#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w1u s ALA 805 N 0.00 3.59 0.46 3.17 0.00 -1.26 -5.00 121.76 122.72 2w1u s ALA 805 Ca 0.00 1.41 0.06 0.00 0.00 0.00 0.00 51.96 53.44 2w1u s ALA 805 Cb 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 2w1u s ALA 805 CO 0.00 -0.84 0.28 -1.54 0.00 0.00 0.00 175.76 173.66 2w1u s SER 806 N -0.02 4.60 0.70 0.00 1.04 0.17 -5.03 113.70 115.15 2w1u s SER 806 Ca 0.55 -1.11 -0.16 0.00 0.48 0.00 0.00 55.95 55.71 2w1u s SER 806 Cb -0.43 -0.14 0.02 0.00 0.10 0.00 0.00 66.02 65.57 2w1u s SER 806 CO 0.53 -0.77 1.25 0.54 0.98 0.00 0.00 173.24 175.77 2w1u s ASN 807 N -4.07 4.31 0.72 7.02 6.03 -1.26 -4.43 114.94 123.25 2w1u s ASN 807 Ca 0.38 2.49 -0.11 0.00 -1.03 0.00 0.00 52.86 54.59 2w1u s ASN 807 Cb 0.00 -2.60 0.03 0.00 -3.03 0.00 0.00 41.25 35.65 2w1u s ASN 807 CO 0.22 -2.20 1.10 -2.16 -2.03 0.00 0.00 177.10 172.03 2w1u s PRO 808 N -3.67 2.59 -0.02 3.55 0.04 -1.26 -4.13 135.00 132.10 2w1u s PRO 808 Ca 0.78 0.29 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 2w1u s PRO 808 Cb -0.33 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.20 2w1u s PRO 808 CO 0.43 -1.17 0.27 -1.12 0.04 0.00 0.00 177.00 175.45 2w1u s SER 809 N -4.42 -0.15 -0.04 6.66 0.01 -0.05 -4.96 113.70 110.75 2w1u s SER 809 Ca 0.59 0.06 -0.30 0.00 1.31 0.00 0.00 55.95 57.61 2w1u s SER 809 Cb -0.11 0.31 -0.03 0.00 0.21 0.00 0.00 66.02 66.40 2w1u s SER 809 CO 0.50 -0.40 1.11 -0.22 0.41 0.00 0.00 173.24 174.64 2w1u s LEU 810 N -1.22 4.30 -0.12 2.44 2.96 -1.26 -1.22 118.68 124.56 2w1u s LEU 810 Ca -0.13 1.74 0.02 0.00 -0.22 0.00 0.00 54.13 55.54 2w1u s LEU 810 Cb -0.06 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.06 2w1u s LEU 810 CO 0.03 -0.47 -0.17 -0.63 -1.32 0.00 0.00 176.35 173.79 2w1u s ILE 811 N 1.76 2.65 0.23 6.68 -1.09 -0.11 -4.91 121.20 126.40 2w1u s ILE 811 Ca 0.53 -0.81 -0.12 0.00 -2.23 0.00 0.00 60.65 58.03 2w1u s ILE 811 Cb -0.23 -2.08 -0.01 0.00 -1.58 0.00 0.00 42.46 38.57 2w1u s ILE 811 CO 0.23 0.54 0.42 0.00 -1.23 0.00 0.00 174.94 174.90 2w1u s ARG 812 N 0.33 1.45 0.16 2.79 1.04 -1.26 -0.45 118.95 123.01 2w1u s ARG 812 Ca -0.14 -1.25 -0.34 0.00 -1.04 0.00 0.00 55.73 52.97 2w1u s ARG 812 Cb -0.17 0.44 -0.14 0.00 -2.04 0.00 0.00 34.95 33.05 2w1u s ARG 812 CO 0.07 -0.58 1.55 0.43 -0.04 0.00 0.00 175.30 176.73 2w1u n SER 813 N -0.34 3.00 -0.28 -2.89 7.64 -0.59 -4.88 113.62 115.28 2w1u n SER 813 Ca -0.03 1.09 0.07 0.00 1.01 0.00 0.00 58.87 61.01 2w1u n SER 813 Cb 0.62 -1.42 0.22 0.00 -1.01 0.00 0.00 64.21 62.62 2w1u n SER 813 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2w1u h GLU 814 N 5.72 0.51 0.00 1.43 4.81 -2.00 -2.93 114.58 122.11 2w1u h GLU 814 Ca -0.45 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2w1u h GLU 814 Cb 1.26 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.52 2w1u h GLU 814 CO 0.87 0.34 -0.06 -1.13 -0.73 0.00 0.00 179.01 178.30 2w1u n SER 815 N -4.94 0.47 -4.75 1.04 3.41 -1.26 -4.83 113.62 102.76 2w1u n SER 815 Ca 0.16 0.49 -0.38 0.00 -0.26 0.00 0.00 58.87 58.88 2w1u n SER 815 Cb 0.45 -0.58 0.03 0.00 -0.26 0.00 0.00 64.21 63.84 2w1u n SER 815 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2w1u s TRP 816 N -3.06 2.44 -0.06 7.33 0.51 -1.11 -4.63 118.94 120.36 2w1u s TRP 816 Ca 0.12 1.43 0.06 0.00 -2.12 0.00 0.00 56.10 55.59 2w1u s TRP 816 Cb 0.15 -3.65 -0.01 0.00 -0.81 0.00 0.00 33.47 29.15 2w1u s TRP 816 CO 0.58 -2.47 -0.25 -0.65 -0.51 0.00 0.00 176.95 173.65 2w1u s GLN 817 N -2.91 2.54 -0.39 4.98 -0.21 -0.54 -4.97 119.66 118.15 2w1u s GLN 817 Ca 0.71 -0.90 -0.29 0.00 0.02 0.00 0.00 55.36 54.89 2w1u s GLN 817 Cb -0.36 -2.16 0.01 0.00 1.00 0.00 0.00 33.01 31.49 2w1u s GLN 817 CO 0.42 0.39 1.44 0.08 -2.12 0.00 0.00 175.29 175.50 2w1u s VAL 818 N -0.18 3.89 -0.20 1.09 1.01 -1.26 0.09 120.40 124.83 2w1u s VAL 818 Ca -0.03 0.91 -0.07 0.00 0.00 0.00 0.00 61.98 62.79 2w1u s VAL 818 Cb -0.14 -4.15 -0.20 0.00 0.00 0.00 0.00 36.38 31.89 2w1u s VAL 818 CO 0.04 -0.70 0.07 0.00 0.00 0.00 0.00 175.10 174.50 2w1u n TYR 819 N 8.82 0.68 -3.83 5.22 9.36 0.12 -4.89 117.16 132.64 2w1u n TYR 819 Ca 0.17 0.18 -0.12 0.00 3.32 0.00 0.00 57.90 61.45 2w1u n TYR 819 Cb 0.48 -1.08 -0.11 0.00 -0.63 0.00 0.00 39.34 37.99 2w1u n TYR 819 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2w1u s GLU 820 N -2.51 0.32 1.95 2.98 2.12 -1.00 -4.97 118.70 117.59 2w1u s GLU 820 Ca -0.29 0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.04 2w1u s GLU 820 Cb 0.08 0.14 0.00 0.00 0.26 0.00 0.00 34.13 34.62 2w1u s GLU 820 CO 0.65 -0.06 0.00 0.41 -0.54 0.00 0.00 175.26 175.72 2w1u n GLY 821 N 2.38 -1.22 3.01 -1.50 0.00 -1.26 -0.32 105.19 106.28 2w1u n GLY 821 Ca -0.16 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.49 2w1u n GLY 821 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2w1u s ASN 822 N -4.00 0.57 0.52 1.61 0.02 -1.26 -4.89 114.94 107.51 2w1u s ASN 822 Ca 0.00 -0.45 0.24 0.00 -1.02 0.00 0.00 52.86 51.63 2w1u s ASN 822 Cb 0.00 0.04 1.43 0.00 0.02 0.00 0.00 41.25 42.74 2w1u s ASN 822 CO 0.00 -0.19 2.11 -0.33 0.02 0.00 0.00 177.10 178.71 2w1u h GLU 823 N 4.82 0.00 -0.27 -0.60 5.08 -1.92 -1.52 114.58 120.17 2w1u h GLU 823 Ca -0.33 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.11 2w1u h GLU 823 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2w1u h GLU 823 CO 0.42 0.09 0.21 0.00 -1.00 0.00 0.00 179.01 178.73 2w1u h ALA 824 N 1.91 2.19 0.00 3.43 0.00 -1.97 -1.64 119.26 123.19 2w1u h ALA 824 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2w1u h ALA 824 Cb 0.