#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 -2.41 1.61 0.13 -1.92 -3.49 132.00 125.91 2kbt h PRO 781 Ca 0.00 0.00 0.24 0.00 -0.87 0.00 0.00 66.00 65.37 2kbt h PRO 781 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 2kbt h PRO 781 CO 0.00 0.52 -0.52 0.41 -0.23 0.00 0.00 178.00 178.18 2kbt n GLY 782 N 0.61 -1.55 3.61 1.56 0.00 -1.26 -4.60 105.19 103.55 2kbt n GLY 782 Ca 0.00 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.81 4.85 -0.12 2.61 2.01 -1.26 -4.82 115.64 116.10 2kbt s THR 783 Ca 0.00 1.11 -0.05 0.00 0.31 0.00 0.00 61.69 63.06 2kbt s THR 783 Cb 0.00 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 2kbt s THR 783 CO 0.00 -0.19 -0.09 -0.26 -0.69 0.00 0.00 174.62 173.39 2kbt h PHE 784 N 8.09 0.00 0.00 4.92 0.04 -1.82 -3.51 116.94 124.67 2kbt h PHE 784 Ca -0.25 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.52 2kbt h PHE 784 Cb 1.10 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.25 2kbt h PHE 784 CO 0.77 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.89 2kbt n GLY 785 N 1.70 -1.28 3.65 -1.45 0.00 -1.26 -4.99 105.19 101.55 2kbt n GLY 785 Ca -0.04 0.49 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 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 -0.19 2.61 -4.23 -1.26 -2.90 115.64 109.66 2kbt s THR 786 Ca 0.00 -1.31 -0.05 0.00 -1.18 0.00 0.00 61.69 59.16 2kbt s THR 786 Cb 0.00 -2.46 0.07 0.00 1.34 0.00 0.00 72.50 71.45 2kbt s THR 786 CO 0.00 0.00 0.11 0.00 -0.54 0.00 0.00 174.62 174.19 2kbt s ALA 787 N -3.32 0.35 -0.20 3.99 0.00 0.28 -3.81 121.76 119.03 2kbt s ALA 787 Ca 0.21 -0.34 -0.29 0.00 0.00 0.00 0.00 51.96 51.55 2kbt s ALA 787 Cb -0.02 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.96 2kbt s ALA 787 CO 0.12 -1.25 1.30 0.21 0.00 0.00 0.00 175.76 176.14 2kbt s LYS 788 N 2.16 4.12 0.43 0.00 2.20 0.34 0.13 119.74 129.12 2kbt s LYS 788 Ca 0.04 1.55 -0.26 0.00 -0.36 0.00 0.00 55.97 56.94 2kbt s LYS 788 Cb -0.16 -3.81 -0.09 0.00 -1.51 0.00 0.00 37.83 32.26 2kbt s LYS 788 CO -0.13 -0.85 1.39 0.00 -0.36 0.00 0.00 175.35 175.39 2kbt s ALA 789 N 3.83 3.27 -0.43 3.13 0.00 0.40 -0.41 121.76 131.55 2kbt s ALA 789 Ca 0.56 1.40 0.04 0.00 0.00 0.00 0.00 51.96 53.96 2kbt s ALA 789 Cb -0.21 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.37 2kbt s ALA 789 CO 0.18 -1.06 0.52 0.54 0.00 0.00 0.00 175.76 175.94 2kbt n ARG 790 N -0.04 1.00 -3.76 0.00 5.12 0.60 -3.52 116.66 116.06 2kbt n ARG 790 Ca 0.04 -0.57 -0.13 0.00 -1.93 0.00 0.00 