#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u0h n GLN 880 N 0.00 -0.52 -4.45 -1.40 10.64 -1.26 -4.92 117.38 115.47 1u0h n GLN 880 Ca 0.00 -2.40 -0.21 0.00 -1.83 0.00 0.00 57.00 52.56 1u0h n GLN 880 Cb 0.00 -0.89 -0.15 0.00 -0.86 0.00 0.00 30.24 28.33 1u0h n GLN 880 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 1u0h s SER 881 N -5.22 1.33 0.33 2.61 1.04 -1.26 -2.29 113.70 110.24 1u0h s SER 881 Ca 0.67 -0.21 0.06 0.00 0.48 0.00 0.00 55.95 56.96 1u0h s SER 881 Cb -0.03 -0.33 -0.01 0.00 0.10 0.00 0.00 66.02 65.75 1u0h s SER 881 CO 0.46 0.08 0.47 -0.31 0.98 0.00 0.00 173.24 174.92 1u0h s TYR 882 N 0.12 3.13 -0.15 5.02 1.51 -0.94 -4.97 117.35 121.06 1u0h s TYR 882 Ca -0.02 -0.21 0.17 0.00 -1.01 0.00 0.00 57.07 56.00 1u0h s TYR 882 Cb -0.08 -1.98 -0.25 0.00 -0.11 0.00 0.00 41.96 39.54 1u0h s TYR 882 CO 0.01 0.00 0.42 -0.25 -1.11 0.00 0.00 175.55 174.62 1u0h n ASP 883 N -1.64 1.10 -3.32 2.29 8.00 -1.26 -2.49 116.55 119.23 1u0h n ASP 883 Ca -0.00 -0.15 -0.11 0.00 0.71 0.00 0.00 54.79 55.23 1u0h n ASP 883 Cb 0.58 1.64 -0.06 0.00 -0.02 0.00 0.00 41.12 43.26 1u0h n ASP 883 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1u0h s VAL 885 N 1.96 1.87 -0.42 0.00 1.01 -0.42 -4.78 120.40 119.62 1u0h s VAL 885 Ca 0.14 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.97 1u0h s VAL 885 Cb -0.12 -1.57 0.03 0.00 0.00 0.00 0.00 36.38 34.71 1u0h s VAL 885 CO -0.16 0.53 0.38 0.00 0.00 0.00 0.00 175.10 175.85 1u0h s VAL 887 N 1.91 5.38 0.03 0.00 1.01 -0.52 0.45 120.40 128.66 1u0h s VAL 887 Ca 0.08 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.48 1u0h s VAL 887 Cb -0.19 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1u0h s VAL 887 CO 0.11 0.57 -0.12 -0.32 0.00 0.00 0.00 175.10 175.35 1u0h s MET 888 N -0.76 0.82 -0.07 2.72 1.75 -0.83 -1.73 119.30 121.20 1u0h s MET 888 Ca 0.16 -0.65 0.02 0.00 -1.25 0.00 0.00 55.69 53.97 1u0h s MET 888 Cb -0.13 -0.79 0.02 0.00 2.84 0.00 0.00 34.83 36.77 1u0h s MET 888 CO 0.05 0.20 -0.11 -0.06 -0.65 0.00 0.00 175.02 174.45 1u0h s PHE 889 N -0.77 1.37 -0.21 4.11 0.40 -0.75 -2.05 117.98 120.08 1u0h s PHE 889 Ca 0.00 -0.52 -0.00 0.00 -0.60 0.00 0.00 56.93 55.81 1u0h s PHE 889 Cb -0.07 -1.04 0.06 0.00 0.51 0.00 0.00 43.02 42.48 1u0h s PHE 889 CO 0.01 -0.30 -0.04 0.00 0.70 0.00 0.00 175.22 175.60 1u0h s ALA 890 N 0.83 1.69 0.23 5.36 0.00 -0.74 -0.62 121.76 128.50 1u0h s ALA 890 Ca -0.12 -1.13 0.11 0.00 0.00 0.00 0.00 51.96 50.82 1u0h s ALA 890 Cb -0.15 -1.33 -0.05 0.00 0.00 0.00 0.00 23.12 21.60 1u0h s ALA 890 CO 0.02 -1.11 -0.17 -1.54 0.00 0.00 0.00 175.76 172.95 1u0h s SER 891 N 1.53 3.77 -0.56 0.00 1.04 0.52 -0.88 113.70 119.12 1u0h s SER 891 Ca -0.04 -0.84 -0.01 0.00 0.48 0.00 0.00 55.95 55.54 1u0h s SER 891 Cb -0.18 -0.43 0.14 0.00 0.10 0.00 0.00 66.02 65.66 1u0h s SER 891 CO -0.07 0.08 0.35 -0.63 0.98 0.00 0.00 173.24 173.95 1u0h s ILE 892 N -2.02 3.35 0.38 -1.02 1.01 -1.20 -0.83 121.20 120.86 1u0h s ILE 892 Ca 0.26 -2.86 0.06 0.00 0.00 0.00 0.00 60.65 58.10 1u0h s ILE 892 Cb -0.07 -3.23 0.23 0.00 0.01 0.00 0.00 42.46 39.40 1u0h s ILE 892 CO 0.14 -0.82 2.00 -0.65 0.00 0.00 0.00 174.94 175.61 1u0h h PRO 893 N 7.11 0.55 0.00 2.79 0.11 -1.93 -2.32 132.00 138.31 1u0h h PRO 893 Ca -0.05 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1u0h h PRO 893 Cb 0.96 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1u0h h PRO 893 CO 0.70 0.43 0.00 -0.25 -0.21 0.00 0.00 178.00 178.66 1u0h n ASP 894 N -4.41 0.00 0.01 -2.05 8.00 -1.26 -3.50 116.55 113.34 1u0h n ASP 894 Ca 0.03 -0.02 -0.19 0.00 0.71 0.00 0.00 54.79 55.31 1u0h n ASP 894 Cb 0.12 -0.23 -0.14 0.00 -0.02 0.00 0.00 41.12 40.84 1u0h n ASP 894 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1u0h h PHE 895 N 0.00 0.39 -1.16 1.24 3.57 -1.81 -3.06 116.94 116.10 1u0h h PHE 895 Ca 0.00 -0.28 0.33 0.00 3.53 0.00 0.00 57.97 61.54 1u0h h PHE 895 Cb 0.11 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.76 1u0h h PHE 895 CO 0.00 1.29 0.79 -0.22 -2.23 0.00 0.00 178.31 177.93 1u0h h LYS 896 N -0.53 0.18 0.03 1.11 3.64 -1.75 0.25 116.57 119.50 1u0h h LYS 896 Ca -0.15 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.14 1u0h h LYS 896 Cb 1.51 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 33.29 1u0h h LYS 896 CO 0.09 0.12 -0.33 1.05 -2.27 0.00 0.00 179.45 178.11 1u0h h GLU 897 N 0.19 0.17 -1.03 1.90 4.11 -1.78 -3.26 114.58 114.88 1u0h h GLU 897 Ca 0.62 -0.22 0.26 0.00 0.07 0.00 0.00 59.36 60.08 1u0h h GLU 897 Cb 2.00 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 31.22 1u0h h GLU 897 CO -0.19 1.01 0.64 0.35 0.07 0.00 0.00 179.01 180.89 1u0h h PHE 898 N -0.56 0.84 -2.49 2.06 3.57 -0.46 -3.40 116.94 116.50 1u0h h PHE 898 Ca -0.05 0.03 -0.53 0.00 3.53 0.00 0.00 57.97 60.95 1u0h h PHE 898 Cb 1.15 -0.24 0.02 0.00 2.79 0.00 0.00 35.95 39.67 1u0h h PHE 898 CO 0.20 0.06 1.15 -0.47 -2.23 0.00 0.00 178.31 177.02 1u0h s TYR 899 N -5.63 1.77 0.01 0.41 5.04 -0.40 -4.99 117.35 113.56 1u0h s TYR 899 Ca -0.10 -0.15 0.04 0.00 -2.44 0.00 0.00 57.07 54.42 1u0h s TYR 899 Cb 0.26 -4.15 -0.01 0.00 0.35 0.00 0.00 41.96 38.41 1u0h s TYR 899 CO 0.80 -4.94 -0.11 0.99 -1.34 0.00 0.00 175.55 170.95 1u0h s THR 900 N 3.66 0.88 -0.76 4.34 2.01 -1.26 -5.01 115.64 119.50 1u0h s THR 900 Ca 0.82 -0.68 0.03 0.00 0.31 0.00 0.00 61.69 62.17 1u0h s THR 900 Cb -0.42 -0.78 0.22 0.00 0.01 0.00 0.00 72.50 71.53 1u0h s THR 900 CO 0.37 0.09 0.75 -0.62 -0.69 0.00 0.00 174.62 174.52 1u0h n GLU 901 N 2.39 2.52 -4.27 4.92 1.02 -1.26 -2.20 120.64 123.76 1u0h n GLU 901 Ca -0.16 -4.56 -0.27 0.00 -0.02 0.00 0.00 57.16 52.14 1u0h n GLU 901 Cb 0.56 -2.33 -0.09 0.00 -0.02 0.00 0.00 31.44 29.56 1u0h n GLU 901 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1u0h s SER 902 N -1.56 4.36 0.52 1.62 1.04 -1.26 -4.76 113.70 113.65 1u0h s SER 902 Ca 0.32 -0.52 0.24 0.00 0.48 0.00 0.00 55.95 56.47 1u0h s SER 902 Cb 0.03 -0.79 1.35 0.00 0.10 0.00 0.00 66.02 66.72 1u0h s SER 902 CO -0.08 0.11 1.99 0.44 0.98 0.00 0.00 173.24 176.68 1u0h h ASP 903 N 2.99 0.05 -0.23 7.02 3.32 -1.97 -0.45 116.42 127.15 1u0h h ASP 903 Ca -0.47 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.58 1u0h h ASP 903 Cb 1.20 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1u0h h ASP 903 CO 0.54 0.02 0.13 0.58 -1.72 0.00 0.00 179.24 178.80 1u0h h VAL 904 N 0.05 1.11 -0.74 -1.35 2.07 -2.00 -2.83 116.25 112.55 