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2w1u h ALA 824 CO 0.01 -0.34 0.10 0.09 0.00 0.00 0.00 179.25 179.11 2w1u n ASN 825 N -4.34 0.41 -0.34 0.00 3.02 -0.57 -2.31 115.26 111.13 2w1u n ASN 825 Ca 0.04 0.65 0.13 0.00 -0.03 0.00 0.00 54.58 55.37 2w1u n ASN 825 Cb 0.36 -0.67 0.60 0.00 -0.61 0.00 0.00 39.78 39.46 2w1u n ASN 825 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2w1u n LEU 826 N -2.07 1.04 -0.13 3.41 4.77 -0.62 -4.01 117.00 119.39 2w1u n LEU 826 Ca -0.01 -0.37 0.01 0.00 -0.03 0.00 0.00 56.01 55.60 2w1u n LEU 826 Cb 0.13 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2w1u n LEU 826 CO 0.07 0.19 0.31 0.18 -1.33 0.00 0.00 177.39 176.80 2w1u n LEU 827 N -0.17 0.44 -0.50 2.23 4.77 -0.98 -0.43 117.00 122.37 2w1u n LEU 827 Ca 0.19 -0.74 0.13 0.00 -0.03 0.00 0.00 56.01 55.56 2w1u n LEU 827 Cb 0.27 -0.03 0.43 0.00 -2.33 0.00 0.00 43.42 41.75 2w1u n LEU 827 CO 0.16 0.18 0.78 -0.90 -1.33 0.00 0.00 177.39 176.28 2w1u n ASP 828 N -0.17 1.62 0.00 -1.43 5.68 -1.24 -4.94 116.55 116.07 2w1u n ASP 828 Ca 0.01 -1.45 0.00 0.00 -0.50 0.00 0.00 54.79 52.85 2w1u n ASP 828 Cb 0.53 0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 2w1u n ASP 828 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2w1u n GLY 829 N 1.24 0.83 3.41 6.12 0.00 -1.26 -5.02 105.19 110.50 2w1u n GLY 829 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 2w1u n GLY 829 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w1u s ASP 830 N -2.72 5.28 0.59 1.61 3.68 -1.26 -4.97 116.67 118.89 2w1u s ASP 830 Ca 0.00 -0.50 0.36 0.00 2.13 0.00 0.00 52.55 54.54 2w1u s ASP 830 Cb 0.00 -1.94 1.87 0.00 -1.45 0.00 0.00 42.92 41.41 2w1u s ASP 830 CO 0.00 -0.15 2.20 0.44 0.13 0.00 0.00 175.17 177.79 2w1u h ASP 831 N 8.28 0.00 -0.15 -0.34 3.45 -1.95 -2.82 116.42 122.89 2w1u h ASP 831 Ca -0.34 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.12 2w1u h ASP 831 Cb 1.15 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.92 2w1u h ASP 831 CO 0.60 0.04 0.00 0.59 -1.57 0.00 0.00 179.24 178.90 2w1u n ASN 832 N -3.36 2.39 -4.44 6.45 3.02 -1.26 -4.77 115.26 113.29 2w1u n ASN 832 Ca -0.02 -1.80 -0.31 0.00 -0.03 0.00 0.00 54.58 52.41 2w1u n ASN 832 Cb 0.16 -0.09 -0.13 0.00 -0.61 0.00 0.00 39.78 39.11 2w1u n ASN 832 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2w1u s THR 833 N -1.82 2.78 0.09 3.41 -4.23 -1.07 -4.98 115.64 109.82 2w1u s THR 833 Ca 0.34 -1.01 -0.02 0.00 -1.18 0.00 0.00 61.69 59.82 2w1u s THR 833 Cb 0.20 -2.11 0.01 0.00 1.34 0.00 0.00 72.50 71.94 2w1u s THR 833 CO 0.30 0.46 0.15 0.61 -0.54 0.00 0.00 174.62 175.60 2w1u n GLY 834 N 1.95 2.32 3.13 3.99 0.00 -1.26 -4.57 105.19 110.75 2w1u n GLY 834 Ca -0.16 -1.25 -0.16 0.00 0.00 0.00 0.00 46.02 44.45 2w1u n GLY 834 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w1u s VAL 835 N -2.66 0.89 -0.21 1.61 0.11 -0.08 -4.16 120.40 115.90 2w1u s VAL 835 Ca 0.05 -1.26 0.00 0.00 -2.93 0.00 0.00 61.98 57.84 2w1u s VAL 835 Cb -0.01 -0.94 0.02 0.00 -1.53 0.00 0.00 36.38 33.93 2w1u s VAL 835 CO 0.04 -0.32 -0.14 0.86 -3.33 0.00 0.00 175.10 172.22 2w1u s TRP 836 N -1.43 2.94 -0.23 1.54 -0.11 0.57 -1.96 118.94 120.25 2w1u s TRP 836 Ca -0.04 -1.64 -0.12 0.00 1.22 0.00 0.00 56.10 55.52 2w1u s TRP 836 Cb -0.09 -1.98 -0.05 0.00 -1.50 0.00 0.00 33.47 29.86 2w1u s TRP 836 CO 0.01 -0.77 0.24 0.71 -4.62 0.00 0.00 176.95 172.53 2w1u s TYR 837 N 1.29 3.33 0.10 5.86 1.51 0.12 0.13 117.35 129.68 2w1u s TYR 837 Ca 0.02 0.35 -0.30 0.00 -1.01 0.00 0.00 57.07 56.13 2w1u s TYR 837 Cb -0.15 -2.36 -0.06 0.00 -0.11 0.00 0.00 41.96 39.28 2w1u s TYR 837 CO -0.09 0.03 1.12 0.21 -1.11 0.00 0.00 175.55 175.71 2w1u s LYS 838 N 1.19 4.52 0.01 -0.62 2.20 0.11 -1.48 119.74 125.68 2w1u s LYS 838 Ca 0.11 1.68 -0.04 0.00 -0.36 0.00 0.00 55.97 57.37 2w1u s LYS 838 Cb -0.14 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.80 2w1u s LYS 838 CO 0.06 -0.09 0.23 0.95 -0.36 0.00 0.00 175.35 176.14 2w1u s THR 839 N 0.55 5.37 0.00 3.43 -4.23 -1.26 -1.46 115.64 118.03 2w1u s THR 839 Ca 0.54 -0.