -0.00 0.00 0.00 175.17 175.00 2kbt s ILE 808 N -2.28 3.29 -0.22 0.77 -0.00 -1.26 0.03 121.20 121.52 2kbt s ILE 808 Ca 0.40 -0.91 0.00 0.00 -0.00 0.00 0.00 60.65 60.14 2kbt s ILE 808 Cb -0.06 -2.40 0.03 0.00 -0.00 0.00 0.00 42.46 40.03 2kbt s ILE 808 CO 0.26 0.39 -0.12 -0.63 -0.00 0.00 0.00 174.94 174.85 2kbt s ILE 809 N -0.95 2.46 -0.31 8.37 1.09 0.35 -4.80 121.20 127.41 2kbt s ILE 809 Ca 0.16 -1.10 -0.29 0.00 -1.10 0.00 0.00 60.65 58.32 2kbt s ILE 809 Cb -0.11 -2.21 -0.00 0.00 -1.06 0.00 0.00 42.46 39.08 2kbt s ILE 809 CO 0.06 0.29 1.36 -0.75 -0.10 0.00 0.00 174.94 175.80 2kbt s LYS 810 N 1.27 3.84 0.06 2.79 2.47 -1.19 0.62 119.74 129.61 2kbt s LYS 810 Ca 0.00 1.25 -0.31 0.00 -1.56 0.00 0.00 55.97 55.35 2kbt s LYS 810 Cb -0.16 -3.92 -0.07 0.00 -1.46 0.00 0.00 37.83 32.22 2kbt s LYS 810 CO -0.08 -1.22 1.35 0.42 0.16 0.00 0.00 175.35 175.99 2kbt s ILE 811 N 4.66 3.61 0.01 5.43 -1.09 -1.26 -2.76 121.20 129.80 2kbt s ILE 811 Ca 0.59 1.11 0.00 0.00 -2.23 0.00 0.00 60.65 60.12 2kbt s ILE 811 Cb -0.17 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 2kbt s ILE 811 CO 0.25 0.05 0.00 0.18 -1.23 0.00 0.00 174.94 174.20 2kbt n LEU 812 N 4.45 0.05 -3.72 2.97 4.77 0.88 -4.95 117.00 121.45 2kbt n LEU 812 Ca 0.11 0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.81 2kbt n LEU 812 Cb 0.44 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 2kbt n LEU 812 CO 0.58 -0.07 -0.23 0.21 -1.33 0.00 0.00 177.39 176.55 2kbt s ASN 813 N -5.05 3.63 -1.27 -1.43 2.47 0.33 -4.96 114.94 108.66 2kbt s ASN 813 Ca 0.00 -2.80 -0.16 0.00 0.42 0.00 0.00 52.86 50.32 2kbt s ASN 813 Cb 0.00 -1.08 0.11 0.00 -1.45 0.00 0.00 41.25 38.83 2kbt s ASN 813 CO 0.00 -0.24 1.63 1.17 -3.72 0.00 0.00 177.10 175.94 2kbt n LYS 814 N 3.32 3.27 -0.34 0.43 4.81 -1.26 -0.40 118.16 127.99 2kbt n LYS 814 Ca 0.11 -3.51 0.14 0.00 -0.87 0.00 0.00 58.31 54.18 2kbt n LYS 814 Cb 0.35 -3.29 0.28 0.00 0.02 0.00 0.00 35.03 32.40 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 7.31 0.02 0.00 1.64 1.57 -1.94 -3.45 116.57 121.72 2kbt h LYS 815 Ca 0.40 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 2kbt h LYS 815 Cb 0.86 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2kbt h LYS 815 CO 1.38 0.01 0.00 0.41 -0.57 0.00 0.00 179.45 180.68 2kbt n GLY 816 N -1.49 3.57 0.68 3.86 0.00 -1.26 -4.94 105.19 105.61 2kbt n GLY 816 Ca 0.23 -0.59 0.51 0.00 0.00 0.00 0.00 46.02 46.17 2kbt n GLY 816 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kbt n GLN 817 N -1.02 0.00 -3.47 1.61 10.64 -1.26 -3.47 117.38 120.41 2kbt n GLN 817 Ca 0.00 1.04 -0.43 0.00 -1.83 0.00 0.00 57.00 55.78 2kbt n GLN 