1u0h h VAL 904 Ca 0.26 -0.28 -0.49 0.00 0.82 0.00 0.00 66.70 67.01 1u0h h VAL 904 Cb 0.98 0.87 -0.22 0.00 -1.52 0.00 0.00 31.29 31.40 1u0h h VAL 904 CO -0.02 0.11 0.63 -0.46 0.02 0.00 0.00 177.57 177.85 1u0h n ASN 905 N -4.87 6.70 -3.64 0.57 0.23 -0.35 -4.87 115.26 109.02 1u0h n ASN 905 Ca -0.03 -3.40 -0.26 0.00 -0.53 0.00 0.00 54.58 50.36 1u0h n ASN 905 Cb 0.07 -0.99 -0.03 0.00 -2.08 0.00 0.00 39.78 36.75 1u0h n ASN 905 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1u0h n LYS 906 N -0.34 -2.51 -3.03 -3.83 4.76 -1.07 -0.51 118.16 111.64 1u0h n LYS 906 Ca 0.46 0.28 -0.13 0.00 -2.87 0.00 0.00 58.31 56.05 1u0h n LYS 906 Cb 0.70 -4.91 0.05 0.00 -1.84 0.00 0.00 35.03 29.03 1u0h n LYS 906 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1u0h n GLU 907 N -3.66 -4.43 -0.99 1.97 4.71 -0.32 -3.28 120.64 114.63 1u0h n GLU 907 Ca 0.04 0.50 0.00 0.00 -0.01 0.00 0.00 57.16 57.69 1u0h n GLU 907 Cb 0.50 -4.51 0.00 0.00 -1.01 0.00 0.00 31.44 26.42 1u0h n GLU 907 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1u0h n GLY 908 N -1.27 0.43 0.07 0.62 0.00 0.34 -4.75 105.19 100.62 1u0h n GLY 908 Ca -0.07 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 1u0h n GLY 908 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1u0h h LEU 909 N 0.00 -0.00 -2.00 0.99 5.85 -1.19 -3.06 115.31 115.90 1u0h h LEU 909 Ca 0.00 -0.93 0.16 0.00 0.84 0.00 0.00 57.88 57.96 1u0h h LEU 909 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1u0h h LEU 909 CO 0.00 0.96 0.41 -0.33 -0.34 0.00 0.00 178.44 179.14 1u0h h GLU 910 N -0.99 0.00 0.04 1.25 4.39 -1.84 0.79 114.58 118.22 1u0h h GLU 910 Ca -0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1u0h h GLU 910 Cb 0.93 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.58 1u0h h GLU 910 CO 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 179.01 177.83 1u0h h LEU 912 N -0.57 0.00 -0.51 0.00 3.38 -1.09 0.71 115.31 117.23 1u0h h LEU 912 Ca -0.01 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 1u0h h LEU 912 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1u0h h LEU 912 CO 0.01 0.00 -0.30 -0.09 0.09 0.00 0.00 178.44 178.15 1u0h h ARG 913 N 0.00 0.89 -0.26 1.13 2.43 -0.53 0.34 114.38 118.39 1u0h h ARG 913 Ca 0.01 -0.42 -0.08 0.00 -0.81 0.00 0.00 59.98 58.68 1u0h h ARG 913 Cb 0.06 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1u0h h ARG 913 CO -0.00 1.07 -0.15 1.25 -1.51 0.00 0.00 179.97 180.62 1u0h h LEU 914 N 0.75 0.58 -1.08 3.80 5.85 -0.46 -1.70 115.31 123.06 1u0h h LEU 914 Ca 0.08 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 1u0h h LEU 914 Cb 0.87 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1u0h h LEU 914 CO 0.08 0.88 0.41 0.25 -0.34 0.00 0.00 178.44 179.72 1u0h h LEU 915 N 0.28 0.94 -0.74 2.25 5.85 -0.92 -0.94 115.31 122.04 1u0h h LEU 915 Ca 0.05 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1u0h h LEU 915 Cb 0.68 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1u0h h LEU 915 CO 0.04 0.76 0.49 -1.13 -0.34 0.00 0.00 178.44 178.26 1u0h h ASN 916 N 1.06 0.85 0.15 1.25 -1.24 -0.02 0.44 115.58 118.07 1u0h h ASN 916 Ca 0.27 -0.02 0.02 0.00 0.71 0.00 0.00 56.30 57.27 1u0h h ASN 916 Cb 0.03 -0.21 -0.04 0.00 0.73 0.00 0.00 38.32 38.83 1u0h h ASN 916 CO -0.04 0.62 -0.31 -0.33 -1.29 0.00 0.00 177.43 176.07 1u0h h GLU 917 N 1.00 -0.53 -0.32 6.67 4.39 -0.28 -0.85 114.58 124.66 1u0h h GLU 917 Ca 0.27 0.04 0.07 0.00 0.34 0.00 0.00 59.36 60.08 1u0h h GLU 917 Cb -0.11 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 28.58 1u0h h GLU 917 CO -0.06 -0.36 -0.30 0.82 -1.16 0.00 0.00 179.01 177.96 1u0h h ILE 918 N -0.55 0.28 -0.50 3.13 2.04 -0.42 0.33 117.51 121.83 1u0h h ILE 918 Ca 0.02 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 1u0h h ILE 918 Cb 0.57 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1u0h h ILE 918 CO -0.16 0.00 0.31 0.40 0.00 0.00 0.00 178.15 178.70 1u0h h ILE 919 N -0.27 1.14 -0.18 -0.67 1.08 -0.77 -1.14 117.51 116.70 1u0h h ILE 919 Ca 0.15 -0.30 -0.11 0.00 -0.39 0.00 0.00 64.86 64.22 1u0h h ILE 919 Cb 0.52 0.43 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 1u0h h ILE 919 CO -0.47 0.14 -0.31 0.00 -0.69 0.00 0.00 178.15 176.82 1u0h h ALA 920 N 1.66 0.28 0.00 1.87 0.00 0.14 -2.51 119.26 120.70 1u0h h ALA 920 Ca 0.18 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1u0h h ALA 920 Cb -0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1u0h h ALA 920 CO -0.04 0.31 -0.03 -0.44 0.00 0.00 0.00 179.25 179.05 1u0h h ASP 921 N 0.17 0.00 0.31 0.00 3.32 0.27 -1.21 116.42 119.29 1u0h h ASP 921 Ca 0.01 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.80 1u0h h ASP 921 Cb 0.90 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.47 1u0h h ASP 921 CO 0.07 0.03 -1.08 -0.26 -1.72 0.00 0.00 179.24 176.28 1u0h h PHE 922 N 0.00 0.73 0.00 4.55 -1.00 -1.06 -3.21 116.94 116.94 1u0h h PHE 922 Ca -0.00 -0.43 -0.03 0.00 2.81 0.00 0.00 57.97 60.31 1u0h h PHE 922 Cb 0.06 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 39.55 1u0h h PHE 922 CO 0.00 1.28 -0.16 -0.44 -1.61 0.00 0.00 178.31 177.37 1u0h h ASP 923 N 0.23 0.00 0.00 2.17 3.32 -0.80 -2.73 116.42 118.61 1u0h h ASP 923 Ca -0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.93 1u0h h ASP 923 Cb 1.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.29 1u0h h ASP 923 CO 0.19 0.16 0.00 0.47 -1.72 0.00 0.00 179.24 178.34 1u0h n ASP 924 N -3.33 0.33 -0.08 6.45 8.00 -0.84 -1.94 116.55 125.14 1u0h n ASP 924 Ca 0.00 -1.35 -0.10 0.00 0.71 0.00 0.00 54.79 54.05 1u0h n ASP 924 Cb 0.39 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.12 41.24 1u0h n ASP 924 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1u0h n LEU 925 N -0.17 2.24 0.30 0.64 4.77 -1.03 -4.44 117.00 119.30 1u0h n LEU 925 Ca 0.00 -0.07 0.19 0.00 -0.03 0.00 0.00 56.01 56.10 1u0h n LEU 925 Cb 0.08 -0.36 0.98 0.00 -2.33 0.00 0.00 43.42 41.79 1u0h n LEU 925 CO 0.00 0.67 1.16 -0.07 -1.33 0.00 0.00 177.39 177.82 1u0h h LEU 926 N 0.00 0.00 -3.82 2.23 3.38 -1.54 0.09 115.31 115.65 1u0h h LEU 926 Ca -0.37 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.23 1u0h h LEU 926 Cb 1.64 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 42.17 1u0h h LEU 926 CO -0.04 0.00 0.47 -1.20 0.09 0.00 0.00 178.44 177.76 1u0h n SER 927 N -3.25 4.22 -4.71 -0.43 7.64 -1.25 -4.51 113.62 111.33 1u0h n SER 927 Ca -0.01 -3.38 -0.31 0.00 1.01 0.00 0.00 58.87 56.18 1u0h n SER 927 Cb 0.24 -0.79 -0.08 0.00 -1.01 0.00 0.00 64.21 62.58 1u0h n SER 927 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1u0h s LYS 928 N -3.06 2.68 0.18 1.43 2.20 0.02 -5.04 119.74 118.15 1u0h s LYS 928 Ca 0.55 -0.76 -0.13 0.00 -0.36 0.00 0.00 55.97 55.27 1u0h s LYS 928 Cb 0.45 -2.61 0.14 0.00 -1.51 0.00 0.00 37.83 34.29 1u0h s LYS 928 CO 0.12 0.56 1.80 -1.35 -0.36 0.00 0.00 175.35 176.12 1u0h h PRO 929 N 3.53 0.55 0.00 4.03 0.11 -1.90 -2.63 132.00 135.68 1u0h h PRO 929 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1u0h h PRO 929 Cb 1.17 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1u0h h PRO 929 CO 0.61 0.36 0.00 1.57 -0.21 0.00 0.00 178.00 180.33 1u0h h LYS 930 N 0.56 0.00 -0.19 1.05 2.10 -1.96 -2.57 116.57 115.56 1u0h h LYS 930 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 1u0h h LYS 930 Cb 0.