#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 0.38 0.00 1.61 0.13 -2.09 -3.46 132.00 128.58 2kbt h PRO 781 Ca 0.00 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2kbt h PRO 781 Cb 0.00 0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.23 2kbt h PRO 781 CO 0.00 1.04 0.00 0.41 -0.23 0.00 0.00 178.00 179.22 2kbt n GLY 782 N 0.79 1.63 1.63 1.56 0.00 -1.26 -5.15 105.19 104.40 2kbt n GLY 782 Ca -0.05 -2.08 -0.11 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.98 0.00 0.00 2.61 -1.04 -1.26 -5.11 114.28 108.49 2kbt n THR 783 Ca 0.00 -1.19 0.00 0.00 -2.04 0.00 0.00 64.05 60.82 2kbt n THR 783 Cb 0.00 0.49 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 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 -0.40 0.00 0.00 -1.42 3.01 -1.25 -5.09 117.46 112.30 2kbt n PHE 784 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2kbt n PHE 784 Cb 0.30 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 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 1.59 -0.36 3.82 1.37 0.00 -1.26 -5.06 105.19 105.28 2kbt n GLY 785 Ca 0.00 0.60 -0.07 0.00 0.00 0.00 0.00 46.02 46.55 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 2.59 0.00 -0.24 2.61 -4.23 -1.26 -3.37 115.64 111.74 2kbt s THR 786 Ca 0.00 -1.06 -0.03 0.00 -1.18 0.00 0.00 61.69 59.42 2kbt s THR 786 Cb 0.00 -2.04 0.12 0.00 1.34 0.00 0.00 72.50 71.92 2kbt s THR 786 CO 0.00 0.00 0.29 0.00 -0.54 0.00 0.00 174.62 174.37 2kbt s ALA 787 N -3.92 -0.58 0.20 3.99 0.00 0.21 -4.03 121.76 117.62 2kbt s ALA 787 Ca 0.13 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 52.10 2kbt s ALA 787 Cb -0.05 -1.56 -0.10 0.00 0.00 0.00 0.00 23.12 21.41 2kbt s ALA 787 CO 0.07 -1.36 1.48 0.21 0.00 0.00 0.00 175.76 176.16 2kbt s LYS 788 N 2.41 4.26 0.00 0.00 2.20 0.49 0.11 119.74 129.20 2kbt s LYS 788 Ca 0.09 2.29 -0.30 0.00 -0.36 0.00 0.00 55.97 57.69 2kbt s LYS 788 Cb -0.15 -3.15 -0.04 0.00 -1.51 0.00 0.00 37.83 32.99 2kbt s LYS 788 CO -0.19 -0.49 1.07 0.00 -0.36 0.00 0.00 175.35 175.39 2kbt s ALA 789 N 0.58 3.29 -2.22 3.13 0.00 -0.04 0.63 121.76 127.13 2kbt s ALA 789 Ca 0.64 0.62 0.23 0.00 0.00 0.00 0.00 51.96 53.46 2kbt s ALA 789 Cb -0.42 -3.40 0.09 0.00 0.00 0.00 0.00 23.12 19.39 2kbt s ALA 789 CO 0.37 -0.39 1.16 0.54 0.00 0.00 0.00 175.76 177.44 2kbt n ARG 790 N 4.17 1.42 -3.66 0.00 5.12 0.56 -3.03 116.66 121.25 2kbt n ARG 790 Ca 0.08 -1.15 -0.08 0.00 -1.93 0.00 0.00 57.85 54.77 2kbt n ARG 790 