#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 3.20 0.41 3.17 0.00 -1.26 -5.01 121.76 122.26 2w1u s ALA 805 Ca 0.00 0.61 0.08 0.00 0.00 0.00 0.00 51.96 52.65 2w1u s ALA 805 Cb 0.00 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2w1u s ALA 805 CO 0.00 0.04 0.29 -1.54 0.00 0.00 0.00 175.76 174.55 2w1u s SER 806 N -1.52 4.82 0.68 0.00 1.04 -0.87 -5.05 113.70 112.81 2w1u s SER 806 Ca 0.51 -0.85 -0.17 0.00 0.48 0.00 0.00 55.95 55.93 2w1u s SER 806 Cb -0.21 -0.57 -0.01 0.00 0.10 0.00 0.00 66.02 65.33 2w1u s SER 806 CO 0.27 -0.58 1.03 -0.46 0.98 0.00 0.00 173.24 174.48 2w1u n ASN 807 N -1.41 0.87 -4.81 7.02 0.23 -1.26 -4.43 115.26 111.47 2w1u n ASN 807 Ca 0.01 0.73 -0.31 0.00 -0.53 0.00 0.00 54.58 54.48 2w1u n ASN 807 Cb 0.63 -1.43 0.04 0.00 -2.08 0.00 0.00 39.78 36.94 2w1u n ASN 807 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2w1u s PRO 808 N -3.20 2.99 0.04 -0.53 0.04 -1.26 -4.27 135.00 128.81 2w1u s PRO 808 Ca 0.76 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2w1u s PRO 808 Cb -0.37 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 2w1u s PRO 808 CO 0.47 -1.06 -0.04 -1.12 0.04 0.00 0.00 177.00 175.29 2w1u s SER 809 N -3.58 0.47 -0.27 6.66 0.01 0.12 -4.97 113.70 112.14 2w1u s SER 809 Ca 0.59 -0.72 -0.23 0.00 1.31 0.00 0.00 55.95 56.90 2w1u s SER 809 Cb -0.14 0.13 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 2w1u s SER 809 CO 0.51 -0.41 0.74 -0.22 0.41 0.00 0.00 173.24 174.27 2w1u s LEU 810 N -2.12 4.08 -0.18 2.44 1.98 -1.26 -0.97 118.68 122.65 2w1u s LEU 810 Ca -0.05 0.76 -0.01 0.00 -2.89 0.00 0.00 54.13 51.94 2w1u s LEU 810 Cb -0.02 -3.02 -0.00 0.00 0.66 0.00 0.00 46.19 43.80 2w1u s LEU 810 CO -0.04 -0.50 -0.11 -0.63 -1.89 0.00 0.00 176.35 173.17 2w1u s ILE 811 N 2.76 2.96 0.26 6.68 -1.09 -0.07 -4.95 121.20 127.75 2w1u s ILE 811 Ca 0.31 -0.66 -0.07 0.00 -2.23 0.00 0.00 60.65 58.00 2w1u s ILE 811 Cb -0.15 -2.29 -0.01 0.00 -1.58 0.00 0.00 42.46 38.43 2w1u s ILE 811 CO 0.10 0.49 0.39 0.00 -1.23 0.00 0.00 174.94 174.68 2w1u s ARG 812 N 1.00 1.56 0.18 2.79 1.04 -1.26 -0.79 118.95 123.48 2w1u s ARG 812 Ca -0.01 -1.49 -0.33 0.00 -1.04 0.00 0.00 55.73 52.86 2w1u s ARG 812 Cb -0.15 0.41 -0.14 0.00 -2.04 0.00 0.00 34.95 33.04 2w1u s ARG 812 CO -0.02 -0.62 1.48 0.43 -0.04 0.00 0.00 175.30 176.53 2w1u n SER 813 N -0.64 2.76 -0.21 -2.89 7.64 -0.67 -4.89 113.62 114.72 2w1u n SER 813 Ca 0.00 1.11 0.00 0.00 1.01 0.00 0.00 58.87 60.99 2w1u n SER 813 Cb 0.63 -1.40 0.11 0.00 -1.01 0.00 0.00 64.21 62.55 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 5.07 0.46 0.00 1.43 4.81 -2.00 -3.07 114.58 121.28 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 1.27 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2w1u h GLU 814 CO 0.82 0.30 0.00 0.66 -0.73 0.00 0.00 179.01 180.06 2w1u h SER 815 N 0.47 0.00 -3.46 1.04 4.64 -1.99 -3.45 113.55 110.80 2w1u h SER 815 Ca 0.32 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.07 2w1u h SER 815 Cb 0.36 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.59 2w1u h SER 815 CO -0.29 0.00 0.36 0.79 -0.87 0.00 0.00 176.83 176.82 2w1u n TRP 816 N -2.56 1.69 -4.47 4.77 8.01 -1.16 -4.68 117.44 119.04 2w1u n TRP 816 Ca 0.04 0.50 -0.33 0.00 -1.31 0.00 0.00 57.50 56.40 2w1u n TRP 816 Cb 0.41 -2.30 -0.10 0.00 -2.01 0.00 0.00 31.31 27.30 2w1u n TRP 816 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.69 176.03 2w1u s GLN 817 N -2.30 2.68 -0.48 -0.99 -0.21 -0.30 -4.96 119.66 113.11 2w1u s GLN 817 Ca 0.65 -0.63 -0.28 0.00 0.02 0.00 0.00 55.36 55.12 2w1u s GLN 817 Cb -0.50 -2.58 0.03 0.00 1.00 0.00 0.00 33.01 30.96 2w1u s GLN 817 CO 0.55 0.63 1.10 0.08 -2.12 0.00 0.00 175.29 175.54 2w1u s VAL 818 N -0.95 4.24 -0.23 1.09 1.01 -1.26 -0.50 120.40 123.80 2w1u s VAL 818 Ca 0.16 1.11 0.08 0.00 0.00 0.00 0.00 61.98 63.33 2w1u s VAL 818 Cb -0.11 -4.58 -0.20 0.00 0.00 0.00 0.00 36.38 31.48 2w1u s VAL 818 CO 0.06 -1.00 -0.09 0.00 0.00 0.00 0.00 175.10 174.06 2w1u n TYR 819 N 7.76 0.03 -3.77 5.22 9.36 0.44 -4.93 117.16 131.28 2w1u n TYR 819 Ca 0.11 0.01 -0.13 0.00 3.32 0.00 0.00 57.90 61.20 2w1u n TYR 819 Cb 0.49 -1.00 -0.09 0.00 -0.63 0.00 0.00 39.34 38.11 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 0.65 3.14 2.98 2.12 -0.93 -4.97 118.70 119.18 2w1u s GLU 820 Ca -0.25 -0.19 0.00 0.00 0.36 0.00 0.00 54.97 54.89 2w1u s GLU 820 Cb 0.08 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.76 2w1u s GLU 820 CO 0.70 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.65 2w1u n GLY 821 N 1.33 0.15 3.40 -1.50 0.00 -1.26 -0.10 105.19 107.20 2w1u n GLY 821 Ca -0.21 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 2w1u n GLY 821 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w1u