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.43 1u0h h LYS 930 CO -0.14 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 178.50 1u0h n PHE 931 N -2.84 0.67 0.06 0.07 3.72 -1.08 -4.68 117.46 113.38 1u0h n PHE 931 Ca 0.00 -0.90 0.01 0.00 -0.05 0.00 0.00 57.45 56.51 1u0h n PHE 931 Cb 0.23 -0.26 0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1u0h n PHE 931 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1u0h n SER 932 N -0.74 0.00 -0.39 4.37 3.41 -0.97 -1.38 113.62 117.91 1u0h n SER 932 Ca 0.19 0.11 0.04 0.00 -0.26 0.00 0.00 58.87 58.95 1u0h n SER 932 Cb 0.81 -0.13 0.08 0.00 -0.26 0.00 0.00 64.21 64.71 1u0h n SER 932 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u0h n GLY 933 N -1.05 1.70 3.84 5.00 0.00 -1.26 -5.00 105.19 108.42 1u0h n GLY 933 Ca 0.01 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1u0h n GLY 933 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0h s VAL 934 N -0.88 4.93 -0.13 1.61 1.01 -0.48 -4.09 120.40 122.37 1u0h s VAL 934 Ca 0.14 0.81 0.01 0.00 0.00 0.00 0.00 61.98 62.93 1u0h s VAL 934 Cb 0.08 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.74 1u0h s VAL 934 CO 0.10 0.39 -0.14 -0.70 0.00 0.00 0.00 175.10 174.76 1u0h s GLU 935 N -1.58 2.19 -0.51 2.72 2.56 -0.66 -4.96 118.70 118.45 1u0h s GLU 935 Ca 0.32 -0.53 -0.29 0.00 0.00 0.00 0.00 54.97 54.47 1u0h s GLU 935 Cb -0.16 -1.98 0.03 0.00 2.00 0.00 0.00 34.13 34.02 1u0h s GLU 935 CO 0.17 -0.19 1.17 0.21 -0.56 0.00 0.00 175.26 176.07 1u0h s LYS 936 N 1.35 3.64 0.08 4.30 2.36 -1.26 -1.40 119.74 128.81 1u0h s LYS 936 Ca 0.01 0.46 -0.11 0.00 -2.55 0.00 0.00 55.97 53.78 1u0h s LYS 936 Cb -0.13 -3.95 -0.22 0.00 -1.05 0.00 0.00 37.83 32.47 1u0h s LYS 936 CO -0.08 -1.50 1.18 0.82 1.55 0.00 0.00 175.35 177.33 1u0h h ILE 937 N 6.22 1.32 0.00 5.43 1.08 -0.22 -3.48 117.51 127.86 1u0h h ILE 937 Ca -0.24 -2.43 0.00 0.00 -0.39 0.00 0.00 64.86 61.80 1u0h h ILE 937 Cb 1.06 2.54 0.00 0.00 -3.07 0.00 0.00 36.82 37.35 1u0h h ILE 937 CO 1.15 0.74 0.00 2.29 -0.69 0.00 0.00 178.15 181.64 1u0h n LYS 938 N -3.78 -1.89 -3.66 2.37 2.85 -1.14 -4.88 118.16 108.03 1u0h n LYS 938 Ca -0.11 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 56.92 1u0h n LYS 938 Cb 0.92 0.00 -0.17 0.00 -0.65 0.00 0.00 35.03 35.13 1u0h n LYS 938 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1u0h s THR 939 N -2.59 0.01 -0.32 0.58 -4.23 -1.26 -2.05 115.64 105.78 1u0h s THR 939 Ca 0.00 0.04 -0.12 0.00 -1.18 0.00 0.00 61.69 60.44 1u0h s THR 939 Cb 0.00 -0.46 -0.02 0.00 1.34 0.00 0.00 72.50 73.36 1u0h s THR 939 CO 0.00 -0.06 0.20 -0.63 -0.54 0.00 0.00 174.62 173.60 1u0h s ILE 940 N 2.11 5.08 0.00 2.99 1.09 -0.26 -4.91 121.20 127.30 1u0h s ILE 940 Ca 0.03 -0.21 0.00 0.00 -1.10 0.00 0.00 60.65 59.38 1u0h s ILE 940 Cb -0.14 -3.57 0.00 0.00 -1.06 0.00 0.00 42.46 37.69 1u0h s ILE 940 CO -0.06 0.06 0.00 0.61 -0.10 0.00 0.00 174.94 175.45 1u0h n GLY 941 N 5.06 3.82 1.36 6.18 0.00 -1.26 0.91 105.19 121.27 1u0h n GLY 941 Ca -0.13 0.21 -0.04 0.00 0.00 0.00 0.00 46.02 46.05 1u0h n GLY 941 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u0h n SER 942 N 7.96 3.28 -4.44 1.61 3.41 -1.26 -4.95 113.62 119.22 1u0h n SER 942 Ca 0.00 -3.51 -0.34 0.00 -0.26 0.00 0.00 58.87 54.75 1u0h n SER 942 Cb 0.00 -0.66 -0.13 0.00 -0.26 0.00 0.00 64.21 63.16 1u0h n SER 942 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1u0h s THR 943 N -3.13 3.82 -0.15 6.66 2.01 0.26 -3.28 115.64 121.83 1u0h s THR 943 Ca 0.47 -0.37 -0.19 0.00 0.31 0.00 0.00 61.69 61.92 1u0h s THR 943 Cb 0.41 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.18 1u0h s THR 943 CO 0.05 0.45 0.51 -0.47 -0.69 0.00 0.00 174.62 174.48 1u0h s TYR 944 N 0.81 3.46 -0.25 4.92 5.04 -0.06 -1.10 117.35 130.18 1u0h s TYR 944 Ca -0.01 0.87 -0.00 0.00 -2.44 0.00 0.00 57.07 55.50 1u0h s TYR 944 Cb -0.14 -2.62 0.03 0.00 0.35 0.00 0.00 41.96 39.58 1u0h s TYR 944 CO 0.02 0.06 -0.09 1.41 -1.34 0.00 0.00 175.55 175.61 1u0h s MET 945 N 1.02 2.69 0.52 4.97 -2.45 -0.87 -1.79 119.30 123.39 1u0h s MET 945 Ca 0.26 -1.06 0.00 0.00 -1.25 0.00 0.00 55.69 53.64 1u0h s MET 945 Cb -0.15 -2.92 -0.00 0.00 1.25 0.00 0.00 34.83 33.00 1u0h s MET 945 CO 0.11 -0.43 0.00 0.00 1.05 0.00 0.00 175.02 175.75 1u0h s ALA 946 N 1.26 4.22 -0.28 4.11 0.00 -0.87 0.54 121.76 130.74 1u0h s ALA 946 Ca -0.02 -0.11 -0.22 0.00 0.00 0.00 0.00 51.96 51.61 1u0h s ALA 946 Cb -0.17 0.03 0.13 0.00 0.00 0.00 0.00 23.12 23.11 1u0h s ALA 946 CO -0.06 -0.01 1.03 0.00 0.00 0.00 0.00 175.76 176.72 1u0h s ALA 947 N -2.91 -2.08 -0.05 0.00 0.00 -0.49 -1.97 121.76 114.26 1u0h s ALA 947 Ca 0.02 1.98 0.05 0.00 0.00 0.00 0.00 51.96 54.01 1u0h s ALA 947 Cb 0.00 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.58 1u0h s ALA 947 CO 0.01 -0.27 -0.21 0.95 0.00 0.00 0.00 175.76 176.25 1u0h s THR 948 N 0.59 1.71 0.00 0.00 -4.23 0.17 -1.66 115.64 112.23 1u0h s THR 948 Ca -0.01 -0.87 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1u0h s THR 948 Cb -0.05 -1.46 0.00 0.00 1.34 0.00 0.00 72.50 72.33 1u0h s THR 948 CO -0.10 0.48 0.00 0.61 -0.54 0.00 0.00 174.62 175.08 1u0h n GLY 949 N 3.11 1.56 0.02 3.99 0.00 -1.26 0.29 105.19 112.91 1u0h n GLY 949 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1u0h n GLY 949 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u0h n LEU 950 N 0.00 0.63 -1.18 0.99 4.77 -1.26 -4.04 117.00 116.91 1u0h n LEU 950 Ca 0.00 -0.03 -0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1u0h n LEU 950 Cb 0.00 -0.15 0.15 