57.85 55.26 2kbt n ARG 790 Cb 0.42 -0.98 -0.13 0.00 -1.16 0.00 0.00 32.46 30.61 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 -0.57 -0.24 -0.64 -1.55 1.51 -1.14 -4.91 117.35 109.81 2kbt s TYR 791 Ca 0.04 0.60 -0.26 0.00 -1.01 0.00 0.00 57.07 56.44 2kbt s TYR 791 Cb 0.03 0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.86 2kbt s TYR 791 CO 0.07 -0.17 1.99 0.16 -1.11 0.00 0.00 175.55 176.50 2kbt s ASP 792 N 0.81 5.04 0.79 2.29 1.47 -1.26 -3.90 116.67 121.91 2kbt s ASP 792 Ca -0.06 0.31 -0.08 0.00 1.18 0.00 0.00 52.55 53.90 2kbt s ASP 792 Cb -0.07 -2.53 0.12 0.00 -0.34 0.00 0.00 42.92 40.09 2kbt s ASP 792 CO -0.05 -2.58 1.11 0.12 0.68 0.00 0.00 175.17 174.45 2kbt s PHE 793 N 10.02 2.25 -0.27 2.11 5.36 -1.12 -4.92 117.98 131.41 2kbt s PHE 793 Ca 0.74 0.27 -0.01 0.00 -0.96 0.00 0.00 56.93 56.98 2kbt s PHE 793 Cb -0.13 -3.44 0.15 0.00 -0.34 0.00 0.00 43.02 39.26 2kbt s PHE 793 CO 0.18 -1.86 0.41 0.00 -1.46 0.00 0.00 175.22 172.49 2kbt s ALA 795 N 2.57 3.52 -0.85 0.00 0.00 -1.26 -4.85 121.76 120.89 2kbt s ALA 795 Ca 0.12 0.78 0.25 0.00 0.00 0.00 0.00 51.96 53.11 2kbt s ALA 795 Cb -0.14 -3.77 0.58 0.00 0.00 0.00 0.00 23.12 19.79 2kbt s ALA 795 CO -0.22 -1.55 1.48 0.54 0.00 0.00 0.00 175.76 176.01 2kbt n ARG 796 N 7.25 0.13 -2.69 0.00 5.12 -1.26 -4.92 116.66 120.30 2kbt n ARG 796 Ca 0.18 0.05 -0.07 0.00 -1.93 0.00 0.00 57.85 56.08 2kbt n ARG 796 Cb 0.44 -1.59 -0.02 0.00 -1.16 0.00 0.00 32.46 30.12 2kbt n ARG 796 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2kbt n ASP 797 N -1.78 0.49 0.01 0.55 10.43 -1.26 -5.05 116.55 119.95 2kbt n ASP 797 Ca 0.05 -1.64 0.11 0.00 2.57 0.00 0.00 54.79 55.88 2kbt n ASP 797 Cb 0.38 0.38 -0.03 0.00 1.84 0.00 0.00 41.12 43.70 2kbt n ASP 797 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 2kbt n ARG 798 N -0.23 0.23 0.00 -1.24 0.00 -1.26 -3.88 116.66 110.28 2kbt n ARG 798 Ca 0.00 -0.03 0.13 0.00 -0.00 0.00 0.00 57.85 57.95 2kbt n ARG 798 Cb 0.18 -1.55 0.44 0.00 -0.00 0.00 0.00 32.46 31.53 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 -1.82 0.66 -4.91 2.89 3.41 -1.26 -4.74 113.62 107.85 2kbt n SER 799 Ca 0.02 -0.54 -0.31 0.00 -0.26 0.00 0.00 58.87 57.78 2kbt n SER 799 Cb 0.41 0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.37 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 -2.65 3.40 0.06 4.33 2.56 -1.25 -2.35 118.70 122.80 2kbt s GLU 800 Ca 0.22 -0.45 -0.22 0.00 0.00 0.00 0.00 54.97 54.53 2kbt s GLU 800 Cb 0.19 -3.02 -0.06 0.00 