Cb 0.49 -1.48 -0.08 0.00 -1.16 0.00 0.00 32.46 30.23 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 -2.38 -0.94 -0.09 -1.55 1.51 -1.20 -4.90 117.35 107.81 2kbt s TYR 791 Ca 0.21 1.86 -0.29 0.00 -1.01 0.00 0.00 57.07 57.84 2kbt s TYR 791 Cb 0.19 0.52 -0.05 0.00 -0.11 0.00 0.00 41.96 42.51 2kbt s TYR 791 CO 0.51 -0.48 1.72 0.34 -1.11 0.00 0.00 175.55 176.54 2kbt s ASP 792 N 1.72 6.49 -0.18 2.29 -1.08 -1.26 -4.47 116.67 120.18 2kbt s ASP 792 Ca -0.09 2.13 -0.06 0.00 -0.52 0.00 0.00 52.55 54.00 2kbt s ASP 792 Cb -0.07 -2.53 -0.03 0.00 -1.46 0.00 0.00 42.92 38.82 2kbt s ASP 792 CO -0.17 -1.09 0.03 0.12 0.52 0.00 0.00 175.17 174.58 2kbt s PHE 793 N 4.66 3.15 -0.53 -5.34 5.36 -1.01 -4.91 117.98 119.36 2kbt s PHE 793 Ca 0.77 -0.12 -0.20 0.00 -0.96 0.00 0.00 56.93 56.41 2kbt s PHE 793 Cb -0.33 -2.07 0.06 0.00 -0.34 0.00 0.00 43.02 40.34 2kbt s PHE 793 CO 0.31 0.01 0.72 0.00 -1.46 0.00 0.00 175.22 174.81 2kbt s ALA 795 N 3.01 2.94 0.26 0.00 0.00 -1.26 -4.82 121.76 121.89 2kbt s ALA 795 Ca 0.19 0.42 0.35 0.00 0.00 0.00 0.00 51.96 52.93 2kbt s ALA 795 Cb -0.18 -3.99 1.60 0.00 0.00 0.00 0.00 23.12 20.56 2kbt s ALA 795 CO 0.13 -2.50 2.07 0.07 0.00 0.00 0.00 175.76 175.54 2kbt h ARG 796 N 12.77 0.00 0.00 0.00 0.11 -1.94 -3.46 114.38 121.86 2kbt h ARG 796 Ca -0.35 0.00 0.02 0.00 0.10 0.00 0.00 59.98 59.74 2kbt h ARG 796 Cb 1.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 2kbt h ARG 796 CO 1.01 0.02 0.29 -0.25 0.10 0.00 0.00 179.97 181.14 2kbt n ASP 797 N -3.14 -1.70 0.04 0.08 9.92 -1.26 -5.00 116.55 115.49 2kbt n ASP 797 Ca -0.00 -2.12 0.07 0.00 -0.53 0.00 0.00 54.79 52.21 2kbt n ASP 797 Cb 0.25 2.82 0.32 0.00 -0.64 0.00 0.00 41.12 43.87 2kbt n ASP 797 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2kbt n ARG 798 N -0.46 0.06 0.02 -1.24 1.74 -1.26 -1.47 116.66 114.05 2kbt n ARG 798 Ca -0.06 0.36 0.10 0.00 -0.77 0.00 0.00 57.85 57.49 2kbt n ARG 798 Cb 0.47 -1.62 0.42 0.00 -1.02 0.00 0.00 32.46 30.70 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 -1.73 0.15 -4.39 0.55 3.41 -1.26 -4.53 113.62 105.81 2kbt n SER 799 Ca 0.02 0.53 -0.20 0.00 -0.26 0.00 0.00 58.87 58.96 2kbt n SER 799 Cb 0.14 -0.56 -0.10 0.00 -0.26 0.00 0.00 64.21 63.43 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 -3.05 1.45 -0.11 4.33 2.56 -0.54 -3.66 118.70 119.69 2kbt s GLU 800 Ca 0.09 -1.66 -0.05 0.00 0.00 0.00 0.00 54.97 53.34 2kbt s GLU 800 Cb 0.12 -1.31 -0.04 0.00 2.00 