0.00 -2.33 0.00 0.00 43.42 41.09 1u0h n LEU 950 CO 0.00 0.08 0.58 -1.20 -1.33 0.00 0.00 177.39 175.52 1u0h n SER 951 N -1.79 3.06 -4.51 -1.43 7.64 -1.26 -4.86 113.62 110.46 1u0h n SER 951 Ca 0.03 -2.45 -0.26 0.00 1.01 0.00 0.00 58.87 57.20 1u0h n SER 951 Cb 0.39 -0.59 -0.10 0.00 -1.01 0.00 0.00 64.21 62.90 1u0h n SER 951 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u0h s ALA 952 N -1.65 2.93 0.33 -0.43 0.00 -1.26 -5.23 121.76 116.46 1u0h s ALA 952 Ca 0.23 -1.85 0.07 0.00 0.00 0.00 0.00 51.96 50.41 1u0h s ALA 952 Cb 0.18 0.42 0.57 0.00 0.00 0.00 0.00 23.12 24.29 1u0h s ALA 952 CO 0.06 -0.21 1.79 0.82 0.00 0.00 0.00 175.76 178.22 1u0h h ILE 953 N 1.86 1.25 0.00 0.00 5.03 -1.91 -3.51 117.51 120.23 1u0h h ILE 953 Ca -0.42 -1.17 0.00 0.00 -0.12 0.00 0.00 64.86 63.15 1u0h h ILE 953 Cb 1.25 1.41 0.00 0.00 -3.03 0.00 0.00 36.82 36.46 1u0h h ILE 953 CO 0.73 0.36 0.00 0.54 -0.68 0.00 0.00 178.15 179.10 1u0h n ARG 964 N -4.15 0.00 0.07 2.37 5.12 -1.26 -4.81 116.66 114.01 1u0h n ARG 964 Ca -0.01 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.04 1u0h n ARG 964 Cb 0.38 0.00 0.37 0.00 -1.16 0.00 0.00 32.46 32.05 1u0h n ARG 964 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1u0h n GLN 965 N 0.00 0.22 -2.27 5.56 10.64 -1.26 -3.46 117.38 126.81 1u0h n GLN 965 Ca 0.00 0.14 -0.20 0.00 -1.83 0.00 0.00 57.00 55.12 1u0h n GLN 965 Cb 0.00 -1.72 0.02 0.00 -0.86 0.00 0.00 30.24 27.68 1u0h n GLN 965 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1u0h n TYR 966 N -2.08 2.53 -0.03 2.61 4.02 -1.26 -4.68 117.16 118.27 1u0h n TYR 966 Ca 0.05 -2.38 0.00 0.00 -0.01 0.00 0.00 57.90 55.56 1u0h n TYR 966 Cb 0.41 -0.28 -0.14 0.00 -0.02 0.00 0.00 39.34 39.32 1u0h n TYR 966 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 176.86 175.73 1u0h n MET 967 N -0.62 0.66 0.07 -0.72 1.56 -1.22 -3.86 117.12 112.99 1u0h n MET 967 Ca 0.35 -0.01 0.08 0.00 -0.27 0.00 0.00 57.70 57.85 1u0h n MET 967 Cb 0.88 -1.60 0.37 0.00 2.15 0.00 0.00 33.22 35.02 1u0h n MET 967 CO 0.00 0.00 0.00 -2.39 -0.73 0.00 0.00 175.97 172.85 1u0h n HIS 968 N -2.62 0.39 0.08 1.12 1.44 -1.26 -1.22 115.22 113.14 1u0h n HIS 968 Ca -0.17 0.17 -0.13 0.00 -2.01 0.00 0.00 57.72 55.58 1u0h n HIS 968 Cb 0.87 -0.77 -0.06 0.00 0.12 0.00 0.00 29.99 30.15 1u0h n HIS 968 CO 0.00 0.00 0.00 0.82 -2.81 0.00 0.00 176.34 174.35 1u0h h ILE 969 N 0.00 1.42 0.00 0.61 1.08 -1.90 -2.97 117.51 115.76 1u0h h ILE 969 Ca 0.00 -2.56 -0.13 0.00 -0.39 0.00 0.00 64.86 61.78 1u0h h ILE 969 Cb 0.22 2.51 -0.02 0.00 -3.07 0.00 0.00 36.82 36.46 1u0h h ILE 969 CO 0.00 0.76 -0.61 1.23 -0.69 0.00 0.00 178.15 178.84 1u0h h GLY 970 N 1.34 0.00 2.00 5.37 0.00 -1.35 -3.15 103.07 107.27 1u0h h GLY 970 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 1u0h h GLY 970 CO 0.17 0.00 -0.47 -0.84 0.00 0.00 0.00 176.54 175.40 1u0h h THR 971 N 0.00 1.16 -0.01 4.70 2.02 -1.44 -1.01 112.91 118.33 1u0h h THR 971 Ca -0.01 -1.72 -0.08 0.00 0.77 0.00 0.00 66.41 65.37 1u0h h THR 971 Cb 1.38 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.75 1u0h h THR 971 CO 0.08 0.46 -0.38 -0.03 0.37 0.00 0.00 175.52 176.02 1u0h h MET 972 N 0.00 0.02 0.06 6.66 -1.53 -1.48 -0.46 114.93 118.20 1u0h h MET 972 Ca -0.00 -0.01 -0.24 0.00 -3.44 0.00 0.00 59.70 56.01 1u0h h MET 972 Cb 0.94 -0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.97 1u0h h MET 972 CO 0.06 0.40 -1.09 0.28 0.14 0.00 0.00 176.91 176.70 1u0h h VAL 973 N 0.02 1.61 0.00 -5.77 2.07 -1.48 -0.92 116.25 111.78 1u0h h VAL 973 Ca -0.00 -3.20 -0.06 0.00 0.82 0.00 0.00 66.70 64.26 1u0h h VAL 973 Cb 0.68 2.86 -0.01 0.00 -1.52 0.00 0.00 31.29 33.30 1u0h h VAL 973 CO 0.05 0.92 -0.30 -0.33 0.02 0.00 0.00 177.57 177.94 1u0h h GLU 974 N 0.04 0.00 0.16 1.57 4.39 -0.55 -2.34 114.58 117.85 1u0h h GLU 974 Ca -0.07 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.40 1u0h h GLU 974 Cb 1.83 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 30.51 1u0h h GLU 974 CO 0.16 0.30 -1.01 0.35 -1.16 0.00 0.00 179.01 177.65 1u0h h PHE 975 N 0.00 0.71 -0.32 4.33 3.57 -1.01 -2.72 116.94 121.50 1u0h h PHE 975 Ca -0.00 -0.50 0.07 0.00 3.53 0.00 0.00 57.97 61.07 1u0h h PHE 975 Cb 0.54 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.18 1u0h h PHE 975 CO 0.00 1.38 -0.16 0.00 -2.23 0.00 0.00 178.31 177.30 1u0h h ALA 976 N 0.13 0.09 -0.52 2.41 0.00 -0.85 0.13 119.26 120.65 1u0h h ALA 976 Ca -0.17 0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.91 1u0h h ALA 976 Cb 1.78 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 19.91 1u0h h ALA 976 CO 0.19 -0.55 0.24 1.88 0.00 0.00 0.00 179.25 181.01 1u0h h TYR 977 N -0.11 0.43 -0.61 0.00 0.05 -1.50 -2.47 116.97 112.76 1u0h h TYR 977 Ca 0.16 0.02 0.09 0.00 0.05 0.00 0.00 58.73 59.05 1u0h h TYR 977 Cb 0.36 -0.12 -0.11 0.00 1.01 0.00 0.00 36.73 37.88 1u0h h TYR 977 CO -0.36 0.19 -0.46 0.00 -1.05 0.00 0.00 178.16 176.47 1u0h h ALA 978 N 1.30 -0.39 -0.97 3.88 0.00 -0.45 0.20 119.26 122.82 1u0h h ALA 978 Ca 0.24 0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.42 1u0h h ALA 978 Cb 0.19 1.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 1u0h h ALA 978 CO -0.19 -0.86 0.61 -0.07 0.00 0.00 0.00 179.25 178.73 1u0h h LEU 979 N -0.22 0.74 0.25 0.00 3.38 -0.75 -1.63 115.31 117.08 1u0h h LEU 979 Ca 0.17 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1u0h h LEU 979 Cb 0.56 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1u0h h LEU 979 CO -0.71 0.32 -0.12 0.58 0.09 0.00 0.00 178.44 178.60 1u0h h VAL 980 N 0.76 0.81 -1.02 1.22 2.07 -0.43 0.45 116.25 120.11 1u0h h VAL 980 Ca 0.52 -0.49 0.24 0.00 0.82 0.00 0.00 66.70 67.79 1u0h h VAL 980 Cb 0.81 1.09 -0.10 0.00 -1.52 0.00 0.00 31.29 31.56 1u0h h VAL 980 CO -0.29 0.11 0.63 1.23 0.02 0.00 0.00 177.57 179.27 1u0h h GLY 981 N -0.60 1.53 1.72 2.17 0.00 -0.04 0.45 103.07 108.30 1u0h h GLY 981 Ca -0.03 -0.27 -0.23 0.00 0.00 0.00 0.00 47.33 46.80 1u0h h GLY 981 CO 0.06 -0.15 -1.19 0.50 0.00 0.00 0.00 176.54 175.75 1u0h h LYS 982 N 0.52 0.01 0.00 4.80 1.57 -1.06 -2.68 116.57 119.73 1u0h h LYS 982 Ca 0.60 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 59.25 1u0h h LYS 982 Cb 1.29 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.59 1u0h h LYS 982 CO -0.36 0.88 -0.55 1.25 -0.57 0.00 0.00 179.45 180.10 1u0h h LEU 983 N 0.00 0.00 0.00 2.94 5.85 0.19 -2.31 115.31 121.99 1u0h h LEU 983 Ca -0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.63 1u0h h LEU 983 Cb 1.84 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.87 1u0h h LEU 983 CO 0.12 0.55 -0.83 0.44 -0.34 0.00 0.00 178.44 178.38 1u0h h ASP 984 N 0.00 0.00 -0.24 1.25 3.32 -1.21 -3.02 116.42 116.53 1u0h h ASP 984 Ca -0.01 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 56.89 1u0h h ASP 984 Cb 1.