817 Cb 0.00 -2.40 -0.10 0.00 -0.86 0.00 0.00 30.24 26.88 2kbt n GLN 817 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.06 174.58 2kbt s GLN 818 N -4.76 2.96 0.00 2.61 -0.21 -1.26 -4.82 119.66 114.18 2kbt s GLN 818 Ca -0.05 -1.04 0.00 0.00 0.02 0.00 0.00 55.36 54.29 2kbt s GLN 818 Cb 0.25 -3.96 0.00 0.00 1.00 0.00 0.00 33.01 30.30 2kbt s GLN 818 CO 0.85 -0.76 0.00 0.41 -2.12 0.00 0.00 175.29 173.67 2kbt n GLY 819 N 5.15 0.47 3.29 3.09 0.00 -1.23 -4.99 105.19 110.97 2kbt n GLY 819 Ca -0.11 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 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 1.12 -0.05 1.61 -2.14 -1.26 -4.00 118.94 114.22 2kbt s TRP 820 Ca 0.00 -1.31 0.04 0.00 2.66 0.00 0.00 56.10 57.48 2kbt s TRP 820 Cb 0.00 -0.44 0.00 0.00 -3.10 0.00 0.00 33.47 29.93 2kbt s TRP 820 CO 0.00 -0.76 -0.16 -1.58 -2.66 0.00 0.00 176.95 171.80 2kbt s TRP 821 N -3.97 1.61 -0.59 1.66 0.51 0.81 -3.60 118.94 115.36 2kbt s TRP 821 Ca 0.36 -0.49 -0.23 0.00 -2.12 0.00 0.00 56.10 53.62 2kbt s TRP 821 Cb 0.05 -1.11 0.06 0.00 -0.81 0.00 0.00 33.47 31.66 2kbt s TRP 821 CO 0.14 -0.19 0.90 0.50 -0.51 0.00 0.00 176.95 177.80 2kbt s ARG 822 N 0.18 3.19 0.00 4.98 3.52 0.47 -2.67 118.95 128.63 2kbt s ARG 822 Ca -0.06 -0.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.90 2kbt s ARG 822 Cb -0.12 -4.14 0.00 0.00 -1.56 0.00 0.00 34.95 29.12 2kbt s ARG 822 CO 0.03 -1.60 0.00 0.41 -0.81 0.00 0.00 175.30 173.32 2kbt n GLY 823 N 5.23 4.16 3.29 8.12 0.00 -1.18 -0.08 105.19 124.72 2kbt n GLY 823 Ca -0.02 -2.00 -0.14 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 -1.98 0.73 -0.03 1.61 -6.30 -1.11 -2.75 118.70 108.87 2kbt s GLU 824 Ca 0.00 -0.09 -0.00 0.00 -2.50 0.00 0.00 54.97 52.38 2kbt s GLU 824 Cb 0.00 0.33 0.03 0.00 0.00 0.00 0.00 34.13 34.49 2kbt s GLU 824 CO 0.00 -0.21 0.03 0.42 0.02 0.00 0.00 175.26 175.52 2kbt s ILE 825 N -1.26 0.01 -1.80 -3.70 1.01 0.59 -3.16 121.20 112.88 2kbt s ILE 825 Ca -0.13 0.22 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2kbt s ILE 825 Cb -0.04 -0.16 0.00 0.00 0.01 0.00 0.00 42.46 42.26 2kbt s ILE 825 CO 0.05 0.13 0.00 -1.22 0.00 0.00 0.00 174.94 173.90 2kbt n TYR 826 N 4.42 -0.75 -0.75 3.97 4.01 -1.26 0.11 117.16 126.90 2kbt n TYR 826 Ca -0.22 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 2kbt n TYR 826 Cb 0.50 -3.65 0.00 0.00 -0.31 0.00 0.00 39.34 35.88 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 -0.79 0.63 3.53 2.72 0.00 -1.26 -5.02 105.19 105.00 2kbt n GLY 827 Ca -0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.25 3.59 0.49 1.61 0.52 0.12 -5.08 118.95 119.95 2kbt s ARG 828 