s ASN 822 N -4.00 -0.25 0.41 1.61 6.03 -1.15 -4.88 114.94 112.70 2w1u s ASN 822 Ca 0.00 -0.38 0.21 0.00 -1.03 0.00 0.00 52.86 51.66 2w1u s ASN 822 Cb 0.00 0.52 0.81 0.00 -3.03 0.00 0.00 41.25 39.55 2w1u s ASN 822 CO 0.00 -0.94 1.78 -0.33 -2.03 0.00 0.00 177.10 175.59 2w1u h GLU 823 N 2.28 0.00 0.00 3.55 5.08 -1.93 -2.46 114.58 121.11 2w1u h GLU 823 Ca -0.32 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.00 2w1u h GLU 823 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 2w1u h GLU 823 CO 0.43 0.30 -0.18 0.00 -1.00 0.00 0.00 179.01 178.56 2w1u h ALA 824 N 1.70 1.53 0.00 3.43 0.00 -1.97 -2.36 119.26 121.59 2w1u h ALA 824 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2w1u h ALA 824 Cb 0.81 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2w1u h ALA 824 CO 0.04 0.22 0.20 -0.91 0.00 0.00 0.00 179.25 178.80 2w1u h ASN 825 N 0.00 0.00 0.91 0.00 2.35 -1.74 -1.72 115.58 115.38 2w1u h ASN 825 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2w1u h ASN 825 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2w1u h ASN 825 CO 0.02 0.00 -0.37 0.18 -1.65 0.00 0.00 177.43 175.61 2w1u n LEU 826 N -2.42 0.55 -0.10 1.61 4.77 -0.89 -3.90 117.00 116.61 2w1u n LEU 826 Ca -0.02 0.28 0.09 0.00 -0.03 0.00 0.00 56.01 56.34 2w1u n LEU 826 Cb 0.23 -0.28 0.13 0.00 -2.33 0.00 0.00 43.42 41.18 2w1u n LEU 826 CO 0.10 -0.02 0.57 0.18 -1.33 0.00 0.00 177.39 176.89 2w1u n LEU 827 N -1.88 2.39 -1.41 2.23 4.77 -0.65 -0.34 117.00 122.11 2w1u n LEU 827 Ca 0.05 -2.99 0.11 0.00 -0.03 0.00 0.00 56.01 53.16 2w1u n LEU 827 Cb 0.39 -0.40 0.33 0.00 -2.33 0.00 0.00 43.42 41.42 2w1u n LEU 827 CO 0.33 0.69 0.79 -0.90 -1.33 0.00 0.00 177.39 176.97 2w1u n ASP 828 N -1.31 4.13 -2.04 -1.43 5.75 -1.20 -4.94 116.55 115.52 2w1u n ASP 828 Ca 0.15 -2.08 -0.16 0.00 -0.01 0.00 0.00 54.79 52.68 2w1u n ASP 828 Cb 0.62 -0.51 -0.03 0.00 -1.03 0.00 0.00 41.12 40.16 2w1u n ASP 828 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w1u n GLY 829 N 1.57 0.31 3.06 6.12 0.00 -1.26 -4.97 105.19 110.02 2w1u n GLY 829 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.17 3.77 0.60 1.61 3.68 -1.26 -4.99 116.67 117.91 2w1u s ASP 830 Ca 0.00 -1.04 0.39 0.00 2.13 0.00 0.00 52.55 54.03 2w1u s ASP 830 Cb 0.00 -1.43 1.88 0.00 -1.45 0.00 0.00 42.92 41.92 2w1u s ASP 830 CO 0.00 -0.12 2.17 0.44 0.13 0.00 0.00 175.17 177.78 2w1u h ASP 831 N 7.88 0.00 -0.34 -0.34 3.45 -1.93 -3.03 116.42 122.11 2w1u h ASP 831 Ca -0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.17 2w1u h ASP 831 Cb 1.09 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.86 2w1u h ASP 831 CO 0.51 0.00 0.00 0.59 -1.57 0.00 0.00 179.24 178.77 2w1u n ASN 832 N -3.06 2.97 -4.34 6.45 3.02 -1.26 -4.83 115.26 114.22 2w1u n ASN 832 Ca -0.01 -1.92 -0.32 0.00 -0.03 0.00 0.00 54.58 52.30 2w1u n ASN 832 Cb 0.19 -0.22 -0.15 0.00 -0.61 0.00 0.00 39.78 38.98 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 -1.57 2.32 0.00 3.41 -4.23 -1.15 -5.07 115.64 109.35 2w1u s THR 833 Ca 0.37 -0.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.89 2w1u s THR 833 Cb 0.21 -1.85 0.00 0.00 1.34 0.00 0.00 72.50 72.21 2w1u s THR 833 CO 0.30 0.58 0.00 0.61 -0.54 0.00 0.00 174.62 175.57 2w1u n GLY 834 N 2.62 3.71 3.30 3.99 0.00 -1.26 -4.60 105.19 112.96 2w1u n GLY 834 Ca -0.17 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.91 0.04 -0.16 1.61 0.11 -0.22 -2.93 120.40 116.93 2w1u s VAL 835 Ca 0.00 -0.32 0.00 0.00 -2.93 0.00 0.00 61.98 58.73 2w1u s VAL 835 Cb 0.00 -0.67 0.03 0.00 -1.53 0.00 0.00 36.38 34.21 2w1u s VAL 835 CO 0.00 -0.18 -0.12 0.86 -3.33 0.00 0.00 175.10 172.33 2w1u s TRP 836 N -1.06 2.17 -0.22 1.54 -0.11 0.86 -1.83 118.94 120.28 2w1u s TRP 836 Ca -0.11 -1.28 -0.12 0.00 1.22 0.00 0.00 56.10 55.80 2w1u s TRP 836 Cb -0.04 -1.57 -0.05 0.00 -1.50 0.00 0.00 33.47 30.31 2w1u s TRP 836 CO 0.05 -0.68 0.24 0.71 -4.62 0.00 0.00 176.95 172.65 2w1u s TYR 837 N 1.48 3.35 -0.05 5.86 1.51 0.87 -0.42 117.35 129.96 2w1u s TYR 837 Ca 0.03 0.38 -0.30 0.00 -1.01 0.00 0.00 57.07 56.17 2w1u s TYR 837 Cb -0.14 -2.35 -0.03 0.00 -0.11 0.00 0.00 41.96 39.33 2w1u s TYR 837 CO -0.10 0.06 1.20 0.21 -1.11 0.00 0.00 175.55 175.81 2w1u s LYS 838 N 1.07 4.36 0.04 -0.62 2.20 0.35 -1.40 119.74 125.75 2w1u s LYS 838 Ca 0.12 1.68 -0.12 0.00 -0.36 0.00 0.00 55.97 57.29 2w1u s LYS 838 Cb -0.14 -3.54 -0.06 0.00 -1.51 0.00 0.00 37.83 32.58 2w1u s LYS 838 CO 0.05 -0.43 0.40 0.95 -0.36 0.00 0.00 175.35 175.96 2w1u s THR 839 N 2.13 5.08 0.00 3.43 -4.23 -1.26 -1.15 115.64 119.64 2w1u s THR 839 Ca 0.56 0.60 0.00 0.00 -1.18 0.00 0.00 61.69 61.67 2w1u s THR 839 Cb -0.25 -3.66 0.00 0.00 1.34 0.00 0.00 72.50 69.93 2w1u s THR 839 CO 0.22 0.41 0.00 0.18 -0.54 0.00 0.00 