2.00 0.00 0.00 34.13 33.23 2kbt s GLU 800 CO 0.55 0.61 0.64 -1.17 -0.56 0.00 0.00 175.26 175.34 2kbt s LEU 801 N -2.44 4.49 -0.77 2.70 0.20 0.54 -4.37 118.68 119.04 2kbt s LEU 801 Ca 0.34 1.32 -0.22 0.00 0.69 0.00 0.00 54.13 56.26 2kbt s LEU 801 Cb -0.13 -3.03 0.08 0.00 -0.43 0.00 0.00 46.19 42.68 2kbt s LEU 801 CO 0.27 0.17 1.09 -0.94 -0.29 0.00 0.00 176.35 176.64 2kbt s SER 802 N -0.64 6.32 0.43 3.68 1.04 -1.26 -4.36 113.70 118.91 2kbt s SER 802 Ca 0.32 -1.24 -0.04 0.00 0.48 0.00 0.00 55.95 55.47 2kbt s SER 802 Cb -0.20 -2.44 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 2kbt s SER 802 CO 0.20 -1.40 0.71 -0.76 0.98 0.00 0.00 173.24 172.97 2kbt s LEU 803 N 3.99 3.76 -0.30 2.42 1.02 -1.26 -4.88 118.68 123.43 2kbt s LEU 803 Ca 0.28 0.79 -0.09 0.00 0.02 0.00 0.00 54.13 55.13 2kbt s LEU 803 Cb -0.11 -3.71 0.15 0.00 0.02 0.00 0.00 46.19 42.54 2kbt s LEU 803 CO 0.04 -0.48 0.73 -0.75 0.02 0.00 0.00 176.35 175.91 2kbt s LYS 804 N -4.54 0.50 0.18 1.70 2.47 -1.26 -2.80 119.74 115.99 2kbt s LYS 804 Ca 0.45 1.16 -0.30 0.00 -1.56 0.00 0.00 55.97 55.72 2kbt s LYS 804 Cb -0.10 0.69 -0.17 0.00 -1.46 0.00 0.00 37.83 36.79 2kbt s LYS 804 CO 0.41 -0.27 0.71 0.39 0.16 0.00 0.00 175.35 176.76 2kbt n GLU 805 N 5.35 0.27 -0.82 4.03 1.02 -1.25 -0.55 120.64 128.69 2kbt n GLU 805 Ca -0.09 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2kbt n GLU 805 Cb 0.50 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 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 1.83 0.65 3.66 0.62 0.00 -1.23 -4.97 105.19 105.75 2kbt n GLY 806 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.19 4.43 0.05 1.61 -0.00 0.29 -4.99 116.67 115.87 2kbt s ASP 807 Ca 0.00 -0.81 0.06 0.00 -0.00 0.00 0.00 52.55 51.80 2kbt s ASP 807 Cb 0.00 -0.69 -0.03 0.00 -0.00 0.00 0.00 42.92 42.20 2kbt s ASP 807 CO 0.00 -0.16 -0.13 0.27 -0.00 0.00 0.00 175.17 175.15 2kbt s ILE 808 N -2.42 3.16 -0.26 0.77 -0.00 -1.26 -0.45 121.20 120.73 2kbt s ILE 808 Ca 0.34 -1.10 -0.03 0.00 -0.00 0.00 0.00 60.65 59.87 2kbt s ILE 808 Cb -0.03 -2.38 0.02 0.00 -0.00 0.00 0.00 42.46 40.07 2kbt s ILE 808 CO 0.20 0.30 -0.03 -0.63 -0.00 0.00 0.00 174.94 174.78 2kbt s ILE 809 N -1.01 3.11 -0.21 8.37 1.09 0.34 -4.79 121.20 128.10 2kbt s ILE 809 Ca 0.17 -0.98 -0.29 0.00 -1.10 0.00 0.00 60.65 58.45 2kbt s ILE 809 Cb -0.11 -2.60 -0.03 0.00 -1.06 0.00 0.00 42.46 38.66 2kbt s ILE 809 CO 0.08 0.15 1.66 -0.75 -0.10 0.00 0.00 174.94 175.98 2kbt s LYS 810 N 1.36 3.78 0.08 