0.00 0.00 34.13 34.90 2kbt s GLU 800 CO 0.37 0.21 0.09 -1.17 -0.56 0.00 0.00 175.26 174.20 2kbt s LEU 801 N -3.39 4.09 -0.74 2.70 0.20 0.14 -4.08 118.68 117.61 2kbt s LEU 801 Ca 0.25 0.35 -0.27 0.00 0.69 0.00 0.00 54.13 55.15 2kbt s LEU 801 Cb -0.01 -1.98 0.02 0.00 -0.43 0.00 0.00 46.19 43.79 2kbt s LEU 801 CO 0.10 0.40 1.37 -0.44 -0.29 0.00 0.00 176.35 177.48 2kbt s SER 802 N -0.99 6.05 0.37 3.68 0.01 -1.26 -4.35 113.70 117.21 2kbt s SER 802 Ca 0.15 -0.39 -0.05 0.00 1.31 0.00 0.00 55.95 56.97 2kbt s SER 802 Cb -0.12 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.51 2kbt s SER 802 CO 0.04 -1.90 0.65 -0.76 0.41 0.00 0.00 173.24 171.67 2kbt s LEU 803 N 6.17 3.89 -0.28 2.44 1.02 -0.87 -4.90 118.68 126.16 2kbt s LEU 803 Ca 0.40 0.77 -0.02 0.00 0.02 0.00 0.00 54.13 55.30 2kbt s LEU 803 Cb -0.08 -3.65 0.17 0.00 0.02 0.00 0.00 46.19 42.65 2kbt s LEU 803 CO 0.15 -0.36 0.53 -0.75 0.02 0.00 0.00 176.35 175.93 2kbt s LYS 804 N -4.11 0.49 0.08 1.70 2.36 -1.26 -2.42 119.74 116.58 2kbt s LYS 804 Ca 0.45 0.87 -0.33 0.00 -2.55 0.00 0.00 55.97 54.41 2kbt s LYS 804 Cb -0.10 0.23 -0.18 0.00 -1.05 0.00 0.00 37.83 36.73 2kbt s LYS 804 CO 0.36 -0.61 0.80 0.39 1.55 0.00 0.00 175.35 177.84 2kbt n GLU 805 N 5.41 0.00 -0.10 4.03 1.02 -1.26 0.21 120.64 129.95 2kbt n GLU 805 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2kbt n GLU 805 Cb 0.51 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.70 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 1.62 1.13 3.98 0.62 0.00 -1.17 -4.97 105.19 106.40 2kbt n GLY 806 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 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 5.87 -0.07 1.61 1.11 0.13 -4.94 116.67 117.50 2kbt s ASP 807 Ca 0.00 -0.02 0.03 0.00 0.18 0.00 0.00 52.55 52.75 2kbt s ASP 807 Cb 0.00 -1.29 -0.02 0.00 1.07 0.00 0.00 42.92 42.67 2kbt s ASP 807 CO 0.00 -0.58 -0.17 0.27 1.18 0.00 0.00 175.17 175.87 2kbt s ILE 808 N -2.35 2.83 -0.30 0.77 -0.00 -1.26 -0.86 121.20 120.03 2kbt s ILE 808 Ca 0.47 -0.79 -0.08 0.00 -0.00 0.00 0.00 60.65 60.25 2kbt s ILE 808 Cb -0.10 -2.11 0.00 0.00 -0.00 0.00 0.00 42.46 40.26 2kbt s ILE 808 CO 0.34 0.57 0.11 -0.63 -0.00 0.00 0.00 174.94 175.33 2kbt s ILE 809 N -0.40 4.18 -0.24 8.37 1.09 0.12 -4.83 121.20 129.48 2kbt s ILE 809 Ca 0.04 -0.61 -0.29 0.00 -1.10 0.00 0.00 60.65 58.69 2kbt s ILE 809 Cb -0.12 -3.15 -0.03 0.00 -1.06 0.00 0.00 42.46 38.10 2kbt s ILE 809 CO 0.02 0.07 1.67 -0.75 -0.10 0.00 0.00 174.94 175.85 2kbt s LYS 810 N 1.54 3.69 -0.17 2.79 2.47 -1.15 0.68 119.74 129.59 2kbt s LYS 810 Ca 0.03 1.63 -0.29 0.00 -1.56 0.00 0.00 55.97 55.78 2kbt s LYS 810 Cb -0.17 -4.08 -0.01 0.00 -1.46 0.00 0.00 37.83 32.11 2kbt s LYS 810 CO 0.04 -1.42 1.28 0.42 0.16 0.00 0.00 175.35 175.82 2kbt s ILE 811 N 5.60 4.25 -0.12 5.43 -1.09 -1.22 -2.73 121.20 131.32 2kbt s ILE 811 Ca 0.74 1.51 -0.07 0.00 -2.23 0.00 0.00 60.65 60.59 2kbt s ILE 811 Cb -0.25 -3.98 -0.05 0.00 -1.58 0.00 0.00 42.46 36.60 2kbt s ILE 811 CO 0.31 -0.15 -0.18 0.18 -1.23 0.00 0.00 174.94 173.87 2kbt n LEU 812 N 6.67 1.07 -4.49 2.97 4.77 0.66 -3.91 117.00 124.74 2kbt n LEU 812 Ca 0.14 0.18 -0.24 0.00 -0.03 0.00 0.00 56.01 56.06 2kbt n LEU 812 Cb 0.45 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 41.01 2kbt n LEU 812 CO 0.56 0.13 -0.38 0.21 -1.33 0.00 0.00 177.39 176.58 2kbt s ASN 813 N -6.18 3.33 -0.45 -1.43 2.47 -0.32 -4.84 114.94 107.51 2kbt s ASN 813 Ca -0.18 -1.18 0.03 0.00 0.42 0.00 0.00 52.86 51.94 2kbt s ASN 813 Cb 0.06 -0.27 0.16 0.00 -1.45 0.00 0.00 41.25 39.75 2kbt s ASN 813 CO 0.24 -0.24 0.32 -0.54 -3.72 0.00 0.00 177.10 173.15 2kbt s LYS 814 N -3.65 1.17 0.17 0.43 1.02 -1.26 -2.39 119.74 115.23 2kbt s LYS 814 Ca 0.31 -2.16 -0.28 0.00 0.02 0.00 0.00 55.97 53.87 2kbt s LYS 814 Cb 0.03 -1.90 -0.08 0.00 -0.52 0.00 0.00 37.83 35.36 2kbt s LYS 814 CO 0.14 -1.30 0.86 0.15 -0.92 0.00 0.00 175.35 174.29 2kbt s LYS 815 N 0.04 4.69 0.19 1.68 -0.14 -1.12 -4.89 119.74 120.19 2kbt s LYS 815 Ca 0.26 1.31 0.00 0.00 -1.36 0.00 0.00 55.97 56.18 2kbt s LYS 815 Cb -0.07 -3.30 0.00 0.00 -1.68 0.00 0.00 37.83 32.78 2kbt s LYS 815 CO -0.12 0.47 0.00 0.41 -0.76 0.00 0.00 175.35 175.35 2kbt n GLY 816 N 1.73 -1.03 0.12 -3.33 0.00 -1.26 -3.50 105.19 97.92 2kbt n GLY 816 Ca -0.03 -0.58 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.55 0.67 0.00 1.61 3.00 -1.26 -4.54 117.38 114.30 2kbt n GLN 817 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2kbt n GLN 817 Cb 0.59 -1.55 0.00 0.00 0.00 0.00 0.00 30.24 29.27 2kbt n GLN 817 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2kbt n GLN 818 N -3.08 2.32 0.00 -1.09 6.02 -1.26 -4.94 117.38 115.34 2kbt n GLN 818 Ca -0.38 -0.27 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 2kbt n GLN 818 Cb 1.06 -0.76 0.00 0.00 1.02 0.00 0.00 30.24 31.56 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 0.41 -2.03 3.30 1.08 0.00 -1.26 -4.66 105.19 102.03 2kbt n GLY 819 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 1.15 -0.02 1.61 -2.14 -1.23 -4.07 118.94 114.24 2kbt s TRP 820 Ca 0.00 -1.33 0.04 0.00 2.66 0.00 0.00 56.10 57.46 2kbt s TRP 820 Cb 0.00 -0.44 -0.01 0.00 -3.10 0.00 0.00 33.47 29.92 2kbt s TRP 820 CO 0.00 -0.78 -0.13 -1.58 -2.66 0.00 0.00 176.95 171.80 2kbt s TRP 821 N -3.91 1.24 -0.13 1.66 0.51 0.93 -2.77 118.94 116.48 2kbt s TRP 821 Ca 0.36 -0.27 -0.23 0.00 -2.12 0.00 0.00 56.10 53.84 2kbt s TRP 821 Cb 0.04 -0.82 -0.03 0.00 -0.81 0.00 0.00 33.47 31.85 2kbt s TRP 821 CO 0.15 -0.06 0.71 0.50 -0.51 0.00 0.00 176.95 177.75 2kbt s ARG 822 N -0.15 4.34 0.00 4.98 3.52 -1.01 -2.84 118.95 127.79 2kbt s ARG 822 Ca 0.02 0.85 0.00 0.00 -0.13 0.00 0.00 55.73 56.47 2kbt s ARG 822 Cb -0.07 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.81 2kbt s ARG 822 CO 0.00 -0.11 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 2kbt n GLY 823 N 3.37 4.62 3.58 8.12 0.00 -1.17 -0.25 105.19 123.47 2kbt n GLY 823 Ca 0.00 -1.23 -0.11 0.00 0.00 0.00 0.00 46.02 44.68 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 1.04 0.61 -0.04 1.61 -6.30 -1.11 -2.95 118.70 111.58 2kbt s GLU 824 Ca 0.00 0.21 -0.01 0.00 -2.50 0.00 0.00 54.97 52.67 2kbt s GLU 824 Cb 0.00 0.29 0.03 0.00 0.00 0.00 0.00 34.13 34.45 2kbt s GLU 824 CO 0.00 -0.18 0.02 0.42 0.02 0.00 0.00 175.26 175.54 2kbt s ILE 825 N -0.96 0.12 -1.92 -3.70 1.01 0.49 -2.93 121.20 113.32 2kbt s ILE 825 Ca -0.02 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2kbt s ILE 825 Cb -0.01 -0.28 0.00 0.00 0.01 0.00 0.00 42.46 42.18 2kbt s ILE 825 CO 0.01 0.17 0.00 -1.22 0.00 0.00 0.00 174.94 173.90 2kbt n TYR 826 N 4.62 0.00 -0.01 3.97 4.01 -1.26 -0.12 117.16 128.37 2kbt n TYR 826 Ca -0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 2kbt n TYR 826 Cb 0.50 -3.20 0.00 0.00 -0.31 0.00 0.00 39.34 36.33 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 -0.43 0.32 3.63 2.72 0.00 -1.26 -5.04 105.19 105.13 2kbt n GLY 827 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.90 4.03 0.41 1.61 3.00 0.83 -5.03 118.95 122.90 2kbt s ARG 828 Ca 0.00 0.93 -0.08 0.00 0.00 0.00 0.00 55.73 56.58 2kbt s ARG 828 Cb 0.00 -3.73 -0.05 0.00 0.00 0.00 0.00 34.95 31.16 2kbt s ARG 828 CO 0.00 -0.83 0.74 0.42 0.00 0.00 0.00 175.30 175.63 2kbt s ILE 829 N 3.43 4.86 -1.31 1.52 -1.09 -1.26 -0.38 121.20 126.98 2kbt s ILE 829 Ca 0.41 0.39 0.00 0.00 -2.23 0.00 