Ca 0.00 -0.57 -0.05 0.00 -0.52 0.00 0.00 55.73 54.58 2kbt s ARG 828 Cb 0.00 -3.73 -0.03 0.00 0.52 0.00 0.00 34.95 31.71 2kbt s ARG 828 CO 0.00 -0.37 0.79 0.42 0.02 0.00 0.00 175.30 176.16 2kbt s ILE 829 N 1.72 4.77 -3.69 1.52 -1.09 -1.26 -0.30 121.20 122.86 2kbt s ILE 829 Ca 0.06 0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 2kbt s ILE 829 Cb -0.17 -3.82 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 2kbt s ILE 829 CO 0.10 -0.80 0.00 0.61 -1.23 0.00 0.00 174.94 173.62 2kbt n GLY 830 N -2.28 -2.06 3.45 6.18 0.00 -1.11 -4.73 105.19 104.63 2kbt n GLY 830 Ca 0.01 -1.20 -0.30 0.00 0.00 0.00 0.00 46.02 44.53 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 -2.37 2.46 0.00 1.61 0.52 -0.83 -3.09 118.94 117.25 2kbt s TRP 831 Ca 0.00 -0.30 -0.19 0.00 0.02 0.00 0.00 56.10 55.62 2kbt s TRP 831 Cb 0.00 -1.34 0.04 0.00 -1.15 0.00 0.00 33.47 31.02 2kbt s TRP 831 CO 0.00 0.34 0.42 -0.59 0.02 0.00 0.00 176.95 177.13 2kbt s PHE 832 N -1.06 -0.30 0.44 -1.98 -0.71 -1.09 0.89 117.98 114.16 2kbt s PHE 832 Ca 0.16 0.40 -0.22 0.00 -1.04 0.00 0.00 56.93 56.22 2kbt s PHE 832 Cb -0.10 0.20 -0.09 0.00 -1.21 0.00 0.00 43.02 41.82 2kbt s PHE 832 CO 0.08 -0.51 1.05 -1.25 -1.34 0.00 0.00 175.22 173.25 2kbt s PRO 833 N -1.81 4.00 0.00 1.99 0.04 -1.26 -0.14 135.00 137.83 2kbt s PRO 833 Ca -0.09 1.45 0.21 0.00 0.04 0.00 0.00 61.00 62.61 2kbt s PRO 833 Cb -0.02 -2.35 0.81 0.00 0.04 0.00 0.00 34.50 32.97 2kbt s PRO 833 CO 0.02 -0.27 1.58 -1.13 0.04 0.00 0.00 177.00 177.24 2kbt n SER 834 N -0.45 1.54 0.00 6.66 3.41 -1.26 -3.31 113.62 120.21 2kbt n SER 834 Ca 0.07 -1.67 0.11 0.00 -0.26 0.00 0.00 58.87 57.12 2kbt n SER 834 Cb 0.51 -0.09 0.03 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 0.23 0.74 -0.14 4.04 3.02 -1.26 -3.96 115.26 117.93 2kbt n ASN 835 Ca 0.16 -0.60 0.06 0.00 -0.03 0.00 0.00 54.58 54.17 2kbt n ASN 835 Cb 0.31 0.72 -0.03 0.00 -0.61 0.00 0.00 39.78 40.17 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 -1.58 0.00 -4.63 3.10 4.02 -1.21 -5.00 117.16 111.86 2kbt n TYR 836 Ca 0.04 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.62 2kbt n TYR 836 Cb 0.35 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.60 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 -1.84 1.37 -0.13 -0.72 -7.23 -1.24 -0.84 120.40 109.77 2kbt s VAL 837 Ca 0.07 -1.93 -0.06 0.00 -1.81 0.00 0.00 61.98 58.25 2kbt s VAL 837 Cb 0.10 -2.30 0.06 0.00 0.56 0.00 0.00 36.38 34.79 2kbt s VAL 837 CO 0.40 0.00 0.28 -1.61 -0.31 0.00 0.00 175.10 173.86 2kbt s GLU 838 N -3.90 0.21 0.51 4.82 2.02 -0.41 -4.82 118.70 117.14 2kbt s GLU 838 Ca 0.14 0.68 0.02 0.00 0.02 