2.79 2.47 -0.94 0.99 119.74 130.27 2kbt s LYS 810 Ca 0.00 1.72 -0.31 0.00 -1.56 0.00 0.00 55.97 55.83 2kbt s LYS 810 Cb -0.17 -4.06 -0.06 0.00 -1.46 0.00 0.00 37.83 32.08 2kbt s LYS 810 CO -0.03 -1.32 1.21 0.42 0.16 0.00 0.00 175.35 175.79 2kbt s ILE 811 N 5.31 3.92 0.00 5.43 -1.09 -1.14 -2.22 121.20 131.41 2kbt s ILE 811 Ca 0.73 1.41 0.00 0.00 -2.23 0.00 0.00 60.65 60.57 2kbt s ILE 811 Cb -0.26 -3.90 0.00 0.00 -1.58 0.00 0.00 42.46 36.71 2kbt s ILE 811 CO 0.30 0.13 0.00 0.18 -1.23 0.00 0.00 174.94 174.32 2kbt n LEU 812 N 3.70 1.66 -3.97 2.97 4.77 -0.06 -4.62 117.00 121.45 2kbt n LEU 812 Ca 0.08 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.97 2kbt n LEU 812 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 2kbt n LEU 812 CO 0.56 0.26 -0.30 0.20 -1.33 0.00 0.00 177.39 176.78 2kbt s ASN 813 N -4.38 0.22 -0.41 -1.43 -0.87 -0.88 -4.79 114.94 102.41 2kbt s ASN 813 Ca 0.00 -0.52 0.01 0.00 -1.57 0.00 0.00 52.86 50.78 2kbt s ASN 813 Cb 0.00 0.16 0.13 0.00 -0.02 0.00 0.00 41.25 41.52 2kbt s ASN 813 CO 0.00 -0.39 0.22 -0.54 -2.57 0.00 0.00 177.10 173.82 2kbt s LYS 814 N -1.99 1.09 0.45 -0.60 1.02 -1.26 -2.00 119.74 116.45 2kbt s LYS 814 Ca -0.11 -1.78 0.31 0.00 0.02 0.00 0.00 55.97 54.41 2kbt s LYS 814 Cb -0.06 -2.10 1.43 0.00 -0.52 0.00 0.00 37.83 36.58 2kbt s LYS 814 CO -0.02 -1.15 1.65 0.87 -0.92 0.00 0.00 175.35 175.77 2kbt h LYS 815 N 6.91 0.11 0.00 1.68 1.79 -1.93 -3.45 116.57 121.68 2kbt h LYS 815 Ca -0.01 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2kbt h LYS 815 Cb 0.94 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 2kbt h LYS 815 CO 0.44 0.07 0.00 0.41 -1.08 0.00 0.00 179.45 179.29 2kbt n GLY 816 N -1.58 -1.01 1.15 3.86 0.00 -1.26 -4.95 105.19 101.40 2kbt n GLY 816 Ca 0.35 -0.99 0.04 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 2.87 -3.66 1.61 6.02 -1.26 -4.80 117.38 118.16 2kbt n GLN 817 Ca 0.00 -1.64 -0.12 0.00 -0.01 0.00 0.00 57.00 55.23 2kbt n GLN 817 Cb 0.00 -1.80 -0.08 0.00 1.02 0.00 0.00 30.24 29.38 2kbt n GLN 817 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2kbt s GLN 818 N -1.85 0.69 0.00 -1.09 -2.07 -1.26 -5.08 119.66 109.00 2kbt s GLN 818 Ca 0.29 0.95 0.00 0.00 -1.82 0.00 0.00 55.36 54.78 2kbt s GLN 818 Cb 0.21 0.26 0.00 0.00 -1.09 0.00 0.00 33.01 32.39 2kbt s GLN 818 CO 0.10 -0.11 0.00 0.41 -1.32 0.00 0.00 175.29 174.37 2kbt n GLY 819 N 3.32 1.34 3.30 2.60 0.00 -1.26 -4.95 105.19 109.53 2kbt n GLY 819 Ca -0.16 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 