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.98 2w1u s THR 839 Cb -0.28 -3.56 0.00 0.00 1.34 0.00 0.00 72.50 70.00 2w1u s THR 839 CO 0.31 0.30 0.00 0.18 -0.54 0.00 0.00 174.62 174.87 2w1u n LEU 840 N 0.86 0.00 -3.84 4.79 4.77 -1.26 -3.73 117.00 118.60 2w1u n LEU 840 Ca -0.10 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.64 2w1u n LEU 840 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.63 2w1u n LEU 840 CO 0.44 0.00 -0.09 0.59 -1.33 0.00 0.00 177.39 177.00 2w1u n ASN 841 N 0.00 -1.60 -3.25 -1.43 3.02 -1.26 -1.08 115.26 109.66 2w1u n ASN 841 Ca 0.00 -0.88 -0.17 0.00 -0.03 0.00 0.00 54.58 53.51 2w1u n ASN 841 Cb 0.00 -3.66 0.08 0.00 -0.61 0.00 0.00 39.78 35.59 2w1u n ASN 841 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w1u n GLY 842 N -1.71 -0.31 3.75 7.41 0.00 -1.26 -2.85 105.19 110.21 2w1u n GLY 842 Ca -0.23 0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 2w1u n GLY 842 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2w1u n ASP 843 N -2.91 -2.90 -4.08 1.61 10.43 -0.96 -4.97 116.55 112.77 2w1u n ASP 843 Ca -0.23 -0.77 -0.30 0.00 2.57 0.00 0.00 54.79 56.07 2w1u n ASP 843 Cb 0.64 -4.15 -0.17 0.00 1.84 0.00 0.00 41.12 39.29 2w1u n ASP 843 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 2w1u s THR 844 N -3.50 1.66 -0.36 -3.53 2.01 -0.24 -2.13 115.64 109.56 2w1u s THR 844 Ca 0.28 -0.73 -0.25 0.00 0.31 0.00 0.00 61.69 61.30 2w1u s THR 844 Cb -0.14 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 70.88 2w1u s THR 844 CO 0.81 0.47 0.90 -0.55 -0.69 0.00 0.00 174.62 175.55 2w1u s SER 845 N 1.02 6.67 0.52 3.53 0.15 -0.09 -4.43 113.70 121.06 2w1u s SER 845 Ca -0.05 0.57 -0.17 0.00 0.70 0.00 0.00 55.95 57.00 2w1u s SER 845 Cb -0.15 -2.45 -0.08 0.00 -1.71 0.00 0.00 66.02 61.64 2w1u s SER 845 CO -0.03 -0.81 0.99 -0.76 1.20 0.00 0.00 173.24 173.83 2w1u s LEU 846 N 3.37 3.63 0.50 3.45 1.43 -1.26 -1.70 118.68 128.10 2w1u s LEU 846 Ca 0.37 1.62 -0.23 0.00 -1.03 0.00 0.00 54.13 54.86 2w1u s LEU 846 Cb -0.12 -4.52 -0.07 0.00 0.03 0.00 0.00 46.19 41.51 2w1u s LEU 846 CO 0.18 -0.66 1.31 0.00 0.23 0.00 0.00 176.35 177.41 2w1u n ALA 847 N -1.56 1.44 0.00 4.21 0.00 -1.26 -2.44 120.51 120.89 2w1u n ALA 847 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2w1u n ALA 847 Cb 0.54 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2w1u n ALA 847 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w1u n GLY 848 N 0.80 1.39 3.80 0.00 0.00 -0.14 -4.99 105.19 106.05 2w1u n GLY 848 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 2w1u n GLY 848 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2w1u s GLU 849 N -0.74 2.96 0.10 1.61 2.02 -1.02 -4.78 118.70 118.85 2w1u s GLU 849 Ca 0.00 1.12 -0.23 0.00 0.02 0.00 0.00 54.97 55.88 2w1u s GLU 849 Cb 0.00 -1.99 0.06 0.00 0.10 0.00 0.00 34.13 32.31 2w1u s GLU 849 CO 0.00 -1.09 0.58 -0.59 0.02 0.00 0.00 175.26 174.18 2w1u s PHE 850 N -2.74 -0.50 -0.09 1.61 -0.71 -1.26 -0.42 117.98 113.86 2w1u s PHE 850 Ca 0.61 0.44 -0.06 0.00 -1.04 0.00 0.00 56.93 56.88 2w1u s PHE 850 Cb -0.16 0.47 0.03 0.00 -1.21 0.00 0.00 43.02 42.15 2w1u s PHE 850 CO 0.47 -0.76 0.22 -1.50 -1.34 0.00 0.00 175.22 172.31 2w1u s ILE 851 N -3.13 -0.02 0.00 -4.49 2.07 -0.56 -1.54 121.20 113.52 2w1u s ILE 851 Ca -0.02 0.08 0.00 0.00 -1.41 0.00 0.00 60.65 59.31 2w1u s ILE 851 Cb -0.00 -0.33 0.00 0.00 0.13 0.00 0.00 42.46 42.26 2w1u s ILE 851 CO -0.07 0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.60 2w1u n GLY 852 N 3.64 1.42 3.08 1.50 0.00 0.41 -0.82 105.19 114.42 2w1u n GLY 852 Ca -0.20 -0.48 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 2w1u n GLY 852 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w1u s LEU 853 N 0.00 1.86 -0.36 0.99 1.43 0.47 -0.94 118.68 122.14 2w1u s LEU 853 Ca 0.00 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 2w1u s LEU 853 Cb 0.00 -0.78 0.00 0.00 0.03 0.00 0.00 46.19 45.44 2w1u s LEU 853 CO 0.00 0.12 0.54 -0.62 0.23 0.00 0.00 176.35 176.61 2w1u s ASP 854 N 0.09 6.33 0.00 2.29 3.68 -0.36 -1.53 116.67 127.17 2w1u s ASP 854 Ca -0.03 -0.06 0.26 0.00 2.13 0.00 0.00 52.55 54.85 2w1u s ASP 854 Cb -0.10 -2.28 1.17 0.00 -1.45 0.00 0.00 42.92 40.26 2w1u s ASP 854 CO 0.01 -0.52 1.85 0.18 0.13 0.00 0.00 175.17 176.82 2w1u n LEU 855 N 5.81 0.00 0.00 -1.34 4.77 0.14 -0.87 117.00 125.51 2w1u n LEU 855 Ca -0.04 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2w1u n LEU 855 Cb 0.49 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2w1u n LEU 855 CO 0.46 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2w1u n GLY 856 N 1.10 2.40 3.67 -0.72 0.00 -1.26 -4.30 105.19 106.08 2w1u n GLY 856 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.09 2w1u n GLY 856 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w1u s LYS 857 N -0.20 0.75 -0.04 1.61 -2.85 -1.26 -0.65 119.74 117.09 2w1u s LYS 857 Ca 0.00 -0.40 -0.30 0.00 -1.00 0.00 0.00 55.97 54.27 2w1u s LYS 857 Cb 0.00 0.26 -0.05 0.00 -2.06 0.00 0.00 37.83 35.98 2w1u s LYS 857 CO 0.00 -0.34 1.53 -1.21 0.10 0.00 0.00 175.35 175.42 2w1u s GLU 858 N -2.82 4.22 -0.03 1.78 2.02 -1.26 -4.17 118.70 118.43 2w1u s GLU 858 Ca 0.12 2.07 0.05 0.00 0.02 0.00 0.00 54.97 57.23 2w1u s GLU 858 Cb 0.02 -3.79 -0.01 0.00 0.10 0.00 0.00 34.13 30.45 2w1u s GLU 858 CO -0.02 -0.74 -0.19 0.42 0.02 0.00 0.00 175.26 174.76 2w1u s ILE 859 N 3.33 1.55 -0.51 -1.63 1.01 -0.42 -4.93 121.20 119.60 2w1u s ILE 