0.00 0.00 54.97 55.82 2kbt s GLU 838 Cb 0.02 -0.05 -0.01 0.00 0.10 0.00 0.00 34.13 34.20 2kbt s GLU 838 CO 0.08 -0.21 0.07 -1.83 0.02 0.00 0.00 175.26 173.38 2kbt s GLU 839 N 1.80 2.20 -1.76 1.61 4.04 -1.26 0.15 118.70 125.48 2kbt s GLU 839 Ca -0.05 -2.33 -0.20 0.00 0.04 0.00 0.00 54.97 52.43 2kbt s GLU 839 Cb -0.11 -1.63 0.18 0.00 0.02 0.00 0.00 34.13 32.59 2kbt s GLU 839 CO -0.09 -0.39 0.72 -3.47 -1.84 0.00 0.00 175.26 170.18 2kbt n ASP 840 N -1.34 -2.80 -0.08 0.83 4.64 -1.25 -4.80 116.55 111.75 2kbt n ASP 840 Ca -0.16 -1.09 -0.18 0.00 -1.38 0.00 0.00 54.79 51.98 2kbt n ASP 840 Cb 0.67 -2.40 -0.13 0.00 -1.04 0.00 0.00 41.12 38.22 2kbt n ASP 840 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2kbt n TYR 841 N -4.29 0.42 -3.93 -0.67 0.18 -1.26 -5.05 117.16 102.56 2kbt n TYR 841 Ca 0.08 0.10 -0.10 0.00 1.88 0.00 0.00 57.90 59.86 2kbt n TYR 841 Cb 0.48 -1.06 -0.02 0.00 -0.38 0.00 0.00 39.34 38.36 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 -6.58 0.13 0.43 9.48 1.04 -1.26 -5.19 113.70 111.76 2kbt s SER 842 Ca -0.28 -1.06 0.05 0.00 0.48 0.00 0.00 55.95 55.14 2kbt s SER 842 Cb 0.08 0.71 -0.06 0.00 0.10 0.00 0.00 66.02 66.85 2kbt s SER 842 CO 0.68 -1.38 0.02 -1.61 0.98 0.00 0.00 173.24 171.92 2kbt s GLU 843 N -3.27 1.99 -0.22 4.02 8.01 -1.26 -4.97 118.70 123.01 2kbt s GLU 843 Ca 0.20 -2.17 0.19 0.00 0.01 0.00 0.00 54.97 53.19 2kbt s GLU 843 Cb -0.03 -1.51 0.48 0.00 -4.31 0.00 0.00 34.13 28.76 2kbt s GLU 843 CO 0.12 -0.16 1.15 0.98 0.01 0.00 0.00 175.26 177.36 2kbt n TYR 844 N -1.02 1.33 -1.64 1.61 9.36 -1.26 -5.10 117.16 120.45 2kbt n TYR 844 Ca -0.09 -1.86 -0.33 0.00 3.32 0.00 0.00 57.90 58.95 2kbt n TYR 844 Cb 0.67 -0.24 0.06 0.00 -0.63 0.00 0.00 39.34 39.19 2kbt n TYR 844 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 2kbt s LEU 845 N -3.13 3.31 -0.09 2.98 2.01 -1.26 -4.96 118.68 117.54 2kbt s LEU 845 Ca 0.35 1.97 -0.30 0.00 0.01 0.00 0.00 54.13 56.16 2kbt s LEU 845 Cb 0.36 -4.55 -0.03 0.00 0.01 0.00 0.00 46.19 41.98 2kbt s LEU 845 CO -0.04 -1.74 1.24 -2.16 1.01 0.00 0.00 176.35 174.66 2kbt s PRO 846 N -4.27 4.31 0.48 1.29 0.04 -1.26 -4.99 135.00 130.59 2kbt s PRO 846 Ca 0.66 1.69 -0.24 0.00 0.04 0.00 0.00 61.00 63.15 2kbt s PRO 846 Cb -0.20 -3.63 -0.07 0.00 0.04 0.00 0.00 34.50 30.64 2kbt s PRO 846 CO 0.45 -0.54 1.32 -1.21 0.04 0.00 0.00 177.00 177.06 2kbt s GLU 847 N 2.66 3.57 0.00 4.56 2.02 -1.26 -5.31 118.70 124.93 2kbt s GLU 847 Ca 0.56 2.17 0.00 0.00 0.02 0.00 0.00 54.97 57.72 2kbt s GLU 847 Cb -0.24 -2.49 0.00 0.00 0.10 0.00 0.00 34.13 31.50 2kbt s GLU 847 CO 0.20 -0.83 0.46 0.25 0.02 0.00 0.00 175.26 175.36