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 1.17 0.06 1.61 -2.14 -1.26 -4.00 118.94 114.37 2kbt s TRP 820 Ca 0.00 -1.34 0.06 0.00 2.66 0.00 0.00 56.10 57.48 2kbt s TRP 820 Cb 0.00 -0.45 -0.03 0.00 -3.10 0.00 0.00 33.47 29.90 2kbt s TRP 820 CO 0.00 -0.78 -0.17 -1.58 -2.66 0.00 0.00 176.95 171.76 2kbt s TRP 821 N -3.89 1.46 -0.33 1.66 0.51 0.76 -4.20 118.94 114.91 2kbt s TRP 821 Ca 0.36 -0.39 -0.14 0.00 -2.12 0.00 0.00 56.10 53.81 2kbt s TRP 821 Cb 0.04 -0.84 -0.02 0.00 -0.81 0.00 0.00 33.47 31.84 2kbt s TRP 821 CO 0.16 0.09 0.32 0.50 -0.51 0.00 0.00 176.95 177.50 2kbt s ARG 822 N -1.43 3.61 0.08 4.98 3.52 -0.85 -2.26 118.95 126.61 2kbt s ARG 822 Ca 0.03 -0.42 0.01 0.00 -0.13 0.00 0.00 55.73 55.21 2kbt s ARG 822 Cb -0.09 -3.78 -0.00 0.00 -1.56 0.00 0.00 34.95 29.52 2kbt s ARG 822 CO 0.02 -0.46 0.09 0.41 -0.81 0.00 0.00 175.30 174.55 2kbt n GLY 823 N 4.98 3.35 3.28 8.12 0.00 -1.18 -0.88 105.19 122.84 2kbt n GLY 823 Ca -0.10 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 2kbt n GLY 823 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kbt s GLU 824 N -2.25 1.17 -0.26 1.61 -1.05 -0.94 -2.61 118.70 114.37 2kbt s GLU 824 Ca 0.08 -1.43 -0.11 0.00 -0.15 0.00 0.00 54.97 53.37 2kbt s GLU 824 Cb 0.00 0.32 0.10 0.00 -0.44 0.00 0.00 34.13 34.11 2kbt s GLU 824 CO 0.06 -0.40 0.58 0.42 0.95 0.00 0.00 175.26 176.87 2kbt s ILE 825 N -4.07 -0.61 -1.96 1.83 1.01 0.11 -2.20 121.20 115.31 2kbt s ILE 825 Ca 0.28 0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.98 2kbt s ILE 825 Cb 0.05 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.64 2kbt s ILE 825 CO 0.06 0.02 0.00 -1.22 0.00 0.00 0.00 174.94 173.80 2kbt n TYR 826 N 5.07 -0.20 -0.37 3.97 4.01 -1.26 0.34 117.16 128.72 2kbt n TYR 826 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 2kbt n TYR 826 Cb 0.52 -3.27 0.00 0.00 -0.31 0.00 0.00 39.34 36.28 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 -0.40 0.80 3.38 2.72 0.00 -1.26 -5.05 105.19 105.38 2kbt n GLY 827 Ca -0.19 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.67 2.95 0.37 1.61 0.52 0.15 -5.08 118.95 118.80 2kbt s ARG 828 Ca 0.00 -0.99 -0.08 0.00 -0.52 0.00 0.00 55.73 54.14 2kbt s ARG 828 Cb 0.00 -3.66 -0.06 0.00 0.52 0.00 0.00 34.95 31.76 2kbt s ARG 828 CO 0.00 -0.62 0.70 0.42 0.02 0.00 0.00 175.30 175.82 2kbt s ILE 829 N 1.56 4.87 -2.61 1.52 -1.09 -1.26 -0.72 121.20 123.47 2kbt s ILE 829 Ca 0.02 0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.84 