174.62 174.89 2w1u n LEU 840 N 1.29 0.00 -3.87 4.79 4.77 -1.26 -3.67 117.00 119.05 2w1u n LEU 840 Ca -0.11 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.61 2w1u n LEU 840 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 2w1u n LEU 840 CO 0.40 0.00 -0.07 0.59 -1.33 0.00 0.00 177.39 176.98 2w1u n ASN 841 N 0.00 -1.93 -1.98 -1.43 3.02 -1.26 -1.23 115.26 110.45 2w1u n ASN 841 Ca 0.00 -0.88 -0.11 0.00 -0.03 0.00 0.00 54.58 53.56 2w1u n ASN 841 Cb 0.00 -3.60 0.04 0.00 -0.61 0.00 0.00 39.78 35.61 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 0.22 3.68 7.41 0.00 -1.26 -3.29 105.19 110.23 2w1u n GLY 842 Ca -0.19 -0.24 -0.21 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.87 -1.33 -4.15 1.61 9.92 -1.02 -4.96 116.55 115.75 2w1u n ASP 843 Ca -0.02 -0.80 -0.26 0.00 -0.53 0.00 0.00 54.79 53.18 2w1u n ASP 843 Cb 0.54 -4.17 -0.16 0.00 -0.64 0.00 0.00 41.12 36.69 2w1u n ASP 843 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2w1u s THR 844 N -3.63 1.46 -0.41 -3.53 2.01 -0.36 -2.10 115.64 109.08 2w1u s THR 844 Ca 0.02 -0.75 -0.18 0.00 0.31 0.00 0.00 61.69 61.09 2w1u s THR 844 Cb -0.01 -1.24 0.02 0.00 0.01 0.00 0.00 72.50 71.28 2w1u s THR 844 CO 0.80 0.42 0.50 -0.55 -0.69 0.00 0.00 174.62 175.10 2w1u s SER 845 N -0.09 6.25 0.49 3.53 0.15 0.25 -4.33 113.70 119.95 2w1u s SER 845 Ca -0.01 -0.45 -0.21 0.00 0.70 0.00 0.00 55.95 55.98 2w1u s SER 845 Cb -0.10 -2.25 -0.08 0.00 -1.71 0.00 0.00 66.02 61.87 2w1u s SER 845 CO 0.01 -0.60 1.07 -0.76 1.20 0.00 0.00 173.24 174.16 2w1u s LEU 846 N 2.35 3.87 0.29 3.45 1.43 -1.26 -1.10 118.68 127.71 2w1u s LEU 846 Ca 0.16 2.03 -0.28 0.00 -1.03 0.00 0.00 54.13 55.01 2w1u s LEU 846 Cb -0.16 -4.50 -0.14 0.00 0.03 0.00 0.00 46.19 41.42 2w1u s LEU 846 CO 0.15 -0.86 1.01 0.00 0.23 0.00 0.00 176.35 176.88 2w1u n ALA 847 N -0.91 -0.20 -0.04 4.21 0.00 -1.26 -2.21 120.51 120.10 2w1u n ALA 847 Ca 0.09 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2w1u n ALA 847 Cb 0.51 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.94 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 1.21 1.01 3.78 0.00 0.00 0.11 -4.96 105.19 106.34 2w1u n GLY 848 Ca 0.09 0.00 -0.33 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 -0.65 2.93 0.03 1.61 2.02 -0.94 -4.76 118.70 118.95 2w1u s GLU 849 Ca 0.00 1.29 -0.19 0.00 0.02 0.00 0.00 54.97 56.09 2w1u s GLU 849 Cb 0.00 -1.97 0.04 0.00 0.10 0.00 0.00 34.13 32.29 2w1u s GLU 849 CO 0.00 -1.13 0.43 -0.59 0.02 0.00 0.00 175.26 173.98 2w1u s PHE 850 N -2.46 -0.29 -0.02 1.61 -0.71 -1.26 -0.41 117.98 114.44 2w1u s PHE 850 Ca 0.65 0.30 -0.02 0.00 -1.04 0.00 0.00 56.93 56.82 2w1u s PHE 850 Cb -0.18 0.23 0.00 0.00 -1.21 0.00 0.00 43.02 41.86 2w1u s PHE 850 CO 0.42 -0.56 0.06 -1.50 -1.34 0.00 0.00 175.22 172.30 2w1u s ILE 851 N -2.29 0.01 -0.44 -4.49 2.07 -0.45 -1.67 121.20 113.94 2w1u s ILE 851 Ca -0.06 -0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.07 2w1u s ILE 851 Cb -0.01 -0.13 0.00 0.00 0.13 0.00 0.00 42.46 42.45 2w1u s ILE 851 CO -0.01 -0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.57 2w1u n GLY 852 N 2.85 -0.82 3.16 1.50 0.00 0.03 -0.52 105.19 111.39 2w1u n GLY 852 Ca -0.14 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.38 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 1.98 -0.34 0.99 1.43 0.62 -0.89 118.68 122.47 2w1u s LEU 853 Ca 0.00 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.60 2w1u s LEU 853 Cb 0.00 -0.95 -0.01 0.00 0.03 0.00 0.00 46.19 45.26 2w1u s LEU 853 CO 0.00 0.19 0.43 -0.62 0.23 0.00 0.00 176.35 176.57 2w1u s ASP 854 N -0.20 6.24 0.00 2.29 3.68 -0.14 -2.26 116.67 126.27 2w1u s ASP 854 Ca 0.02 -0.10 0.29 0.00 2.13 0.00 0.00 52.55 54.88 2w1u s ASP 854 Cb -0.09 -2.23 1.21 0.00 -1.45 0.00 0.00 42.92 40.36 2w1u s ASP 854 CO 0.01 -0.38 1.91 0.18 0.13 0.00 0.00 175.17 177.01 2w1u n LEU 855 N 5.52 0.03 0.00 -1.34 4.77 0.76 -0.70 117.00 126.04 2w1u n LEU 855 Ca -0.07 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 2w1u n LEU 855 Cb 0.49 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2w1u n LEU 855 CO 0.42 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2w1u n GLY 856 N 1.50 2.67 3.55 -0.72 0.00 -1.26 -4.22 105.19 106.70 2w1u n GLY 856 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.46 0.97 0.06 1.61 -2.85 -1.26 -2.04 119.74 115.77 2w1u s LYS 857 Ca 0.00 -0.41 -0.31 0.00 -1.00 0.00 0.00 55.97 54.26 2w1u s LYS 857 Cb 0.00 0.42 -0.07 0.00 -2.06 0.00 0.00 37.83 36.12 2w1u s LYS 857 CO 0.00 -0.43 1.38 -2.00 0.10 0.00 0.00 175.35 174.39 2w1u s GLU 858 N -3.26 4.31 -0.03 1.78 2.12 -1.26 -4.41 118.70 117.96 2w1u s GLU 858 Ca 0.06 1.99 0.04 0.00 0.36 0.00 0.00 54.97 57.42 2w1u s GLU 858 Cb -0.01 -3.41 -0.01 0.00 