859 Ca 0.68 -0.80 -0.28 0.00 0.00 0.00 0.00 60.65 60.24 2w1u s ILE 859 Cb -0.32 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 40.86 2w1u s ILE 859 CO 0.27 0.44 1.31 -0.54 0.00 0.00 0.00 174.94 176.42 2w1u s LYS 860 N -0.19 3.49 -0.09 2.79 -0.14 -1.26 -1.81 119.74 122.53 2w1u s LYS 860 Ca 0.01 0.55 -0.21 0.00 -1.36 0.00 0.00 55.97 54.96 2w1u s LYS 860 Cb -0.10 -4.04 -0.04 0.00 -1.68 0.00 0.00 37.83 31.98 2w1u s LYS 860 CO 0.01 -1.69 0.61 -0.51 -0.76 0.00 0.00 175.35 173.02 2w1u s LEU 861 N 5.37 4.29 0.07 3.17 1.43 0.20 -4.50 118.68 128.71 2w1u s LEU 861 Ca 0.52 1.03 0.23 0.00 -1.03 0.00 0.00 54.13 54.87 2w1u s LEU 861 Cb -0.10 -2.93 -0.06 0.00 0.03 0.00 0.00 46.19 43.14 2w1u s LEU 861 CO 0.28 -0.08 0.91 0.47 0.23 0.00 0.00 176.35 178.16 2w1u n ASP 862 N 3.83 0.54 0.00 2.29 9.92 0.88 -0.86 116.55 133.16 2w1u n ASP 862 Ca -0.03 -0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 2w1u n ASP 862 Cb 0.51 0.99 0.00 0.00 -0.64 0.00 0.00 41.12 41.98 2w1u n ASP 862 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2w1u n GLY 863 N 1.30 -0.76 3.23 0.44 0.00 -0.95 0.19 105.19 108.65 2w1u n GLY 863 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 2w1u n GLY 863 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w1u s ILE 864 N -2.00 1.09 -0.24 -0.61 -5.25 -0.44 -0.08 121.20 113.68 2w1u s ILE 864 Ca 0.00 -1.97 -0.04 0.00 -0.99 0.00 0.00 60.65 57.65 2w1u s ILE 864 Cb 0.00 -1.75 0.08 0.00 2.95 0.00 0.00 42.46 43.75 2w1u s ILE 864 CO 0.00 -0.72 0.10 -0.60 -1.79 0.00 0.00 174.94 171.93 2w1u s ARG 865 N -3.57 0.25 -0.16 0.37 3.52 0.36 -1.34 118.95 118.38 2w1u s ARG 865 Ca 0.14 -0.42 0.01 0.00 -0.13 0.00 0.00 55.73 55.33 2w1u s ARG 865 Cb 0.02 -1.56 0.01 0.00 -1.56 0.00 0.00 34.95 31.85 2w1u s ARG 865 CO -0.00 -0.86 -0.19 -0.06 -0.81 0.00 0.00 175.30 173.38 2w1u s PHE 866 N 2.04 2.75 -0.34 5.12 0.08 -0.26 -0.77 117.98 126.60 2w1u s PHE 866 Ca 0.06 -1.31 -0.11 0.00 0.12 0.00 0.00 56.93 55.69 2w1u s PHE 866 Cb -0.16 -1.88 0.00 0.00 -0.57 0.00 0.00 43.02 40.41 2w1u s PHE 866 CO -0.23 -0.62 0.19 0.08 -0.10 0.00 0.00 175.22 174.53 2w1u s VAL 867 N 0.98 4.75 0.31 -0.44 1.01 0.17 -0.78 120.40 126.39 2w1u s VAL 867 Ca -0.03 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2w1u s VAL 867 Cb -0.15 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2w1u s VAL 867 CO -0.04 -0.04 0.47 0.27 0.00 0.00 0.00 175.10 175.75 2w1u s ILE 868 N 1.62 4.81 0.13 2.22 -4.36 -0.18 -0.45 121.20 125.00 2w1u s ILE 868 Ca 0.04 -0.81 0.00 0.00 -0.26 0.00 0.00 60.65 59.62 2w1u s ILE 868 Cb -0.18 -3.71 0.00 0.00 1.25 0.00 0.00 42.46 39.82 2w1u s ILE 868 CO 0.07 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.52 2w1u n GLY 869 N -1.63 -2.02 3.84 6.27 0.00 0.64 -0.72 105.19 111.57 2w1u n GLY 869 Ca -0.05 -1.34 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 2w1u n GLY 869 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2w1u s LYS 870 N -1.30 1.87 0.38 1.61 -2.85 -1.26 -3.13 119.74 115.06 2w1u s LYS 870 Ca 0.00 -1.09 -0.03 0.00 -1.00 0.00 0.00 55.97 53.84 2w1u s LYS 870 Cb 0.00 0.61 -0.04 0.00 -2.06 0.00 0.00 37.83 36.34 2w1u s LYS 870 CO 0.00 -0.86 0.65 -0.80 0.10 0.00 0.00 175.35 174.44 2w1u s ASN 871 N -2.96 6.33 0.59 0.03 0.01 -1.26 -3.80 114.94 113.88 2w1u s ASN 871 Ca 0.12 0.72 0.00 0.00 -0.71 0.00 0.00 52.86 53.00 2w1u s ASN 871 Cb -0.06 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.45 2w1u s ASN 871 CO 0.08 -0.38 0.00 0.61 -1.51 0.00 0.00 177.10 175.90 2w1u n GLY 872 N -1.73 0.37 3.69 0.66 0.00 -1.26 -4.79 105.19 102.13 2w1u n GLY 872 Ca -0.02 -0.85 -0.44 0.00 0.00 0.00 0.00 46.02 44.71 2w1u n GLY 872 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w1u n GLY 873 N 0.00 1.16 2.24 -0.02 0.00 -1.26 -2.14 105.19 105.18 2w1u n GLY 873 Ca 0.00 0.58 -0.10 0.00 0.00 0.00 0.00 46.02 46.50 2w1u n GLY 873 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w1u n GLY 874 N 3.04 0.69 0.23 -0.02 0.00 -1.26 -4.87 105.19 103.00 2w1u n GLY 874 Ca 0.14 -0.55 0.16 0.00 0.00 0.00 0.00 46.02 45.77 2w1u n GLY 874 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2w1u h SER 875 N 0.00 0.00 -0.08 1.61 4.64 -1.57 -1.63 113.55 116.52 2w1u h SER 875 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2w1u h SER 875 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2w1u h SER 875 CO 0.28 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 175.04 2w1u n SER 876 N -2.67 2.50 -4.11 4.97 7.64 -1.26 0.48 113.62 121.16 2w1u n SER 876 Ca -0.00 -1.72 -0.42 0.00 1.01 0.00 0.00 58.87 57.73 2w1u n SER 876 Cb 0.17 -0.04 -0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2w1u n SER 876 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2w1u n ASP 877 N 0.93 4.32 -3.97 6.43 10.43 -0.61 -4.89 116.55 129.19 2w1u n ASP 877 Ca 0.11 -2.87 -0.09 0.00 2.57 0.00 0.00 54.79 54.50 2w1u n ASP 877 Cb 0.42 -1.70 -0.11 0.00 1.84 0.00 0.00 41.12 41.58 2w1u n ASP 877 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2w1u s LYS 878 N 