2kbt s ILE 829 Cb -0.19 -3.74 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 2kbt s ILE 829 CO 0.06 -0.48 0.00 0.61 -1.23 0.00 0.00 174.94 173.90 2kbt n GLY 830 N -1.25 -1.29 3.38 6.18 0.00 -1.07 -4.53 105.19 106.60 2kbt n GLY 830 Ca 0.01 -1.02 -0.28 0.00 0.00 0.00 0.00 46.02 44.73 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 2.22 0.01 1.61 0.52 -0.99 -3.13 118.94 116.18 2kbt s TRP 831 Ca 0.00 -0.38 -0.20 0.00 0.02 0.00 0.00 56.10 55.53 2kbt s TRP 831 Cb 0.00 -1.18 0.04 0.00 -1.15 0.00 0.00 33.47 31.18 2kbt s TRP 831 CO 0.00 0.35 0.45 -0.59 0.02 0.00 0.00 176.95 177.17 2kbt s PHE 832 N -1.21 -0.34 0.44 -1.98 -0.71 -0.96 -0.34 117.98 112.90 2kbt s PHE 832 Ca 0.14 0.44 -0.22 0.00 -1.04 0.00 0.00 56.93 56.25 2kbt s PHE 832 Cb -0.10 0.23 -0.09 0.00 -1.21 0.00 0.00 43.02 41.86 2kbt s PHE 832 CO 0.06 -0.53 1.05 -1.25 -1.34 0.00 0.00 175.22 173.21 2kbt s PRO 833 N -1.89 3.98 0.00 1.99 0.04 -1.26 -0.17 135.00 137.69 2kbt s PRO 833 Ca -0.09 1.45 0.22 0.00 0.04 0.00 0.00 61.00 62.61 2kbt s PRO 833 Cb -0.02 -2.32 0.78 0.00 0.04 0.00 0.00 34.50 32.98 2kbt s PRO 833 CO 0.02 -0.29 1.57 0.45 0.04 0.00 0.00 177.00 178.79 2kbt n SER 834 N -0.51 1.64 0.02 6.66 2.88 -1.26 -3.38 113.62 119.68 2kbt n SER 834 Ca 0.07 -1.68 0.11 0.00 -1.33 0.00 0.00 58.87 56.04 2kbt n SER 834 Cb 0.51 -0.09 0.03 0.00 -0.75 0.00 0.00 64.21 63.91 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 0.30 0.64 -0.36 -3.46 3.02 -1.26 -3.92 115.26 110.21 2kbt n ASN 835 Ca 0.16 -0.31 0.05 0.00 -0.03 0.00 0.00 54.58 54.46 2kbt n ASN 835 Cb 0.33 0.76 0.03 0.00 -0.61 0.00 0.00 39.78 40.28 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 -1.85 0.00 -4.49 3.10 4.02 -1.22 -5.00 117.16 111.72 2kbt n TYR 836 Ca 0.03 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.69 2kbt n TYR 836 Cb 0.41 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.62 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 -1.16 1.42 -0.05 -0.72 -7.23 -1.23 -0.29 120.40 111.14 2kbt s VAL 837 Ca 0.11 -2.01 -0.01 0.00 -1.81 0.00 0.00 61.98 58.27 2kbt s VAL 837 Cb 0.09 -2.82 0.03 0.00 0.56 0.00 0.00 36.38 34.24 2kbt s VAL 837 CO 0.20 -0.02 0.01 -1.61 -0.31 0.00 0.00 175.10 173.37 2kbt s GLU 838 N -3.84 0.37 0.48 4.82 0.41 0.45 -4.85 118.70 116.55 2kbt s GLU 838 Ca 0.36 0.13 0.05 0.00 -0.41 0.00 0.00 54.97 55.10 2kbt s GLU 838 Cb 0.09 -0.67 -0.01 0.00 -1.78 0.00 0.00 34.13 31.75 2kbt s GLU 838 CO 0.16 -0.22 0.20 -1.83 -0.49 0.00 0.00 