0.26 0.00 0.00 34.13 30.96 2w1u s GLU 858 CO -0.07 -0.48 -0.15 0.42 -0.54 0.00 0.00 175.26 174.43 2w1u s ILE 859 N 1.71 1.27 -0.60 -3.70 1.01 0.26 -4.94 121.20 116.21 2w1u s ILE 859 Ca 0.64 -0.65 -0.28 0.00 0.00 0.00 0.00 60.65 60.36 2w1u s ILE 859 Cb -0.34 -1.08 0.02 0.00 0.01 0.00 0.00 42.46 41.07 2w1u s ILE 859 CO 0.28 0.37 1.31 -0.54 0.00 0.00 0.00 174.94 176.36 2w1u s LYS 860 N -0.08 3.35 -0.03 2.79 1.02 -1.26 -1.65 119.74 123.88 2w1u s LYS 860 Ca -0.00 0.24 -0.20 0.00 0.02 0.00 0.00 55.97 56.03 2w1u s LYS 860 Cb -0.09 -4.10 -0.05 0.00 -0.52 0.00 0.00 37.83 33.07 2w1u s LYS 860 CO 0.01 -1.90 0.56 -0.51 -0.92 0.00 0.00 175.35 172.60 2w1u s LEU 861 N 5.63 4.39 0.00 3.17 1.43 0.96 -4.53 118.68 129.74 2w1u s LEU 861 Ca 0.46 1.09 0.22 0.00 -1.03 0.00 0.00 54.13 54.86 2w1u s LEU 861 Cb -0.09 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.24 2w1u s LEU 861 CO 0.23 0.09 1.03 0.47 0.23 0.00 0.00 176.35 178.41 2w1u n ASP 862 N 2.86 0.83 0.00 2.29 9.92 0.18 -1.03 116.55 131.59 2w1u n ASP 862 Ca -0.07 -0.75 0.00 0.00 -0.53 0.00 0.00 54.79 53.44 2w1u n ASP 862 Cb 0.51 0.81 0.00 0.00 -0.64 0.00 0.00 41.12 41.81 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 1.49 -2.00 3.20 0.44 0.00 -0.98 -0.58 105.19 106.75 2w1u n GLY 863 Ca 0.04 -1.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.03 0.85 -0.25 -0.61 -5.25 -0.55 -0.69 121.20 112.68 2w1u s ILE 864 Ca 0.00 -1.97 -0.03 0.00 -0.99 0.00 0.00 60.65 57.66 2w1u s ILE 864 Cb 0.00 -1.73 0.08 0.00 2.95 0.00 0.00 42.46 43.76 2w1u s ILE 864 CO 0.00 -0.83 0.09 -0.60 -1.79 0.00 0.00 174.94 171.82 2w1u s ARG 865 N -3.79 0.38 -0.17 0.37 3.52 -0.50 -1.59 118.95 117.18 2w1u s ARG 865 Ca 0.13 -0.53 -0.01 0.00 -0.13 0.00 0.00 55.73 55.19 2w1u s ARG 865 Cb 0.04 -1.69 -0.00 0.00 -1.56 0.00 0.00 34.95 31.74 2w1u s ARG 865 CO -0.03 -0.86 -0.12 -0.06 -0.81 0.00 0.00 175.30 173.43 2w1u s PHE 866 N 1.95 2.85 -0.37 5.12 0.08 0.34 -1.62 117.98 126.34 2w1u s PHE 866 Ca 0.05 -0.97 -0.10 0.00 0.12 0.00 0.00 56.93 56.03 2w1u s PHE 866 Cb -0.17 -1.95 0.03 0.00 -0.57 0.00 0.00 43.02 40.36 2w1u s PHE 866 CO -0.22 -0.47 0.19 0.08 -0.10 0.00 0.00 175.22 174.70 2w1u s VAL 867 N 0.96 4.46 0.41 -0.44 1.01 0.55 0.25 120.40 127.61 2w1u s VAL 867 Ca -0.02 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2w1u s VAL 867 Cb -0.15 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 2w1u s VAL 867 CO -0.01 -0.21 0.61 0.27 0.00 0.00 0.00 175.10 175.76 2w1u s ILE 868 N 1.54 4.18 0.13 2.22 -4.36 -0.69 -1.12 121.20 123.10 2w1u s ILE 868 Ca 0.02 -0.58 0.00 0.00 -0.26 0.00 0.00 60.65 59.82 2w1u s ILE 868 Cb -0.19 -3.53 0.00 0.00 1.25 0.00 0.00 42.46 39.99 2w1u s ILE 868 CO 0.06 -0.33 0.00 0.61 0.24 0.00 0.00 174.94 175.52 2w1u n GLY 869 N -1.95 -1.62 3.58 6.27 0.00 0.95 -1.01 105.19 111.41 2w1u n GLY 869 Ca 0.00 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.98 1.34 0.49 1.61 -2.85 -1.26 -3.02 119.74 115.07 2w1u s LYS 870 Ca 0.00 -0.60 -0.11 0.00 -1.00 0.00 0.00 55.97 54.26 2w1u s LYS 870 Cb 0.00 0.55 -0.06 0.00 -2.06 0.00 0.00 37.83 36.26 2w1u s LYS 870 CO 0.00 -0.60 0.88 -0.80 0.10 0.00 0.00 175.35 174.93 2w1u s ASN 871 N -2.77 6.44 0.15 0.03 0.01 -1.26 -3.73 114.94 113.80 2w1u s ASN 871 Ca 0.05 1.27 0.00 0.00 -0.71 0.00 0.00 52.86 53.47 2w1u s ASN 871 Cb -0.02 -2.39 0.00 0.00 0.41 0.00 0.00 41.25 39.25 2w1u s ASN 871 CO -0.06 -0.58 0.00 0.61 -1.51 0.00 0.00 177.10 175.56 2w1u n GLY 872 N -1.86 0.44 3.68 0.66 0.00 -1.26 -4.77 105.19 102.08 2w1u n GLY 872 Ca 0.04 -1.00 -0.45 0.00 0.00 0.00 0.00 46.02 44.61 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 0.97 2.08 -0.02 0.00 -1.26 -1.84 105.19 105.12 2w1u n GLY 873 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.57 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 2.64 0.47 0.36 -0.02 0.00 -1.26 -4.88 105.19 102.50 2w1u n GLY 874 Ca 0.13 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.34 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 -0.65 1.61 4.64 -1.45 0.18 113.55 117.88 2w1u h SER 875 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2w1u h SER 875 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2w1u h SER 875 CO 0.00 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.76 2w1u n SER 876 N -3.73 3.92 -4.33 4.97 7.64 -1.26 0.04 113.62 120.86 2w1u n SER 876 Ca 0.04 -2.09 -0.44 0.00 1.01 0.00 0.00 58.87 57.39 2w1u n SER 876 Cb 0.45 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 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 1.33 5.33 -3.81 6.43 10.43 0.05 -4.91 116.55 131.40 2w1u n ASP 877 Ca 0.22 -3.03 -0.12 0.00 2.57 0.00 0.00 54.79 54.43 2w1u n ASP 877 Cb 0.64 -1.50 -0.09 0.00 1.84 0.00 0.00 41.12 42.00 