3.70 0.30 0.48 -1.24 1.02 -1.26 -1.24 119.74 121.49 2w1u s LYS 878 Ca 0.50 -0.57 -0.24 0.00 0.02 0.00 0.00 55.97 55.68 2w1u s LYS 878 Cb 0.09 0.11 -0.07 0.00 -0.52 0.00 0.00 37.83 37.44 2w1u s LYS 878 CO -0.01 -0.05 1.34 0.91 -0.92 0.00 0.00 175.35 176.62 2w1u n TRP 879 N 1.67 2.30 0.04 3.18 8.01 -1.26 -4.96 117.44 126.42 2w1u n TRP 879 Ca -0.23 0.45 -0.20 0.00 -1.31 0.00 0.00 57.50 56.21 2w1u n TRP 879 Cb 0.55 -2.39 -0.14 0.00 -2.01 0.00 0.00 31.31 27.32 2w1u n TRP 879 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 2w1u h ASN 880 N 1.84 0.45 -3.51 -0.99 -0.26 -1.88 -3.43 115.58 107.80 2w1u h ASN 880 Ca -0.50 -0.94 -0.48 0.00 -0.56 0.00 0.00 56.30 53.82 2w1u h ASN 880 Cb 1.29 -0.15 -0.33 0.00 -1.06 0.00 0.00 38.32 38.08 2w1u h ASN 880 CO 0.59 1.36 -0.80 -0.54 -1.06 0.00 0.00 177.43 176.97 2w1u s LYS 881 N -2.48 1.41 0.25 0.81 1.02 -1.26 0.01 119.74 119.50 2w1u s LYS 881 Ca -0.14 -0.34 -0.21 0.00 0.02 0.00 0.00 55.97 55.30 2w1u s LYS 881 Cb 0.01 -1.22 0.03 0.00 -0.52 0.00 0.00 37.83 36.13 2w1u s LYS 881 CO 0.82 0.03 0.68 -0.59 -0.92 0.00 0.00 175.35 175.37 2w1u s PHE 882 N 0.61 -0.25 0.05 3.18 -0.71 -0.81 -0.23 117.98 119.82 2w1u s PHE 882 Ca -0.12 -0.15 0.02 0.00 -1.04 0.00 0.00 56.93 55.64 2w1u s PHE 882 Cb -0.14 0.65 -0.03 0.00 -1.21 0.00 0.00 43.02 42.30 2w1u s PHE 882 CO 0.02 -1.14 -0.08 -1.59 -1.34 0.00 0.00 175.22 171.10 2w1u s LYS 883 N -3.88 0.55 -0.25 1.99 -2.85 -0.04 -0.36 119.74 114.90 2w1u s LYS 883 Ca 0.09 -0.79 -0.11 0.00 -1.00 0.00 0.00 55.97 54.15 2w1u s LYS 883 Cb -0.05 -0.31 -0.05 0.00 -2.06 0.00 0.00 37.83 35.37 2w1u s LYS 883 CO 0.02 0.05 0.21 -1.17 0.10 0.00 0.00 175.35 174.56 2w1u s LEU 884 N -1.66 4.08 0.03 2.77 2.96 0.11 -0.76 118.68 126.21 2w1u s LEU 884 Ca -0.09 0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 53.93 2w1u s LEU 884 Cb -0.09 -2.17 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 2w1u s LEU 884 CO 0.00 -0.01 -0.01 -1.83 -1.32 0.00 0.00 176.35 173.18 2w1u s GLU 885 N 1.41 0.45 0.24 1.98 -1.05 -0.68 0.04 118.70 121.09 2w1u s GLU 885 Ca 0.09 -0.85 0.01 0.00 -0.15 0.00 0.00 54.97 54.07 2w1u s GLU 885 Cb -0.15 0.16 -0.05 0.00 -0.44 0.00 0.00 34.13 33.66 2w1u s GLU 885 CO 0.07 -0.08 0.10 1.52 0.95 0.00 0.00 175.26 177.82 2w1u s TYR 886 N -2.49 1.42 -0.02 4.83 -0.85 -0.42 -1.59 117.35 118.24 2w1u s TYR 886 Ca -0.06 -1.21 -0.25 0.00 -0.52 0.00 0.00 57.07 55.03 2w1u s TYR 886 Cb -0.02 -0.81 0.05 0.00 0.38 0.00 0.00 41.96 41.56 2w1u s TYR 886 CO -0.05 -0.40 0.54 0.45 -1.52 0.00 0.00 175.55 174.58 2w1u s SER 887 N -3.27 -0.48 0.09 -0.18 0.15 -0.43 -0.95 113.70 108.64 2w1u s SER 887 Ca 0.37 0.43 0.20 0.00 0.70 0.00 0.00 55.95 57.65 2w1u s SER 887 Cb 0.08 0.46 -0.11 0.00 -1.71 0.00 0.00 66.02 64.74 2w1u s SER 887 CO 0.12 -0.58 0.83 0.18 1.20 0.00 0.00 173.24 174.99 2w1u n LEU 888 N 0.92 0.72 0.00 3.45 4.32 -1.26 -1.61 117.00 123.54 2w1u n LEU 888 Ca -0.20 0.30 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 2w1u n LEU 888 Cb 0.57 0.04 0.00 0.00 -1.62 0.00 0.00 43.42 42.41 2w1u n LEU 888 CO 0.23 0.02 0.21 -0.90 -1.22 0.00 0.00 177.39 175.72 2w1u n ASP 889 N -2.73 0.56 -1.59 -1.43 3.85 -1.26 -4.61 116.55 109.33 2w1u n ASP 889 Ca -0.07 -1.17 -0.20 0.00 -0.71 0.00 0.00 54.79 52.64 2w1u n ASP 889 Cb 0.72 0.00 -0.08 0.00 -1.35 0.00 0.00 41.12 40.40 2w1u n ASP 889 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2w1u n ASN 890 N -0.09 -5.45 0.07 -1.12 2.85 -1.26 -4.76 115.26 105.50 2w1u n ASN 890 Ca 0.00 0.47 0.00 0.00 -0.11 0.00 0.00 54.58 54.94 2w1u n ASN 890 Cb 0.27 -4.71 0.00 0.00 1.24 0.00 0.00 39.78 36.58 2w1u n ASN 890 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2w1u n GLU 891 N -2.45 0.00 -3.41 1.20 1.02 -1.26 -5.04 120.64 110.71 2w1u n GLU 891 Ca -0.20 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.56 2w1u n GLU 891 Cb 0.66 -0.35 -0.06 0.00 -0.02 0.00 0.00 31.44 31.66 2w1u n GLU 891 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2w1u s SER 892 N -5.59 6.57 -0.00 1.62 0.01 -1.26 -5.08 113.70 109.97 2w1u s SER 892 Ca 0.00 0.67 0.07 0.00 1.31 0.00 0.00 55.95 58.00 2w1u s SER 892 Cb 0.00 -2.24 -0.03 0.00 0.21 0.00 0.00 66.02 63.97 2w1u s SER 892 CO 0.00 0.04 -0.21 0.26 0.41 0.00 0.00 173.24 173.74 2w1u s TRP 893 N 0.58 2.48 -0.12 2.43 0.52 -1.26 -4.31 118.94 119.25 2w1u s TRP 893 Ca 0.22 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 56.04 2w1u s TRP 893 Cb -0.14 -1.50 0.01 0.00 -1.15 0.00 0.00 33.47 30.68 2w1u s TRP 893 CO 0.07 0.12 -0.20 0.99 0.02 0.00 0.00 176.95 177.95 2w1u s THR 894 N -0.75 1.86 0.02 2.01 2.01 -0.12 -4.94 115.64 115.72 2w1u s THR 894 Ca 0.12 -0.87 -0.30 0.00 0.31 0.00 0.00 61.69 60.95 2w1u s THR 894 Cb -0.10 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.71 2w1u s THR 894 CO 0.01 0.51 1.14 -0.89 -0.69 0.00 0.00 174.62 174.70 2w1u s THR 895 N 0.80 4.31 -0.16 -0.82 2.01 -1.26 -1.30 115.64 119.23 2w1u s THR 895 Ca -0.09 1.66 -0.19 0.00 0.31 0.00 0.00 61.69 63.38 2w1u s THR 895 Cb -0.16 -4.06 -0.23 0.00 