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1u0h h ASP 984 CO 0.07 0.04 -0.08 0.00 -1.72 0.00 0.00 179.24 177.55 1u0h h ALA 985 N 2.20 0.33 -0.65 3.45 0.00 -1.11 -2.75 119.26 120.73 1u0h h ALA 985 Ca 0.00 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1u0h h ALA 985 Cb 0.90 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 1u0h h ALA 985 CO 0.00 0.15 0.43 0.82 0.00 0.00 0.00 179.25 180.65 1u0h h ILE 986 N 0.21 1.17 -0.78 0.00 2.04 -1.49 -1.83 117.51 116.82 1u0h h ILE 986 Ca 0.06 -0.31 0.20 0.00 1.00 0.00 0.00 64.86 65.81 1u0h h ILE 986 Cb 0.56 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 1u0h h ILE 986 CO 0.03 0.16 0.54 0.78 0.00 0.00 0.00 178.15 179.66 1u0h h ASN 987 N 0.88 0.17 0.03 1.72 2.35 -1.35 -0.25 115.58 119.13 1u0h h ASN 987 Ca 0.24 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1u0h h ASN 987 Cb -0.10 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1u0h h ASN 987 CO -0.05 0.07 -0.02 0.50 -1.65 0.00 0.00 177.43 176.29 1u0h h LYS 988 N 0.17 -0.04 -0.00 0.81 1.63 -1.11 -1.83 116.57 116.20 1u0h h LYS 988 Ca 0.38 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.19 1u0h h LYS 988 Cb 1.26 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 1u0h h LYS 988 CO -0.07 -0.01 -0.15 0.72 -3.45 0.00 0.00 179.45 176.49 1u0h n HIS 989 N -5.10 0.00 0.49 1.91 8.25 -0.35 -3.84 115.22 116.59 1u0h n HIS 989 Ca -0.07 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.44 1u0h n HIS 989 Cb 0.06 -0.36 0.01 0.00 1.12 0.00 0.00 29.99 30.81 1u0h n HIS 989 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1u0h n SER 990 N -1.38 1.38 -2.87 0.41 3.41 -0.25 -4.98 113.62 109.35 1u0h n SER 990 Ca 0.09 -1.19 -0.20 0.00 -0.26 0.00 0.00 58.87 57.30 1u0h n SER 990 Cb 0.32 0.40 0.05 0.00 -0.26 0.00 0.00 64.21 64.72 1u0h n SER 990 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1u0h n PHE 991 N -0.10 -2.04 -4.60 7.33 3.72 -0.70 -5.00 117.46 116.07 1u0h n PHE 991 Ca 0.05 0.63 -0.32 0.00 -0.05 0.00 0.00 57.45 57.76 1u0h n PHE 991 Cb 0.24 -4.25 -0.06 0.00 -0.94 0.00 0.00 39.48 34.47 1u0h n PHE 991 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1u0h s ASN 992 N -2.96 4.24 -0.31 4.37 0.01 -1.13 -5.08 114.94 114.08 1u0h s ASN 992 Ca 0.36 -1.59 0.18 0.00 -0.71 0.00 0.00 52.86 51.11 1u0h s ASN 992 Cb -0.16 0.54 0.47 0.00 0.41 0.00 0.00 41.25 42.51 1u0h s ASN 992 CO 0.45 -0.92 1.02 -0.67 -1.51 0.00 0.00 177.10 175.47 1u0h n ASP 993 N -1.38 1.82 -4.73 -1.22 2.03 -1.26 -4.72 116.55 107.10 1u0h n ASP 993 Ca -0.16 -2.60 -0.42 0.00 0.52 0.00 0.00 54.79 52.13 1u0h n ASP 993 Cb 0.66 -0.50 -0.03 0.00 -0.72 0.00 0.00 41.12 40.53 1u0h n ASP 993 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1u0h s PHE 994 N -3.38 3.06 -0.04 -0.67 0.08 -1.26 -4.99 117.98 110.78 1u0h s PHE 994 Ca 0.29 0.78 0.04 0.00 0.12 0.00 0.00 56.93 58.17 1u0h s PHE 994 Cb 0.41 -3.87 -0.03 0.00 -0.57 0.00 0.00 43.02 38.96 1u0h s PHE 994 CO -0.00 -3.10 -0.16 0.15 -0.10 0.00 0.00 175.22 172.01 1u0h s LYS 995 N 0.67 2.43 0.22 0.44 -0.14 -1.26 -4.71 119.74 117.39 1u0h s LYS 995 Ca 0.66 -0.74 -0.05 0.00 -1.36 0.00 0.00 55.97 54.48 1u0h s LYS 995 Cb -0.43 -2.32 -0.05 0.00 -1.68 0.00 0.00 37.83 33.35 1u0h s LYS 995 CO 0.35 0.61 0.47 -1.17 -0.76 0.00 0.00 175.35 174.85 1u0h s LEU 996 N -0.73 4.17 -0.06 3.17 2.96 -1.26 -4.39 118.68 122.54 1u0h s LEU 996 Ca 0.11 0.66 0.01 0.00 -0.22 0.00 0.00 54.13 54.69 1u0h s LEU 996 Cb -0.10 -3.43 0.02 0.00 0.50 0.00 0.00 46.19 43.18 1u0h s LEU 996 CO 0.00 -0.08 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.29 1u0h s ARG 997 N -3.13 1.13 0.18 1.98 3.52 -0.01 0.35 118.95 122.96 1u0h s ARG 997 Ca 0.43 -0.19 0.11 0.00 -0.13 0.00 0.00 55.73 55.95 1u0h s ARG 997 Cb -0.11 -1.08 -0.04 0.00 -1.56 0.00 0.00 34.95 32.15 1u0h s ARG 997 CO 0.27 -0.09 -0.23 0.08 -0.81 0.00 0.00 175.30 174.53 1u0h s VAL 998 N 1.01 2.46 -0.25 7.11 1.01 -1.16 -0.36 120.40 130.22 1u0h s VAL 998 Ca -0.09 -1.93 -0.04 0.00 0.00 0.00 0.00 61.98 59.92 1u0h s VAL 998 Cb -0.14 -2.17 0.10 0.00 0.00 0.00 0.00 36.38 34.17 1u0h s VAL 998 CO -0.00 -0.08 0.17 -0.83 0.00 0.00 0.00 175.10 174.36 1u0h s GLY 999 N -2.58 0.26 0.03 4.51 0.00 0.21 -2.04 107.32 107.71 1u0h s GLY 999 Ca 0.20 -0.56 0.03 0.00 0.00 0.00 0.00 44.72 44.39 1u0h s GLY 999 CO 0.10 2.12 -0.00 -0.42 0.00 0.00 0.00 173.10 174.90 1u0h s ILE 1000N 2.19 4.09 0.29 0.90 1.01 -0.91 -1.81 121.20 126.97 1u0h s ILE 1000Ca 0.07 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 59.82 1u0h s ILE 1000Cb -0.16 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.46 1u0h s ILE 1000CO -0.26 0.29 0.65 0.21 0.00 0.00 0.00 174.94 175.82 1u0h s ASN 1001N -1.82 -0.09 -0.24 3.58 3.04 -0.71 -4.34 114.94 114.37 1u0h s ASN 1001Ca 0.22 -0.85 -0.22 0.00 0.04 0.00 0.00 52.86 52.04 1u0h s ASN 1001Cb -0.12 0.71 0.06 0.00 -1.54 0.00 0.00 41.25 40.36 1u0h s ASN 1001CO 0.13 -1.35 0.63 -1.38 -3.04 0.00 0.00 177.10 172.10 1u0h s HIS 1002N -3.61 -0.70 -3.53 0.43 -3.43 -1.26 -1.43 115.29 101.76 1u0h s HIS 1002Ca 0.16 1.70 0.00 0.00 -0.80 0.00 0.00 55.06 56.12 1u0h s HIS 1002Cb -0.04 0.24 0.00 0.00 -1.43 0.00 0.00 32.58 31.35 1u0h s HIS 1002CO 0.09 -0.34 0.00 0.41 -2.00 0.00 0.00 174.74 172.91 1u0h n GLY 1003N 2.73 -1.10 3.76 -1.38 0.00 -0.88 -4.90 105.19 103.42 1u0h n GLY 1003Ca -0.14 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 1u0h n GLY 1003CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u0h s PRO 1004N -1.41 4.42 0.37 1.61 0.04 -1.06 -1.30 135.00 137.66 1u0h s PRO 1004Ca 0.00 2.10 0.07 0.00 0.04 0.00 0.00 61.00 63.20 1u0h s PRO 1004Cb 0.00 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.39 1u0h s PRO 1004CO 0.00 -0.13 0.24 0.14 0.04 0.00 0.00 177.00 177.29 1u0h s VAL 1005N -0.78 0.15 -0.38 -0.36 -7.23 -1.04 -4.13 120.40 106.63 1u0h s VAL 1005Ca 0.50 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 1u0h s VAL 1005Cb -0.37 -2.43 0.13 0.00 0.56 0.00 0.00 36.38 34.27 1u0h s VAL 1005CO 0.46 0.00 0.21 -0.63 -0.31 0.00 0.00 175.10 174.83 1u0h