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 0.58 0.58 0.53 -1.24 1.02 -1.26 -0.88 119.74 119.07 2w1u s LYS 878 Ca 0.39 -0.28 -0.21 0.00 0.02 0.00 0.00 55.97 55.89 2w1u s LYS 878 Cb -0.02 0.25 -0.05 0.00 -0.52 0.00 0.00 37.83 37.49 2w1u s LYS 878 CO -0.01 -0.15 1.26 -1.58 -0.92 0.00 0.00 175.35 173.95 2w1u s TRP 879 N -1.34 2.49 0.01 3.18 0.51 -1.26 -4.97 118.94 117.57 2w1u s TRP 879 Ca -0.14 1.46 -0.14 0.00 -2.12 0.00 0.00 56.10 55.16 2w1u s TRP 879 Cb -0.06 -3.59 -0.35 0.00 -0.81 0.00 0.00 33.47 28.66 2w1u s TRP 879 CO 0.03 -2.30 0.93 -0.91 -0.51 0.00 0.00 176.95 174.19 2w1u h ASN 880 N 1.49 0.79 -3.50 2.95 -0.26 -1.89 -3.43 115.58 111.74 2w1u h ASN 880 Ca -0.50 -0.91 -0.39 0.00 -0.56 0.00 0.00 56.30 53.94 2w1u h ASN 880 Cb 1.28 -0.26 -0.34 0.00 -1.06 0.00 0.00 38.32 37.95 2w1u h ASN 880 CO 0.58 1.73 -0.77 -0.54 -1.06 0.00 0.00 177.43 177.37 2w1u s LYS 881 N -2.60 0.68 0.15 0.81 1.02 -1.26 0.65 119.74 119.20 2w1u s LYS 881 Ca -0.10 -0.07 -0.25 0.00 0.02 0.00 0.00 55.97 55.57 2w1u s LYS 881 Cb 0.04 -0.72 0.06 0.00 -0.52 0.00 0.00 37.83 36.69 2w1u s LYS 881 CO 0.93 -0.08 0.86 -0.59 -0.92 0.00 0.00 175.35 175.55 2w1u s PHE 882 N 0.87 -0.22 0.04 3.18 -0.71 -1.04 -0.64 117.98 119.45 2w1u s PHE 882 Ca -0.11 -0.08 0.01 0.00 -1.04 0.00 0.00 56.93 55.72 2w1u s PHE 882 Cb -0.14 0.63 -0.02 0.00 -1.21 0.00 0.00 43.02 42.28 2w1u s PHE 882 CO -0.00 -0.86 -0.06 -1.59 -1.34 0.00 0.00 175.22 171.37 2w1u s LYS 883 N -3.43 0.49 -0.22 1.99 -2.85 -0.06 -0.54 119.74 115.12 2w1u s LYS 883 Ca 0.10 -0.77 -0.12 0.00 -1.00 0.00 0.00 55.97 54.18 2w1u s LYS 883 Cb -0.02 -0.15 -0.05 0.00 -2.06 0.00 0.00 37.83 35.55 2w1u s LYS 883 CO -0.00 0.01 0.21 -1.17 0.10 0.00 0.00 175.35 174.50 2w1u s LEU 884 N -1.68 4.16 0.03 2.77 2.96 0.67 -0.43 118.68 127.16 2w1u s LEU 884 Ca -0.10 0.25 -0.06 0.00 -0.22 0.00 0.00 54.13 54.00 2w1u s LEU 884 Cb -0.08 -2.20 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 2w1u s LEU 884 CO -0.01 0.07 0.12 -1.83 -1.32 0.00 0.00 176.35 173.38 2w1u s GLU 885 N 0.88 0.58 0.23 1.98 -1.05 -0.64 -0.27 118.70 120.41 2w1u s GLU 885 Ca 0.11 -0.67 0.01 0.00 -0.15 0.00 0.00 54.97 54.27 2w1u s GLU 885 Cb -0.13 0.23 -0.05 0.00 -0.44 0.00 0.00 34.13 33.74 2w1u s GLU 885 CO 0.04 -0.15 0.09 1.52 0.95 0.00 0.00 175.26 177.71 2w1u s TYR 886 N -2.35 1.39 0.07 4.83 -0.85 -0.33 -1.44 117.35 118.67 2w1u s TYR 886 Ca -0.07 -1.21 -0.23 0.00 -0.52 0.00 0.00 57.07 55.04 2w1u s TYR 886 Cb -0.03 -0.78 0.06 0.00 0.38 0.00 0.00 41.96 41.59 2w1u s TYR 886 CO -0.03 -0.40 0.55 0.45 -1.52 0.00 0.00 175.55 174.60 2w1u s SER 887 N -3.25 -0.49 -0.10 -0.18 0.15 -0.26 -1.13 113.70 108.45 2w1u s SER 887 Ca 0.36 0.16 0.16 0.00 0.70 0.00 0.00 55.95 57.33 2w1u s SER 887 Cb 0.07 0.52 -0.23 0.00 -1.71 0.00 0.00 66.02 64.68 2w1u s SER 887 CO 0.12 -0.78 0.43 0.18 1.20 0.00 0.00 173.24 174.39 2w1u n LEU 888 N 0.22 0.49 0.00 3.45 7.99 -1.26 -1.04 117.00 126.84 2w1u n LEU 888 Ca -0.18 0.23 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 2w1u n LEU 888 Cb 0.61 0.29 0.00 0.00 -0.11 0.00 0.00 43.42 44.21 2w1u n LEU 888 CO 0.18 0.40 0.29 -0.90 -1.51 0.00 0.00 177.39 175.84 2w1u n ASP 889 N -2.88 0.93 -0.05 -1.43 3.85 -1.26 -4.52 116.55 111.18 2w1u n ASP 889 Ca -0.22 -1.33 -0.01 0.00 -0.71 0.00 0.00 54.79 52.52 2w1u n ASP 889 Cb 1.06 0.00 -0.00 0.00 -1.35 0.00 0.00 41.12 40.83 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 -0.16 -4.73 -0.00 -1.12 5.15 -1.26 -4.76 115.26 108.38 2w1u n ASN 890 Ca 0.00 0.02 -0.02 0.00 -0.60 0.00 0.00 54.58 53.98 2w1u n ASN 890 Cb 0.24 -2.29 -0.01 0.00 -0.53 0.00 0.00 39.78 37.20 2w1u n ASN 890 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2w1u n GLU 891 N -0.79 0.04 -3.75 1.20 1.02 -1.26 -5.00 120.64 112.10 2w1u n GLU 891 Ca -0.01 0.02 -0.35 0.00 -0.02 0.00 0.00 57.16 56.79 2w1u n GLU 891 Cb 0.30 -0.56 -0.09 0.00 -0.02 0.00 0.00 31.44 31.07 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 -5.25 6.07 0.03 1.62 0.01 -1.26 -5.10 113.70 109.82 2w1u s SER 892 Ca -0.02 0.16 0.07 0.00 1.31 0.00 0.00 55.95 57.46 2w1u s SER 892 Cb 0.01 -2.07 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 2w1u s SER 892 CO 0.03 0.14 -0.18 0.26 0.41 0.00 0.00 173.24 173.89 2w1u s TRP 893 N 0.62 2.55 -0.10 2.43 0.52 -1.26 -4.37 118.94 119.32 2w1u s TRP 893 Ca 0.07 -0.26 0.03 0.00 0.02 0.00 0.00 56.10 55.96 2w1u s TRP 893 Cb -0.12 -1.47 0.01 0.00 -1.15 0.00 0.00 33.47 30.74 2w1u s TRP 893 CO 0.01 0.23 -0.20 0.99 0.02 0.00 0.00 176.95 178.00 2w1u s THR 894 N -0.90 1.82 -0.03 2.01 2.01 -0.29 -4.95 115.64 115.32 2w1u s THR 894 Ca 0.14 -0.87 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2w1u s THR 894 Cb -0.10 -1.60 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 