0.01 0.00 0.00 72.50 68.06 2w1u s THR 895 CO -0.00 0.10 0.41 0.40 -0.69 0.00 0.00 174.62 174.83 2w1u h ILE 896 N 4.70 1.03 -1.99 1.82 2.04 -0.75 -3.49 117.51 120.88 2w1u h ILE 896 Ca -0.40 -2.29 -0.04 0.00 1.00 0.00 0.00 64.86 63.14 2w1u h ILE 896 Cb 1.20 2.55 -0.21 0.00 -0.74 0.00 0.00 36.82 39.63 2w1u h ILE 896 CO 0.81 0.53 0.15 -0.75 0.00 0.00 0.00 178.15 178.90 2w1u s LYS 897 N -2.40 0.89 0.25 2.37 2.20 -1.11 -5.02 119.74 116.91 2w1u s LYS 897 Ca -0.24 0.80 0.05 0.00 -0.36 0.00 0.00 55.97 56.22 2w1u s LYS 897 Cb 0.04 0.43 -0.03 0.00 -1.51 0.00 0.00 37.83 36.76 2w1u s LYS 897 CO 0.68 -0.16 0.34 -1.21 -0.36 0.00 0.00 175.35 174.63 2w1u s GLU 898 N -0.04 3.34 -0.00 4.03 2.02 -1.26 -0.71 118.70 126.07 2w1u s GLU 898 Ca -0.03 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.14 2w1u s GLU 898 Cb -0.04 -2.83 0.00 0.00 0.10 0.00 0.00 34.13 31.37 2w1u s GLU 898 CO 0.03 0.41 -0.01 0.71 0.02 0.00 0.00 175.26 176.42 2w1u s TYR 899 N -2.02 0.12 -0.31 1.61 2.02 0.51 -4.96 117.35 114.32 2w1u s TYR 899 Ca 0.34 -0.01 0.01 0.00 -0.37 0.00 0.00 57.07 57.05 2w1u s TYR 899 Cb -0.09 -0.11 0.09 0.00 -0.40 0.00 0.00 41.96 41.46 2w1u s TYR 899 CO 0.28 -0.02 0.05 0.34 -1.57 0.00 0.00 175.55 174.64 2w1u s ASP 900 N 0.12 4.30 -0.32 2.29 -1.08 -1.26 -1.91 116.67 118.81 2w1u s ASP 900 Ca -0.01 -1.78 0.08 0.00 -0.52 0.00 0.00 52.55 50.32 2w1u s ASP 900 Cb -0.02 -1.23 0.53 0.00 -1.46 0.00 0.00 42.92 40.74 2w1u s ASP 900 CO -0.00 -0.37 1.53 0.29 0.52 0.00 0.00 175.17 177.14 2w1u n LYS 901 N 4.58 1.92 -0.33 4.34 4.76 0.10 -4.73 118.16 128.80 2w1u n LYS 901 Ca -0.01 -3.19 0.17 0.00 -2.87 0.00 0.00 58.31 52.40 2w1u n LYS 901 Cb 0.42 -1.88 0.40 0.00 -1.84 0.00 0.00 35.03 32.13 2w1u n LYS 901 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2w1u h THR 902 N 1.02 0.64 -0.43 -0.18 2.02 -1.85 -1.84 112.91 112.29 2w1u h THR 902 Ca 0.29 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2w1u h THR 902 Cb 1.82 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2w1u h THR 902 CO 0.51 0.11 0.00 0.61 0.37 0.00 0.00 175.52 177.12 2w1u n GLY 903 N -1.38 1.51 3.77 2.16 0.00 -1.26 -4.97 105.19 105.01 2w1u n GLY 903 Ca 0.24 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 45.24 2w1u n GLY 903 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w1u s ALA 904 N -1.44 2.91 0.84 4.61 0.00 -0.69 -5.00 121.76 122.99 2w1u s ALA 904 Ca 0.38 0.93 -0.13 0.00 0.00 0.00 0.00 51.96 53.14 2w1u s ALA 904 Cb 0.21 -3.38 0.08 0.00 0.00 0.00 0.00 23.12 20.03 2w1u s ALA 904 CO 0.29 -0.70 1.06 -2.30 0.00 0.00 0.00 175.76 174.11 2w1u n PRO 905 N -0.67 0.02 -1.42 0.00 -0.02 -1.26 -4.98 135.00 126.67 2w1u n PRO 905 Ca 0.08 0.08 -0.35 0.00 -2.02 0.00 0.00 63.50 61.30 2w1u n PRO 905 Cb 0.48 -2.32 0.10 0.00 -0.02 0.00 0.00 33.50 31.74 2w1u n PRO 905 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2w1u s ALA 906 N -2.23 2.10 0.00 3.55 0.00 -1.26 -4.89 121.76 119.03 2w1u s ALA 906 Ca 0.70 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.63 2w1u s ALA 906 Cb -0.28 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.34 2w1u s ALA 906 CO 0.54 -1.93 0.00 0.41 0.00 0.00 0.00 175.76 174.78 2w1u n GLY 907 N 0.58 -1.24 3.70 0.00 0.00 0.18 -4.98 105.19 103.42 2w1u n GLY 907 Ca 0.14 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 2w1u n GLY 907 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2w1u n LYS 908 N -0.14 2.21 -3.89 1.61 5.02 -1.25 -4.38 118.16 117.35 2w1u n LYS 908 Ca 0.00 0.78 -0.29 0.00 -2.02 0.00 0.00 58.31 56.78 2w1u n LYS 908 Cb 0.00 -2.41 -0.16 0.00 -0.02 0.00 0.00 35.03 32.43 2w1u n LYS 908 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2w1u s ASP 909 N -0.05 3.08 -0.56 4.39 3.68 0.11 -4.97 116.67 122.34 2w1u s ASP 909 Ca 0.59 -0.80 -0.24 0.00 2.13 0.00 0.00 52.55 54.24 2w1u s ASP 909 Cb -0.57 -0.95 0.05 0.00 -1.45 0.00 0.00 42.92 39.99 2w1u s ASP 909 CO 0.58 -0.21 0.92 -0.69 0.13 0.00 0.00 175.17 175.90 2w1u s VAL 910 N 1.60 4.42 -0.59 1.11 1.01 -1.26 -1.01 120.40 125.68 2w1u s VAL 910 Ca -0.01 0.16 -0.23 0.00 0.00 0.00 0.00 61.98 61.90 2w1u s VAL 910 Cb -0.16 -4.53 0.05 0.00 0.00 0.00 0.00 36.38 31.74 2w1u s VAL 910 CO -0.07 -1.12 0.92 -0.63 0.00 0.00 0.00 175.10 174.20 2w1u s ILE 911 N 3.85 4.40 -0.13 2.22 -1.09 0.04 -4.98 121.20 125.51 2w1u s ILE 911 Ca 0.28 -0.06 0.01 0.00 -2.23 0.00 0.00 60.65 58.65 2w1u s ILE 911 Cb -0.13 -4.58 0.02 0.00 -1.58 0.00 0.00 42.46 36.18 2w1u s ILE 911 CO 0.18 -1.23 -0.17 -0.70 -1.23 0.00 0.00 174.94 171.79 2w1u s GLU 912 N 3.88 2.47 -0.01 2.79 2.12 -1.26 -1.10 118.70 127.59 2w1u s GLU 912 Ca 0.25 -0.64 0.04 0.00 0.36 0.00 0.00 54.97 54.98 2w1u s GLU 912 Cb -0.15 -2.13 -0.01 0.00 0.26 0.00 0.00 34.13 32.10 2w1u s GLU 912 CO 0.15 -0.12 -0.14 -1.21 -0.54 0.00 0.00 175.26 173.40 2w1u s GLU 913 N 1.15 1.09 -0.17 4.30 0.41 -0.45 -5.01 118.70 120.03 2w1u s GLU 913 Ca -0.02 -0.50 -0.03 0.00 -0.41 0.00 0.00 54.97 54.01 2w1u s GLU 913 Cb -0.14 -1.06 -0.02 0.00 -1.78 0.00 0.00 34.13 31.13 2w1u s GLU 