s ILE 1006N -3.32 0.73 1.13 -0.62 1.01 -0.94 -2.22 121.20 116.96 1u0h s ILE 1006Ca 0.35 -2.00 -0.13 0.00 0.00 0.00 0.00 60.65 58.86 1u0h s ILE 1006Cb 0.02 -1.53 0.26 0.00 0.01 0.00 0.00 42.46 41.22 1u0h s ILE 1006CO 0.24 -0.91 1.05 0.00 0.00 0.00 0.00 174.94 175.32 1u0h s ALA 1007N 0.85 -0.03 0.00 9.38 0.00 -0.97 -1.71 121.76 129.29 1u0h s ALA 1007Ca 0.17 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1u0h s ALA 1007Cb -0.23 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1u0h s ALA 1007CO -0.03 -3.55 0.00 0.41 0.00 0.00 0.00 175.76 172.59 1u0h n GLY 1008N 0.07 1.80 3.88 0.00 0.00 -1.10 -4.15 105.19 105.68 1u0h n GLY 1008Ca 0.04 -1.88 -0.21 0.00 0.00 0.00 0.00 46.02 43.97 1u0h n GLY 1008CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0h s VAL 1009N -1.36 2.91 -0.13 1.61 1.01 -1.26 0.08 120.40 123.26 1u0h s VAL 1009Ca 0.00 -1.32 -0.27 0.00 0.00 0.00 0.00 61.98 60.39 1u0h s VAL 1009Cb 0.00 -3.05 0.06 0.00 0.00 0.00 0.00 36.38 33.40 1u0h s VAL 1009CO 0.00 -0.04 0.65 -0.51 0.00 0.00 0.00 175.10 175.20 1u0h s ILE 1010N -2.42 0.00 0.00 2.22 2.07 -0.82 -4.90 121.20 117.35 1u0h s ILE 1010Ca 0.47 -0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.67 1u0h s ILE 1010Cb -0.04 -0.95 0.00 0.00 0.13 0.00 0.00 42.46 41.60 1u0h s ILE 1010CO 0.28 -0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.90 1u0h n GLY 1011N 1.67 1.19 0.07 1.50 0.00 -1.26 -2.08 105.19 106.29 1u0h n GLY 1011Ca -0.17 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.49 1u0h n GLY 1011CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0h h ALA 1012N 0.00 -0.03 -3.00 4.61 0.00 -2.00 -2.97 119.26 115.87 1u0h h ALA 1012Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1u0h h ALA 1012Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1u0h h ALA 1012CO 0.00 -0.25 0.00 1.04 0.00 0.00 0.00 179.25 180.04 1u0h n GLN 1013N -4.85 0.00 -3.82 0.00 1.13 -1.26 -4.15 117.38 104.43 1u0h n GLN 1013Ca -0.09 0.31 -0.28 0.00 -1.94 0.00 0.00 57.00 55.00 1u0h n GLN 1013Cb 0.27 -0.85 -0.12 0.00 0.11 0.00 0.00 30.24 29.65 1u0h n GLN 1013CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1u0h s LYS 1014N -0.70 2.04 -0.22 -1.09 2.20 -1.26 -5.09 119.74 115.62 1u0h s LYS 1014Ca 0.00 -2.90 -0.38 0.00 -0.36 0.00 0.00 55.97 52.34 1u0h s LYS 1014Cb 0.00 -3.02 -0.17 0.00 -1.51 0.00 0.00 37.83 33.12 1u0h s LYS 1014CO 0.00 -1.25 1.16 -2.30 -0.36 0.00 0.00 175.35 172.60 1u0h n PRO 1015N 2.48 0.00 -5.14 4.03 -0.02 -1.12 -4.92 135.00 130.31 1u0h n PRO 1015Ca 0.17 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.34 1u0h n PRO 1015Cb 0.36 -1.29 -0.17 0.00 -0.02 0.00 0.00 33.50 32.38 1u0h n PRO 1015CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1u0h s GLN 1016N 1.34 2.58 -0.02 -0.52 -0.21 -0.88 -4.88 119.66 117.07 1u0h s GLN 1016Ca 0.85 -0.82 -0.30 0.00 0.02 0.00 0.00 55.36 55.11 1u0h s GLN 1016Cb -1.20 -2.08 -0.04 0.00 1.00 0.00 0.00 33.01 30.70 1u0h s GLN 1016CO 0.60 0.26 1.23 -0.47 -2.12 0.00 0.00 175.29 174.79 1u0h s TYR 1017N 0.13 3.19 -0.08 0.91 5.04 -1.26 -1.95 117.35 123.33 1u0h s TYR 1017Ca -0.11 1.17 -0.22 0.00 -2.44 0.00 0.00 57.07 55.48 1u0h s TYR 1017Cb -0.15 -3.46 0.05 0.00 0.35 0.00 0.00 41.96 38.75 1u0h s TYR 1017CO 0.06 -1.47 0.51 0.34 -1.34 0.00 0.00 175.55 173.64 1u0h s ASP 1018N 1.46 -0.46 -0.13 4.32 -1.08 0.11 -4.91 116.67 115.98 1u0h s ASP 1018Ca 0.58 0.58 -0.04 0.00 -0.52 0.00 0.00 52.55 53.15 1u0h s ASP 1018Cb -0.27 0.60 -0.03 0.00 -1.46 0.00 0.00 42.92 41.76 1u0h s ASP 1018CO 0.24 -0.44 0.02 0.27 0.52 0.00 0.00 175.17 175.78 1u0h s ILE 1019N -0.86 4.47 0.00 4.11 -4.36 -1.26 -2.73 121.20 120.57 1u0h s ILE 1019Ca -0.09 -0.17 0.00 0.00 -0.26 0.00 0.00 60.65 60.13 1u0h s ILE 1019Cb -0.03 -2.94 0.00 0.00 1.25 0.00 0.00 42.46 40.75 1u0h s ILE 1019CO 0.06 0.55 0.00 0.79 0.24 0.00 0.00 174.94 176.57 1u0h n TRP 1020N 2.76 -0.24 0.00 1.37 8.01 -0.69 -4.85 117.44 123.80 1u0h n TRP 1020Ca -0.18 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.01 1u0h n TRP 1020Cb 0.53 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.83 1u0h n TRP 1020CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1u0h n GLY 1021N 5.00 2.84 0.32 6.99 0.00 -1.26 -2.22 105.19 116.86 1u0h n GLY 1021Ca 0.00 -1.65 0.11 0.00 0.00 0.00 0.00 46.02 44.48 1u0h n GLY 1021CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1u0h h ASN 1022N 0.00 0.18 -1.04 1.61 -0.73 -2.00 -1.15 115.58 112.45 1u0h h ASN 1022Ca 0.00 -0.00 0.27 0.00 1.87 0.00 0.00 56.30 58.44 1u0h h ASN 1022Cb 0.00 -0.04 -0.10 0.00 0.27 0.00 0.00 38.32 38.45 1u0h h ASN 1022CO 0.00 0.12 0.66 0.74 -0.37 0.00 0.00 177.43 178.59 1u0h h THR 1023N 0.21 0.51 -0.09 -3.57 2.02 -1.87 0.41 112.91 110.53 1u0h h THR 1023Ca 0.15 -0.14 -0.22 0.00 0.77 0.00 0.00 66.41 66.97 1u0h h THR 1023Cb 0.34 0.07 0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1u0h h THR 1023CO -0.03 0.07 -0.82 0.58 0.37 0.00 0.00 175.52 175.70 1u0h h VAL 1024N 0.41 1.30 -0.78 3.16 2.07 -1.46 -2.67 116.25 118.28 1u0h h VAL 1024Ca 0.61 -2.04 0.01 0.00 0.82 0.00 0.00 66.70 66.10 1u0h h VAL 1024Cb 1.50 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 33.39 1u0h h VAL 1024CO -0.32 0.64 0.51 -1.13 0.02 0.00 0.00 177.57 177.29 1u0h h ASN 1025N 0.41 0.88 -0.19 0.57 -0.73 -0.95 -1.55 115.58 114.02 1u0h h ASN 1025Ca -0.08 -0.02 -0.14 0.00 1.87 0.00 0.00 56.30 57.93 1u0h h ASN 1025Cb 1.46 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.83 1u0h h ASN 1025CO 0.17 0.63 -0.38 0.58 -0.37 0.00 0.00 177.43 178.06 1u0h h VAL 1026N 1.04 1.29 -0.19 2.57 2.07 -1.42 -1.95 116.25 119.65 1u0h h VAL 1026Ca 0.29 -1.55 0.01 0.00 0.82 0.00 0.00 66.70 66.27 1u0h h VAL 1026Cb -0.10 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1u0h h VAL 1026CO -0.07 0.50 0.10 0.00 0.02 0.00 0.00 177.57 178.12 1u0h h ALA 1027N 0.98 0.23 -0.20 1.67 0.00 -1.06 0.22 119.26 121.10 1u0h h ALA 1027Ca 0.05 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1u0h h ALA 1027Cb 0.92 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1u0h h ALA 1027CO 0.08 -0.32 0.13 0.66 0.00 0.00 0.00 179.25 179.80 1u0h h SER 1028N 0.21 0.23 0.35 0.00 4.64 -1.22 -1.30 113.55 116.46 1u0h h SER 1028Ca 0.08 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1u0h h SER 1028Cb 0.02 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1u0h h SER 1028CO -0.05 0.18 0.00 0.03 -0.87 0.00 0.00 176.83 176.12 1u0h h