2w1u s THR 894 CO 0.05 0.51 0.99 -0.89 -0.69 0.00 0.00 174.62 174.59 2w1u s THR 895 N 0.59 4.82 -0.17 -0.82 2.01 -1.26 -1.18 115.64 119.63 2w1u s THR 895 Ca -0.14 2.04 -0.22 0.00 0.31 0.00 0.00 61.69 63.68 2w1u s THR 895 Cb -0.17 -4.31 -0.23 0.00 0.01 0.00 0.00 72.50 67.81 2w1u s THR 895 CO 0.04 0.11 0.43 0.40 -0.69 0.00 0.00 174.62 174.91 2w1u h ILE 896 N 4.88 1.14 -2.42 1.82 2.04 -1.00 -3.49 117.51 120.49 2w1u h ILE 896 Ca -0.38 -2.27 -0.09 0.00 1.00 0.00 0.00 64.86 63.12 2w1u h ILE 896 Cb 1.20 2.62 -0.23 0.00 -0.74 0.00 0.00 36.82 39.67 2w1u h ILE 896 CO 0.78 0.49 -0.07 -0.75 0.00 0.00 0.00 178.15 178.60 2w1u s LYS 897 N -2.36 0.65 -0.04 2.37 2.20 -1.15 -5.00 119.74 116.41 2w1u s LYS 897 Ca -0.24 0.73 0.02 0.00 -0.36 0.00 0.00 55.97 56.12 2w1u s LYS 897 Cb 0.03 0.32 -0.03 0.00 -1.51 0.00 0.00 37.83 36.64 2w1u s LYS 897 CO 0.66 -0.08 -0.09 -2.00 -0.36 0.00 0.00 175.35 173.48 2w1u s GLU 898 N 0.22 2.60 -0.00 4.03 2.12 -1.26 -0.24 118.70 126.16 2w1u s GLU 898 Ca -0.01 -0.66 0.07 0.00 0.36 0.00 0.00 54.97 54.74 2w1u s GLU 898 Cb -0.04 -2.50 -0.02 0.00 0.26 0.00 0.00 34.13 31.84 2w1u s GLU 898 CO 0.01 0.63 -0.23 0.71 -0.54 0.00 0.00 175.26 175.84 2w1u s TYR 899 N -0.86 2.03 -0.27 5.30 2.02 0.30 -5.01 117.35 120.86 2w1u s TYR 899 Ca 0.14 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.48 2w1u s TYR 899 Cb -0.11 -1.29 0.07 0.00 -0.40 0.00 0.00 41.96 40.23 2w1u s TYR 899 CO 0.03 -0.00 -0.06 0.34 -1.57 0.00 0.00 175.55 174.29 2w1u s ASP 900 N -0.68 4.30 -0.19 2.29 -1.08 -1.26 -2.51 116.67 117.54 2w1u s ASP 900 Ca 0.09 -1.47 0.16 0.00 -0.52 0.00 0.00 52.55 50.81 2w1u s ASP 900 Cb -0.09 -1.42 0.55 0.00 -1.46 0.00 0.00 42.92 40.50 2w1u s ASP 900 CO -0.00 -0.24 1.45 0.29 0.52 0.00 0.00 175.17 177.18 2w1u n LYS 901 N 4.49 2.99 -0.34 4.34 4.76 0.21 -4.71 118.16 129.89 2w1u n LYS 901 Ca -0.10 -2.88 0.26 0.00 -2.87 0.00 0.00 58.31 52.71 2w1u n LYS 901 Cb 0.43 -1.88 0.54 0.00 -1.84 0.00 0.00 35.03 32.28 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 1.89 0.44 -0.39 -0.18 2.02 -1.84 -1.64 112.91 113.21 2w1u h THR 902 Ca 0.01 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2w1u h THR 902 Cb 1.50 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 2w1u h THR 902 CO 0.25 0.06 0.00 0.61 0.37 0.00 0.00 175.52 176.81 2w1u n GLY 903 N -1.48 2.91 3.77 2.16 0.00 -1.26 -5.01 105.19 106.28 2w1u n GLY 903 Ca 0.28 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 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 -1.29 2.96 0.50 4.61 0.00 -0.62 -4.99 121.76 122.92 2w1u s ALA 904 Ca 0.30 0.91 -0.23 0.00 0.00 0.00 0.00 51.96 52.94 2w1u s ALA 904 Cb 0.18 -3.37 -0.07 0.00 0.00 0.00 0.00 23.12 19.85 2w1u s ALA 904 CO 0.17 -0.64 1.38 -0.35 0.00 0.00 0.00 175.76 176.32 2w1u n PRO 905 N -0.54 1.94 -1.24 0.00 -0.04 -1.26 -4.97 135.00 128.89 2w1u n PRO 905 Ca 0.08 0.70 -0.36 0.00 -0.04 0.00 0.00 63.50 63.88 2w1u n PRO 905 Cb 0.48 -2.58 0.08 0.00 -0.04 0.00 0.00 33.50 31.45 2w1u n PRO 905 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w1u n ALA 906 N -0.63 -1.11 0.00 0.55 0.00 -1.26 -4.85 120.51 113.21 2w1u n ALA 906 Ca 0.08 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2w1u n ALA 906 Cb 0.43 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2w1u n ALA 906 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w1u n GLY 907 N 1.39 -1.76 3.65 0.00 0.00 0.11 -4.98 105.19 103.60 2w1u n GLY 907 Ca 0.11 -2.11 -0.44 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.03 1.77 -3.75 1.61 5.02 -1.25 -4.17 118.16 117.36 2w1u n LYS 908 Ca 0.00 0.62 -0.26 0.00 -2.02 0.00 0.00 58.31 56.66 2w1u n LYS 908 Cb 0.00 -2.14 -0.17 0.00 -0.02 0.00 0.00 35.03 32.70 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 -0.28 2.40 -0.42 4.39 3.68 -0.18 -4.96 116.67 121.31 2w1u s ASP 909 Ca 0.60 -0.54 -0.23 0.00 2.13 0.00 0.00 52.55 54.51 2w1u s ASP 909 Cb -0.65 -0.54 0.02 0.00 -1.45 0.00 0.00 42.92 40.31 2w1u s ASP 909 CO 0.59 -0.26 0.77 -0.69 0.13 0.00 0.00 175.17 175.71 2w1u s VAL 910 N 1.90 4.68 -0.65 1.11 1.01 -1.26 -1.70 120.40 125.49 2w1u s VAL 910 Ca 0.01 0.55 -0.17 0.00 0.00 0.00 0.00 61.98 62.38 2w1u s VAL 910 Cb -0.15 -4.28 0.14 0.00 0.00 0.00 0.00 36.38 32.09 2w1u s VAL 910 CO -0.07 -0.62 0.67 -0.63 0.00 0.00 0.00 175.10 174.44 2w1u s ILE 911 N 3.21 5.16 -0.19 2.22 -1.09 0.14 -4.98 121.20 125.67 2w1u s ILE 911 Ca 0.30 -1.60 -0.03 0.00 -2.23 0.00 0.00 60.65 57.10 2w1u s ILE 911 Cb -0.12 -4.44 -0.01 0.00 -1.58 0.00 0.00 42.46 36.30 2w1u s ILE 911 CO 0.21 -1.03 -0.07 -0.70 -1.23 0.00 0.00 174.94 172.12 2w1u s GLU 912 N 1.64 3.39 -0.03 2.79 2.12 -1.26 -0.50 118.70 126.84 2w1u s GLU 912 Ca 0.11 -0.64 0.05 0.00 0.36 0.00 0.00 54.97 54.85 2w1u s GLU 