175.26 173.08 2kbt s GLU 839 N 1.54 2.22 -1.49 1.61 4.04 -1.26 0.13 118.70 125.49 2kbt s GLU 839 Ca -0.02 -2.06 -0.06 0.00 0.04 0.00 0.00 54.97 52.87 2kbt s GLU 839 Cb -0.13 -1.89 0.01 0.00 0.02 0.00 0.00 34.13 32.14 2kbt s GLU 839 CO -0.03 -0.35 0.14 -3.47 -1.84 0.00 0.00 175.26 169.70 2kbt n ASP 840 N -1.42 0.05 -0.10 0.83 -0.08 -1.25 -4.82 116.55 109.77 2kbt n ASP 840 Ca -0.06 -1.27 -0.12 0.00 -1.51 0.00 0.00 54.79 51.82 2kbt n ASP 840 Cb 0.65 -1.69 -0.10 0.00 2.34 0.00 0.00 41.12 42.32 2kbt n ASP 840 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kbt n TYR 841 N -4.66 0.00 -3.82 -0.67 0.18 -1.26 -5.06 117.16 101.87 2kbt n TYR 841 Ca -0.29 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.39 2kbt n TYR 841 Cb 0.68 -0.79 -0.05 0.00 -0.38 0.00 0.00 39.34 38.80 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 -5.68 -0.17 0.34 9.48 1.04 -1.26 -5.18 113.70 112.27 2kbt s SER 842 Ca -0.22 -0.62 0.08 0.00 0.48 0.00 0.00 55.95 55.68 2kbt s SER 842 Cb 0.06 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.69 2kbt s SER 842 CO 0.53 -1.03 0.16 -0.70 0.98 0.00 0.00 173.24 173.18 2kbt s GLU 843 N -3.91 2.41 -0.53 4.02 2.12 -1.26 -4.98 118.70 116.58 2kbt s GLU 843 Ca 0.12 -1.53 0.06 0.00 0.36 0.00 0.00 54.97 53.99 2kbt s GLU 843 Cb -0.00 -2.21 0.36 0.00 0.26 0.00 0.00 34.13 32.54 2kbt s GLU 843 CO -0.01 0.10 0.96 0.98 -0.54 0.00 0.00 175.26 176.76 2kbt n TYR 844 N -1.18 3.53 -1.07 5.30 9.36 -1.26 -5.09 117.16 126.75 2kbt n TYR 844 Ca -0.03 -3.78 -0.36 0.00 3.32 0.00 0.00 57.90 57.06 2kbt n TYR 844 Cb 0.61 -0.40 0.06 0.00 -0.63 0.00 0.00 39.34 38.99 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 -0.25 -2.16 -4.79 2.98 7.99 -1.26 -4.94 117.00 114.58 2kbt n LEU 845 Ca 0.32 0.42 -0.29 0.00 -0.01 0.00 0.00 56.01 56.44 2kbt n LEU 845 Cb 0.48 -1.02 0.12 0.00 -0.11 0.00 0.00 43.42 42.88 2kbt n LEU 845 CO 0.33 -4.37 0.71 -2.16 -1.51 0.00 0.00 177.39 170.39 2kbt s PRO 846 N -2.47 1.56 0.79 3.23 0.04 -1.26 -5.02 135.00 131.86 2kbt s PRO 846 Ca 0.55 0.45 -0.11 0.00 0.04 0.00 0.00 61.00 61.92 2kbt s PRO 846 Cb -0.29 -1.87 0.07 0.00 0.04 0.00 0.00 34.50 32.45 2kbt s PRO 846 CO 0.69 -1.94 1.12 -1.21 0.04 0.00 0.00 177.00 175.69 2kbt s GLU 847 N -5.22 2.02 0.00 4.56 0.41 -1.26 -5.31 118.70 113.90 2kbt s GLU 847 Ca 0.62 1.34 0.28 0.00 -0.41 0.00 0.00 54.97 56.80 2kbt s GLU 847 Cb -0.15 -1.86 0.99 0.00 -1.78 0.00 0.00 34.13 31.33 2kbt s GLU 847 CO 0.54 -1.84 1.71 0.25 -0.49 0.00 0.00 175.26 175.42