913 CO -0.06 0.29 -0.05 -1.12 -0.49 0.00 0.00 175.26 173.84 2w1u s SER 914 N -0.35 4.62 -0.52 -0.19 0.01 -1.26 -1.32 113.70 114.69 2w1u s SER 914 Ca 0.05 -0.20 -0.15 0.00 1.31 0.00 0.00 55.95 56.95 2w1u s SER 914 Cb -0.05 -1.76 0.11 0.00 0.21 0.00 0.00 66.02 64.53 2w1u s SER 914 CO -0.00 0.13 0.46 -0.36 0.41 0.00 0.00 173.24 173.88 2w1u s PHE 915 N 0.60 3.26 0.18 2.43 2.99 0.13 -4.93 117.98 122.63 2w1u s PHE 915 Ca -0.03 -1.21 -0.10 0.00 0.00 0.00 0.00 56.93 55.59 2w1u s PHE 915 Cb -0.15 -3.59 0.09 0.00 0.00 0.00 0.00 43.02 39.37 2w1u s PHE 915 CO 0.03 -0.95 1.70 0.93 -0.00 0.00 0.00 175.22 176.92 2w1u h GLU 916 N 8.83 1.02 -5.24 0.44 4.39 -1.94 -3.23 114.58 118.85 2w1u h GLU 916 Ca -0.29 -0.24 -0.63 0.00 0.34 0.00 0.00 59.36 58.54 2w1u h GLU 916 Cb 1.10 -0.14 -0.14 0.00 -0.10 0.00 0.00 28.75 29.47 2w1u h GLU 916 CO 0.98 0.92 -0.11 0.99 -1.16 0.00 0.00 179.01 180.63 2w1u s THR 917 N -5.32 5.10 0.46 1.13 2.01 -1.26 -5.06 115.64 112.70 2w1u s THR 917 Ca -0.12 0.60 -0.24 0.00 0.31 0.00 0.00 61.69 62.24 2w1u s THR 917 Cb 0.14 -3.82 -0.08 0.00 0.01 0.00 0.00 72.50 68.75 2w1u s THR 917 CO 0.83 0.03 1.29 -2.65 -0.69 0.00 0.00 174.62 173.43 2w1u n PRO 918 N 5.51 1.87 -3.97 4.92 -0.02 -1.22 -4.98 135.00 137.11 2w1u n PRO 918 Ca -0.06 0.67 -0.35 0.00 -2.02 0.00 0.00 63.50 61.74 2w1u n PRO 918 Cb 0.50 -2.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.43 2w1u n PRO 918 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2w1u s ILE 919 N -1.24 4.66 -0.22 4.25 1.01 -0.04 -4.84 121.20 124.79 2w1u s ILE 919 Ca 0.64 -0.07 -0.24 0.00 0.00 0.00 0.00 60.65 60.98 2w1u s ILE 919 Cb -0.47 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 2w1u s ILE 919 CO 0.56 0.43 0.78 -0.44 0.00 0.00 0.00 174.94 176.27 2w1u s SER 920 N 0.67 6.81 -0.09 3.58 0.01 -1.26 0.62 113.70 124.04 2w1u s SER 920 Ca 0.03 1.00 -0.13 0.00 1.31 0.00 0.00 55.95 58.16 2w1u s SER 920 Cb -0.13 -2.42 0.03 0.00 0.21 0.00 0.00 66.02 63.71 2w1u s SER 920 CO 0.02 -0.45 0.32 0.00 0.41 0.00 0.00 173.24 173.54 2w1u s ALA 921 N 2.56 -0.81 -0.13 1.44 0.00 -0.75 -4.74 121.76 119.32 2w1u s ALA 921 Ca 0.34 0.74 0.18 0.00 0.00 0.00 0.00 51.96 53.22 2w1u s ALA 921 Cb -0.16 -0.35 -0.23 0.00 0.00 0.00 0.00 23.12 22.38 2w1u s ALA 921 CO 0.09 -0.19 0.43 1.17 0.00 0.00 0.00 175.76 177.26 2w1u n LYS 922 N 2.39 0.66 -4.49 0.00 4.81 -0.63 -1.30 118.16 119.60 2w1u n LYS 922 Ca -0.16 0.05 -0.21 0.00 -0.87 0.00 0.00 58.31 57.12 2w1u n LYS 922 Cb 0.57 -1.63 -0.15 0.00 0.02 0.00 0.00 35.03 33.84 2w1u n LYS 922 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2w1u s TYR 923 N -2.84 1.05 -0.08 5.64 2.02 -0.77 0.25 117.35 122.62 2w1u s TYR 923 Ca -0.07 -0.24 -0.07 0.00 -0.37 0.00 0.00 57.07 56.32 2w1u s TYR 923 Cb 0.09 -0.71 0.02 0.00 -0.40 0.00 0.00 41.96 40.96 2w1u s TYR 923 CO 0.84 -0.06 0.21 -1.50 -1.57 0.00 0.00 175.55 173.47 2w1u s ILE 924 N -0.05 -0.01 0.20 2.71 2.07 -0.58 -1.31 121.20 124.23 2w1u s ILE 924 Ca 0.01 0.02 -0.22 0.00 -1.41 0.00 0.00 60.65 59.05 2w1u s ILE 924 Cb -0.07 -0.30 0.05 0.00 0.13 0.00 0.00 42.46 42.27 2w1u s ILE 924 CO 0.00 0.01 0.63 0.00 -1.91 0.00 0.00 174.94 173.67 2w1u s ARG 925 N 0.25 1.45 -0.13 3.50 1.70 -0.62 -0.39 118.95 124.71 2w1u s ARG 925 Ca -0.01 -0.67 -0.06 0.00 -0.47 0.00 0.00 55.73 54.52 2w1u s ARG 925 Cb -0.03 0.59 -0.04 0.00 -0.57 0.00 0.00 34.95 34.90 2w1u s ARG 925 CO -0.01 -0.64 0.09 -0.51 -1.08 0.00 0.00 175.30 173.15 2w1u s LEU 926 N -2.81 4.04 -0.07 -1.89 1.43 0.00 -1.68 118.68 117.70 2w1u s LEU 926 Ca 0.05 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.45 2w1u s LEU 926 Cb -0.03 -1.98 0.01 0.00 0.03 0.00 0.00 46.19 44.22 2w1u s LEU 926 CO -0.06 0.33 -0.11 -0.89 0.23 0.00 0.00 176.35 175.84 2w1u s THR 927 N -0.55 1.10 0.35 5.49 2.01 0.06 -1.50 115.64 122.60 2w1u s THR 927 Ca 0.11 -0.45 -0.28 0.00 0.31 0.00 0.00 61.69 61.38 2w1u s THR 927 Cb -0.12 -1.02 -0.11 0.00 0.01 0.00 0.00 72.50 71.27 2w1u s THR 927 CO 0.02 0.35 1.38 0.21 -0.69 0.00 0.00 174.62 175.90 2w1u s ASN 928 N 0.76 6.56 0.00 3.53 2.47 0.44 -0.86 114.94 127.85 2w1u s ASN 928 Ca -0.13 2.85 0.09 0.00 0.42 0.00 0.00 52.86 56.09 2w1u s ASN 928 Cb -0.15 -2.66 0.06 0.00 -1.45 0.00 0.00 41.25 37.04 2w1u s ASN 928 CO 0.03 -0.70 0.75 0.23 -3.72 0.00 0.00 177.10 173.69 2w1u n MET 929 N 0.62 0.80 -3.68 0.43 2.81 0.67 -0.97 117.12 117.81 2w1u n MET 929 Ca 0.01 -0.94 -0.10 0.00 -1.81 0.00 0.00 57.70 54.85 2w1u n MET 929 Cb 0.41 -1.15 -0.11 0.00 -0.71 0.00 0.00 33.22 31.66 2w1u n MET 929 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2w1u s GLU 930 N -0.92 0.32 0.01 0.03 2.12 -1.23 -4.84 118.70 114.20 2w1u s GLU 930 Ca 0.10 0.83 -0.36 0.00 0.36 0.00 0.00 54.97 55.90 2w1u s GLU 930 Cb 0.08 0.07 -0.15 0.00 0.26 0.00 0.00 34.13 34.39 2w1u s GLU 930 CO 0.15 -0.20 1.59 0.09 -0.54 0.00 0.00 175.26 176.35 2w1u n ASN 931 N 4.72 2.59 -3.84 -1.70 3.02 -1.26 -4.44 115.26 114.35 2w1u n ASN 931 Ca -0.17 1.07 -0.17 0.00 -0.03 0.00 0.00 54.58 55.27 2w1u n ASN 931 Cb 0.53 -1.29 -0.16 0.00 -0.61 0.00 0.00 39.78 38.24 2w1u n ASN 931 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2w1u s ILE 932 N 1.84 0.24 -1.30 2.41 2.07 -0.69 -4.97 121.20 120.81 2w1u s ILE 932 Ca 0.87 0.04 -0.10 0.00 -1.41 0.00 0.00 60.65 60.04 2w1u s ILE 932 Cb -0.83 -0.32 -0.06 0.00 0.13 0.00 0.00 42.46 41.37 2w1u s ILE 932 CO 0.48 0.16 2.49 -3.20 -1.91 0.00 0.00 174.94 172.95 2w1u n ASN 933 N 4.08 6.22 -3.92 4.50 5.15 -1.26 -0.92 115.26 129.11 2w1u n ASN 933 Ca -0.27 -2.55 -0.10 0.00 -0.60 0.00 0.00 54.58 51.07 2w1u n ASN 933 Cb 0.51 -1.39 -0.10 0.00 -0.53 0.00 0.00 39.78 38.26 2w1u n ASN 933 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2w1u s LYS 934 N 2.99 0.42 0.87 1.20 1.02 -0.90 -4.90 119.74 120.44 2w1u s LYS 934 Ca 0.56 -0.50 -0.15 0.00 0.02 0.00 0.00 55.97 55.90 2w1u s LYS 934 Cb 0.15 0.16 0.21 0.00 -0.52 0.00 0.00 37.83 37.83 2w1u s LYS 934 CO -0.04 -0.09 0.95 0.91 -0.92 0.00 0.00 175.35 176.16 2w1u n TRP 935 N 1.49 -3.84 -3.76 3.18 7.02 -1.26 -3.20 117.44 117.07 2w1u n TRP 935 Ca -0.23 -0.85 -0.15 0.00 -1.02 0.00 0.00 57.50 55.25 2w1u n TRP 935 Cb 0.55 -0.85 -0.16 0.00 -2.42 0.00 0.00 31.31 28.43 2w1u n TRP 935 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2w1u s LEU 936 N 0.00 0.94 -0.02 -0.99 1.43 -0.55 -4.21 118.68 115.27 2w1u s LEU 936 Ca 0.57 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.78 2w1u s LEU 936 Cb -0.04 0.01 -0.03 0.00 0.03 0.00 0.00 46.19 46.16 2w1u s LEU 936 CO 0.42 -0.14 -0.03 0.42 0.23 0.00 0.00 176.35 177.25 2w1u s THR 937 N 1.18 3.95 0.03 5.49 -4.23 -0.38 0.12 115.64 121.81 2w1u s THR 937 Ca -0.08 -0.58 -0.04 0.00 -1.18 0.00 0.00 61.69 59.80 2w1u s THR 937 Cb -0.13 -2.71 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 2w1u s THR 937 CO -0.04 0.45 0.07 -0.36 -0.54 0.00 0.00 174.62 174.20 2w1u s PHE 938 N -0.99 0.23 0.00 3.99 0.40 -0.83 -0.26 117.98 120.52 2w1u s PHE 938 Ca 0.17 -0.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.97 2w1u s PHE 938 Cb -0.11 -0.17 0.00 0.00 0.51 0.00 0.00 43.02 43.25 2w1u s PHE 938 CO 0.07 -0.33 0.00 0.43 0.70 0.00 0.00 175.22 176.09 2w1u n SER 939 N 0.91 3.69 -3.64 1.36 7.64 0.41 -0.90 113.62 123.09 2w1u n SER 939 Ca -0.20 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 59.58 2w1u n SER 939 Cb 0.58 0.20 -0.07 0.00 -1.01 0.00 0.00 64.21 63.90 2w1u n SER 939 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2w1u s GLU 940 N -1.82 0.73 -0.17 1.43 2.56 -1.08 -4.24 118.70 116.10 2w1u s GLU 940 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 54.97 55.98 2w1u s GLU 940 Cb 0.00 0.28 0.03 0.00 2.00 0.00 0.00 34.13 36.44 2w1u s GLU 940 CO 0.00 -0.11 -0.10 -0.06 -0.56 0.00 0.00 175.26 174.43 2w1u s PHE 941 N 0.84 2.08 0.03 5.30 0.08 0.42 0.43 117.98 127.16 2w1u s PHE 941 Ca -0.04 -1.28 0.02 0.00 0.12 0.00 0.00 56.93 55.76 2w1u s PHE 941 Cb -0.05 -1.51 -0.02 0.00 -0.57 0.00 0.00 43.02 40.87 2w1u s PHE 941 CO -0.08 -0.67 -0.08 0.00 -0.10 0.00 0.00 175.22 174.30 2w1u s ALA 942 N 1.51 0.58 0.24 5.36 0.00 0.05 -4.75 121.76 124.75 2w1u s ALA 942 Ca 0.02 -0.64 0.09 0.00 0.00 0.00 0.00 51.96 51.42 2w1u s ALA 942 Cb -0.15 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 2w1u s ALA 942 CO -0.09 0.03 0.03 0.96 0.00 0.00 0.00 175.76 176.69 2w1u s ILE 943 N -1.03 3.69 -0.14 0.00 -4.36 -1.26 -0.49 121.20 117.61 2w1u s ILE 943 Ca -0.06 -1.69 0.02 0.00 -0.26 0.00 0.00 60.65 58.66 2w1u s ILE 943 Cb -0.08 -2.94 0.00 0.00 1.25 0.00 0.00 42.46 40.69 2w1u s ILE 943 CO 0.00 -0.30 -0.20 -0.69 0.24 0.00 0.00 174.94 174.00 2w1u s VAL 944 N -2.12 2.28 -0.28 8.37 1.01 0.89 -4.88 120.40 125.67 2w1u s VAL 944 Ca 0.30 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2w1u s VAL 944 Cb -0.07 -1.92 0.16 0.00 0.00 0.00 0.00 36.38 34.54 2w1u s VAL 944 CO 0.20 0.54 0.42 -0.55 0.00 0.00 0.00 175.10 175.72 2w1u s SER 945 N 0.71 0.15 0.53 3.32 0.15 -1.26 -0.08 113.70 117.22 2w1u s SER 945 Ca -0.09 -0.15 0.22 0.00 0.70 0.00 0.00 55.95 56.63 2w1u s SER 945 Cb -0.16 1.21 1.38 0.00 -1.71 0.00 0.00 66.02 66.75 2w1u s SER 945 CO 0.01 -0.33 2.08 0.44 1.20 0.00 0.00 173.24 176.63 2w1u h ASP 946 N 8.15 0.00 -0.71 5.45 3.32 -1.86 -1.25 116.42 129.53 2w1u h ASP 946 Ca -0.11 0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.97 2w1u h ASP 946 Cb 1.13 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.64 2w1u h ASP 946 CO 0.26 0.00 0.44 -0.08 -1.72 0.00 0.00 179.24 178.14 2w1u h GLU 947 N 0.00 0.82 0.00 3.56 4.81 -1.95 -2.52 114.58 119.31 2w1u h GLU 947 Ca 0.12 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2w1u h GLU 947 Cb 0.51 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.70 2w1u h GLU 947 CO -0.00 0.54 0.00 -0.07 -0.73 0.00 0.00 179.01 178.75 2w1u h LEU 948 N 0.85 0.00 0.00 1.64 3.38 -1.56 -3.51 115.31 116.10 2w1u h LEU 948 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 2w1u h LEU 948 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2w1u h LEU 948 CO -0.12 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.79