ARG 1029N 0.26 0.00 -0.04 4.77 2.47 -0.93 0.78 114.38 121.68 1u0h h ARG 1029Ca 0.07 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1u0h h ARG 1029Cb -0.01 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1u0h h ARG 1029CO -0.01 0.00 0.00 -1.33 0.56 0.00 0.00 179.97 179.19 1u0h n MET 1030N -2.87 1.22 0.01 0.04 2.81 0.74 -3.35 117.12 115.71 1u0h n MET 1030Ca -0.01 -0.33 0.00 0.00 -1.81 0.00 0.00 57.70 55.55 1u0h n MET 1030Cb 0.14 -1.34 0.00 0.00 -0.71 0.00 0.00 33.22 31.31 1u0h n MET 1030CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1u0h n ASP 1031N -0.47 0.11 0.15 7.83 2.03 0.18 -3.87 116.55 122.51 1u0h n ASP 1031Ca 0.16 0.01 0.19 0.00 0.52 0.00 0.00 54.79 55.67 1u0h n ASP 1031Cb 0.15 -0.03 0.75 0.00 -0.72 0.00 0.00 41.12 41.27 1u0h n ASP 1031CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1u0h h SER 1032N 0.00 0.00 -0.18 1.67 4.64 -1.43 0.47 113.55 118.72 1u0h h SER 1032Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u0h h SER 1032Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1u0h h SER 1032CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 1u0h n THR 1033N -3.50 0.55 -1.00 2.95 -2.24 -1.21 -5.02 114.28 104.80 1u0h n THR 1033Ca 0.05 -0.78 -0.22 0.00 -2.27 0.00 0.00 64.05 60.83 1u0h n THR 1033Cb 0.57 0.82 0.18 0.00 -2.10 0.00 0.00 70.33 69.80 1u0h n THR 1033CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0h n GLY 1034N 0.49 -2.53 3.38 3.38 0.00 0.16 -5.06 105.19 105.02 1u0h n GLY 1034Ca 0.08 -1.51 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 1u0h n GLY 1034CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0h s VAL 1035N -2.56 2.29 0.35 1.61 1.01 -1.26 -5.02 120.40 116.83 1u0h s VAL 1035Ca 0.53 -1.44 -0.28 0.00 0.00 0.00 0.00 61.98 60.79 1u0h s VAL 1035Cb -0.05 -1.94 -0.12 0.00 0.00 0.00 0.00 36.38 34.28 1u0h s VAL 1035CO 0.40 0.30 1.38 0.18 0.00 0.00 0.00 175.10 177.36 1u0h n LEU 1036N 1.53 4.05 -1.64 3.92 4.77 -1.26 -1.87 117.00 126.50 1u0h n LEU 1036Ca -0.17 1.21 -0.19 0.00 -0.03 0.00 0.00 56.01 56.83 1u0h n LEU 1036Cb 0.52 -1.54 -0.06 0.00 -2.33 0.00 0.00 43.42 40.01 1u0h n LEU 1036CO 0.24 -0.21 -0.20 0.47 -1.33 0.00 0.00 177.39 176.36 1u0h n ASP 1037N 0.72 -5.35 -3.96 -1.43 8.00 0.15 -4.97 116.55 109.71 1u0h n ASP 1037Ca 0.04 0.35 -0.17 0.00 0.71 0.00 0.00 54.79 55.71 1u0h n ASP 1037Cb 0.37 -4.49 -0.15 0.00 -0.02 0.00 0.00 41.12 36.83 1u0h n ASP 1037CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1u0h s LYS 1038N -3.95 0.58 -0.08 -1.24 -0.14 -0.78 -5.07 119.74 109.07 1u0h s LYS 1038Ca 0.00 -0.21 -0.14 0.00 -1.36 0.00 0.00 55.97 54.27 1u0h s LYS 1038Cb 0.00 -0.57 -0.05 0.00 -1.68 0.00 0.00 37.83 35.53 1u0h s LYS 1038CO 0.00 0.10 0.34 0.42 -0.76 0.00 0.00 175.35 175.45 1u0h s ILE 1039N 0.04 5.20 -0.25 2.17 1.01 -1.26 -2.96 121.20 125.15 1u0h s ILE 1039Ca -0.00 0.66 -0.06 0.00 0.00 0.00 0.00 60.65 61.25 1u0h s ILE 1039Cb -0.05 -3.65 -0.01 0.00 0.01 0.00 0.00 42.46 38.77 1u0h s ILE 1039CO -0.00 0.51 0.03 -1.58 0.00 0.00 0.00 174.94 173.89 1u0h s GLN 1040N -0.46 3.36 0.11 2.79 0.74 -0.87 -2.09 119.66 123.24 1u0h s GLN 1040Ca 0.20 -0.66 0.10 0.00 0.05 0.00 0.00 55.36 55.05 1u0h s GLN 1040Cb -0.15 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.71 1u0h s GLN 1040CO 0.09 -0.27 -0.22 0.14 -0.55 0.00 0.00 175.29 174.47 1u0h s VAL 1041N 1.52 2.54 0.97 1.34 -7.23 0.19 -2.14 120.40 117.60 1u0h s VAL 1041Ca 0.05 -1.56 -0.16 0.00 -1.81 0.00 0.00 61.98 58.50 1u0h s VAL 1041Cb -0.15 -2.13 0.21 0.00 0.56 0.00 0.00 36.38 34.87 1u0h s VAL 1041CO 0.01 0.15 1.33 0.42 -0.31 0.00 0.00 175.10 176.69 1u0h s THR 1042N -1.06 2.00 0.00 5.32 -4.23 -1.26 0.93 115.64 117.34 1u0h s THR 1042Ca 0.15 -0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 1u0h s THR 1042Cb -0.10 -2.98 0.00 0.00 1.34 0.00 0.00 72.50 70.75 1u0h s THR 1042CO 0.07 0.00 0.89 1.21 -0.54 0.00 0.00 174.62 176.26 1u0h n GLU 1043N -3.79 0.00 -0.28 3.99 4.07 -1.25 0.71 120.64 124.08 1u0h n GLU 1043Ca 0.16 0.54 0.16 0.00 -0.06 0.00 0.00 57.16 57.96 1u0h n GLU 1043Cb 0.59 -1.39 0.42 0.00 -0.06 0.00 0.00 31.44 31.00 1u0h n GLU 1043CO 0.00 0.00 0.00 1.05 -0.06 0.00 0.00 177.13 178.12 1u0h h GLU 1044N 0.00 0.57 -0.71 5.31 -0.00 -1.95 0.83 114.58 118.63 1u0h h GLU 1044Ca 0.00 -0.03 -0.07 0.00 -0.00 0.00 0.00 59.36 59.25 1u0h h GLU 1044Cb 0.00 -0.13 -0.03 0.00 -0.00 0.00 0.00 28.75 28.59 1u0h h GLU 1044CO 0.00 0.38 0.16 1.15 -0.00 0.00 0.00 179.01 180.70 1u0h h THR 1045N 0.59 1.26 0.27 -1.06 2.02 -1.90 0.38 112.91 114.48 1u0h h THR 1045Ca 0.50 -0.99 -0.00 0.00 0.77 0.00 0.00 66.41 66.69 1u0h h THR 1045Cb 0.98 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1u0h h THR 1045CO -0.24 0.38 -0.21 -1.28 0.37 0.00 0.00 175.52 174.54 1u0h h SER 1046N 1.08 -0.54 0.29 4.18 0.87 0.65 -1.98 113.55 118.09 1u0h h SER 1046Ca 0.22 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.82 1u0h h SER 1046Cb 0.39 0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 62.48 1u0h h SER 1046CO 0.00 -0.32 -0.51 -0.07 -0.53 0.00 0.00 176.83 175.40 1u0h h LEU 1047N -0.49 -1.47 -1.53 2.23 3.38 -0.09 -1.86 115.31 115.48 1u0h h LEU 1047Ca -0.02 0.14 0.26 0.00 0.09 0.00 0.00 57.88 58.35 1u0h h LEU 1047Cb 0.43 0.52 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 1u0h h LEU 1047CO -0.01 -0.60 0.67 0.40 0.09 0.00 0.00 178.44 179.00 1u0h h ILE 1048N -0.85 0.55 -0.13 1.22 2.04 -0.89 0.12 117.51 119.56 1u0h h ILE 1048Ca -0.03 -0.11 -0.17 0.00 1.00 0.00 0.00 64.86 65.55 1u0h h ILE 1048Cb 0.80 0.20 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1u0h h ILE 1048CO -0.18 0.06 -0.64 -0.07 0.00 0.00 0.00 178.15 177.32 1u0h h LEU 1049N 0.32 0.57 -0.33 1.44 3.38 -0.69 -3.06 115.31 116.94 1u0h h LEU 1049Ca 0.55 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 1u0h h LEU 1049Cb 1.53 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 1u0h h LEU 1049CO -0.21 1.06 0.02 1.56 0.09 0.00 0.00 178.44 180.96 1u0h h GLN 1050N 0.36 0.57 -0.90 1.13 4.20 -0.03 -0.52 115.11 119.93 1u0h h GLN 1050Ca -0.01 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1u0h h GLN 1050Cb 1.19 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.92 1u0h h GLN 1050CO 0.12 0.68 0.00 0.25 -0.67 0.00 0.00 178.83 179.21 1u0h n THR 1051N -4.56 0.23 -0.90 -0.54 -2.24 -0.62 -0.65 114.28 105.00 1u0h n THR 1051Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1u0h n THR 1051Cb 0.25 