912 Cb -0.22 -2.88 -0.01 0.00 0.26 0.00 0.00 34.13 31.28 2w1u s GLU 912 CO 0.00 -0.05 -0.17 -1.21 -0.54 0.00 0.00 175.26 173.29 2w1u s GLU 913 N 1.07 1.58 -0.15 4.30 0.41 -0.62 -5.01 118.70 120.29 2w1u s GLU 913 Ca 0.01 -0.59 -0.03 0.00 -0.41 0.00 0.00 54.97 53.95 2w1u s GLU 913 Cb -0.15 -1.43 -0.02 0.00 -1.78 0.00 0.00 34.13 30.75 2w1u s GLU 913 CO -0.01 0.29 -0.06 -1.12 -0.49 0.00 0.00 175.26 173.86 2w1u s SER 914 N -0.13 4.59 -0.39 -0.19 0.01 -1.26 -1.48 113.70 114.85 2w1u s SER 914 Ca 0.00 -0.18 -0.16 0.00 1.31 0.00 0.00 55.95 56.93 2w1u s SER 914 Cb -0.09 -1.73 0.01 0.00 0.21 0.00 0.00 66.02 64.41 2w1u s SER 914 CO 0.01 0.17 0.38 -0.36 0.41 0.00 0.00 173.24 173.85 2w1u s PHE 915 N 0.34 3.20 0.18 2.43 2.99 0.25 -4.96 117.98 122.41 2w1u s PHE 915 Ca -0.06 -0.27 -0.16 0.00 0.00 0.00 0.00 56.93 56.44 2w1u s PHE 915 Cb -0.15 -2.74 0.13 0.00 0.00 0.00 0.00 43.02 40.26 2w1u s PHE 915 CO 0.04 -0.57 1.65 1.49 -0.00 0.00 0.00 175.22 177.83 2w1u h GLU 916 N 8.60 -0.01 -6.25 0.44 4.81 -1.96 -3.39 114.58 116.83 2w1u h GLU 916 Ca -0.28 0.00 -0.69 0.00 -0.13 0.00 0.00 59.36 58.26 2w1u h GLU 916 Cb 1.13 0.00 -0.22 0.00 0.63 0.00 0.00 28.75 30.29 2w1u h GLU 916 CO 0.74 -0.01 -0.75 0.95 -0.73 0.00 0.00 179.01 179.22 2w1u s THR 917 N -6.22 3.27 0.39 0.32 -4.23 -1.26 -5.10 115.64 102.82 2w1u s THR 917 Ca -0.14 -0.64 -0.26 0.00 -1.18 0.00 0.00 61.69 59.46 2w1u s THR 917 Cb 0.16 -2.30 -0.11 0.00 1.34 0.00 0.00 72.50 71.59 2w1u s THR 917 CO 0.71 0.59 1.26 -2.65 -0.54 0.00 0.00 174.62 174.00 2w1u n PRO 918 N 2.31 1.95 -4.32 3.99 -0.02 -1.26 -4.97 135.00 132.69 2w1u n PRO 918 Ca -0.17 0.69 -0.34 0.00 -2.02 0.00 0.00 63.50 61.66 2w1u n PRO 918 Cb 0.52 -2.34 -0.13 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.17 3.49 -0.30 4.25 1.01 -0.20 -4.86 121.20 123.42 2w1u s ILE 919 Ca 0.59 -0.48 -0.24 0.00 0.00 0.00 0.00 60.65 60.52 2w1u s ILE 919 Cb -0.53 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.40 2w1u s ILE 919 CO 0.59 0.47 0.81 -0.44 0.00 0.00 0.00 174.94 176.37 2w1u s SER 920 N 0.78 6.70 0.00 3.58 0.01 -1.26 -0.03 113.70 123.49 2w1u s SER 920 Ca -0.02 0.75 -0.06 0.00 1.31 0.00 0.00 55.95 57.92 2w1u s SER 920 Cb -0.15 -2.42 -0.00 0.00 0.21 0.00 0.00 66.02 63.66 2w1u s SER 920 CO 0.02 -0.61 0.11 0.00 0.41 0.00 0.00 173.24 173.17 2w1u s ALA 921 N 2.97 -0.26 -0.09 1.44 0.00 -0.66 -4.69 121.76 120.47 2w1u s ALA 921 Ca 0.33 -0.19 0.11 0.00 0.00 0.00 0.00 51.96 52.21 2w1u s ALA 921 Cb -0.14 0.11 -0.16 0.00 0.00 0.00 0.00 23.12 22.93 2w1u s ALA 921 CO 0.12 -0.20 0.10 1.17 0.00 0.00 0.00 175.76 176.95 2w1u n LYS 922 N 1.51 1.64 -4.53 0.00 4.81 -0.21 -0.58 118.16 120.81 2w1u n LYS 922 Ca -0.23 -0.03 -0.21 0.00 -0.87 0.00 0.00 58.31 56.97 2w1u n LYS 922 Cb 0.56 -1.30 -0.15 0.00 0.02 0.00 0.00 35.03 34.16 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 -2.44 1.19 -0.18 5.64 2.02 -0.79 -0.17 117.35 122.62 2w1u s TYR 923 Ca -0.05 -0.26 -0.14 0.00 -0.37 0.00 0.00 57.07 56.24 2w1u s TYR 923 Cb 0.05 -0.75 0.05 0.00 -0.40 0.00 0.00 41.96 40.91 2w1u s TYR 923 CO 0.49 -0.00 0.46 -1.50 -1.57 0.00 0.00 175.55 173.42 2w1u s ILE 924 N -0.47 -0.01 0.06 2.71 2.07 -0.96 -1.10 121.20 123.51 2w1u s ILE 924 Ca 0.04 0.02 -0.22 0.00 -1.41 0.00 0.00 60.65 59.08 2w1u s ILE 924 Cb -0.06 -0.65 0.05 0.00 0.13 0.00 0.00 42.46 41.94 2w1u s ILE 924 CO 0.00 0.01 0.53 0.00 -1.91 0.00 0.00 174.94 173.56 2w1u s ARG 925 N 0.60 1.07 -0.15 3.50 1.70 -0.52 -0.27 118.95 124.87 2w1u s ARG 925 Ca -0.03 -0.28 -0.13 0.00 -0.47 0.00 0.00 55.73 54.82 2w1u s ARG 925 Cb -0.05 0.49 -0.05 0.00 -0.57 0.00 0.00 34.95 34.77 2w1u s ARG 925 CO -0.04 -0.40 0.26 -0.51 -1.08 0.00 0.00 175.30 173.54 2w1u s LEU 926 N -2.10 4.27 -0.11 -1.89 1.43 0.32 -1.62 118.68 118.99 2w1u s LEU 926 Ca -0.04 0.50 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 2w1u s LEU 926 Cb -0.00 -2.32 0.01 0.00 0.03 0.00 0.00 46.19 43.90 2w1u s LEU 926 CO -0.03 0.16 -0.18 -0.89 0.23 0.00 0.00 176.35 175.63 2w1u s THR 927 N 0.19 1.68 0.36 5.49 2.01 0.43 -1.35 115.64 124.45 2w1u s THR 927 Ca 0.16 -0.77 -0.28 0.00 0.31 0.00 0.00 61.69 61.10 2w1u s THR 927 Cb -0.13 -1.50 -0.11 0.00 0.01 0.00 0.00 72.50 70.77 2w1u s THR 927 CO 0.04 0.48 1.49 0.21 -0.69 0.00 0.00 174.62 176.14 2w1u s ASN 928 N 0.75 6.39 0.00 3.53 2.47 0.46 -0.88 114.94 127.65 2w1u s ASN 928 Ca -0.11 3.00 0.06 0.00 0.42 0.00 0.00 52.86 56.24 2w1u s ASN 928 Cb -0.16 -2.66 -0.04 0.00 -1.45 0.00 0.00 41.25 36.94 2w1u s ASN 928 CO 0.02 -0.85 0.36 0.23 -3.72 0.00 0.00 177.10 173.14 2w1u n MET 929 N 0.77 3.95 -3.73 0.43 2.81 0.19 0.07 117.12 121.62 2w1u n MET 929 Ca 0.02 -0.18 -0.14 0.00 -1.81 0.00 0.00 57.70 55.60 2w1u n MET 929 Cb 0.39 -0.87 -0.14 0.00 -0.71 0.00 0.00 33.22 