0.00 60.65 59.23 2kbt s ILE 829 Cb -0.13 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 2kbt s ILE 829 CO 0.14 -0.60 0.00 0.61 -1.23 0.00 0.00 174.94 173.87 2kbt n GLY 830 N -1.55 -0.91 3.37 6.18 0.00 -1.15 -4.63 105.19 106.49 2kbt n GLY 830 Ca 0.01 -0.82 -0.19 0.00 0.00 0.00 0.00 46.02 45.03 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 1.72 -0.24 1.61 0.52 -1.24 -3.05 118.94 115.26 2kbt s TRP 831 Ca 0.00 -1.08 -0.31 0.00 0.02 0.00 0.00 56.10 54.73 2kbt s TRP 831 Cb 0.00 -1.06 0.16 0.00 -1.15 0.00 0.00 33.47 31.43 2kbt s TRP 831 CO 0.00 -0.18 1.24 -0.59 0.02 0.00 0.00 176.95 177.44 2kbt s PHE 832 N -3.55 -0.13 0.42 -1.98 -0.71 -1.13 0.28 117.98 111.17 2kbt s PHE 832 Ca 0.37 0.19 -0.23 0.00 -1.04 0.00 0.00 56.93 56.22 2kbt s PHE 832 Cb 0.08 0.49 -0.09 0.00 -1.21 0.00 0.00 43.02 42.29 2kbt s PHE 832 CO 0.14 -0.14 1.05 -1.25 -1.34 0.00 0.00 175.22 173.68 2kbt s PRO 833 N -1.39 4.09 0.00 1.99 0.04 -1.26 -0.05 135.00 138.41 2kbt s PRO 833 Ca 0.07 1.49 0.20 0.00 0.04 0.00 0.00 61.00 62.80 2kbt s PRO 833 Cb -0.01 -2.45 1.10 0.00 0.04 0.00 0.00 34.50 33.17 2kbt s PRO 833 CO -0.05 -0.21 1.72 -1.13 0.04 0.00 0.00 177.00 177.37 2kbt n SER 834 N -0.25 0.29 -0.10 6.66 3.41 -1.26 -2.63 113.62 119.74 2kbt n SER 834 Ca 0.06 -1.44 0.11 0.00 -0.26 0.00 0.00 58.87 57.33 2kbt n SER 834 Cb 0.50 -0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.43 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 -0.61 1.09 -0.00 4.04 3.02 -1.26 -4.04 115.26 117.50 2kbt n ASN 835 Ca 0.15 -0.94 0.05 0.00 -0.03 0.00 0.00 54.58 53.81 2kbt n ASN 835 Cb 0.11 0.72 -0.06 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 -1.19 0.00 -4.45 3.10 4.02 -1.08 -5.01 117.16 112.55 2kbt n TYR 836 Ca 0.06 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.68 2kbt n TYR 836 Cb 0.36 -0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.58 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 -2.07 2.05 -0.09 -0.72 -7.23 -1.21 -0.32 120.40 110.80 2kbt s VAL 837 Ca 0.04 -1.89 -0.04 0.00 -1.81 0.00 0.00 61.98 58.28 2kbt s VAL 837 Cb 0.08 -2.94 0.05 0.00 0.56 0.00 0.00 36.38 34.13 2kbt s VAL 837 CO 0.46 0.00 0.20 -1.61 -0.31 0.00 0.00 175.10 173.84 2kbt s GLU 838 N -3.79 0.11 0.45 4.82 2.02 0.20 -4.84 118.70 117.68 2kbt s GLU 838 Ca 0.35 0.54 0.06 0.00 0.02 0.00 0.00 54.97 55.95 2kbt s GLU 838 Cb 0.07 -0.16 -0.03 0.00 0.10 0.00 0.00 34.13 34.11 2kbt s GLU 838 CO 0.19 -0.23 0.21 -1.83 0.02 0.00 0.00 175.26 173.61 2kbt s GLU 839 N 1.79 2.23 -1.81 1.61 4.04 -1.26 0.19 118.70 125.49 2kbt s GLU 839 Ca -0.03 -1.95 -0.19 0.00 0.04 0.00 0.00 54.97 52.84 2kbt s GLU 839 Cb -0.12 -1.95 0.19 0.00 0.02 0.00 0.00 34.13 32.27 2kbt s GLU 839 CO -0.07 -0.26 0.49 -3.47 -1.84 0.00 0.00 175.26 170.11 2kbt n ASP 840 N -1.36 -1.35 -0.07 0.83 4.64 -1.26 -4.78 116.55 113.21 2kbt n ASP 840 Ca -0.04 -1.24 -0.18 0.00 -1.38 0.00 0.00 54.79 51.96 2kbt n ASP 840 Cb 0.65 -1.68 -0.13 0.00 -1.04 0.00 0.00 41.12 38.91 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 -4.19 0.56 -3.89 -0.67 0.18 -1.26 -5.05 117.16 102.85 2kbt n TYR 841 Ca 0.02 0.13 -0.09 0.00 1.88 0.00 0.00 57.90 59.84 2kbt n TYR 841 Cb 0.50 -1.08 -0.01 0.00 -0.38 0.00 0.00 39.34 38.38 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 -6.57 0.04 0.68 9.48 1.04 -1.26 -5.18 113.70 111.93 2kbt s SER 842 Ca -0.25 -1.00 0.03 0.00 0.48 0.00 0.00 55.95 55.20 2kbt s SER 842 Cb 0.08 0.75 0.12 0.00 0.10 0.00 0.00 66.02 67.07 2kbt s SER 842 CO 0.71 -1.46 0.94 -1.61 0.98 0.00 0.00 173.24 172.80 2kbt s GLU 843 N -3.12 1.82 -0.43 4.02 0.41 -1.26 -5.05 118.70 115.09 2kbt s GLU 843 Ca 0.17 -1.34 0.09 0.00 -0.41 0.00 0.00 54.97 53.49 2kbt s GLU 843 Cb -0.04 -2.43 0.41 0.00 -1.78 0.00 0.00 34.13 30.28 2kbt s GLU 843 CO 0.11 -1.30 0.99 0.98 -0.49 0.00 0.00 175.26 175.54 2kbt n TYR 844 N -2.67 2.54 -0.86 1.61 9.36 -1.26 -5.10 117.16 120.78 2kbt n TYR 844 Ca 0.16 -3.29 -0.34 0.00 3.32 0.00 0.00 57.90 57.75 2kbt n TYR 844 Cb 0.61 -0.28 0.10 0.00 -0.63 0.00 0.00 39.34 39.13 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 -0.23 -2.03 -4.75 2.98 7.99 -1.26 -4.89 117.00 114.81 2kbt n LEU 845 Ca 0.28 0.28 -0.40 0.00 -0.01 0.00 0.00 56.01 56.15 2kbt n LEU 845 Cb 0.65 -1.07 -0.04 0.00 -0.11 0.00 0.00 43.42 42.85 2kbt n LEU 845 CO 0.30 -4.38 0.78 -2.16 -1.51 0.00 0.00 177.39 170.42 2kbt s PRO 846 N -3.13 4.64 -0.41 3.23 0.04 -1.26 -4.92 135.00 133.19 2kbt s PRO 846 Ca 0.52 1.76 -0.27 0.00 0.04 0.00 0.00 61.00 63.05 2kbt s PRO 846 Cb -0.20 -3.22 -0.06 0.00 0.04 0.00 0.00 34.50 31.06 2kbt s PRO 846 CO 0.72 0.19 2.36 -1.21 0.04 0.00 0.00 177.00 179.10 2kbt s GLU 847 N -1.11 2.39 0.00 4.56 2.02 -1.26 -5.32 118.70 119.98 2kbt s GLU 847 Ca 0.46 1.59 0.02 0.00 0.02 0.00 0.00 54.97 57.06 2kbt s GLU 847 Cb -0.31 -4.53 0.12 0.00 0.10 0.00 0.00 34.13 29.52 2kbt s GLU 847 CO 0.39 -2.95 0.61 -2.37 0.02 0.00 0.00 175.26 170.96