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 67.99 1u0h n THR 1051CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1u0h n LEU 1052N 0.37 0.16 -0.09 3.22 4.77 -0.38 -5.01 117.00 120.06 1u0h n LEU 1052Ca 0.00 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 1u0h n LEU 1052Cb 0.21 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1u0h n LEU 1052CO 0.00 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 1u0h n GLY 1053N -0.03 1.16 3.27 -0.72 0.00 0.18 -5.05 105.19 104.00 1u0h n GLY 1053Ca 0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 1u0h n GLY 1053CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u0h s TYR 1054N -2.18 2.11 -0.15 1.61 4.12 -0.34 -4.98 117.35 117.54 1u0h s TYR 1054Ca 0.00 -0.40 -0.07 0.00 0.02 0.00 0.00 57.07 56.62 1u0h s TYR 1054Cb 0.00 -1.35 -0.04 0.00 -1.52 0.00 0.00 41.96 39.04 1u0h s TYR 1054CO 0.00 -0.03 0.10 0.95 0.02 0.00 0.00 175.55 176.59 1u0h s THR 1055N -0.57 5.16 0.24 -0.71 -4.23 -1.26 -3.73 115.64 110.54 1u0h s THR 1055Ca 0.09 0.09 0.07 0.00 -1.18 0.00 0.00 61.69 60.76 1u0h s THR 1055Cb -0.09 -3.29 -0.05 0.00 1.34 0.00 0.00 72.50 70.41 1u0h s THR 1055CO -0.01 0.53 -0.09 0.00 -0.54 0.00 0.00 174.62 174.52 1u0h s THR 1057N -3.06 0.92 -0.21 0.00 2.01 -0.44 -4.92 115.64 109.95 1u0h s THR 1057Ca 0.26 -0.63 -0.27 0.00 0.31 0.00 0.00 61.69 61.37 1u0h s THR 1057Cb 0.02 -0.79 -0.00 0.00 0.01 0.00 0.00 72.50 71.73 1u0h s THR 1057CO 0.09 0.16 0.91 0.00 -0.69 0.00 0.00 174.62 175.09 1u0h h ARG 1059N 7.46 0.69 0.00 0.00 2.43 -1.53 -3.47 114.38 119.96 1u0h h ARG 1059Ca -0.24 -0.49 0.00 0.00 -0.81 0.00 0.00 59.98 58.44 1u0h h ARG 1059Cb 1.10 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1u0h h ARG 1059CO 0.89 1.11 0.00 0.41 -1.51 0.00 0.00 179.97 180.87 1u0h n GLY 1060N 0.45 0.75 3.89 2.80 0.00 -1.24 -5.02 105.19 106.82 1u0h n GLY 1060Ca -0.05 -2.06 -0.29 0.00 0.00 0.00 0.00 46.02 43.62 1u0h n GLY 1060CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u0h s ILE 1061N -1.54 4.83 -0.13 -0.61 -1.09 -1.26 -1.58 121.20 119.82 1u0h s ILE 1061Ca 0.00 0.46 -0.13 0.00 -2.23 0.00 0.00 60.65 58.75 1u0h s ILE 1061Cb 0.00 -3.81 0.04 0.00 -1.58 0.00 0.00 42.46 37.11 1u0h s ILE 1061CO 0.00 -0.75 0.37 -0.51 -1.23 0.00 0.00 174.94 172.82 1u0h s ILE 1062N -2.64 0.00 -0.32 2.92 -1.16 0.84 -4.89 121.20 115.96 1u0h s ILE 1062Ca 0.50 -0.02 -0.21 0.00 -0.51 0.00 0.00 60.65 60.41 1u0h s ILE 1062Cb -0.10 -0.52 -0.00 0.00 0.61 0.00 0.00 42.46 42.44 1u0h s ILE 1062CO 0.40 -0.01 0.68 0.21 -2.81 0.00 0.00 174.94 173.41 1u0h s ASN 1063N 0.14 6.53 -0.47 4.50 3.84 -1.26 0.43 114.94 128.65 1u0h s ASN 1063Ca -0.00 0.45 -0.10 0.00 0.21 0.00 0.00 52.86 53.41 1u0h s ASN 1063Cb -0.03 -2.35 0.11 0.00 -0.55 0.00 0.00 41.25 38.43 1u0h s ASN 1063CO 0.01 -0.54 0.36 -0.69 -2.79 0.00 0.00 177.10 173.44 1u0h s VAL 1064N 2.74 4.39 -0.20 -5.21 1.01 0.17 -4.98 120.40 118.31 1u0h s VAL 1064Ca 0.27 -1.66 -0.41 0.00 0.00 0.00 0.00 61.98 60.18 1u0h s VAL 1064Cb -0.15 -3.84 -0.18 0.00 0.00 0.00 0.00 36.38 32.22 1u0h s VAL 1064CO 0.13 -0.74 1.49 1.17 0.00 0.00 0.00 175.10 177.14 1u0h n LYS 1065N 4.97 0.63 0.00 2.72 4.81 -1.26 -0.38 118.16 129.64 1u0h n LYS 1065Ca -0.09 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1u0h n LYS 1065Cb 0.41 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.64 1u0h n LYS 1065CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1u0h n GLY 1066N 3.24 3.11 0.66 3.14 0.00 -1.26 -4.74 105.19 109.34 1u0h n GLY 1066Ca 0.25 -0.93 0.08 0.00 0.00 0.00 0.00 46.02 45.42 1u0h n GLY 1066CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1u0h n LYS 1067N 0.00 1.36 0.00 1.61 4.81 0.49 -5.08 118.16 121.35 1u0h n LYS 1067Ca 0.00 -1.48 0.00 0.00 -0.87 0.00 0.00 58.31 55.96 1u0h n LYS 1067Cb 0.00 -1.32 0.00 0.00 0.02 0.00 0.00 35.03 33.73 1u0h n LYS 1067CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1u0h n GLY 1068N 0.96 0.39 3.65 3.14 0.00 -0.40 -4.79 105.19 108.13 1u0h n GLY 1068Ca 0.10 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 1u0h n GLY 1068CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u0h s ASP 1069N -4.00 5.38 -0.00 1.61 1.01 -1.26 0.45 116.67 119.85 1u0h s ASP 1069Ca 0.00 0.09 0.03 0.00 0.71 0.00 0.00 52.55 53.38 1u0h s ASP 1069Cb 0.00 -1.75 -0.01 0.00 1.01 0.00 0.00 42.92 42.17 1u0h s ASP 1069CO 0.00 0.27 -0.08 -0.76 0.21 0.00 0.00 175.17 174.81 1u0h s LEU 1070N -0.22 2.03 -0.12 1.23 1.43 0.17 -4.91 118.68 118.29 1u0h s LEU 1070Ca 0.06 -0.18 -0.26 0.00 -1.03 0.00 0.00 54.13 52.73 1u0h s LEU 1070Cb -0.12 -0.42 -0.02 0.00 0.03 0.00 0.00 46.19 45.66 1u0h s LEU 1070CO 0.02 0.09 0.84 -0.75 0.23 0.00 0.00 176.35 176.77 1u0h s LYS 1071N -0.29 4.37 0.39 1.70 2.20 -1.26 -0.11 119.74 126.74 1u0h s LYS 1071Ca 0.03 1.07 0.08 0.00 -0.36 0.00 0.00 55.97 56.78 1u0h s LYS 1071Cb -0.04 -3.53 -0.06 0.00 -1.51 0.00 0.00 37.83 32.70 1u0h s LYS 1071CO -0.00 -0.21 0.09 0.95 -0.36 0.00 0.00 175.35 175.82 1u0h s THR 1072N 1.70 2.34 0.03 3.43 -4.23 -0.62 -3.83 115.64 114.46 1u0h s THR 1072Ca 0.41 -1.84 -0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1u0h s THR 1072Cb -0.18 -2.94 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 1u0h s THR 1072CO 0.16 -0.06 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.84 1u0h s TYR 1073N -2.60 0.32 -0.16 3.99 1.51 0.26 -1.34 117.35 119.33 1u0h s TYR 1073Ca 0.38 -0.63 -0.06 0.00 -1.01 0.00 0.00 57.07 55.75 1u0h s TYR 1073Cb 0.04 -0.23 -0.04 0.00 -0.11 0.00 0.00 41.96 41.62 1u0h s TYR 1073CO 0.21 -0.22 0.04 -0.06 -1.11 0.00 0.00 175.55 174.41 1u0h s PHE 1074N -1.91 3.23 0.16 2.71 0.08 0.26 0.56 117.98 123.07 1u0h s PHE 1074Ca -0.12 0.07 -0.30 0.00 0.12 0.00 0.00 56.93 56.71 1u0h s PHE 1074Cb -0.07 -2.00 -0.07 0.00 -0.57 0.00 0.00 43.02 40.31 1u0h s PHE 1074CO -0.03 0.22 1.11 0.08 -0.10 0.00 0.00 175.22 176.51 1u0h s VAL 1075N 0.06 3.91 0.53 -0.44 1.01 -0.89 -1.33 120.40 123.25 1u0h s VAL 1075Ca 0.04 1.59 -0.05 0.00 0.00 0.00 0.00 61.98 63.56 1u0h s VAL 1075Cb -0.12 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 1u0h s VAL 1075CO 0.01 0.25 0.83 0.20 0.00 0.00 0.00 175.10 176.39 1u0h s ASN 1076N 0.09 5.98 0.00 3.32 0.01 -0.10 -4.61 114.94 119.63 1u0h s ASN 1076Ca 0.51 0.83 0.00 0.00 -0.71 0.00 0.00 52.86 53.49 1u0h s ASN 1076Cb -0.29 -2.01 0.00 0.00 0.41 0.00 0.00 41.25 39.36 1u0h s ASN 1076CO 0.34 -0.78 0.07 0.41 -1.51 0.00 0.00 177.10 175.62