31.89 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 -1.41 0.12 0.14 0.03 2.12 -1.24 -4.82 118.70 113.65 2w1u s GLU 930 Ca 0.04 0.46 -0.35 0.00 0.36 0.00 0.00 54.97 55.48 2w1u s GLU 930 Cb 0.05 -0.17 -0.15 0.00 0.26 0.00 0.00 34.13 34.12 2w1u s GLU 930 CO 0.23 -0.19 1.43 0.09 -0.54 0.00 0.00 175.26 176.28 2w1u n ASN 931 N 4.39 2.32 -3.83 -1.70 3.02 -1.26 -4.38 115.26 113.82 2w1u n ASN 931 Ca -0.23 1.11 -0.14 0.00 -0.03 0.00 0.00 54.58 55.29 2w1u n ASN 931 Cb 0.52 -1.31 -0.15 0.00 -0.61 0.00 0.00 39.78 38.22 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 0.53 0.05 -1.37 2.41 2.07 -0.26 -4.94 121.20 119.68 2w1u s ILE 932 Ca 0.79 0.08 -0.16 0.00 -1.41 0.00 0.00 60.65 59.95 2w1u s ILE 932 Cb -0.80 -0.11 0.06 0.00 0.13 0.00 0.00 42.46 41.74 2w1u s ILE 932 CO 0.44 0.07 1.96 0.59 -1.91 0.00 0.00 174.94 176.09 2w1u n ASN 933 N 3.67 4.46 -3.66 4.50 3.02 -1.26 -0.58 115.26 125.41 2w1u n ASN 933 Ca -0.21 -2.89 -0.08 0.00 -0.03 0.00 0.00 54.58 51.37 2w1u n ASN 933 Cb 0.54 -1.69 -0.08 0.00 -0.61 0.00 0.00 39.78 37.94 2w1u n ASN 933 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2w1u s LYS 934 N 3.51 0.61 1.22 3.52 1.02 -0.89 -4.93 119.74 123.79 2w1u s LYS 934 Ca 0.50 1.12 -0.18 0.00 0.02 0.00 0.00 55.97 57.42 2w1u s LYS 934 Cb 0.09 0.13 0.29 0.00 -0.52 0.00 0.00 37.83 37.81 2w1u s LYS 934 CO -0.01 -0.16 0.65 0.91 -0.92 0.00 0.00 175.35 175.83 2w1u n TRP 935 N 4.37 -3.18 -3.72 3.18 7.02 -1.26 -3.77 117.44 120.08 2w1u n TRP 935 Ca -0.20 -0.46 -0.14 0.00 -1.02 0.00 0.00 57.50 55.67 2w1u n TRP 935 Cb 0.57 -1.24 -0.14 0.00 -2.42 0.00 0.00 31.31 28.08 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 0.47 0.01 -0.99 1.43 -0.49 -4.18 118.68 114.93 2w1u s LEU 936 Ca 0.50 0.36 0.03 0.00 -1.03 0.00 0.00 54.13 53.99 2w1u s LEU 936 Cb -0.09 0.43 -0.03 0.00 0.03 0.00 0.00 46.19 46.52 2w1u s LEU 936 CO 0.42 -0.17 -0.05 0.42 0.23 0.00 0.00 176.35 177.19 2w1u s THR 937 N 1.46 3.74 0.08 5.49 -4.23 -0.06 -0.09 115.64 122.03 2w1u s THR 937 Ca -0.06 -0.78 -0.07 0.00 -1.18 0.00 0.00 61.69 59.60 2w1u s THR 937 Cb -0.11 -2.65 -0.01 0.00 1.34 0.00 0.00 72.50 71.06 2w1u s THR 937 CO -0.07 0.36 0.13 -0.36 -0.54 0.00 0.00 174.62 174.15 2w1u s PHE 938 N -1.04 0.25 0.00 3.99 0.40 -0.76 -0.03 117.98 120.78 2w1u s PHE 938 Ca 0.18 -0.71 0.00 0.00 -0.60 0.00 0.00 56.93 55.81 2w1u s PHE 938 Cb -0.11 -0.15 0.00 0.00 0.51 0.00 0.00 43.02 43.27 2w1u s PHE 938 CO 0.09 -0.50 0.00 0.43 0.70 0.00 0.00 175.22 175.94 2w1u n SER 939 N -0.00 2.33 -3.62 1.36 7.64 -0.27 -1.06 113.62 119.99 2w1u n SER 939 Ca -0.15 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.60 2w1u n SER 939 Cb 0.62 0.13 -0.07 0.00 -1.01 0.00 0.00 64.21 63.88 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 -1.52 0.78 -0.21 1.43 2.56 -0.87 -4.23 118.70 116.65 2w1u s GLU 940 Ca 0.00 0.86 -0.01 0.00 0.00 0.00 0.00 54.97 55.82 2w1u s GLU 940 Cb 0.00 0.38 0.06 0.00 2.00 0.00 0.00 34.13 36.57 2w1u s GLU 940 CO 0.00 -0.11 -0.00 -0.06 -0.56 0.00 0.00 175.26 174.53 2w1u s PHE 941 N 0.24 1.55 0.10 5.30 0.08 0.54 -0.33 117.98 125.46 2w1u s PHE 941 Ca 0.00 -1.19 0.04 0.00 0.12 0.00 0.00 56.93 55.90 2w1u s PHE 941 Cb -0.05 -1.24 -0.04 0.00 -0.57 0.00 0.00 43.02 41.13 2w1u s PHE 941 CO -0.00 -0.67 -0.10 0.00 -0.10 0.00 0.00 175.22 174.35 2w1u s ALA 942 N 1.68 1.15 0.35 5.36 0.00 -0.64 -4.70 121.76 124.96 2w1u s ALA 942 Ca -0.03 -1.21 0.08 0.00 0.00 0.00 0.00 51.96 50.80 2w1u s ALA 942 Cb -0.18 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 2w1u s ALA 942 CO -0.07 -0.03 0.07 0.96 0.00 0.00 0.00 175.76 176.68 2w1u s ILE 943 N -2.49 2.66 -0.09 0.00 -4.36 -1.26 -1.40 121.20 114.25 2w1u s ILE 943 Ca 0.06 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 58.61 2w1u s ILE 943 Cb -0.03 -2.88 0.01 0.00 1.25 0.00 0.00 42.46 40.82 2w1u s ILE 943 CO 0.00 -0.16 -0.16 -0.69 0.24 0.00 0.00 174.94 174.17 2w1u s VAL 944 N -2.51 1.47 -0.22 8.37 1.01 0.13 -4.83 120.40 123.82 2w1u s VAL 944 Ca 0.36 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 2w1u s VAL 944 Cb 0.00 -1.33 0.11 0.00 0.00 0.00 0.00 36.38 35.16 2w1u s VAL 944 CO 0.21 0.43 0.28 -0.55 0.00 0.00 0.00 175.10 175.47 2w1u s SER 945 N 0.79 0.99 0.14 3.32 0.15 -1.26 0.47 113.70 118.30 2w1u s SER 945 Ca -0.11 -0.10 0.10 0.00 0.70 0.00 0.00 55.95 56.54 2w1u s SER 945 Cb -0.16 0.65 0.53 0.00 -1.71 0.00 0.00 66.02 65.34 2w1u s SER 945 CO 0.02 -0.32 1.30 0.47 1.20 0.00 0.00 173.24 175.91 2w1u n ASP 946 N 5.33 0.25 0.00 5.45 10.43 -1.26 -4.96 116.55 131.79 2w1u n ASP 946 Ca -0.05 0.61 0.00 0.00 2.57 0.00 0.00 54.79 57.93 2w1u n ASP 946 Cb 0.50 -0.65 0.00 0.00 1.84 0.00 0.00 41.12 42.81 2w1u n ASP 946 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51